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GDP-Man:Man(3)GlcNAc(2)-PP-Dol alpha-1,2-mannosyltransferase

GDP-Man:Man(3)GlcNAc(2)-PP-Dol alpha-1,2-mannosyltransferase that operates in the biosynthetic pathway of dolichol-linked oligosaccharides, the glycan precursors employed in protein asparagine (N)-glycosylation. The assembly of dolichol-linked oligosaccharides begins on the cytosolic side of the endoplasmic reticulum membrane and finishes in its lumen. The sequential addition of sugars to dolichol pyrophosphate produces dolichol-linked oligosaccharides containing fourteen sugars, including two GlcNAcs, nine mannoses and three glucoses. Once assembled, the oligosaccharide is transferred from the lipid to nascent proteins by oligosaccharyltransferases. Catalyzes, on the cytoplasmic face of the endoplasmic reticulum, the addition of the fourth and fifth mannose residues to the dolichol-linked oligosaccharide chain, to produce Man(5)GlcNAc(2)-PP-dolichol core oligosaccharide. Man(5)GlcNAc(2)-PP-dolichol is a substrate for ALG3, the following enzyme in the biosynthetic pathway.

AlphaFold DB , UniProt , Accession A0A096MPG7, Species PAPAN (Papio anubis, Olive baboon), Gene ALG11, Length 492 aa.

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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	54.2	Low	64.3	Low	227 Å²	227	123.6 Å²	123.6	100%	1.118	64%	0.641	S	S	*	*				0	-33.9	0	-79	174.9	123.1	0	0	113.2	D3	M1-D3 PolarHBondContact O-N 3.34Å
2	A	56.8	Low	65.7	Low	80 Å²	80	122.8 Å²	122.8	66%	0.661	63%	0.629	S	S	*	*	H	α-helix	trans	-66.1	-31.1	-178.9	0	0	0	0	0	116.2	R6	A2-R6 PolarHBondContact O-N 2.81Å
3	D	56.7	Low	66.7	Low	138 Å²	138	120.7 Å²	120.7	74%	0.738	62%	0.619	S	S	*	*	H	α-helix	trans	-75.1	-30.2	-179.8	-94.7	-24.2	0	0	0	114.2	M1 S7	M1-D3 PolarHBondContact O-N 3.34Å; D3-S7 WeakPolarHBondContact O-CB 3.13Å; D3-S7 PolarHBondContact O-N 2.7Å
4	G	58.8	Low	67.7	Low	53 Å²	53	118.4 Å²	118.4	55%	0.546	61%	0.607	S	S	.	*	H	α-helix	trans	-70.2	-39	179.3	0	0	0	0	0	112.6	W8	G4-W8 WeakPolarHBondContact O-CB 3.4Å; G4-W8 PolarHBondContact O-N 3.3Å; G4-W8 VanDerWaalsContact O-N 3.14Å
5	E	58.4	Low	68.6	Low	126 Å²	126	123.3 Å²	123.3	59%	0.589	62%	0.615	S	S	*	*	H	α-helix	trans	-67.7	-42.9	175.7	-73.6	-171.8	150.8	0	0	111.5	S7 W8 Y9	E5-S7 PolarHBondContact O-N 2.71Å; E5-W8 WeakPolarHBondContact O-CB 3.32Å; E5-W8 PolarHBondContact O-N 3.49Å; E5-Y9 HydrophobicContact CB-CD2 4.48Å; E5-Y9 HydrophobicContact CB-CE2 4.25Å; E5-Y9 WeakPolarHBondContact O-CD2 3.36Å; E5-Y9 PolarHBondContact O-N 3.4Å
6	R	59.6	Low	69.4	Low	188 Å²	188	122.8 Å²	122.8	71%	0.709	61%	0.609	S	S	*	*	H	α-helix	trans	-62.7	-40.8	180	-149.7	177.6	-163.5	-175.7	4.4	112.4	A2 L10	A2-R6 PolarHBondContact O-N 2.81Å; R6-L10 PolarHBondContact O-N 2.95Å; R6-L10 VanDerWaalsContact O-N 3.14Å
7	S	63.9	Low	70	Confident	75 Å²	75	122.8 Å²	122.8	52%	0.524	60%	0.604	S	S	.	*	H	α-helix	trans	-65.2	-39.6	174.8	-175.9	0	0	0	0	112.4	D3 E5 L10 C11	D3-S7 WeakPolarHBondContact O-CB 3.13Å; D3-S7 PolarHBondContact O-N 2.7Å; E5-S7 PolarHBondContact O-N 2.71Å; S7-L10 PolarHBondContact O-N 2.79Å; S7-C11 WeakPolarHBondContact O-CB 3.49Å; S7-C11 PolarHBondContact O-N 3.36Å
8	W	70.1	Confident	70.6	Confident	148 Å²	148	123.8 Å²	123.8	56%	0.561	60%	0.602	S	S	*	*	H	α-helix	trans	-65.1	-43	176.8	178.5	-108.8	0	0	0	113.2	G4 E5 C11 K12	G4-W8 WeakPolarHBondContact O-CB 3.4Å; G4-W8 PolarHBondContact O-N 3.3Å; G4-W8 VanDerWaalsContact O-N 3.14Å; E5-W8 WeakPolarHBondContact O-CB 3.32Å; E5-W8 PolarHBondContact O-N 3.49Å; W8-C11 PolarHBondContact O-N 3.43Å; W8-K12 VanDerWaalsContact CE2-CE 3.41Å; W8-K12 VanDerWaalsContact CZ2-CE 3.45Å; W8-K12 VanDerWaalsContact NE1-CE 3.3Å; W8-K12 PolarHBondContact O-N 3.36Å
9	Y	74.4	Confident	71.4	Confident	152 Å²	152	120.9 Å²	120.9	60%	0.596	60%	0.595	S	S	*	*	H	α-helix	trans	-64.5	-39	174.6	-74.1	-69.3	0	0	0	112	E5 K12 L13	E5-Y9 HydrophobicContact CB-CD2 4.48Å; E5-Y9 HydrophobicContact CB-CE2 4.25Å; E5-Y9 WeakPolarHBondContact O-CD2 3.36Å; E5-Y9 PolarHBondContact O-N 3.4Å; Y9-K12 PolarHBondContact O-N 2.91Å; Y9-L13 VanDerWaalsContact O-CB 3.3Å; Y9-L13 WeakPolarHBondContact O-CB 3.32Å; Y9-L13 PolarHBondContact O-N 3.48Å
10	L	75.9	Confident	72.1	Confident	107 Å²	107	119.7 Å²	119.7	56%	0.56	59%	0.59	S	S	*	*	H	α-helix	trans	-63	-43.2	175.1	-136.2	95.6	0	0	0	111.8	R6 S7 L13 L14	R6-L10 PolarHBondContact O-N 2.95Å; R6-L10 VanDerWaalsContact O-N 3.14Å; S7-L10 PolarHBondContact O-N 2.79Å; L10-L13 PolarHBondContact O-N 3.23Å; L10-L14 HydrophobicContact CD2-CD1 4.49Å; L10-L14 WeakPolarHBondContact O-CB 3.49Å; L10-L14 WeakPolarHBondContact O-CG 3.43Å; L10-L14 PolarHBondContact O-N 2.88Å
11	C	78.6	Confident	72.8	Confident	66 Å²	66	119.4 Å²	119.4	45%	0.446	59%	0.586	S	S	.	*	H	α-helix	trans	-64.2	-40.7	176.7	-99	0	0	0	0	112.9	S7 W8 R15	S7-C11 WeakPolarHBondContact O-CB 3.49Å; S7-C11 PolarHBondContact O-N 3.36Å; W8-C11 PolarHBondContact O-N 3.43Å; C11-R15 WeakPolarHBondContact O-CB 3.32Å; C11-R15 WeakPolarHBondContact O-CG 3.11Å; C11-R15 PolarHBondContact O-N 3.41Å
12	K	81.2	Confident	74.3	Confident	114 Å²	114	114.5 Å²	114.5	50%	0.496	56%	0.559	S	S	.	*	H	α-helix	trans	-66.9	-41.2	174.7	-79	-173.2	171.9	-179.5	0	112.1	W8 Y9 R15 F16	W8-K12 VanDerWaalsContact CE2-CE 3.41Å; W8-K12 VanDerWaalsContact CZ2-CE 3.45Å; W8-K12 VanDerWaalsContact NE1-CE 3.3Å; W8-K12 PolarHBondContact O-N 3.36Å; Y9-K12 PolarHBondContact O-N 2.91Å; K12-R15 PolarHBondContact O-N 3.46Å; K12-F16 WeakPolarHBondContact O-CB 3.24Å; K12-F16 PolarHBondContact O-N 2.96Å
13	L	79	Confident	75.8	Confident	95 Å²	95	114 Å²	114	50%	0.497	55%	0.549	S	S	.	.	H	α-helix	trans	-63.6	-45	176.9	-168.5	78.1	0	0	0	111.2	Y9 L10 F16 F17	Y9-L13 VanDerWaalsContact O-CB 3.3Å; Y9-L13 WeakPolarHBondContact O-CB 3.32Å; Y9-L13 PolarHBondContact O-N 3.48Å; L10-L13 PolarHBondContact O-N 3.23Å; L13-F16 WeakPolarHBondContact O-CB 3.43Å; L13-F16 PolarHBondContact O-N 3.28Å; L13-F17 HydrophobicContact CD1-CE2 3.96Å; L13-F17 HydrophobicContact CD2-CE2 3.94Å; L13-F17 HydrophobicContact CG-CD2 3.94Å; L13-F17 HydrophobicContact CG-CE2 3.6Å; L13-F17 WeakPolarHBondContact O-CD2 3.47Å; L13-F17 PolarHBondContact O-N 3.5Å
14	L	79.9	Confident	77.4	Confident	88 Å²	88	108.9 Å²	108.9	46%	0.461	53%	0.529	S	S	.	.	H	α-helix	trans	-61.2	-46.2	174.7	-77.4	164.5	0	0	0	111.5	L10 F16 F17 Y18	L10-L14 HydrophobicContact CD2-CD1 4.49Å; L10-L14 WeakPolarHBondContact O-CB 3.49Å; L10-L14 WeakPolarHBondContact O-CG 3.43Å; L10-L14 PolarHBondContact O-N 2.88Å; L14-F16 VanDerWaalsContact C-N 3.28Å; L14-F16 PolarHBondContact O-N 3.34Å; L14-F17 PolarHBondContact O-N 3.09Å; L14-Y18 WeakPolarHBondContact O-CD2 3.48Å; L14-Y18 PolarHBondContact O-N 3.31Å
15	R	81.9	Confident	78.8	Confident	192 Å²	192	110.6 Å²	110.6	73%	0.725	53%	0.525	S	S	*	.	H	α-helix	trans	-59.2	-39.2	175.3	-79.3	-178.4	178.5	-172.3	0.2	112.4	C11 K12 Y18 S19	C11-R15 WeakPolarHBondContact O-CB 3.32Å; C11-R15 WeakPolarHBondContact O-CG 3.11Å; C11-R15 PolarHBondContact O-N 3.41Å; K12-R15 PolarHBondContact O-N 3.46Å; R15-Y18 PolarHBondContact O-N 3.15Å; R15-S19 WeakPolarHBondContact O-CB 3.45Å; R15-S19 PolarHBondContact O-N 3.45Å; R15-S19 PolarHBondContact O-OG 3.21Å
16	F	81.1	Confident	80.4	Confident	116 Å²	116	110 Å²	110	51%	0.509	53%	0.525	S	S	.	.	H	α-helix	trans	-64.9	-43.9	175.4	177.2	-101.9	0	0	0	112.4	K12 L13 L14 S19 L20	K12-F16 WeakPolarHBondContact O-CB 3.24Å; K12-F16 PolarHBondContact O-N 2.96Å; L13-F16 WeakPolarHBondContact O-CB 3.43Å; L13-F16 PolarHBondContact O-N 3.28Å; L14-F16 VanDerWaalsContact C-N 3.28Å; L14-F16 PolarHBondContact O-N 3.34Å; F16-S19 WeakPolarHBondContact CA-OG 3.43Å; F16-S19 PolarHBondContact O-N 2.9Å; F16-S19 PolarHBondContact O-OG 2.91Å; F16-L20 HydrophobicContact CD1-CD1 4.1Å; F16-L20 HydrophobicContact CE1-CD1 3.51Å; F16-L20 HydrophobicContact CE2-CD1 4.09Å; F16-L20 HydrophobicContact CZ-CD1 3.52Å; F16-L20 HydrophobicContact CZ-CG 4.44Å; F16-L20 WeakPolarHBondContact O-CG 3.31Å; F16-L20 PolarHBondContact O-N 3.43Å; F16-L20 VanDerWaalsContact O-N 3.15Å
17	F	80.2	Confident	81.9	Confident	122 Å²	122	104.9 Å²	104.9	54%	0.535	51%	0.514	S	S	.	.	H	α-helix	trans	-64.6	-43.5	174.6	-78.4	-63.3	0	0	0	112	L13 L14 S19 L20 F21	L13-F17 HydrophobicContact CD1-CE2 3.96Å; L13-F17 HydrophobicContact CD2-CE2 3.94Å; L13-F17 HydrophobicContact CG-CD2 3.94Å; L13-F17 HydrophobicContact CG-CE2 3.6Å; L13-F17 WeakPolarHBondContact O-CD2 3.47Å; L13-F17 PolarHBondContact O-N 3.5Å; L14-F17 PolarHBondContact O-N 3.09Å; F17-S19 VanDerWaalsContact C-N 3.33Å; F17-S19 PolarHBondContact O-N 3.15Å; F17-L20 PolarHBondContact O-N 3.41Å; F17-F21 VanDerWaalsContact O-CB 3.24Å; F17-F21 WeakPolarHBondContact O-CB 3.45Å; F17-F21 PolarHBondContact O-N 2.96Å
18	Y	80.8	Confident	83.2	Confident	142 Å²	142	105 Å²	105	56%	0.557	51%	0.514	S	S	*	.	H	α-helix	trans	-62.5	-38.2	174.6	-84.3	-70.1	0	0	0	112.4	L14 R15 L20 F21 F22	L14-Y18 WeakPolarHBondContact O-CD2 3.48Å; L14-Y18 PolarHBondContact O-N 3.31Å; R15-Y18 PolarHBondContact O-N 3.15Å; Y18-L20 PolarHBondContact O-N 2.98Å; Y18-F21 PolarHBondContact O-N 3.2Å; Y18-F22 HydrophobicContact CD1-CE2 4.04Å; Y18-F22 WeakPolarHBondContact O-CD2 3.45Å; Y18-F22 PolarHBondContact O-N 3.11Å
19	S	85	Confident	84.2	Confident	68 Å²	68	99.7 Å²	99.7	48%	0.476	51%	0.505	S	S	.	.	H	α-helix	trans	-68.3	-22.4	177.3	64.5	0	0	0	0	113.5	R15 F16 F17 P23	R15-S19 WeakPolarHBondContact O-CB 3.45Å; R15-S19 PolarHBondContact O-N 3.45Å; R15-S19 PolarHBondContact O-OG 3.21Å; F16-S19 WeakPolarHBondContact CA-OG 3.43Å; F16-S19 PolarHBondContact O-N 2.9Å; F16-S19 PolarHBondContact O-OG 2.91Å; F17-S19 VanDerWaalsContact C-N 3.33Å; F17-S19 PolarHBondContact O-N 3.15Å; S19-P23 WeakPolarHBondContact O-CD 3.32Å; S19-P23 WeakPolarHBondContact O-CG 3.37Å
20	L	84.9	Confident	85	Confident	96 Å²	96	95.9 Å²	95.9	50%	0.503	50%	0.498	S	S	.	.	H	α-helix	trans	-91.4	-31.2	172.9	-68.9	174.2	0	0	0	112.6	F16 F17 Y18 G24	F16-L20 HydrophobicContact CD1-CD1 4.1Å; F16-L20 HydrophobicContact CE1-CD1 3.51Å; F16-L20 HydrophobicContact CE2-CD1 4.09Å; F16-L20 HydrophobicContact CZ-CD1 3.52Å; F16-L20 HydrophobicContact CZ-CG 4.44Å; F16-L20 WeakPolarHBondContact O-CG 3.31Å; F16-L20 PolarHBondContact O-N 3.43Å; F16-L20 VanDerWaalsContact O-N 3.15Å; F17-L20 PolarHBondContact O-N 3.41Å; Y18-L20 PolarHBondContact O-N 2.98Å; L20-G24 PolarHBondContact O-N 3.47Å
21	F	87	Confident	85.8	Confident	114 Å²	114	96.1 Å²	96.1	50%	0.5	50%	0.499	S	S	.	.	H	α-helix	trans	-65.1	-48.4	-175	-176.2	-106.3	0	0	0	112.5	F17 Y18 G24 L25	F17-F21 VanDerWaalsContact O-CB 3.24Å; F17-F21 WeakPolarHBondContact O-CB 3.45Å; F17-F21 PolarHBondContact O-N 2.96Å; Y18-F21 PolarHBondContact O-N 3.2Å; F21-G24 PolarHBondContact O-N 2.98Å; F21-L25 HydrophobicContact CD1-CD1 3.75Å; F21-L25 HydrophobicContact CD1-CG 4.41Å; F21-L25 HydrophobicContact CE1-CD1 3.27Å; F21-L25 HydrophobicContact CE1-CG 4.11Å; F21-L25 HydrophobicContact CE2-CD1 4.37Å; F21-L25 HydrophobicContact CE2-CG 4.41Å; F21-L25 HydrophobicContact CG-CD1 4.49Å; F21-L25 HydrophobicContact CZ-CD1 3.62Å; F21-L25 HydrophobicContact CZ-CD2 4.39Å; F21-L25 HydrophobicContact CZ-CG 4.11Å; F21-L25 WeakPolarHBondContact O-CB 3.5Å; F21-L25 WeakPolarHBondContact O-CG 3.18Å; F21-L25 PolarHBondContact O-N 3.05Å
22	F	85.9	Confident	86.4	Confident	125 Å²	125	96.7 Å²	96.7	55%	0.548	50%	0.503	S	S	.	.	H	α-helix	trans	-67.7	-47.3	-179.1	-74.9	-75.4	0	0	0	113.4	Y18 G24 L25 I26	Y18-F22 HydrophobicContact CD1-CE2 4.04Å; Y18-F22 WeakPolarHBondContact O-CD2 3.45Å; Y18-F22 PolarHBondContact O-N 3.11Å; F22-G24 VanDerWaalsContact C-N 3.29Å; F22-G24 PolarHBondContact O-N 2.87Å; F22-L25 PolarHBondContact O-N 3Å; F22-I26 WeakPolarHBondContact O-CG1 3.45Å; F22-I26 PolarHBondContact O-N 2.83Å
23	P	89.4	Confident	86.9	Confident	69 Å²	69	95.4 Å²	95.4	45%	0.448	50%	0.504	S	S	.	.	H	α-helix	trans	-59.4	-40.2	171.4	-26.4	37.2	0	0	0	112.3	S19 L25 I26 V27	S19-P23 WeakPolarHBondContact O-CD 3.32Å; S19-P23 WeakPolarHBondContact O-CG 3.37Å; P23-L25 PolarHBondContact O-N 3.32Å; P23-I26 PolarHBondContact O-N 3.44Å; P23-V27 VanDerWaalsContact O-CG2 3.31Å; P23-V27 WeakPolarHBondContact O-CG2 3.39Å; P23-V27 PolarHBondContact O-N 3.03Å
24	G	88.3	Confident	87.5	Confident	31 Å²	31	94.3 Å²	94.3	32%	0.32	50%	0.504	S	S	.	.	H	α-helix	trans	-59.4	-45	174.7	0	0	0	0	0	112.6	L20 F21 F22 I26 V27 C28	L20-G24 PolarHBondContact O-N 3.47Å; F21-G24 PolarHBondContact O-N 2.98Å; F22-G24 VanDerWaalsContact C-N 3.29Å; F22-G24 PolarHBondContact O-N 2.87Å; G24-I26 PolarHBondContact O-N 3.31Å; G24-V27 PolarHBondContact O-N 2.75Å; G24-C28 WeakPolarHBondContact O-CB 3.42Å; G24-C28 PolarHBondContact O-N 2.97Å; G24-C28 PolarHBondContact O-SG 2.65Å; G24-C28 VanDerWaalsContact O-SG 3.36Å
25	L	89.4	Confident	88.1	Confident	88 Å²	88	95 Å²	95	46%	0.461	51%	0.507	S	S	.	.	H	α-helix	trans	-62	-41.7	174.7	-79.8	176.5	0	0	0	112.4	F21 F22 P23 C28 G29	F21-L25 HydrophobicContact CD1-CD1 3.75Å; F21-L25 HydrophobicContact CD1-CG 4.41Å; F21-L25 HydrophobicContact CE1-CD1 3.27Å; F21-L25 HydrophobicContact CE1-CG 4.11Å; F21-L25 HydrophobicContact CE2-CD1 4.37Å; F21-L25 HydrophobicContact CE2-CG 4.41Å; F21-L25 HydrophobicContact CG-CD1 4.49Å; F21-L25 HydrophobicContact CZ-CD1 3.62Å; F21-L25 HydrophobicContact CZ-CD2 4.39Å; F21-L25 HydrophobicContact CZ-CG 4.11Å; F21-L25 WeakPolarHBondContact O-CB 3.5Å; F21-L25 WeakPolarHBondContact O-CG 3.18Å; F21-L25 PolarHBondContact O-N 3.05Å; F22-L25 PolarHBondContact O-N 3Å; P23-L25 PolarHBondContact O-N 3.32Å; L25-C28 PolarHBondContact O-N 3.14Å; L25-G29 PolarHBondContact O-N 2.79Å
26	I	91	Very high	88.4	Confident	115 Å²	115	90.4 Å²	90.4	59%	0.59	50%	0.5	S	S	*	.	H	α-helix	trans	-65.1	-44.5	177.3	-67.1	166.2	0	0	0	110.4	F22 P23 G24 G29 T30	F22-I26 WeakPolarHBondContact O-CG1 3.45Å; F22-I26 PolarHBondContact O-N 2.83Å; P23-I26 PolarHBondContact O-N 3.44Å; G24-I26 PolarHBondContact O-N 3.31Å; I26-G29 PolarHBondContact O-N 3.22Å; I26-T30 HydrophobicContact CG2-CG2 4.37Å; I26-T30 WeakPolarHBondContact O-CB 3.03Å; I26-T30 WeakPolarHBondContact O-CG2 3.43Å; I26-T30 PolarHBondContact O-N 3.3Å; I26-T30 PolarHBondContact O-OG1 3.08Å
27	V	92.4	Very high	89	Confident	80 Å²	80	89.9 Å²	89.9	49%	0.485	50%	0.502	S	S	.	.	H	α-helix	trans	-62.4	-46.5	176.4	172.2	0	0	0	0	110.7	P23 G24 G29 T30 L31	P23-V27 VanDerWaalsContact O-CG2 3.31Å; P23-V27 WeakPolarHBondContact O-CG2 3.39Å; P23-V27 PolarHBondContact O-N 3.03Å; G24-V27 PolarHBondContact O-N 2.75Å; V27-G29 PolarHBondContact O-N 3.23Å; V27-T30 WeakPolarHBondContact CA-OG1 3.05Å; V27-T30 PolarHBondContact O-N 3.34Å; V27-T30 PolarHBondContact O-OG1 3.37Å; V27-L31 HydrophobicContact CG1-CD1 3.9Å; V27-L31 HydrophobicContact CG1-CG 4.4Å; V27-L31 WeakPolarHBondContact O-CB 3.44Å; V27-L31 VanDerWaalsContact O-CG 3.25Å; V27-L31 WeakPolarHBondContact O-CG 3.46Å; V27-L31 PolarHBondContact O-N 3.46Å
28	C	90.8	Very high	89.6	Confident	77 Å²	77	88.1 Å²	88.1	52%	0.52	50%	0.501	S	S	.	.	H	α-helix	trans	-60.7	-44.6	175	-74.5	0	0	0	0	111.9	G24 L25 L31 C32	G24-C28 WeakPolarHBondContact O-CB 3.42Å; G24-C28 PolarHBondContact O-N 2.97Å; G24-C28 PolarHBondContact O-SG 2.65Å; G24-C28 VanDerWaalsContact O-SG 3.36Å; L25-C28 PolarHBondContact O-N 3.14Å; C28-L31 PolarHBondContact O-N 3.24Å; C28-C32 WeakPolarHBondContact O-CB 3.49Å; C28-C32 PolarHBondContact O-N 2.95Å; C28-C32 PolarHBondContact O-SG 3.47Å
29	G	90.8	Very high	90.1	Very high	36 Å²	36	84.1 Å²	84.1	37%	0.371	49%	0.489	S	S	.	.	H	α-helix	trans	-61.8	-46.3	178.3	0	0	0	0	0	112.5	L25 I26 V27 C32 V33	L25-G29 PolarHBondContact O-N 2.79Å; I26-G29 PolarHBondContact O-N 3.22Å; V27-G29 PolarHBondContact O-N 3.23Å; G29-C32 WeakPolarHBondContact O-CB 3.21Å; G29-C32 PolarHBondContact O-N 3.49Å; G29-V33 WeakPolarHBondContact O-CG2 3.39Å; G29-V33 PolarHBondContact O-N 2.67Å
30	T	92.4	Very high	90.4	Very high	73 Å²	73	88.8 Å²	88.8	45%	0.448	50%	0.496	S	S	.	.	H	α-helix	trans	-64.2	-43.3	177	50.5	0	0	0	0	111.9	I26 V27 C32 V33 C34	I26-T30 HydrophobicContact CG2-CG2 4.37Å; I26-T30 WeakPolarHBondContact O-CB 3.03Å; I26-T30 WeakPolarHBondContact O-CG2 3.43Å; I26-T30 PolarHBondContact O-N 3.3Å; I26-T30 PolarHBondContact O-OG1 3.08Å; V27-T30 WeakPolarHBondContact CA-OG1 3.05Å; V27-T30 PolarHBondContact O-N 3.34Å; V27-T30 PolarHBondContact O-OG1 3.37Å; T30-C32 VanDerWaalsContact C-N 3.33Å; T30-C32 PolarHBondContact O-N 3.39Å; T30-V33 PolarHBondContact O-N 3.15Å; T30-C34 WeakPolarHBondContact O-CB 3.37Å; T30-C34 PolarHBondContact O-N 3.02Å; T30-C34 PolarHBondContact O-SG 3.21Å
31	L	92	Very high	90.8	Very high	112 Å²	112	85.5 Å²	85.5	59%	0.586	49%	0.485	S	S	*	.	H	α-helix	trans	-60.9	-40.8	174.3	-72	172.7	0	0	0	112.2	V27 C28 C34 L35	V27-L31 HydrophobicContact CG1-CD1 3.9Å; V27-L31 HydrophobicContact CG1-CG 4.4Å; V27-L31 WeakPolarHBondContact O-CB 3.44Å; V27-L31 VanDerWaalsContact O-CG 3.25Å; V27-L31 WeakPolarHBondContact O-CG 3.46Å; V27-L31 PolarHBondContact O-N 3.46Å; C28-L31 PolarHBondContact O-N 3.24Å; L31-C34 PolarHBondContact O-N 3.31Å; L31-L35 WeakPolarHBondContact O-CB 3.12Å; L31-L35 PolarHBondContact O-N 2.98Å
32	C	90.6	Very high	91	Very high	77 Å²	77	82.1 Å²	82.1	52%	0.52	47%	0.472	S	S	.	.	H	α-helix	trans	-62.1	-44.8	174.3	-74.5	0	0	0	0	112	C28 G29 T30 L35 V36	C28-C32 WeakPolarHBondContact O-CB 3.49Å; C28-C32 PolarHBondContact O-N 2.95Å; C28-C32 PolarHBondContact O-SG 3.47Å; G29-C32 WeakPolarHBondContact O-CB 3.21Å; G29-C32 PolarHBondContact O-N 3.49Å; T30-C32 VanDerWaalsContact C-N 3.33Å; T30-C32 PolarHBondContact O-N 3.39Å; C32-L35 PolarHBondContact O-N 3.44Å; C32-V36 WeakPolarHBondContact O-CG2 3.34Å; C32-V36 PolarHBondContact O-N 3.44Å
33	V	91.8	Very high	91.3	Very high	88 Å²	88	79.8 Å²	79.8	53%	0.533	46%	0.46	S	S	.	.	H	α-helix	trans	-62.8	-46.1	177	172	0	0	0	0	110.9	G29 T30 L35 V36 I37	G29-V33 WeakPolarHBondContact O-CG2 3.39Å; G29-V33 PolarHBondContact O-N 2.67Å; T30-V33 PolarHBondContact O-N 3.15Å; V33-L35 VanDerWaalsContact C-N 3.32Å; V33-L35 PolarHBondContact O-N 3.32Å; V33-V36 PolarHBondContact O-N 2.95Å; V33-I37 HydrophobicContact CG1-CD1 3.89Å; V33-I37 WeakPolarHBondContact O-CG1 3.23Å; V33-I37 PolarHBondContact O-N 3.37Å
34	C	92.9	Very high	91.4	Very high	72 Å²	72	79.2 Å²	79.2	49%	0.486	45%	0.452	S	S	.	.	H	α-helix	trans	-58	-44.7	175.4	-72	0	0	0	0	111.7	T30 L31 V36 I37 V38	T30-C34 WeakPolarHBondContact O-CB 3.37Å; T30-C34 PolarHBondContact O-N 3.02Å; T30-C34 PolarHBondContact O-SG 3.21Å; L31-C34 PolarHBondContact O-N 3.31Å; C34-V36 PolarHBondContact O-N 3.42Å; C34-I37 PolarHBondContact O-N 3.41Å; C34-V38 VanDerWaalsContact O-CG2 3.32Å; C34-V38 WeakPolarHBondContact O-CG2 3.34Å; C34-V38 PolarHBondContact O-N 3.39Å
35	L	90.6	Very high	91.5	Very high	102 Å²	102	82.8 Å²	82.8	53%	0.534	46%	0.464	S	S	.	.	H	α-helix	trans	-60.6	-44.9	176.6	179.9	63.4	0	0	0	111.5	L31 C32 V33 I37 V38 L39	L31-L35 WeakPolarHBondContact O-CB 3.12Å; L31-L35 PolarHBondContact O-N 2.98Å; C32-L35 PolarHBondContact O-N 3.44Å; V33-L35 VanDerWaalsContact C-N 3.32Å; V33-L35 PolarHBondContact O-N 3.32Å; L35-I37 VanDerWaalsContact C-N 3.35Å; L35-I37 PolarHBondContact O-N 3.48Å; L35-V38 PolarHBondContact O-N 3.04Å; L35-L39 HydrophobicContact CD1-CD1 4.21Å; L35-L39 HydrophobicContact CD1-CG 4.13Å; L35-L39 HydrophobicContact CG-CD1 4.04Å; L35-L39 HydrophobicContact CG-CG 4.35Å; L35-L39 WeakPolarHBondContact O-CB 3.45Å; L35-L39 VanDerWaalsContact O-CG 3.28Å; L35-L39 WeakPolarHBondContact O-CG 3.44Å; L35-L39 PolarHBondContact O-N 3.34Å
36	V	90.1	Very high	91.5	Very high	95 Å²	95	78.9 Å²	78.9	58%	0.576	44%	0.443	S	S	*	.	H	α-helix	trans	-60.7	-44.2	177.2	170	0	0	0	0	111.2	C32 V33 C34 V38 L39 W40	C32-V36 WeakPolarHBondContact O-CG2 3.34Å; C32-V36 PolarHBondContact O-N 3.44Å; V33-V36 PolarHBondContact O-N 2.95Å; C34-V36 PolarHBondContact O-N 3.42Å; V36-V38 PolarHBondContact O-N 2.87Å; V36-L39 PolarHBondContact O-N 3.45Å; V36-W40 VanDerWaalsContact O-CB 3.28Å; V36-W40 WeakPolarHBondContact O-CB 3.34Å; V36-W40 PolarHBondContact O-N 3.27Å
37	I	92.5	Very high	91.3	Very high	106 Å²	106	76.6 Å²	76.6	54%	0.544	43%	0.43	S	S	.	.	H	α-helix	trans	-61.4	-44.9	177.1	-68	167.5	0	0	0	110.7	V33 C34 L35 W40 G41	V33-I37 HydrophobicContact CG1-CD1 3.89Å; V33-I37 WeakPolarHBondContact O-CG1 3.23Å; V33-I37 PolarHBondContact O-N 3.37Å; C34-I37 PolarHBondContact O-N 3.41Å; L35-I37 VanDerWaalsContact C-N 3.35Å; L35-I37 PolarHBondContact O-N 3.48Å; I37-W40 PolarHBondContact O-N 3.34Å; I37-G41 PolarHBondContact O-N 3.01Å
38	V	92.9	Very high	90.9	Very high	84 Å²	84	81.1 Å²	81.1	51%	0.509	44%	0.438	S	S	.	.	H	α-helix	trans	-62.4	-48.9	177.8	169.8	0	0	0	0	111	C34 L35 V36 W40 G41 I42	C34-V38 VanDerWaalsContact O-CG2 3.32Å; C34-V38 WeakPolarHBondContact O-CG2 3.34Å; C34-V38 PolarHBondContact O-N 3.39Å; L35-V38 PolarHBondContact O-N 3.04Å; V36-V38 PolarHBondContact O-N 2.87Å; V38-W40 VanDerWaalsContact C-N 3.29Å; V38-W40 PolarHBondContact O-N 3.19Å; V38-G41 PolarHBondContact O-N 3.48Å; V38-I42 HydrophobicContact CG1-CD1 3.89Å; V38-I42 WeakPolarHBondContact O-CG1 3.5Å; V38-I42 PolarHBondContact O-N 2.95Å
39	L	91.4	Very high	90.4	Very high	59 Å²	59	83 Å²	83	31%	0.309	44%	0.438	S	S	.	.	H	α-helix	trans	-62.1	-37.8	178.7	-69.3	179	0	0	0	112	L35 V36 I42 R43 I188	L35-L39 HydrophobicContact CD1-CD1 4.21Å; L35-L39 HydrophobicContact CD1-CG 4.13Å; L35-L39 HydrophobicContact CG-CD1 4.04Å; L35-L39 HydrophobicContact CG-CG 4.35Å; L35-L39 WeakPolarHBondContact O-CB 3.45Å; L35-L39 VanDerWaalsContact O-CG 3.28Å; L35-L39 WeakPolarHBondContact O-CG 3.44Å; L35-L39 PolarHBondContact O-N 3.34Å; V36-L39 PolarHBondContact O-N 3.45Å; L39-I42 PolarHBondContact O-N 3.17Å; L39-R43 WeakPolarHBondContact O-CB 3.37Å; L39-R43 PolarHBondContact O-N 3.48Å; L39-I188 HydrophobicContact CD2-CD1 3.86Å; L39-I188 HydrophobicContact CD2-CG1 4.4Å
40	W	92.1	Very high	90	Very high	165 Å²	165	83 Å²	83	63%	0.625	43%	0.428	S	S	*	.	H	α-helix	trans	-66	-43.5	174.5	-173.6	78.5	0	0	0	111.9	V36 I37 V38 I42 R43 L44	V36-W40 VanDerWaalsContact O-CB 3.28Å; V36-W40 WeakPolarHBondContact O-CB 3.34Å; V36-W40 PolarHBondContact O-N 3.27Å; I37-W40 PolarHBondContact O-N 3.34Å; V38-W40 VanDerWaalsContact C-N 3.29Å; V38-W40 PolarHBondContact O-N 3.19Å; W40-I42 VanDerWaalsContact C-N 3.34Å; W40-I42 PolarHBondContact O-N 2.96Å; W40-R43 WeakPolarHBondContact O-CB 3.36Å; W40-R43 PolarHBondContact O-N 2.93Å; W40-L44 HydrophobicContact CD2-CD1 4.04Å; W40-L44 HydrophobicContact CD2-CG 4.4Å; W40-L44 HydrophobicContact CE3-CD1 3.77Å; W40-L44 HydrophobicContact CH2-CD1 3.55Å; W40-L44 HydrophobicContact CZ2-CD1 3.79Å; W40-L44 HydrophobicContact CZ2-CD2 4.47Å; W40-L44 HydrophobicContact CZ2-CG 4.41Å; W40-L44 HydrophobicContact CZ3-CD1 3.52Å; W40-L44 WeakPolarHBondContact O-CG 3.32Å; W40-L44 PolarHBondContact O-N 2.72Å
41	G	92.3	Very high	89.1	Confident	27 Å²	27	86.7 Å²	86.7	28%	0.278	44%	0.438	S	S	.	.	H	α-helix	trans	-58.1	-44.7	172.8	0	0	0	0	0	112.2	I37 V38 L44 L45	I37-G41 PolarHBondContact O-N 3.01Å; V38-G41 PolarHBondContact O-N 3.48Å; G41-L44 PolarHBondContact O-N 3.04Å; G41-L45 WeakPolarHBondContact O-CG 3.2Å; G41-L45 PolarHBondContact O-N 3.27Å; G41-L45 VanDerWaalsContact O-N 3.09Å
42	I	92	Very high	87.9	Confident	43 Å²	43	88 Å²	88	22%	0.221	44%	0.444	C	S	.	.	H	α-helix	trans	-63.9	-44.2	176.4	-63	163.4	0	0	0	111.1	V38 L39 W40 L44 L45 L46 W161 I188	V38-I42 HydrophobicContact CG1-CD1 3.89Å; V38-I42 WeakPolarHBondContact O-CG1 3.5Å; V38-I42 PolarHBondContact O-N 2.95Å; L39-I42 PolarHBondContact O-N 3.17Å; W40-I42 VanDerWaalsContact C-N 3.34Å; W40-I42 PolarHBondContact O-N 2.96Å; I42-L44 VanDerWaalsContact C-N 3.29Å; I42-L44 PolarHBondContact O-N 3.47Å; I42-L45 WeakPolarHBondContact O-CB 3.45Å; I42-L45 PolarHBondContact O-N 3.48Å; I42-L45 VanDerWaalsContact O-N 3.12Å; I42-L46 HydrophobicContact CG2-CD1 3.87Å; I42-L46 HydrophobicContact CG2-CG 4.11Å; I42-L46 WeakPolarHBondContact O-CG 3.47Å; I42-L46 PolarHBondContact O-N 3.06Å; I42-W161 HydrophobicContact CD1-CH2 4.22Å; I42-W161 HydrophobicContact CG2-CH2 3.69Å; I42-W161 HydrophobicContact CG2-CZ2 4.41Å; I42-I188 HydrophobicContact CG2-CG2 4.36Å
43	R	92.5	Very high	86.8	Confident	76 Å²	76	89.7 Å²	89.7	29%	0.287	45%	0.452	S	S	.	.	H	α-helix	trans	-54.2	-46.2	174.6	174	176.3	179.2	132.3	-1.8	111.4	L39 W40 L45 L46 Q47 Y187 I188	L39-R43 WeakPolarHBondContact O-CB 3.37Å; L39-R43 PolarHBondContact O-N 3.48Å; W40-R43 WeakPolarHBondContact O-CB 3.36Å; W40-R43 PolarHBondContact O-N 2.93Å; R43-L45 VanDerWaalsContact C-N 3.34Å; R43-L45 PolarHBondContact O-N 3.43Å; R43-L46 PolarHBondContact O-N 3.41Å; R43-Q47 HydrophobicContact CG-CG 4.4Å; R43-Q47 WeakPolarHBondContact O-CB 3.31Å; R43-Q47 WeakPolarHBondContact O-CG 3.33Å; R43-Q47 PolarHBondContact O-N 3.3Å; R43-Y187 WeakPolarHBondContact CD-O 3.13Å; R43-Y187 PolarHBondContact NH1-O 2.61Å; R43-I188 WeakPolarHBondContact CB-O 3.26Å; R43-I188 WeakPolarHBondContact CG-O 3.3Å
44	L	91	Very high	85.4	Confident	57 Å²	57	86 Å²	86	30%	0.298	43%	0.43	S	S	.	.	H	α-helix	trans	-62.2	-41	177.9	-69.6	178.1	0	0	0	112.5	W40 G41 I42 Q47 R48	W40-L44 HydrophobicContact CD2-CD1 4.04Å; W40-L44 HydrophobicContact CD2-CG 4.4Å; W40-L44 HydrophobicContact CE3-CD1 3.77Å; W40-L44 HydrophobicContact CH2-CD1 3.55Å; W40-L44 HydrophobicContact CZ2-CD1 3.79Å; W40-L44 HydrophobicContact CZ2-CD2 4.47Å; W40-L44 HydrophobicContact CZ2-CG 4.41Å; W40-L44 HydrophobicContact CZ3-CD1 3.52Å; W40-L44 WeakPolarHBondContact O-CG 3.32Å; W40-L44 PolarHBondContact O-N 2.72Å; G41-L44 PolarHBondContact O-N 3.04Å; I42-L44 VanDerWaalsContact C-N 3.29Å; I42-L44 PolarHBondContact O-N 3.47Å; L44-Q47 PolarHBondContact O-N 3.49Å; L44-R48 VanDerWaalsContact O-CG 3.31Å; L44-R48 WeakPolarHBondContact O-CG 3.35Å; L44-R48 PolarHBondContact O-N 3.19Å
45	L	90.7	Very high	83.9	Confident	107 Å²	107	86.3 Å²	86.3	56%	0.56	43%	0.43	S	S	*	.	H	α-helix	trans	-64	-43.6	176.2	-68.2	174	0	0	0	111.8	G41 I42 R43 R48 K49	G41-L45 WeakPolarHBondContact O-CG 3.2Å; G41-L45 PolarHBondContact O-N 3.27Å; G41-L45 VanDerWaalsContact O-N 3.09Å; I42-L45 WeakPolarHBondContact O-CB 3.45Å; I42-L45 PolarHBondContact O-N 3.48Å; I42-L45 VanDerWaalsContact O-N 3.12Å; R43-L45 VanDerWaalsContact C-N 3.34Å; R43-L45 PolarHBondContact O-N 3.43Å; L45-R48 PolarHBondContact O-N 3.4Å; L45-K49 PolarHBondContact O-N 3.16Å
46	L	89.8	Confident	82.4	Confident	5 Å²	5	83.1 Å²	83.1	3%	0.026	42%	0.416	C	S	.	.	H	α-helix	trans	-63.6	-43.8	176.9	-73.3	176.5	0	0	0	111.7	I42 R43 R48 K49 K50 L164 M165 V168 I188	I42-L46 HydrophobicContact CG2-CD1 3.87Å; I42-L46 HydrophobicContact CG2-CG 4.11Å; I42-L46 WeakPolarHBondContact O-CG 3.47Å; I42-L46 PolarHBondContact O-N 3.06Å; R43-L46 PolarHBondContact O-N 3.41Å; L46-R48 VanDerWaalsContact C-N 3.32Å; L46-R48 PolarHBondContact O-N 3.26Å; L46-K49 PolarHBondContact O-N 3.44Å; L46-K50 WeakPolarHBondContact O-CB 3.37Å; L46-K50 PolarHBondContact O-N 3.37Å; L46-L164 HydrophobicContact CD1-CD2 3.85Å; L46-L164 HydrophobicContact CD1-CG 4.1Å; L46-M165 HydrophobicContact CD2-SD 3.9Å; L46-V168 HydrophobicContact CB-CG2 4.03Å; L46-V168 HydrophobicContact CD2-CG2 3.86Å; L46-V168 HydrophobicContact CG-CG2 4.39Å; L46-I188 HydrophobicContact CD1-CG2 3.79Å
47	Q	85.8	Confident	80.6	Confident	68 Å²	68	88.9 Å²	88.9	32%	0.318	43%	0.434	S	S	.	.	H	α-helix	trans	-65.2	-34.6	176.8	-73.3	-171.4	-19.4	0	0	112.8	R43 L44 K50 K51	R43-Q47 HydrophobicContact CG-CG 4.4Å; R43-Q47 WeakPolarHBondContact O-CB 3.31Å; R43-Q47 WeakPolarHBondContact O-CG 3.33Å; R43-Q47 PolarHBondContact O-N 3.3Å; L44-Q47 PolarHBondContact O-N 3.49Å; Q47-K50 PolarHBondContact O-N 3.18Å; Q47-K51 PolarHBondContact O-N 2.98Å
48	R	84.3	Confident	78.8	Confident	174 Å²	174	90.7 Å²	90.7	66%	0.657	44%	0.444	S	S	*	.	H	α-helix	trans	-65.4	-45.1	172.3	-74.6	175.2	-178.6	-173.5	1.1	111.6	L44 L45 L46 K50 K51 L52	L44-R48 VanDerWaalsContact O-CG 3.31Å; L44-R48 WeakPolarHBondContact O-CG 3.35Å; L44-R48 PolarHBondContact O-N 3.19Å; L45-R48 PolarHBondContact O-N 3.4Å; L46-R48 VanDerWaalsContact C-N 3.32Å; L46-R48 PolarHBondContact O-N 3.26Å; R48-K50 VanDerWaalsContact C-N 3.34Å; R48-K50 PolarHBondContact O-N 2.87Å; R48-K51 PolarHBondContact O-N 2.94Å; R48-L52 PolarHBondContact O-N 2.67Å
49	K	80.8	Confident	77.2	Confident	116 Å²	116	89.7 Å²	89.7	50%	0.504	45%	0.451	S	S	.	.	H	α-helix	trans	-60.5	-42.2	174.7	-76.5	-172.3	175.2	-172.7	0	112	L45 L46 K51 L52 V53	L45-K49 PolarHBondContact O-N 3.16Å; L46-K49 PolarHBondContact O-N 3.44Å; K49-K51 PolarHBondContact O-N 2.72Å; K49-L52 WeakPolarHBondContact O-CB 3.23Å; K49-L52 PolarHBondContact O-N 3.13Å; K49-V53 PolarHBondContact O-N 3.31Å
50	K	82.4	Confident	75.9	Confident	37 Å²	37	94.6 Å²	94.6	16%	0.161	47%	0.47	C	S	.	.	H	α-helix	trans	-56	-49	177.1	-179.7	177.3	175.2	176.4	0	112.5	L46 Q47 R48 L52 V53 S54 V168 P169 D170	L46-K50 WeakPolarHBondContact O-CB 3.37Å; L46-K50 PolarHBondContact O-N 3.37Å; Q47-K50 PolarHBondContact O-N 3.18Å; R48-K50 VanDerWaalsContact C-N 3.34Å; R48-K50 PolarHBondContact O-N 2.87Å; K50-L52 PolarHBondContact O-N 3.46Å; K50-V53 PolarHBondContact O-N 3.21Å; K50-V53 VanDerWaalsContact O-N 3.09Å; K50-S54 PolarHBondContact O-N 3.34Å; K50-S54 PolarHBondContact O-OG 3.1Å; K50-V168 HydrophobicContact CB-CB 4.28Å; K50-V168 HydrophobicContact CD-CB 4.42Å; K50-V168 HydrophobicContact CD-CG1 4.06Å; K50-P169 PolarHBondContact NZ-O 3.27Å; K50-D170 WeakPolarHBondContact CE-OD1 3.41Å; K50-D170 VanDerWaalsContact NZ-CA 3.32Å; K50-D170 IonicContact NZ-OD1 3.75Å; K50-D170 PolarHBondContact NZ-OD1 3.4Å
51	K	72.8	Confident	74.9	Confident	151 Å²	151	92.3 Å²	92.3	66%	0.657	47%	0.47	S	S	*	.	H	α-helix	trans	-59	-34.8	178.8	-74.9	-174.3	178.7	-173.7	0	113	Q47 R48 K49 S54 T55	Q47-K51 PolarHBondContact O-N 2.98Å; R48-K51 PolarHBondContact O-N 2.94Å; K49-K51 PolarHBondContact O-N 2.72Å; K51-S54 PolarHBondContact O-OG 3.22Å; K51-T55 PolarHBondContact O-OG1 3.28Å
52	L	66.9	Low	74.6	Confident	139 Å²	139	94.2 Å²	94.2	73%	0.728	47%	0.471	S	S	*	.	H	α-helix	trans	-69	-35.1	177.7	-69.7	163.5	0	0	0	112.1	R48 K49 K50	R48-L52 PolarHBondContact O-N 2.67Å; K49-L52 WeakPolarHBondContact O-CB 3.23Å; K49-L52 PolarHBondContact O-N 3.13Å; K50-L52 PolarHBondContact O-N 3.46Å
53	V	67.3	Low	74.6	Confident	112 Å²	112	95.6 Å²	95.6	68%	0.679	48%	0.478	S	S	*	.	H	α-helix	trans	-82.5	-33.3	-179.3	178.8	0	0	0	0	112.1	K49 K50 T55	K49-V53 PolarHBondContact O-N 3.31Å; K50-V53 PolarHBondContact O-N 3.21Å; K50-V53 VanDerWaalsContact O-N 3.09Å; V53-T55 PolarHBondContact O-N 2.87Å
54	S	63.3	Low	74.7	Confident	11 Å²	11	92.5 Å²	92.5	8%	0.077	47%	0.467	C	S	.	.	H	α-helix	trans	-73.3	-13.7	-179.1	70.3	0	0	0	0	114	K50 K51 S56 N61 Q62	K50-S54 PolarHBondContact O-N 3.34Å; K50-S54 PolarHBondContact O-OG 3.1Å; K51-S54 PolarHBondContact O-OG 3.22Å; S54-S56 PolarHBondContact O-N 2.8Å; S54-N61 WeakPolarHBondContact O-CA 3.46Å; S54-N61 PolarHBondContact O-OD1 3.29Å; S54-N61 PolarHBondContact OG-OD1 2.75Å; S54-Q62 PolarHBondContact O-N 2.94Å; S54-Q62 VanDerWaalsContact O-N 3.15Å
55	T	61.4	Low	75	Confident	79 Å²	79	89.8 Å²	89.8	49%	0.485	45%	0.453	S	S	.	.	B	Isolated β-bridge	trans	-80.9	103	-177.5	-49.4	0	0	0	0	109.8	K51 V53	K51-T55 PolarHBondContact O-OG1 3.28Å; V53-T55 PolarHBondContact O-N 2.87Å
56	S	58.7	Low	75.4	Confident	35 Å²	35	84.7 Å²	84.7	25%	0.245	43%	0.426	C	S	.	.			trans	-63.1	158.2	174.9	175.5	0	0	0	0	111.9	S54 N58 G59 K60	S54-S56 PolarHBondContact O-N 2.8Å; S56-N58 PolarHBondContact O-N 3.22Å; S56-N58 PolarHBondContact OG-N 2.84Å; S56-G59 PolarHBondContact O-N 2.84Å; S56-K60 VanDerWaalsContact CB-O 3.24Å; S56-K60 WeakPolarHBondContact CB-O 3.23Å; S56-K60 PolarHBondContact N-O 3.49Å
57	K	51.3	Low	75.8	Confident	216 Å²	216	84.6 Å²	84.6	94%	0.939	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	-22.3	170	-74.2	-174.8	177.1	-178.9	0	113.3
58	N	54.7	Low	76.4	Confident	144 Å²	144	81.3 Å²	81.3	77%	0.77	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	9.3	178.8	-67.4	-4.7	0	0	0	114.3	S56 K60	S56-N58 PolarHBondContact O-N 3.22Å; S56-N58 PolarHBondContact OG-N 2.84Å; N58-K60 VanDerWaalsContact C-N 3.27Å; N58-K60 PolarHBondContact O-N 3.49Å
59	G	60	Low	77.1	Confident	63 Å²	63	73.1 Å²	73.1	65%	0.649	38%	0.38	S	S	*	.	S	Bend	trans	74.8	4	176.7	0	0	0	0	0	116	S56	S56-G59 PolarHBondContact O-N 2.84Å
60	K	63.1	Low	77.8	Confident	161 Å²	161	67.6 Å²	67.6	70%	0.7	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-91.6	134.9	172.2	-68.5	-174.9	179.2	-179.5	0	110.6	S56 N58 Q62	S56-K60 VanDerWaalsContact CB-O 3.24Å; S56-K60 WeakPolarHBondContact CB-O 3.23Å; S56-K60 PolarHBondContact N-O 3.49Å; N58-K60 VanDerWaalsContact C-N 3.27Å; N58-K60 PolarHBondContact O-N 3.49Å; K60-Q62 PolarHBondContact O-N 3.42Å
61	N	71.8	Confident	78.3	Confident	117 Å²	117	67.9 Å²	67.9	63%	0.626	36%	0.356	S	S	*	.	B	Isolated β-bridge	trans	-71.7	118.5	170.2	-94.5	-18.7	0	0	0	109.6	S54	S54-N61 WeakPolarHBondContact O-CA 3.46Å; S54-N61 PolarHBondContact O-OD1 3.29Å; S54-N61 PolarHBondContact OG-OD1 2.75Å
62	Q	86.1	Confident	79.3	Confident	67 Å²	67	60.7 Å²	60.7	31%	0.313	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-90.2	136.7	171.2	-70	-178.1	-50.9	0	0	109.9	S54 K60 E95 V97	S54-Q62 PolarHBondContact O-N 2.94Å; S54-Q62 VanDerWaalsContact O-N 3.15Å; K60-Q62 PolarHBondContact O-N 3.42Å; Q62-E95 PolarHBondContact NE2-O 3.5Å; Q62-V97 HydrophobicContact CB-CG2 4.03Å
63	M	92.1	Very high	80.4	Confident	72 Å²	72	55.8 Å²	55.8	36%	0.355	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-72.6	129.7	175.6	-175.9	-177.1	-73	0	0	109.9	I65 A96 V97 D170 V171 F491	M63-I65 HydrophobicContact CG-CG1 4.34Å; M63-I65 HydrophobicContact SD-CG1 4.39Å; M63-A96 CarbonylContact O-C 3.22Å; M63-A96 WeakPolarHBondContact O-CA 3.39Å; M63-A96 WeakPolarHBondContact O-CB 3.39Å; M63-V97 PolarHBondContact O-N 2.83Å; M63-D170 WeakPolarHBondContact CA-OD2 3.31Å; M63-D170 HydrophobicContact CG-CB 3.83Å; M63-V171 HydrophobicContact SD-CG2 4.4Å; M63-F491 HydrophobicContact CE-CD1 4.31Å; M63-F491 HydrophobicContact SD-CD1 3.49Å; M63-F491 WeakPolarHBondContact SD-CD1 3.42Å; M63-F491 HydrophobicContact SD-CE1 3.93Å
64	V	95.3	Very high	81.2	Confident	11 Å²	11	53 Å²	53	7%	0.067	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	118.8	177.5	-176	0	0	0	0	109.6	V97 V99 P169 D170 V171	V64-V97 WeakPolarHBondContact CA-O 3.42Å; V64-V97 HydrophobicContact CG2-CB 4.4Å; V64-V99 HydrophobicContact CG1-CG2 3.91Å; V64-P169 HydrophobicContact CB-CB 4.49Å; V64-P169 HydrophobicContact CG1-CB 4.09Å; V64-D170 PolarHBondContact N-OD2 3.43Å; V64-D170 WeakPolarHBondContact O-CB 3.21Å; V64-D170 PolarHBondContact O-N 2.99Å; V64-V171 PolarHBondContact O-N 2.96Å; V64-V171 VanDerWaalsContact O-N 3.1Å
65	I	97.6	Very high	81.9	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	119.5	177.4	-53.1	171.5	0	0	0	107.9	M63 F67 L89 A96 V97 Y98 V99 V171 F491	M63-I65 HydrophobicContact CG-CG1 4.34Å; M63-I65 HydrophobicContact SD-CG1 4.39Å; I65-F67 HydrophobicContact CG2-CE2 4.24Å; I65-L89 HydrophobicContact CG2-CD1 4.08Å; I65-A96 HydrophobicContact CD1-CB 3.7Å; I65-A96 HydrophobicContact CG1-CB 4.21Å; I65-V97 PolarHBondContact N-O 3.21Å; I65-Y98 HydrophobicContact CB-CD1 4.22Å; I65-Y98 HydrophobicContact CB-CE1 4.24Å; I65-Y98 HydrophobicContact CD1-CE1 3.77Å; I65-Y98 WeakPolarHBondContact O-CA 3.45Å; I65-V99 PolarHBondContact O-N 3.17Å; I65-V171 HydrophobicContact CG1-CB 4.43Å; I65-V171 HydrophobicContact CG2-CB 4.28Å; I65-V171 HydrophobicContact CG2-CG1 4.37Å; I65-F491 HydrophobicContact CD1-CE1 3.48Å; I65-F491 VanDerWaalsContact CD1-CE1 3.48Å; I65-F491 HydrophobicContact CD1-CZ 4.01Å; I65-F491 HydrophobicContact CG1-CE1 3.9Å
66	A	98.1	Very high	82.9	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	134.4	-177.5	0	0	0	0	0	112.9	V99 Y101 P169 V171 Y172 I173	A66-V99 CarbonylContact C-O 3.56Å; A66-V99 VanDerWaalsContact CA-O 3.25Å; A66-V99 WeakPolarHBondContact CA-O 3.18Å; A66-V99 HydrophobicContact CB-CB 3.86Å; A66-V99 HydrophobicContact CB-CG1 4.26Å; A66-Y101 HydrophobicContact CB-CD2 4.15Å; A66-Y101 HydrophobicContact CB-CE2 3.34Å; A66-P169 HydrophobicContact CB-CB 3.62Å; A66-P169 HydrophobicContact CB-CG 3.87Å; A66-V171 PolarHBondContact N-O 3.43Å; A66-Y172 CarbonylContact O-C 3.54Å; A66-Y172 WeakPolarHBondContact O-CA 3.05Å; A66-I173 PolarHBondContact O-N 2.99Å
67	F	98.6	Very high	84.1	Confident	3 Å²	3	50.8 Å²	50.8	1%	0.013	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	130.9	171.4	-75.9	-102.8	0	0	0	110.1	I65 L82 A85 L86 L89 V99 V100 Y101 I173 F483	I65-F67 HydrophobicContact CG2-CE2 4.24Å; F67-L82 HydrophobicContact CB-CD1 3.52Å; F67-L82 HydrophobicContact CD1-CD1 3.51Å; F67-L82 HydrophobicContact CD2-CD1 4.43Å; F67-L82 HydrophobicContact CE1-CD1 4.31Å; F67-L82 HydrophobicContact CG-CD1 3.57Å; F67-A85 HydrophobicContact CE1-CB 3.9Å; F67-A85 HydrophobicContact CZ-CB 3.94Å; F67-L86 HydrophobicContact CD2-CD2 3.57Å; F67-L86 HydrophobicContact CD2-CG 3.98Å; F67-L86 HydrophobicContact CE2-CD2 3.55Å; F67-L86 HydrophobicContact CE2-CG 3.91Å; F67-L86 HydrophobicContact CZ-CD2 4.48Å; F67-L86 HydrophobicContact CZ-CG 4.41Å; F67-L89 HydrophobicContact CE2-CD1 3.68Å; F67-L89 HydrophobicContact CZ-CD1 3.63Å; F67-V99 PolarHBondContact N-O 3.18Å; F67-V100 HydrophobicContact CB-CG2 4.49Å; F67-Y101 WeakPolarHBondContact O-CD2 3.32Å; F67-Y101 PolarHBondContact O-N 3.06Å; F67-I173 WeakPolarHBondContact CA-O 3.43Å; F67-I173 HydrophobicContact CD1-CB 4Å; F67-I173 HydrophobicContact CD1-CG2 4.02Å; F67-I173 HydrophobicContact CE1-CB 4.03Å; F67-I173 HydrophobicContact CE1-CD1 4.02Å; F67-I173 HydrophobicContact CE1-CG2 3.84Å; F67-I173 HydrophobicContact CE2-CD1 4.18Å; F67-I173 HydrophobicContact CG-CB 4.44Å; F67-I173 HydrophobicContact CZ-CB 4.47Å; F67-I173 HydrophobicContact CZ-CD1 3.71Å; F67-F483 HydrophobicContact CZ-CZ 4.35Å
68	F	98.5	Very high	85.9	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	109.1	168.9	-165.3	-96.2	0	0	0	109.3	P70 Y101 L133 L159 A163 Y172 I173 S175 Y178 T181	F68-P70 HydrophobicContact CD1-CG 4Å; F68-P70 HydrophobicContact CE1-CG 3.5Å; F68-P70 HydrophobicContact CZ-CG 3.93Å; F68-Y101 HydrophobicContact CB-CD2 4.35Å; F68-Y101 HydrophobicContact CD2-CD2 4Å; F68-Y101 HydrophobicContact CD2-CG 4.2Å; F68-L133 HydrophobicContact CE2-CD1 3.88Å; F68-L133 HydrophobicContact CZ-CD1 4.39Å; F68-L159 HydrophobicContact CE1-CD2 4.44Å; F68-L159 HydrophobicContact CE2-CG 4.38Å; F68-L159 HydrophobicContact CZ-CB 4.29Å; F68-L159 HydrophobicContact CZ-CD2 3.85Å; F68-L159 HydrophobicContact CZ-CG 3.79Å; F68-A163 HydrophobicContact CD2-CB 4.26Å; F68-A163 HydrophobicContact CE2-CB 3.97Å; F68-Y172 HydrophobicContact CB-CE2 3.54Å; F68-Y172 WeakPolarHBondContact CB-OH 3.23Å; F68-Y172 HydrophobicContact CD2-CE2 4.15Å; F68-Y172 HydrophobicContact CG-CE2 4.13Å; F68-Y172 WeakPolarHBondContact CG-OH 3.42Å; F68-I173 PolarHBondContact N-O 3.5Å; F68-S175 PolarHBondContact O-N 2.86Å; F68-S175 PolarHBondContact O-OG 2.85Å; F68-S175 VanDerWaalsContact O-OG 3.06Å; F68-Y178 HydrophobicContact CD1-CD2 4.03Å; F68-Y178 AromaticContact CE1-CD2 3.66Å; F68-Y178 HydrophobicContact CE1-CD2 3.66Å; F68-Y178 HydrophobicContact CE1-CE2 4.49Å; F68-Y178 HydrophobicContact CE1-CG 4.03Å; F68-T181 HydrophobicContact CD1-CG2 4.45Å; F68-T181 HydrophobicContact CE1-CG2 4Å; F68-T181 HydrophobicContact CZ-CG2 4.05Å
69	H	97.7	Very high	87.7	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.005	22%	0.217	C	C	.	.			trans	-148	78.9	-177.1	-150.3	100.8	0	0	0	110.7	Y71 G78 L82 Y101 S175	H69-Y71 PolarHBondContact CD2-O 3.2Å; H69-Y71 PolarHBondContact O-N 2.79Å; H69-G78 PolarHBondContact CE1-O 3.13Å; H69-L82 HydrophobicContact CB-CD1 4.36Å; H69-L82 HydrophobicContact CB-CD2 3.82Å; H69-Y101 CarbonylContact C-O 3.54Å; H69-Y101 PolarHBondContact N-O 3.46Å; H69-S175 PolarHBondContact CE1-O 3.23Å; H69-S175 VanDerWaalsContact CE1-O 3.27Å; H69-S175 PolarHBondContact ND1-O 2.85Å; H69-S175 PolarHBondContact ND1-OG 3.06Å
70	P	96.1	Very high	89.2	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.188	C	C	.	.	S	Bend	trans	-59.6	-16.4	-174.1	-27.5	36.9	0	0	0	116.3	F68 G103 R136 L159 Y178	F68-P70 HydrophobicContact CD1-CG 4Å; F68-P70 HydrophobicContact CE1-CG 3.5Å; F68-P70 HydrophobicContact CZ-CG 3.93Å; P70-G103 PolarHBondContact O-N 3Å; P70-R136 HydrophobicContact CB-CG 4.33Å; P70-R136 VanDerWaalsContact O-CD 3.26Å; P70-R136 WeakPolarHBondContact O-CD 3.37Å; P70-R136 PolarHBondContact O-NH1 2.92Å; P70-R136 VanDerWaalsContact O-NH1 3.11Å; P70-L159 HydrophobicContact CB-CD2 4.15Å; P70-L159 HydrophobicContact CG-CD2 3.81Å; P70-Y178 HydrophobicContact CB-CE2 4.49Å; P70-Y178 HydrophobicContact CG-CD2 4.08Å; P70-Y178 HydrophobicContact CG-CE2 3.75Å
71	Y	93.5	Very high	90.8	Very high	43 Å²	43	24.8 Å²	24.8	17%	0.169	16%	0.156	C	C	.	.			trans	-124.4	66	-179.1	-57.2	-91.2	0	0	0	110.7	H69 N73 E79 R136 V139 E140 M176 Y178	H69-Y71 PolarHBondContact CD2-O 3.2Å; H69-Y71 PolarHBondContact O-N 2.79Å; Y71-N73 VanDerWaalsContact C-N 3.31Å; Y71-N73 PolarHBondContact O-N 2.79Å; Y71-E79 WeakPolarHBondContact O-CG 3.17Å; Y71-R136 HydrophobicContact CE1-CG 4.35Å; Y71-R136 HydrophobicContact CE2-CG 4.5Å; Y71-V139 HydrophobicContact CE2-CG2 4.33Å; Y71-E140 WeakPolarHBondContact CE1-OE1 3.32Å; Y71-E140 PolarHBondContact OH-OE1 2.96Å; Y71-E140 PolarHBondContact OH-OE2 2.84Å; Y71-M176 HydrophobicContact CD2-CE 3.88Å; Y71-M176 HydrophobicContact CG-CE 4.4Å; Y71-Y178 WeakPolarHBondContact CE2-OH 3.21Å
72	C	92.9	Very high	92	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89	6.9	-175.1	69.7	0	0	0	0	113.9	E79 L82 W83 T102 D104	C72-E79 VanDerWaalsContact C-CD 3.49Å; C72-L82 HydrophobicContact CB-CD2 3.89Å; C72-W83 HydrophobicContact CB-CH2 4.35Å; C72-W83 HydrophobicContact CB-CZ2 3.96Å; C72-W83 WeakPolarHBondContact O-CZ2 3.46Å; C72-T102 WeakPolarHBondContact SG-CB 2.97Å; C72-T102 PolarHBondContact SG-OG1 3.37Å; C72-D104 PolarHBondContact N-OD2 2.92Å; C72-D104 PolarHBondContact SG-OD2 3.24Å
73	N	91.3	Very high	92.6	Very high	36 Å²	36	16 Å²	16	19%	0.193	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-133.8	19.2	-178.1	-170.4	31.5	0	0	0	114.5	Y71 E79 D104 I112 R119	Y71-N73 VanDerWaalsContact C-N 3.31Å; Y71-N73 PolarHBondContact O-N 2.79Å; N73-E79 WeakPolarHBondContact CA-OE2 3.43Å; N73-E79 PolarHBondContact N-OE2 2.94Å; N73-D104 PolarHBondContact N-OD2 2.85Å; N73-I112 HydrophobicContact CB-CG1 4.26Å; N73-R119 PolarHBondContact O-NH1 3.01Å; N73-R119 PolarHBondContact OD1-NH1 2.95Å
74	A	83.4	Confident	92.8	Very high	53 Å²	53	12.8 Å²	12.8	44%	0.438	10%	0.095	S	C	.	.	S	Bend	trans	-85	-8.7	-179.4	0	0	0	0	0	114.3	E79	A74-E79 WeakPolarHBondContact CA-OE1 3.31Å; A74-E79 VanDerWaalsContact CB-OE1 3.25Å; A74-E79 WeakPolarHBondContact CB-OE1 3.14Å; A74-E79 PolarHBondContact N-OE1 2.96Å; A74-E79 PolarHBondContact N-OE2 3.33Å; A74-E79 VanDerWaalsContact N-OE2 3.16Å
75	G	77.7	Confident	92.9	Very high	22 Å²	22	12.3 Å²	12.3	23%	0.227	9%	0.093	C	C	.	.			trans	72.9	24.5	-176.5	0	0	0	0	0	115.1	E79	G75-E79 PolarHBondContact N-OE1 3.36Å; G75-E79 PolarHBondContact N-OE2 3.35Å
76	G	81.4	Confident	93	Very high	22 Å²	22	12.3 Å²	12.3	23%	0.227	9%	0.093	C	C	.	.			trans	-89.5	166.1	-179.2	0	0	0	0	0	115.1	G78 E79 R80 F120	G76-G78 PolarHBondContact O-N 3.06Å; G76-E79 PolarHBondContact N-OE1 3Å; G76-E79 WeakPolarHBondContact O-CB 3.26Å; G76-E79 PolarHBondContact O-N 3.16Å; G76-E79 VanDerWaalsContact O-N 3.14Å; G76-R80 PolarHBondContact O-N 3.23Å; G76-F120 VanDerWaalsContact O-CZ 3.26Å; G76-F120 WeakPolarHBondContact O-CZ 3.31Å
77	G	84.4	Confident	92.9	Very high	36 Å²	36	14.3 Å²	14.3	37%	0.371	10%	0.1	S	C	.	.	H	α-helix	trans	-60.6	-28	174.7	0	0	0	0	0	114	R80 V81	G77-R80 WeakPolarHBondContact O-CB 3.49Å; G77-R80 PolarHBondContact O-N 3.32Å; G77-V81 WeakPolarHBondContact O-CG2 2.95Å; G77-V81 PolarHBondContact O-N 2.72Å
78	G	89.1	Confident	92.9	Very high	18 Å²	18	14.1 Å²	14.1	19%	0.186	10%	0.099	C	C	.	.	H	α-helix	trans	-63.6	-39.6	173.9	0	0	0	0	0	113.2	H69 G76 R80 V81 L82	H69-G78 PolarHBondContact CE1-O 3.13Å; G76-G78 PolarHBondContact O-N 3.06Å; G78-R80 VanDerWaalsContact C-N 3.32Å; G78-R80 PolarHBondContact O-N 2.91Å; G78-V81 WeakPolarHBondContact O-CB 3.42Å; G78-V81 PolarHBondContact O-N 2.91Å; G78-L82 PolarHBondContact O-N 3.43Å
79	E	92.3	Very high	92.9	Very high	5 Å²	5	14.1 Å²	14.1	2%	0.023	10%	0.099	C	C	.	.	H	α-helix	trans	-63	-40.5	173.8	-78.9	161	-110.9	0	0	111.6	Y71 C72 N73 A74 G75 G76 V81 L82 W83 F120	Y71-E79 WeakPolarHBondContact O-CG 3.17Å; C72-E79 VanDerWaalsContact C-CD 3.49Å; N73-E79 WeakPolarHBondContact CA-OE2 3.43Å; N73-E79 PolarHBondContact N-OE2 2.94Å; A74-E79 WeakPolarHBondContact CA-OE1 3.31Å; A74-E79 VanDerWaalsContact CB-OE1 3.25Å; A74-E79 WeakPolarHBondContact CB-OE1 3.14Å; A74-E79 PolarHBondContact N-OE1 2.96Å; A74-E79 PolarHBondContact N-OE2 3.33Å; A74-E79 VanDerWaalsContact N-OE2 3.16Å; G75-E79 PolarHBondContact N-OE1 3.36Å; G75-E79 PolarHBondContact N-OE2 3.35Å; G76-E79 PolarHBondContact N-OE1 3Å; G76-E79 WeakPolarHBondContact O-CB 3.26Å; G76-E79 PolarHBondContact O-N 3.16Å; G76-E79 VanDerWaalsContact O-N 3.14Å; E79-V81 PolarHBondContact O-N 3.42Å; E79-L82 WeakPolarHBondContact O-CB 3.49Å; E79-L82 PolarHBondContact O-N 2.71Å; E79-L82 VanDerWaalsContact O-N 3.15Å; E79-W83 VanDerWaalsContact O-CG 3.31Å; E79-W83 PolarHBondContact O-N 3.34Å; E79-F120 HydrophobicContact CB-CE2 3.72Å; E79-F120 HydrophobicContact CB-CZ 4.02Å
80	R	92.6	Very high	92.9	Very high	11 Å²	11	14.1 Å²	14.1	4%	0.042	10%	0.099	C	C	.	.	H	α-helix	trans	-56.9	-43.4	176.4	-172.2	176.1	171.1	63.4	2.6	111.3	G76 G77 G78 W83 C84 F120 I122 P281 D476	G76-R80 PolarHBondContact O-N 3.23Å; G77-R80 WeakPolarHBondContact O-CB 3.49Å; G77-R80 PolarHBondContact O-N 3.32Å; G78-R80 VanDerWaalsContact C-N 3.32Å; G78-R80 PolarHBondContact O-N 2.91Å; R80-W83 PolarHBondContact O-N 2.86Å; R80-C84 WeakPolarHBondContact O-CB 3.47Å; R80-C84 PolarHBondContact O-N 2.88Å; R80-F120 HydrophobicContact CB-CD1 3.93Å; R80-F120 HydrophobicContact CB-CE1 4.04Å; R80-F120 HydrophobicContact CB-CG 4.19Å; R80-F120 HydrophobicContact CB-CZ 4.38Å; R80-F120 HydrophobicContact CG-CB 4.41Å; R80-F120 HydrophobicContact CG-CD1 4.15Å; R80-F120 HydrophobicContact CG-CG 4.28Å; R80-F120 PolarHBondContact NH1-O 2.88Å; R80-I122 HydrophobicContact CG-CD1 4.02Å; R80-P281 VanDerWaalsContact CD-O 3.3Å; R80-P281 WeakPolarHBondContact CD-O 3.45Å; R80-P281 HydrophobicContact CG-CG 4.3Å; R80-P281 PolarHBondContact NE-O 3Å; R80-D476 IonicContact CZ-OD1 3.02Å; R80-D476 IonicContact CZ-OD2 3.59Å; R80-D476 IonicContact NH2-OD1 2.64Å; R80-D476 PolarHBondContact NH2-OD1 3.16Å; R80-D476 IonicContact NH2-OD2 3.4Å; R80-D476 PolarHBondContact NH2-OD2 3.44Å
81	V	95.9	Very high	92.9	Very high	3 Å²	3	19.1 Å²	19.1	2%	0.018	12%	0.121	C	C	.	.	H	α-helix	trans	-61.2	-47.7	175.8	-178.4	0	0	0	0	111.2	G77 G78 E79 W83 C84 A85 Y196 H198 P280 P281 F479	G77-V81 WeakPolarHBondContact O-CG2 2.95Å; G77-V81 PolarHBondContact O-N 2.72Å; G78-V81 WeakPolarHBondContact O-CB 3.42Å; G78-V81 PolarHBondContact O-N 2.91Å; E79-V81 PolarHBondContact O-N 3.42Å; V81-W83 VanDerWaalsContact C-N 3.34Å; V81-W83 PolarHBondContact O-N 3.44Å; V81-C84 PolarHBondContact O-N 3.08Å; V81-A85 WeakPolarHBondContact O-CB 3.4Å; V81-A85 PolarHBondContact O-N 2.64Å; V81-Y196 HydrophobicContact CB-CE1 4.49Å; V81-Y196 HydrophobicContact CG1-CD1 3.89Å; V81-Y196 HydrophobicContact CG1-CD2 4.01Å; V81-Y196 HydrophobicContact CG1-CE1 3.71Å; V81-Y196 HydrophobicContact CG1-CE2 3.81Å; V81-Y196 HydrophobicContact CG1-CG 4.04Å; V81-Y196 HydrophobicContact CG2-CE1 4.23Å; V81-H198 VanDerWaalsContact CG2-CE1 3.48Å; V81-H198 WeakPolarHBondContact CG2-CE1 2.77Å; V81-P280 HydrophobicContact CG2-CB 3.99Å; V81-P281 HydrophobicContact CG2-CG 4.48Å; V81-F479 HydrophobicContact CG1-CE2 3.99Å; V81-F479 HydrophobicContact CG1-CZ 3.81Å
82	L	97.6	Very high	93.1	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-52.3	-51.6	175.6	168.5	68.5	0	0	0	111.5	F67 H69 C72 G78 E79 A85 L86 V100	F67-L82 HydrophobicContact CB-CD1 3.52Å; F67-L82 HydrophobicContact CD1-CD1 3.51Å; F67-L82 HydrophobicContact CD2-CD1 4.43Å; F67-L82 HydrophobicContact CE1-CD1 4.31Å; F67-L82 HydrophobicContact CG-CD1 3.57Å; H69-L82 HydrophobicContact CB-CD1 4.36Å; H69-L82 HydrophobicContact CB-CD2 3.82Å; C72-L82 HydrophobicContact CB-CD2 3.89Å; G78-L82 PolarHBondContact O-N 3.43Å; E79-L82 WeakPolarHBondContact O-CB 3.49Å; E79-L82 PolarHBondContact O-N 2.71Å; E79-L82 VanDerWaalsContact O-N 3.15Å; L82-A85 PolarHBondContact O-N 2.93Å; L82-L86 HydrophobicContact CD1-CD1 3.77Å; L82-L86 HydrophobicContact CD1-CG 4.25Å; L82-L86 HydrophobicContact CG-CD1 4.01Å; L82-L86 WeakPolarHBondContact O-CB 3.39Å; L82-L86 WeakPolarHBondContact O-CG 3.48Å; L82-L86 PolarHBondContact O-N 3.18Å; L82-V100 HydrophobicContact CD2-CG1 4.45Å
83	W	97.3	Very high	93.2	Very high	1 Å²	1	23.4 Å²	23.4	0%	0.004	14%	0.14	C	C	.	.	H	α-helix	trans	-70.7	-38.9	-173.9	-58.6	127.2	0	0	0	112.6	C72 E79 R80 V81 L86 R87 I112 L113 A116 F120 I122 L124 F130	C72-W83 HydrophobicContact CB-CH2 4.35Å; C72-W83 HydrophobicContact CB-CZ2 3.96Å; C72-W83 WeakPolarHBondContact O-CZ2 3.46Å; E79-W83 VanDerWaalsContact O-CG 3.31Å; E79-W83 PolarHBondContact O-N 3.34Å; R80-W83 PolarHBondContact O-N 2.86Å; V81-W83 VanDerWaalsContact C-N 3.34Å; V81-W83 PolarHBondContact O-N 3.44Å; W83-L86 HydrophobicContact CE3-CD1 3.69Å; W83-L86 HydrophobicContact CZ3-CD1 3.7Å; W83-R87 WeakPolarHBondContact O-CB 3.38Å; W83-R87 PolarHBondContact O-N 3.26Å; W83-I112 HydrophobicContact CH2-CG2 3.64Å; W83-I112 HydrophobicContact CZ2-CG2 3.48Å; W83-I112 VanDerWaalsContact CZ2-CG2 3.48Å; W83-L113 HydrophobicContact CE3-CD2 4.46Å; W83-L113 HydrophobicContact CH2-CD2 4.37Å; W83-L113 HydrophobicContact CZ3-CD2 3.98Å; W83-A116 HydrophobicContact CD2-CB 3.99Å; W83-A116 HydrophobicContact CG-CB 3.86Å; W83-F120 AromaticContact CD1-CD2 3.92Å; W83-I122 HydrophobicContact CB-CB 4.26Å; W83-I122 HydrophobicContact CB-CD1 3.7Å; W83-I122 HydrophobicContact CB-CG2 3.87Å; W83-L124 HydrophobicContact CE3-CD1 4.14Å; W83-L124 HydrophobicContact CZ3-CD1 4.27Å; W83-F130 HydrophobicContact CH2-CE1 4Å; W83-F130 HydrophobicContact CH2-CZ 4.04Å; W83-F130 HydrophobicContact CZ3-CZ 4.46Å
84	C	97.3	Very high	93.3	Very high	3 Å²	3	24.8 Å²	24.8	2%	0.02	15%	0.15	C	C	.	.	H	α-helix	trans	-65.3	-41.3	172.7	-76.6	0	0	0	0	111.8	R80 V81 R87 A88 I122 P281 F479	R80-C84 WeakPolarHBondContact O-CB 3.47Å; R80-C84 PolarHBondContact O-N 2.88Å; V81-C84 PolarHBondContact O-N 3.08Å; C84-R87 PolarHBondContact O-N 2.9Å; C84-A88 WeakPolarHBondContact O-CB 3.5Å; C84-A88 PolarHBondContact O-N 3.17Å; C84-I122 WeakPolarHBondContact SG-CD1 3.34Å; C84-P281 HydrophobicContact CB-CB 4.15Å; C84-P281 HydrophobicContact CB-CG 3.71Å; C84-F479 HydrophobicContact CB-CD1 3.77Å; C84-F479 HydrophobicContact CB-CE1 3.51Å; C84-F479 HydrophobicContact CB-CZ 4.48Å
85	A	98.2	Very high	93.7	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.008	16%	0.161	C	C	.	.	H	α-helix	trans	-63.6	-45.1	178.2	0	0	0	0	0	111.6	F67 V81 L82 A88 L89 F479 F483	F67-A85 HydrophobicContact CE1-CB 3.9Å; F67-A85 HydrophobicContact CZ-CB 3.94Å; V81-A85 WeakPolarHBondContact O-CB 3.4Å; V81-A85 PolarHBondContact O-N 2.64Å; L82-A85 PolarHBondContact O-N 2.93Å; A85-A88 PolarHBondContact O-N 3.45Å; A85-L89 WeakPolarHBondContact O-CG 3.44Å; A85-L89 PolarHBondContact O-N 2.9Å; A85-F479 HydrophobicContact CB-CE1 4.34Å; A85-F479 HydrophobicContact CB-CZ 4.18Å; A85-F483 HydrophobicContact CB-CD1 4.47Å; A85-F483 HydrophobicContact CB-CD2 4.28Å; A85-F483 HydrophobicContact CB-CE1 3.96Å; A85-F483 HydrophobicContact CB-CE2 3.72Å; A85-F483 HydrophobicContact CB-CZ 3.55Å
86	L	98	Very high	94.5	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-59.8	-47	174.1	-82.1	167	0	0	0	111.7	F67 L82 W83 A88 L89 Q90 Y98 V100 L124	F67-L86 HydrophobicContact CD2-CD2 3.57Å; F67-L86 HydrophobicContact CD2-CG 3.98Å; F67-L86 HydrophobicContact CE2-CD2 3.55Å; F67-L86 HydrophobicContact CE2-CG 3.91Å; F67-L86 HydrophobicContact CZ-CD2 4.48Å; F67-L86 HydrophobicContact CZ-CG 4.41Å; L82-L86 HydrophobicContact CD1-CD1 3.77Å; L82-L86 HydrophobicContact CD1-CG 4.25Å; L82-L86 HydrophobicContact CG-CD1 4.01Å; L82-L86 WeakPolarHBondContact O-CB 3.39Å; L82-L86 WeakPolarHBondContact O-CG 3.48Å; L82-L86 PolarHBondContact O-N 3.18Å; W83-L86 HydrophobicContact CE3-CD1 3.69Å; W83-L86 HydrophobicContact CZ3-CD1 3.7Å; L86-A88 VanDerWaalsContact C-N 3.34Å; L86-A88 PolarHBondContact O-N 3.34Å; L86-L89 PolarHBondContact O-N 3.37Å; L86-Q90 WeakPolarHBondContact O-CB 3.5Å; L86-Q90 VanDerWaalsContact O-CG 3.31Å; L86-Q90 WeakPolarHBondContact O-CG 3.38Å; L86-Q90 PolarHBondContact O-N 3.39Å; L86-Y98 HydrophobicContact CD2-CD1 3.73Å; L86-Y98 HydrophobicContact CD2-CG 4.25Å; L86-V100 HydrophobicContact CD1-CG2 3.75Å; L86-L124 HydrophobicContact CB-CD2 4.02Å; L86-L124 HydrophobicContact CD1-CD1 4.49Å
87	R	97.9	Very high	95.1	Very high	42 Å²	42	29.2 Å²	29.2	16%	0.158	16%	0.155	C	C	.	.	H	α-helix	trans	-59.1	-44.6	176.8	-177.1	177.5	66.2	-171.8	-3.2	111.6	W83 C84 Q90 K91 L124 I125 D476	W83-R87 WeakPolarHBondContact O-CB 3.38Å; W83-R87 PolarHBondContact O-N 3.26Å; C84-R87 PolarHBondContact O-N 2.9Å; R87-Q90 PolarHBondContact O-N 3.31Å; R87-K91 WeakPolarHBondContact O-CG 3.41Å; R87-K91 PolarHBondContact O-N 3.02Å; R87-L124 HydrophobicContact CB-CD2 4.04Å; R87-I125 HydrophobicContact CG-CD1 4.4Å; R87-D476 IonicContact NH2-OD2 3.74Å; R87-D476 PolarHBondContact NH2-OD2 3.33Å
88	A	98.1	Very high	95.7	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-61.1	-47	177.6	0	0	0	0	0	111.7	C84 A85 L86 K91 K92 E480 F483 L484	C84-A88 WeakPolarHBondContact O-CB 3.5Å; C84-A88 PolarHBondContact O-N 3.17Å; A85-A88 PolarHBondContact O-N 3.45Å; L86-A88 VanDerWaalsContact C-N 3.34Å; L86-A88 PolarHBondContact O-N 3.34Å; A88-K91 PolarHBondContact O-N 2.9Å; A88-K92 PolarHBondContact O-N 2.86Å; A88-E480 HydrophobicContact CB-CB 4.37Å; A88-E480 HydrophobicContact CB-CG 3.77Å; A88-F483 HydrophobicContact CB-CD1 4.21Å; A88-L484 HydrophobicContact CB-CD1 4.37Å; A88-L484 HydrophobicContact CB-CD2 4.15Å; A88-L484 HydrophobicContact CB-CG 4.14Å
89	L	97.9	Very high	96.2	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-64.9	-41.5	177.5	-69.2	171.7	0	0	0	111.9	I65 F67 A85 L86 K91 K92 Y93 Y98 I173 F483 L484 V487 F491	I65-L89 HydrophobicContact CG2-CD1 4.08Å; F67-L89 HydrophobicContact CE2-CD1 3.68Å; F67-L89 HydrophobicContact CZ-CD1 3.63Å; A85-L89 WeakPolarHBondContact O-CG 3.44Å; A85-L89 PolarHBondContact O-N 2.9Å; L86-L89 PolarHBondContact O-N 3.37Å; L89-K91 PolarHBondContact O-N 2.6Å; L89-K92 PolarHBondContact O-N 2.84Å; L89-Y93 HydrophobicContact CD2-CD2 3.98Å; L89-Y93 HydrophobicContact CD2-CE2 3.96Å; L89-Y93 PolarHBondContact O-N 2.77Å; L89-Y98 HydrophobicContact CB-CE1 3.58Å; L89-Y98 HydrophobicContact CD1-CE1 4.43Å; L89-Y98 PolarHBondContact O-OH 2.92Å; L89-I173 HydrophobicContact CD1-CD1 4.33Å; L89-F483 HydrophobicContact CD1-CE1 4.12Å; L89-F483 HydrophobicContact CD1-CZ 4.22Å; L89-F483 HydrophobicContact CD2-CE1 4.01Å; L89-F483 HydrophobicContact CG-CE1 3.79Å; L89-F483 HydrophobicContact CG-CZ 4.39Å; L89-L484 HydrophobicContact CD2-CD2 3.94Å; L89-V487 HydrophobicContact CD2-CG2 4Å; L89-F491 HydrophobicContact CD2-CE2 3.92Å; L89-F491 HydrophobicContact CD2-CZ 3.71Å
90	Q	97.4	Very high	96.5	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-58.6	-35.9	178.2	-80.9	-176.8	-8.1	0	0	112.3	L86 R87 P94 Y98 I125 H126	L86-Q90 WeakPolarHBondContact O-CB 3.5Å; L86-Q90 VanDerWaalsContact O-CG 3.31Å; L86-Q90 WeakPolarHBondContact O-CG 3.38Å; L86-Q90 PolarHBondContact O-N 3.39Å; R87-Q90 PolarHBondContact O-N 3.31Å; Q90-P94 WeakPolarHBondContact O-CA 3.3Å; Q90-Y98 WeakPolarHBondContact CA-OH 3.44Å; Q90-Y98 HydrophobicContact CB-CE2 4.28Å; Q90-Y98 HydrophobicContact CG-CD1 4.43Å; Q90-Y98 HydrophobicContact CG-CD2 3.63Å; Q90-Y98 HydrophobicContact CG-CE1 4.21Å; Q90-Y98 HydrophobicContact CG-CE2 3.38Å; Q90-Y98 HydrophobicContact CG-CG 4.16Å; Q90-Y98 PolarHBondContact N-OH 3.01Å; Q90-I125 HydrophobicContact CB-CB 4.42Å; Q90-I125 HydrophobicContact CB-CD1 4.47Å; Q90-H126 HydrophobicContact CG-CB 4.25Å; Q90-H126 PolarHBondContact NE2-O 2.88Å
91	K	96.9	Very high	96.7	Very high	106 Å²	106	26 Å²	26	46%	0.461	13%	0.126	S	C	.	.	H	α-helix	trans	-66.6	-43.9	172.8	-67.9	172.5	177.3	178.3	0	112.3	R87 A88 L89 I125 E480	R87-K91 WeakPolarHBondContact O-CG 3.41Å; R87-K91 PolarHBondContact O-N 3.02Å; A88-K91 PolarHBondContact O-N 2.9Å; L89-K91 PolarHBondContact O-N 2.6Å; K91-I125 HydrophobicContact CB-CD1 4.43Å; K91-I125 HydrophobicContact CD-CD1 4.27Å; K91-I125 HydrophobicContact CG-CD1 3.28Å; K91-E480 WeakPolarHBondContact CD-OE1 3.35Å; K91-E480 VanDerWaalsContact NZ-CD 3.26Å; K91-E480 IonicContact NZ-OE1 2.72Å; K91-E480 PolarHBondContact NZ-OE1 2.8Å; K91-E480 IonicContact NZ-OE2 2.94Å; K91-E480 PolarHBondContact NZ-OE2 2.82Å
92	K	96.5	Very high	96.8	Very high	76 Å²	76	25.9 Å²	25.9	33%	0.33	13%	0.125	S	C	.	.	H	α-helix	trans	-77.6	-34.5	-175.9	-169.8	170.6	-179.8	173.3	0	113	A88 L89 L484 E488	A88-K92 PolarHBondContact O-N 2.86Å; L89-K92 PolarHBondContact O-N 2.84Å; K92-L484 HydrophobicContact CB-CD1 4.38Å; K92-L484 HydrophobicContact CB-CD2 4.06Å; K92-L484 HydrophobicContact CD-CB 4.43Å; K92-L484 HydrophobicContact CD-CD1 4.34Å; K92-L484 HydrophobicContact CD-CD2 3.9Å; K92-L484 HydrophobicContact CD-CG 4.45Å; K92-E488 IonicContact NZ-OE1 2.9Å; K92-E488 PolarHBondContact NZ-OE1 3.05Å
93	Y	95.2	Very high	96.8	Very high	57 Å²	57	26 Å²	26	22%	0.224	13%	0.126	C	C	.	.			trans	-131.2	65.9	-173.9	-52.4	-66.7	0	0	0	111.9	L89 E95 A96 Y98 F491	L89-Y93 HydrophobicContact CD2-CD2 3.98Å; L89-Y93 HydrophobicContact CD2-CE2 3.96Å; L89-Y93 PolarHBondContact O-N 2.77Å; Y93-E95 PolarHBondContact O-N 3.22Å; Y93-E95 VanDerWaalsContact O-N 3.1Å; Y93-A96 WeakPolarHBondContact O-CB 3.48Å; Y93-A96 PolarHBondContact O-N 2.95Å; Y93-Y98 PolarHBondContact O-OH 3.06Å; Y93-F491 HydrophobicContact CD2-CD1 4.47Å; Y93-F491 HydrophobicContact CD2-CE1 4.26Å; Y93-F491 HydrophobicContact CD2-CZ 4.3Å; Y93-F491 HydrophobicContact CE2-CD1 4.01Å; Y93-F491 AromaticContact CE2-CD2 3.69Å; Y93-F491 HydrophobicContact CE2-CD2 3.69Å; Y93-F491 HydrophobicContact CE2-CE1 4.02Å; Y93-F491 AromaticContact CE2-CE2 3.71Å; Y93-F491 HydrophobicContact CE2-CE2 3.71Å; Y93-F491 AromaticContact CE2-CG 3.85Å; Y93-F491 HydrophobicContact CE2-CG 3.85Å; Y93-F491 AromaticContact CE2-CZ 3.88Å; Y93-F491 HydrophobicContact CE2-CZ 3.88Å; Y93-F491 AromaticContact CZ-CD2 3.81Å; Y93-F491 AromaticContact CZ-CG 3.74Å; Y93-F491 WeakPolarHBondContact OH-CD2 3.46Å
94	P	94.3	Very high	96.7	Very high	64 Å²	64	26.9 Å²	26.9	42%	0.416	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-23.3	-173.4	25.6	-35.8	0	0	0	114.3	Q90 A96	Q90-P94 WeakPolarHBondContact O-CA 3.3Å; P94-A96 VanDerWaalsContact C-N 3.33Å
95	E	91.8	Very high	96.6	Very high	144 Å²	144	30 Å²	30	67%	0.673	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-6	179.7	-60.4	-59.6	133.1	0	0	113.9	Q62 Y93	Q62-E95 PolarHBondContact NE2-O 3.5Å; Y93-E95 PolarHBondContact O-N 3.22Å; Y93-E95 VanDerWaalsContact O-N 3.1Å
96	A	93.8	Very high	96.3	Very high	15 Å²	15	37.1 Å²	37.1	12%	0.124	19%	0.187	C	C	.	.	S	Bend	trans	-78.7	151.6	179.8	0	0	0	0	0	112	M63 I65 Y93 P94 Y98	M63-A96 CarbonylContact O-C 3.22Å; M63-A96 WeakPolarHBondContact O-CA 3.39Å; M63-A96 WeakPolarHBondContact O-CB 3.39Å; I65-A96 HydrophobicContact CD1-CB 3.7Å; I65-A96 HydrophobicContact CG1-CB 4.21Å; Y93-A96 WeakPolarHBondContact O-CB 3.48Å; Y93-A96 PolarHBondContact O-N 2.95Å; P94-A96 VanDerWaalsContact C-N 3.33Å; A96-Y98 HydrophobicContact CB-CE2 4.06Å; A96-Y98 WeakPolarHBondContact O-CD2 3.31Å; A96-Y98 WeakPolarHBondContact O-CE2 3.36Å
97	V	94.9	Very high	96.2	Very high	31 Å²	31	38.9 Å²	38.9	19%	0.188	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	124.3	172.4	179.1	0	0	0	0	108.8	Q62 M63 V64 I65 V99	Q62-V97 HydrophobicContact CB-CG2 4.03Å; M63-V97 PolarHBondContact O-N 2.83Å; V64-V97 WeakPolarHBondContact CA-O 3.42Å; V64-V97 HydrophobicContact CG2-CB 4.4Å; I65-V97 PolarHBondContact N-O 3.21Å; V97-V99 HydrophobicContact CG1-CG2 4.44Å
98	Y	97.3	Very high	96.1	Very high	3 Å²	3	39.4 Å²	39.4	1%	0.012	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	125.6	-178.9	-65.2	-82	0	0	0	111.4	I65 L86 L89 Q90 Y93 A96 Q129	I65-Y98 HydrophobicContact CB-CD1 4.22Å; I65-Y98 HydrophobicContact CB-CE1 4.24Å; I65-Y98 HydrophobicContact CD1-CE1 3.77Å; I65-Y98 WeakPolarHBondContact O-CA 3.45Å; L86-Y98 HydrophobicContact CD2-CD1 3.73Å; L86-Y98 HydrophobicContact CD2-CG 4.25Å; L89-Y98 HydrophobicContact CB-CE1 3.58Å; L89-Y98 HydrophobicContact CD1-CE1 4.43Å; L89-Y98 PolarHBondContact O-OH 2.92Å; Q90-Y98 WeakPolarHBondContact CA-OH 3.44Å; Q90-Y98 HydrophobicContact CB-CE2 4.28Å; Q90-Y98 HydrophobicContact CG-CD1 4.43Å; Q90-Y98 HydrophobicContact CG-CD2 3.63Å; Q90-Y98 HydrophobicContact CG-CE1 4.21Å; Q90-Y98 HydrophobicContact CG-CE2 3.38Å; Q90-Y98 HydrophobicContact CG-CG 4.16Å; Q90-Y98 PolarHBondContact N-OH 3.01Å; Y93-Y98 PolarHBondContact O-OH 3.06Å; A96-Y98 HydrophobicContact CB-CE2 4.06Å; A96-Y98 WeakPolarHBondContact O-CD2 3.31Å; A96-Y98 WeakPolarHBondContact O-CE2 3.36Å; Y98-Q129 PolarHBondContact O-N 3.44Å
99	V	98.1	Very high	96	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.006	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	138.8	179	179.3	0	0	0	0	110	V64 I65 A66 F67 V97 Y101 Q129 V131	V64-V99 HydrophobicContact CG1-CG2 3.91Å; I65-V99 PolarHBondContact O-N 3.17Å; A66-V99 CarbonylContact C-O 3.56Å; A66-V99 VanDerWaalsContact CA-O 3.25Å; A66-V99 WeakPolarHBondContact CA-O 3.18Å; A66-V99 HydrophobicContact CB-CB 3.86Å; A66-V99 HydrophobicContact CB-CG1 4.26Å; F67-V99 PolarHBondContact N-O 3.18Å; V97-V99 HydrophobicContact CG1-CG2 4.44Å; V99-Y101 HydrophobicContact CG1-CD1 4.45Å; V99-Y101 HydrophobicContact CG1-CE1 4.16Å; V99-Q129 CarbonylContact C-O 3.6Å; V99-Q129 VanDerWaalsContact CA-O 3.26Å; V99-Q129 WeakPolarHBondContact CA-O 3.49Å; V99-Q129 HydrophobicContact CG2-CB 4.25Å; V99-V131 HydrophobicContact CG1-CB 4.4Å; V99-V131 HydrophobicContact CG1-CG2 3.64Å
100	V	98.6	Very high	95.9	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	117.3	169.4	176.2	0	0	0	0	108.7	F67 L82 L86 V128 Q129 F130 V131	F67-V100 HydrophobicContact CB-CG2 4.49Å; L82-V100 HydrophobicContact CD2-CG1 4.45Å; L86-V100 HydrophobicContact CD1-CG2 3.75Å; V100-V128 HydrophobicContact CB-CG1 4.23Å; V100-V128 HydrophobicContact CG2-CG1 3.6Å; V100-Q129 PolarHBondContact N-O 2.9Å; V100-F130 HydrophobicContact CB-CD1 3.99Å; V100-F130 HydrophobicContact CB-CE1 4.06Å; V100-F130 HydrophobicContact CG1-CD1 4.23Å; V100-F130 HydrophobicContact CG1-CE1 4.18Å; V100-V131 PolarHBondContact O-N 2.71Å
101	Y	98.6	Very high	95.8	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	116.8	168.3	-54.2	-70.7	0	0	0	109.1	A66 F67 F68 H69 V99 V131 A163 C167 P169 Y172 F185	A66-Y101 HydrophobicContact CB-CD2 4.15Å; A66-Y101 HydrophobicContact CB-CE2 3.34Å; F67-Y101 WeakPolarHBondContact O-CD2 3.32Å; F67-Y101 PolarHBondContact O-N 3.06Å; F68-Y101 HydrophobicContact CB-CD2 4.35Å; F68-Y101 HydrophobicContact CD2-CD2 4Å; F68-Y101 HydrophobicContact CD2-CG 4.2Å; H69-Y101 CarbonylContact C-O 3.54Å; H69-Y101 PolarHBondContact N-O 3.46Å; V99-Y101 HydrophobicContact CG1-CD1 4.45Å; V99-Y101 HydrophobicContact CG1-CE1 4.16Å; Y101-V131 WeakPolarHBondContact CA-O 3.49Å; Y101-V131 HydrophobicContact CD1-CB 3.61Å; Y101-V131 HydrophobicContact CD1-CG1 3.68Å; Y101-V131 HydrophobicContact CD1-CG2 4.17Å; Y101-V131 HydrophobicContact CE1-CB 4.09Å; Y101-V131 HydrophobicContact CE1-CG1 4.07Å; Y101-V131 HydrophobicContact CE1-CG2 4.17Å; Y101-A163 HydrophobicContact CD1-CB 3.48Å; Y101-A163 VanDerWaalsContact CD1-CB 3.48Å; Y101-A163 HydrophobicContact CD2-CB 4.24Å; Y101-A163 HydrophobicContact CE1-CB 3.8Å; Y101-A163 WeakPolarHBondContact CE1-O 3.28Å; Y101-A163 HydrophobicContact CE2-CB 4.49Å; Y101-A163 HydrophobicContact CG-CB 3.74Å; Y101-C167 HydrophobicContact CE1-CB 4.08Å; Y101-C167 PolarHBondContact OH-O 2.84Å; Y101-P169 WeakPolarHBondContact OH-CD 3.36Å; Y101-Y172 HydrophobicContact CD2-CE2 4.47Å; Y101-Y172 HydrophobicContact CE2-CD2 4.28Å; Y101-Y172 HydrophobicContact CE2-CE2 4.35Å; Y101-F185 HydrophobicContact CE2-CE1 4.09Å; Y101-F185 HydrophobicContact CE2-CZ 4.22Å
102	T	97.9	Very high	95.8	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	146.7	-175.9	177.2	0	0	0	0	111.5	C72 D104 F130 V131 F132 L133	C72-T102 WeakPolarHBondContact SG-CB 2.97Å; C72-T102 PolarHBondContact SG-OG1 3.37Å; T102-D104 WeakPolarHBondContact OG1-CB 3.44Å; T102-D104 PolarHBondContact OG1-N 2.94Å; T102-D104 PolarHBondContact OG1-OD2 2.76Å; T102-D104 VanDerWaalsContact OG1-OD2 3.05Å; T102-F130 HydrophobicContact CG2-CD1 3.92Å; T102-V131 PolarHBondContact N-O 2.92Å; T102-F132 HydrophobicContact CG2-CD1 3.7Å; T102-F132 HydrophobicContact CG2-CE1 3.79Å; T102-F132 HydrophobicContact CG2-CG 4.4Å; T102-F132 CarbonylContact O-C 3.38Å; T102-F132 WeakPolarHBondContact O-CA 3.35Å; T102-L133 PolarHBondContact O-N 3.34Å
103	G	96.8	Very high	95.8	Very high	2 Å²	2	45.4 Å²	45.4	2%	0.021	25%	0.245	C	C	.	.			trans	-95.9	9.5	170.6	0	0	0	0	0	114.1	P70 V105 L133 R136	P70-G103 PolarHBondContact O-N 3Å; G103-V105 PolarHBondContact O-N 3.48Å; G103-L133 WeakPolarHBondContact CA-O 3.47Å; G103-R136 VanDerWaalsContact O-CZ 3.25Å; G103-R136 PolarHBondContact O-NE 3.3Å; G103-R136 PolarHBondContact O-NH1 3.17Å
104	D	94.8	Very high	95.7	Very high	19 Å²	19	46.1 Å²	46.1	10%	0.102	25%	0.25	C	C	.	.			trans	-76.9	55.9	179.1	-67.5	-55	0	0	0	112.3	C72 N73 T102 N106 V107 I112 F132 R136	C72-D104 PolarHBondContact N-OD2 2.92Å; C72-D104 PolarHBondContact SG-OD2 3.24Å; N73-D104 PolarHBondContact N-OD2 2.85Å; T102-D104 WeakPolarHBondContact OG1-CB 3.44Å; T102-D104 PolarHBondContact OG1-N 2.94Å; T102-D104 PolarHBondContact OG1-OD2 2.76Å; T102-D104 VanDerWaalsContact OG1-OD2 3.05Å; D104-N106 PolarHBondContact O-N 3.02Å; D104-V107 HydrophobicContact CB-CG2 3.74Å; D104-V107 VanDerWaalsContact O-CG2 3.28Å; D104-V107 WeakPolarHBondContact O-CG2 3.37Å; D104-V107 PolarHBondContact O-N 3.02Å; D104-I112 HydrophobicContact CB-CD1 4.32Å; D104-F132 VanDerWaalsContact O-CE1 3.31Å; D104-F132 WeakPolarHBondContact O-CE1 3.38Å; D104-R136 IonicContact OD1-CZ 2.75Å; D104-R136 IonicContact OD1-NH1 3.74Å; D104-R136 PolarHBondContact OD1-NH1 2.91Å; D104-R136 IonicContact OD1-NH2 3.93Å
105	V	94.8	Very high	95.6	Very high	68 Å²	68	43.6 Å²	43.6	41%	0.412	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-16.2	-172	-58.6	0	0	0	0	115.1	G103 F132 L133	G103-V105 PolarHBondContact O-N 3.48Å; V105-F132 HydrophobicContact CG1-CB 4.26Å; V105-L133 VanDerWaalsContact CG1-O 3.3Å; V105-L133 WeakPolarHBondContact CG1-O 3.48Å
106	N	93.6	Very high	95.6	Very high	151 Å²	151	36.9 Å²	36.9	81%	0.807	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.6	5.1	-175.6	-62.6	-34	0	0	0	113.4	D104	D104-N106 PolarHBondContact O-N 3.02Å
107	V	94.9	Very high	95.5	Very high	38 Å²	38	39.6 Å²	39.6	23%	0.23	21%	0.214	C	C	.	.	S	Bend	trans	-133.7	149.9	178.7	-68.2	0	0	0	0	110.5	D104 I112 F132	D104-V107 HydrophobicContact CB-CG2 3.74Å; D104-V107 VanDerWaalsContact O-CG2 3.28Å; D104-V107 WeakPolarHBondContact O-CG2 3.37Å; D104-V107 PolarHBondContact O-N 3.02Å; V107-I112 HydrophobicContact CG2-CD1 3.92Å; V107-I112 HydrophobicContact CG2-CG1 3.7Å; V107-F132 WeakPolarHBondContact O-CE1 3.28Å; V107-F132 WeakPolarHBondContact O-CZ 3.5Å
108	S	96.6	Very high	95.1	Very high	53 Å²	53	47.5 Å²	47.5	37%	0.371	24%	0.24	S	C	.	.			trans	-77.4	155.9	174.7	65.8	0	0	0	0	111.8	Q110 Q111 I112	S108-Q110 PolarHBondContact O-N 3.46Å; S108-Q111 PolarHBondContact O-N 3.47Å; S108-Q111 VanDerWaalsContact O-N 3.11Å; S108-Q111 VanDerWaalsContact OG-CG 3.27Å; S108-Q111 WeakPolarHBondContact OG-CG 3.12Å; S108-Q111 PolarHBondContact OG-N 3.32Å; S108-Q111 PolarHBondContact OG-OE1 3.25Å; S108-I112 WeakPolarHBondContact O-CG1 3.34Å; S108-I112 PolarHBondContact O-N 2.81Å; S108-I112 VanDerWaalsContact O-N 3.09Å
109	G	95.9	Very high	94.4	Very high	15 Å²	15	53.2 Å²	53.2	16%	0.155	26%	0.262	C	S	.	.	H	α-helix	trans	-56.6	-35.6	174	0	0	0	0	0	113.1	I112 L113	G109-I112 PolarHBondContact O-N 2.78Å; G109-L113 WeakPolarHBondContact O-CG 3.4Å; G109-L113 PolarHBondContact O-N 2.87Å
110	Q	95.6	Very high	93.8	Very high	132 Å²	132	54.4 Å²	54.4	62%	0.617	27%	0.267	S	S	*	.	H	α-helix	trans	-64.2	-44.8	175.7	-176.6	178.5	-14.5	0	0	111.8	S108 I112 L113 E114	S108-Q110 PolarHBondContact O-N 3.46Å; Q110-I112 VanDerWaalsContact C-N 3.28Å; Q110-I112 PolarHBondContact O-N 2.99Å; Q110-L113 PolarHBondContact O-N 3.42Å; Q110-E114 HydrophobicContact CG-CG 4.45Å; Q110-E114 WeakPolarHBondContact CG-OE1 3.19Å; Q110-E114 PolarHBondContact NE2-OE1 3.24Å; Q110-E114 WeakPolarHBondContact O-CB 3.46Å; Q110-E114 WeakPolarHBondContact O-CG 3.38Å; Q110-E114 PolarHBondContact O-N 3.39Å
111	Q	95.9	Very high	93.3	Very high	104 Å²	104	59.2 Å²	59.2	49%	0.486	29%	0.293	S	S	.	.	H	α-helix	trans	-62.3	-36.6	176.8	-73.2	167.1	-54.5	0	0	112	S108 G115	S108-Q111 PolarHBondContact O-N 3.47Å; S108-Q111 VanDerWaalsContact O-N 3.11Å; S108-Q111 VanDerWaalsContact OG-CG 3.27Å; S108-Q111 WeakPolarHBondContact OG-CG 3.12Å; S108-Q111 PolarHBondContact OG-N 3.32Å; S108-Q111 PolarHBondContact OG-OE1 3.25Å; Q111-G115 PolarHBondContact O-N 3.3Å
112	I	96.1	Very high	92.9	Very high	1 Å²	1	59.4 Å²	59.4	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-62.3	-49	174.8	-65.1	168.5	0	0	0	110.3	N73 W83 D104 V107 S108 G109 Q110 G115 A116 F130 F132	N73-I112 HydrophobicContact CB-CG1 4.26Å; W83-I112 HydrophobicContact CH2-CG2 3.64Å; W83-I112 HydrophobicContact CZ2-CG2 3.48Å; W83-I112 VanDerWaalsContact CZ2-CG2 3.48Å; D104-I112 HydrophobicContact CB-CD1 4.32Å; V107-I112 HydrophobicContact CG2-CD1 3.92Å; V107-I112 HydrophobicContact CG2-CG1 3.7Å; S108-I112 WeakPolarHBondContact O-CG1 3.34Å; S108-I112 PolarHBondContact O-N 2.81Å; S108-I112 VanDerWaalsContact O-N 3.09Å; G109-I112 PolarHBondContact O-N 2.78Å; Q110-I112 VanDerWaalsContact C-N 3.28Å; Q110-I112 PolarHBondContact O-N 2.99Å; I112-G115 WeakPolarHBondContact O-CA 3.5Å; I112-G115 PolarHBondContact O-N 3.07Å; I112-A116 PolarHBondContact O-N 3.33Å; I112-F130 HydrophobicContact CB-CE1 4.41Å; I112-F130 HydrophobicContact CB-CZ 4.28Å; I112-F130 HydrophobicContact CD1-CD1 4.17Å; I112-F130 HydrophobicContact CD1-CE1 4.01Å; I112-F130 HydrophobicContact CG2-CE1 3.98Å; I112-F130 HydrophobicContact CG2-CZ 4.05Å; I112-F132 HydrophobicContact CD1-CE1 4.1Å; I112-F132 HydrophobicContact CD1-CZ 4.35Å
113	L	96.3	Very high	92.8	Very high	55 Å²	55	67.3 Å²	67.3	29%	0.288	32%	0.323	S	S	.	.	H	α-helix	trans	-65.7	-38.8	179.6	-66	175.7	0	0	0	112.6	W83 G109 Q110 G115 A116 F117 L124 F130	W83-L113 HydrophobicContact CE3-CD2 4.46Å; W83-L113 HydrophobicContact CH2-CD2 4.37Å; W83-L113 HydrophobicContact CZ3-CD2 3.98Å; G109-L113 WeakPolarHBondContact O-CG 3.4Å; G109-L113 PolarHBondContact O-N 2.87Å; Q110-L113 PolarHBondContact O-N 3.42Å; L113-G115 VanDerWaalsContact C-N 3.31Å; L113-A116 WeakPolarHBondContact O-CB 3.41Å; L113-A116 PolarHBondContact O-N 3.48Å; L113-F117 PolarHBondContact O-N 2.92Å; L113-L124 HydrophobicContact CD2-CD1 3.6Å; L113-L124 HydrophobicContact CD2-CG 4.24Å; L113-F130 HydrophobicContact CD1-CE2 4.3Å; L113-F130 HydrophobicContact CD2-CZ 4.13Å; L113-F130 HydrophobicContact CG-CE2 4.2Å; L113-F130 HydrophobicContact CG-CZ 4.14Å
114	E	94	Very high	92.7	Very high	72 Å²	72	69 Å²	69	34%	0.336	33%	0.332	S	S	.	.	H	α-helix	trans	-63.1	-39	172.1	-74.4	177	-162.2	0	0	111.6	Q110 F117 R118	Q110-E114 HydrophobicContact CG-CG 4.45Å; Q110-E114 WeakPolarHBondContact CG-OE1 3.19Å; Q110-E114 PolarHBondContact NE2-OE1 3.24Å; Q110-E114 WeakPolarHBondContact O-CB 3.46Å; Q110-E114 WeakPolarHBondContact O-CG 3.38Å; Q110-E114 PolarHBondContact O-N 3.39Å; E114-F117 PolarHBondContact O-N 3.02Å; E114-R118 WeakPolarHBondContact O-CB 3.5Å; E114-R118 VanDerWaalsContact O-CG 3.31Å; E114-R118 WeakPolarHBondContact O-CG 3.37Å; E114-R118 PolarHBondContact O-N 2.98Å; E114-R118 IonicContact OE2-NH2 3.94Å
115	G	91.3	Very high	92.7	Very high	11 Å²	11	72.2 Å²	72.2	11%	0.113	35%	0.348	C	S	.	.	H	α-helix	trans	-61.2	-43.9	173	0	0	0	0	0	112.4	Q111 I112 L113 F117 R118 R119	Q111-G115 PolarHBondContact O-N 3.3Å; I112-G115 WeakPolarHBondContact O-CA 3.5Å; I112-G115 PolarHBondContact O-N 3.07Å; L113-G115 VanDerWaalsContact C-N 3.31Å; G115-F117 VanDerWaalsContact C-N 3.34Å; G115-F117 PolarHBondContact O-N 2.82Å; G115-R118 PolarHBondContact O-N 2.8Å; G115-R119 WeakPolarHBondContact O-CB 3.44Å; G115-R119 WeakPolarHBondContact O-CG 3.46Å; G115-R119 PolarHBondContact O-N 3.2Å
116	A	92.4	Very high	92.7	Very high	3 Å²	3	72.1 Å²	72.1	3%	0.025	34%	0.343	C	S	.	.	H	α-helix	trans	-60.5	-42.9	174.9	0	0	0	0	0	111.9	W83 I112 L113 F120	W83-A116 HydrophobicContact CD2-CB 3.99Å; W83-A116 HydrophobicContact CG-CB 3.86Å; I112-A116 PolarHBondContact O-N 3.33Å; L113-A116 WeakPolarHBondContact O-CB 3.41Å; L113-A116 PolarHBondContact O-N 3.48Å; A116-F120 WeakPolarHBondContact O-CA 3.49Å; A116-F120 VanDerWaalsContact O-CB 3.32Å; A116-F120 WeakPolarHBondContact O-CB 3.49Å; A116-F120 PolarHBondContact O-N 3.29Å
117	F	90.8	Very high	92.7	Very high	72 Å²	72	70.7 Å²	70.7	32%	0.316	34%	0.342	S	S	.	.	H	α-helix	trans	-63.8	-48.5	174.7	177.2	-112.3	0	0	0	112	L113 E114 G115 R119 N121 I122 R123	L113-F117 PolarHBondContact O-N 2.92Å; E114-F117 PolarHBondContact O-N 3.02Å; G115-F117 VanDerWaalsContact C-N 3.34Å; G115-F117 PolarHBondContact O-N 2.82Å; F117-R119 PolarHBondContact O-N 3.11Å; F117-N121 VanDerWaalsContact CE2-OD1 3.31Å; F117-N121 WeakPolarHBondContact CE2-OD1 3.39Å; F117-N121 WeakPolarHBondContact O-CA 3.43Å; F117-N121 PolarHBondContact O-N 2.81Å; F117-I122 WeakPolarHBondContact CA-O 3.49Å; F117-I122 PolarHBondContact N-O 3.03Å; F117-R123 HydrophobicContact CD2-CG 3.42Å; F117-R123 VanDerWaalsContact CD2-CG 3.42Å; F117-R123 VanDerWaalsContact CD2-NE 3.3Å; F117-R123 VanDerWaalsContact CE1-NH2 3.33Å; F117-R123 HydrophobicContact CE2-CG 3.92Å; F117-R123 HydrophobicContact CG-CG 4.18Å
118	R	86.1	Confident	92.7	Very high	197 Å²	197	69.7 Å²	69.7	74%	0.743	34%	0.336	S	S	*	.	H	α-helix	trans	-65	-37.9	-177.2	-72.1	177.3	-168.4	-179.3	8.3	113.3	E114 G115	E114-R118 WeakPolarHBondContact O-CB 3.5Å; E114-R118 VanDerWaalsContact O-CG 3.31Å; E114-R118 WeakPolarHBondContact O-CG 3.37Å; E114-R118 PolarHBondContact O-N 2.98Å; E114-R118 IonicContact OE2-NH2 3.94Å; G115-R118 PolarHBondContact O-N 2.8Å
119	R	83.8	Confident	92.8	Very high	123 Å²	123	72.8 Å²	72.8	46%	0.464	35%	0.345	S	S	.	.	H	α-helix	trans	-88.7	-34.3	-175	-65.1	179.3	-174.9	132	-1.4	113.3	N73 G115 F117	N73-R119 PolarHBondContact O-NH1 3.01Å; N73-R119 PolarHBondContact OD1-NH1 2.95Å; G115-R119 WeakPolarHBondContact O-CB 3.44Å; G115-R119 WeakPolarHBondContact O-CG 3.46Å; G115-R119 PolarHBondContact O-N 3.2Å; F117-R119 PolarHBondContact O-N 3.11Å
120	F	85.9	Confident	92.9	Very high	27 Å²	27	73.8 Å²	73.8	12%	0.118	35%	0.345	C	S	.	.	H	α-helix	trans	-123.8	-3.1	-168.7	-53.7	-55	0	0	0	113.7	G76 E79 R80 W83 A116 I122	G76-F120 VanDerWaalsContact O-CZ 3.26Å; G76-F120 WeakPolarHBondContact O-CZ 3.31Å; E79-F120 HydrophobicContact CB-CE2 3.72Å; E79-F120 HydrophobicContact CB-CZ 4.02Å; R80-F120 HydrophobicContact CB-CD1 3.93Å; R80-F120 HydrophobicContact CB-CE1 4.04Å; R80-F120 HydrophobicContact CB-CG 4.19Å; R80-F120 HydrophobicContact CB-CZ 4.38Å; R80-F120 HydrophobicContact CG-CB 4.41Å; R80-F120 HydrophobicContact CG-CD1 4.15Å; R80-F120 HydrophobicContact CG-CG 4.28Å; R80-F120 PolarHBondContact NH1-O 2.88Å; W83-F120 AromaticContact CD1-CD2 3.92Å; A116-F120 WeakPolarHBondContact O-CA 3.49Å; A116-F120 VanDerWaalsContact O-CB 3.32Å; A116-F120 WeakPolarHBondContact O-CB 3.49Å; A116-F120 PolarHBondContact O-N 3.29Å; F120-I122 HydrophobicContact CB-CD1 3.73Å; F120-I122 HydrophobicContact CB-CG1 3.95Å; F120-I122 WeakPolarHBondContact O-CG1 3.49Å; F120-I122 PolarHBondContact O-N 3.41Å
121	N	87.2	Confident	93	Very high	101 Å²	101	68.3 Å²	68.3	54%	0.54	32%	0.32	S	S	.	.			trans	55.3	34	-173.9	-164.1	25.9	0	0	0	113.2	F117	F117-N121 VanDerWaalsContact CE2-OD1 3.31Å; F117-N121 WeakPolarHBondContact CE2-OD1 3.39Å; F117-N121 WeakPolarHBondContact O-CA 3.43Å; F117-N121 PolarHBondContact O-N 2.81Å
122	I	91.1	Very high	93.1	Very high	4 Å²	4	66.4 Å²	66.4	2%	0.021	31%	0.311	C	S	.	.			trans	-105.1	124.1	179.6	-59.7	165.6	0	0	0	109.7	R80 W83 C84 F117 F120 L124	R80-I122 HydrophobicContact CG-CD1 4.02Å; W83-I122 HydrophobicContact CB-CB 4.26Å; W83-I122 HydrophobicContact CB-CD1 3.7Å; W83-I122 HydrophobicContact CB-CG2 3.87Å; C84-I122 WeakPolarHBondContact SG-CD1 3.34Å; F117-I122 WeakPolarHBondContact CA-O 3.49Å; F117-I122 PolarHBondContact N-O 3.03Å; F120-I122 HydrophobicContact CB-CD1 3.73Å; F120-I122 HydrophobicContact CB-CG1 3.95Å; F120-I122 WeakPolarHBondContact O-CG1 3.49Å; F120-I122 PolarHBondContact O-N 3.41Å; I122-L124 HydrophobicContact CG2-CD2 4.45Å
123	R	94.4	Very high	93.2	Very high	165 Å²	165	66.4 Å²	66.4	62%	0.623	31%	0.31	S	S	*	.			trans	-112.2	134.8	167.2	-63	-172	176.4	-163.7	-0.8	109.7	F117	F117-R123 HydrophobicContact CD2-CG 3.42Å; F117-R123 VanDerWaalsContact CD2-CG 3.42Å; F117-R123 VanDerWaalsContact CD2-NE 3.3Å; F117-R123 VanDerWaalsContact CE1-NH2 3.33Å; F117-R123 HydrophobicContact CE2-CG 3.92Å; F117-R123 HydrophobicContact CG-CG 4.18Å
124	L	96.1	Very high	93.2	Very high	37 Å²	37	73.7 Å²	73.7	19%	0.194	33%	0.334	C	S	.	.			trans	-82.6	151.8	172.4	-60.2	-172.4	0	0	0	110.1	W83 L86 R87 L113 I122 V128	W83-L124 HydrophobicContact CE3-CD1 4.14Å; W83-L124 HydrophobicContact CZ3-CD1 4.27Å; L86-L124 HydrophobicContact CB-CD2 4.02Å; L86-L124 HydrophobicContact CD1-CD1 4.49Å; R87-L124 HydrophobicContact CB-CD2 4.04Å; L113-L124 HydrophobicContact CD2-CD1 3.6Å; L113-L124 HydrophobicContact CD2-CG 4.24Å; I122-L124 HydrophobicContact CG2-CD2 4.45Å; L124-V128 HydrophobicContact CD1-CB 4.42Å; L124-V128 HydrophobicContact CD1-CG2 3.38Å
125	I	94.9	Very high	93.3	Very high	88 Å²	88	74.2 Å²	74.2	45%	0.451	34%	0.335	S	S	.	.	S	Bend	trans	-89	-38.3	-174.6	-58.6	162.7	0	0	0	110	R87 Q90 K91	R87-I125 HydrophobicContact CG-CD1 4.4Å; Q90-I125 HydrophobicContact CB-CB 4.42Å; Q90-I125 HydrophobicContact CB-CD1 4.47Å; K91-I125 HydrophobicContact CB-CD1 4.43Å; K91-I125 HydrophobicContact CD-CD1 4.27Å; K91-I125 HydrophobicContact CG-CD1 3.28Å
126	H	93.4	Very high	93.6	Very high	66 Å²	66	76 Å²	76	31%	0.306	34%	0.339	S	S	.	.	S	Bend	trans	-119.3	156.9	-179.1	-59.7	-57.2	0	0	0	111.4	Q90	Q90-H126 HydrophobicContact CG-CB 4.25Å; Q90-H126 PolarHBondContact NE2-O 2.88Å
127	P	93.7	Very high	93.7	Very high	120 Å²	120	82.3 Å²	82.3	78%	0.779	36%	0.363	S	S	*	.			trans	-57.3	147.1	174.2	-23.7	34.2	0	0	0	112.4
128	V	96.2	Very high	94	Very high	18 Å²	18	80.2 Å²	80.2	11%	0.109	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	134.7	173.7	175.1	0	0	0	0	109	V100 L124 F130	V100-V128 HydrophobicContact CB-CG1 4.23Å; V100-V128 HydrophobicContact CG2-CG1 3.6Å; L124-V128 HydrophobicContact CD1-CB 4.42Å; L124-V128 HydrophobicContact CD1-CG2 3.38Å; V128-F130 HydrophobicContact CB-CE2 4.39Å; V128-F130 HydrophobicContact CG1-CE2 4.31Å; V128-F130 HydrophobicContact CG1-CZ 4.37Å
129	Q	97	Very high	94.5	Very high	118 Å²	118	70.8 Å²	70.8	55%	0.551	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.7	127.2	173.6	-65.5	-176.3	-9.9	0	0	110	Y98 V99 V100	Y98-Q129 PolarHBondContact O-N 3.44Å; V99-Q129 CarbonylContact C-O 3.6Å; V99-Q129 VanDerWaalsContact CA-O 3.26Å; V99-Q129 WeakPolarHBondContact CA-O 3.49Å; V99-Q129 HydrophobicContact CG2-CB 4.25Å; V100-Q129 PolarHBondContact N-O 2.9Å
130	F	98	Very high	94.9	Very high	35 Å²	35	67.6 Å²	67.6	15%	0.154	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	127.5	176.4	-70.7	-87.1	0	0	0	110.4	W83 V100 T102 I112 L113 V128 F132	W83-F130 HydrophobicContact CH2-CE1 4Å; W83-F130 HydrophobicContact CH2-CZ 4.04Å; W83-F130 HydrophobicContact CZ3-CZ 4.46Å; V100-F130 HydrophobicContact CB-CD1 3.99Å; V100-F130 HydrophobicContact CB-CE1 4.06Å; V100-F130 HydrophobicContact CG1-CD1 4.23Å; V100-F130 HydrophobicContact CG1-CE1 4.18Å; T102-F130 HydrophobicContact CG2-CD1 3.92Å; I112-F130 HydrophobicContact CB-CE1 4.41Å; I112-F130 HydrophobicContact CB-CZ 4.28Å; I112-F130 HydrophobicContact CD1-CD1 4.17Å; I112-F130 HydrophobicContact CD1-CE1 4.01Å; I112-F130 HydrophobicContact CG2-CE1 3.98Å; I112-F130 HydrophobicContact CG2-CZ 4.05Å; L113-F130 HydrophobicContact CD1-CE2 4.3Å; L113-F130 HydrophobicContact CD2-CZ 4.13Å; L113-F130 HydrophobicContact CG-CE2 4.2Å; L113-F130 HydrophobicContact CG-CZ 4.14Å; V128-F130 HydrophobicContact CB-CE2 4.39Å; V128-F130 HydrophobicContact CG1-CE2 4.31Å; V128-F130 HydrophobicContact CG1-CZ 4.37Å; F130-F132 HydrophobicContact CB-CD2 4.16Å; F130-F132 HydrophobicContact CB-CE2 3.54Å; F130-F132 HydrophobicContact CB-CZ 3.77Å; F130-F132 HydrophobicContact CG-CZ 4.32Å
131	V	97.9	Very high	95	Very high	17 Å²	17	71.1 Å²	71.1	10%	0.103	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	104.6	171	175.5	0	0	0	0	107.5	V99 V100 Y101 T102 L133 Q166 C167	V99-V131 HydrophobicContact CG1-CB 4.4Å; V99-V131 HydrophobicContact CG1-CG2 3.64Å; V100-V131 PolarHBondContact O-N 2.71Å; Y101-V131 WeakPolarHBondContact CA-O 3.49Å; Y101-V131 HydrophobicContact CD1-CB 3.61Å; Y101-V131 HydrophobicContact CD1-CG1 3.68Å; Y101-V131 HydrophobicContact CD1-CG2 4.17Å; Y101-V131 HydrophobicContact CE1-CB 4.09Å; Y101-V131 HydrophobicContact CE1-CG1 4.07Å; Y101-V131 HydrophobicContact CE1-CG2 4.17Å; T102-V131 PolarHBondContact N-O 2.92Å; V131-L133 HydrophobicContact CG1-CD2 3.99Å; V131-L133 PolarHBondContact O-N 2.89Å; V131-Q166 HydrophobicContact CG1-CB 3.68Å; V131-Q166 HydrophobicContact CG1-CG 4.22Å; V131-C167 HydrophobicContact CG2-CB 4.33Å
132	F	98.1	Very high	95.1	Very high	65 Å²	65	71 Å²	71	29%	0.285	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	114.6	-176.5	-69.4	-80.8	0	0	0	111.1	T102 D104 V105 V107 I112 F130	T102-F132 HydrophobicContact CG2-CD1 3.7Å; T102-F132 HydrophobicContact CG2-CE1 3.79Å; T102-F132 HydrophobicContact CG2-CG 4.4Å; T102-F132 CarbonylContact O-C 3.38Å; T102-F132 WeakPolarHBondContact O-CA 3.35Å; D104-F132 VanDerWaalsContact O-CE1 3.31Å; D104-F132 WeakPolarHBondContact O-CE1 3.38Å; V105-F132 HydrophobicContact CG1-CB 4.26Å; V107-F132 WeakPolarHBondContact O-CE1 3.28Å; V107-F132 WeakPolarHBondContact O-CZ 3.5Å; I112-F132 HydrophobicContact CD1-CE1 4.1Å; I112-F132 HydrophobicContact CD1-CZ 4.35Å; F130-F132 HydrophobicContact CB-CD2 4.16Å; F130-F132 HydrophobicContact CB-CE2 3.54Å; F130-F132 HydrophobicContact CB-CZ 3.77Å; F130-F132 HydrophobicContact CG-CZ 4.32Å
133	L	98	Very high	95.2	Very high	0 Å²	0	74.8 Å²	74.8	0%	0	36%	0.356	C	S	.	.			trans	-93.5	122.7	-177.8	-51.5	-176.7	0	0	0	110.4	F68 T102 G103 V105 V131 L159 E162 A163	F68-L133 HydrophobicContact CE2-CD1 3.88Å; F68-L133 HydrophobicContact CZ-CD1 4.39Å; T102-L133 PolarHBondContact O-N 3.34Å; G103-L133 WeakPolarHBondContact CA-O 3.47Å; V105-L133 VanDerWaalsContact CG1-O 3.3Å; V105-L133 WeakPolarHBondContact CG1-O 3.48Å; V131-L133 HydrophobicContact CG1-CD2 3.99Å; V131-L133 PolarHBondContact O-N 2.89Å; L133-L159 HydrophobicContact CB-CD1 3.58Å; L133-L159 HydrophobicContact CD1-CD1 3.52Å; L133-L159 HydrophobicContact CD1-CD2 4.42Å; L133-L159 HydrophobicContact CD1-CG 3.7Å; L133-L159 HydrophobicContact CG-CD1 4.19Å; L133-E162 HydrophobicContact CD2-CB 4.5Å; L133-E162 HydrophobicContact CD2-CG 4.05Å; L133-A163 HydrophobicContact CD1-CB 4.09Å; L133-A163 HydrophobicContact CD2-CB 3.82Å
134	R	97.4	Very high	95.1	Very high	209 Å²	209	69 Å²	69	79%	0.789	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-81.2	-20.1	-177.7	-60.9	-176.5	-179.8	-162.3	-0.8	112.3	R136 E162	R134-R136 VanDerWaalsContact C-N 3.34Å; R134-R136 PolarHBondContact O-N 3.01Å; R134-E162 PolarHBondContact N-OE1 3.31Å; R134-E162 PolarHBondContact N-OE2 3.28Å
135	K	96.9	Very high	94.7	Very high	82 Å²	82	72.2 Å²	72.2	36%	0.357	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-92.3	19.9	-173.7	-59.3	177.6	-177.6	175	0	114.3	Y137 L138 L159 E162	K135-Y137 HydrophobicContact CB-CE1 4.19Å; K135-Y137 HydrophobicContact CG-CE1 4.28Å; K135-Y137 PolarHBondContact O-N 2.95Å; K135-Y137 VanDerWaalsContact O-N 3.11Å; K135-L138 HydrophobicContact CB-CD1 3.84Å; K135-L138 HydrophobicContact CB-CG 4.23Å; K135-L138 HydrophobicContact CD-CD1 4.24Å; K135-L138 HydrophobicContact CG-CD1 4.46Å; K135-L138 WeakPolarHBondContact O-CB 3.32Å; K135-L138 WeakPolarHBondContact O-CG 3.26Å; K135-L138 PolarHBondContact O-N 3.33Å; K135-L159 HydrophobicContact CB-CD1 4.13Å; K135-E162 VanDerWaalsContact CB-OE2 3.23Å; K135-E162 WeakPolarHBondContact CB-OE2 3.09Å; K135-E162 HydrophobicContact CD-CB 4.47Å; K135-E162 WeakPolarHBondContact CG-OE2 3.4Å; K135-E162 PolarHBondContact N-OE2 3.49Å
136	R	96.3	Very high	94.4	Very high	50 Å²	50	75 Å²	75	19%	0.189	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-54.8	-31.5	177.5	-175.8	176.1	67.9	-171.7	0.2	112.6	P70 Y71 G103 D104 R134 L138 V139 E140	P70-R136 HydrophobicContact CB-CG 4.33Å; P70-R136 VanDerWaalsContact O-CD 3.26Å; P70-R136 WeakPolarHBondContact O-CD 3.37Å; P70-R136 PolarHBondContact O-NH1 2.92Å; P70-R136 VanDerWaalsContact O-NH1 3.11Å; Y71-R136 HydrophobicContact CE1-CG 4.35Å; Y71-R136 HydrophobicContact CE2-CG 4.5Å; G103-R136 VanDerWaalsContact O-CZ 3.25Å; G103-R136 PolarHBondContact O-NE 3.3Å; G103-R136 PolarHBondContact O-NH1 3.17Å; D104-R136 IonicContact OD1-CZ 2.75Å; D104-R136 IonicContact OD1-NH1 3.74Å; D104-R136 PolarHBondContact OD1-NH1 2.91Å; D104-R136 IonicContact OD1-NH2 3.93Å; R134-R136 VanDerWaalsContact C-N 3.34Å; R134-R136 PolarHBondContact O-N 3.01Å; R136-L138 PolarHBondContact O-N 3.5Å; R136-V139 HydrophobicContact CG-CG2 4.09Å; R136-V139 WeakPolarHBondContact O-CG2 3.47Å; R136-V139 PolarHBondContact O-N 3.48Å; R136-E140 IonicContact NE-OE1 3.94Å
137	Y	95.7	Very high	94.2	Very high	134 Å²	134	77.6 Å²	77.6	53%	0.525	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-54.6	-22.2	176.1	71.5	-91.6	0	0	0	114	K135 V139 E140 L143	K135-Y137 HydrophobicContact CB-CE1 4.19Å; K135-Y137 HydrophobicContact CG-CE1 4.28Å; K135-Y137 PolarHBondContact O-N 2.95Å; K135-Y137 VanDerWaalsContact O-N 3.11Å; Y137-V139 PolarHBondContact O-N 2.95Å; Y137-E140 PolarHBondContact O-N 3.37Å; Y137-L143 HydrophobicContact CD2-CD2 4.41Å
138	L	97	Very high	94.1	Very high	28 Å²	28	74 Å²	74	15%	0.147	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-71.4	-14	175.7	-63.6	179.4	0	0	0	113.8	K135 R136 L143 Y144 G155 F158	K135-L138 HydrophobicContact CB-CD1 3.84Å; K135-L138 HydrophobicContact CB-CG 4.23Å; K135-L138 HydrophobicContact CD-CD1 4.24Å; K135-L138 HydrophobicContact CG-CD1 4.46Å; K135-L138 WeakPolarHBondContact O-CB 3.32Å; K135-L138 WeakPolarHBondContact O-CG 3.26Å; K135-L138 PolarHBondContact O-N 3.33Å; R136-L138 PolarHBondContact O-N 3.5Å; L138-L143 HydrophobicContact CD2-CD2 4.12Å; L138-Y144 VanDerWaalsContact O-CE2 3.24Å; L138-Y144 WeakPolarHBondContact O-CE2 3.4Å; L138-Y144 PolarHBondContact O-OH 3.13Å; L138-G155 WeakPolarHBondContact O-CA 3.39Å; L138-F158 HydrophobicContact CD1-CB 3.62Å; L138-F158 HydrophobicContact CD1-CG 4.39Å
139	V	95.6	Very high	94	Very high	0 Å²	0	74.6 Å²	74.6	0%	0	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-108.5	6.3	176.6	-62.6	0	0	0	0	112.8	Y71 R136 Y137 Q152 L159 Y178	Y71-V139 HydrophobicContact CE2-CG2 4.33Å; R136-V139 HydrophobicContact CG-CG2 4.09Å; R136-V139 WeakPolarHBondContact O-CG2 3.47Å; R136-V139 PolarHBondContact O-N 3.48Å; Y137-V139 PolarHBondContact O-N 2.95Å; V139-Q152 PolarHBondContact O-NE2 3.25Å; V139-L159 HydrophobicContact CG1-CD2 3.96Å; V139-L159 HydrophobicContact CG2-CD2 3.88Å; V139-Y178 HydrophobicContact CB-CE1 3.79Å; V139-Y178 HydrophobicContact CG1-CD1 4.35Å; V139-Y178 HydrophobicContact CG1-CE1 3.82Å; V139-Y178 HydrophobicContact CG2-CE1 4.32Å; V139-Y178 WeakPolarHBondContact CG2-OH 3.36Å
140	E	92.9	Very high	93.9	Very high	56 Å²	56	71.7 Å²	71.7	26%	0.262	35%	0.346	S	S	.	.			trans	-77.8	137.7	175.6	-58.7	-64.3	161.6	0	0	110.6	Y71 R136 Y137 S142 L143 Y144	Y71-E140 WeakPolarHBondContact CE1-OE1 3.32Å; Y71-E140 PolarHBondContact OH-OE1 2.96Å; Y71-E140 PolarHBondContact OH-OE2 2.84Å; R136-E140 IonicContact NE-OE1 3.94Å; Y137-E140 PolarHBondContact O-N 3.37Å; E140-S142 VanDerWaalsContact C-N 3.29Å; E140-S142 PolarHBondContact O-N 2.84Å; E140-L143 PolarHBondContact O-N 2.96Å; E140-Y144 WeakPolarHBondContact O-CD2 3.47Å
141	D	86.9	Confident	93.8	Very high	100 Å²	100	70.5 Å²	70.5	54%	0.535	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-65.4	-33.4	-178.9	60.2	-9.7	0	0	0	112.4	L143 Y144 T148	D141-L143 PolarHBondContact O-N 2.82Å; D141-L143 VanDerWaalsContact O-N 3.12Å; D141-Y144 CarbonylContact O-C 3.56Å; D141-Y144 PolarHBondContact O-N 2.84Å; D141-T148 HydrophobicContact CB-CG2 3.88Å
142	S	89.4	Confident	93.8	Very high	100 Å²	100	72 Å²	72	70%	0.699	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-58.7	-24.7	178.6	64	0	0	0	0	113.8	E140 Y144	E140-S142 VanDerWaalsContact C-N 3.29Å; E140-S142 PolarHBondContact O-N 2.84Å; S142-Y144 PolarHBondContact O-N 3.16Å
143	L	92.8	Very high	93.7	Very high	82 Å²	82	69.1 Å²	69.1	43%	0.429	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-74	-19.1	176.8	-172.2	60.5	0	0	0	112.2	Y137 L138 E140 D141 P145	Y137-L143 HydrophobicContact CD2-CD2 4.41Å; L138-L143 HydrophobicContact CD2-CD2 4.12Å; E140-L143 PolarHBondContact O-N 2.96Å; D141-L143 PolarHBondContact O-N 2.82Å; D141-L143 VanDerWaalsContact O-N 3.12Å; L143-P145 WeakPolarHBondContact O-CD 3.34Å
144	Y	93.5	Very high	93.7	Very high	45 Å²	45	72.9 Å²	72.9	18%	0.176	36%	0.357	C	S	.	.			trans	-127.9	76.4	-171.6	-52	-71.5	0	0	0	111.3	L138 E140 D141 S142 H146 T148 G151 Q152	L138-Y144 VanDerWaalsContact O-CE2 3.24Å; L138-Y144 WeakPolarHBondContact O-CE2 3.4Å; L138-Y144 PolarHBondContact O-OH 3.13Å; E140-Y144 WeakPolarHBondContact O-CD2 3.47Å; D141-Y144 CarbonylContact O-C 3.56Å; D141-Y144 PolarHBondContact O-N 2.84Å; S142-Y144 PolarHBondContact O-N 3.16Å; Y144-H146 PolarHBondContact O-N 3.36Å; Y144-H146 VanDerWaalsContact O-N 3.15Å; Y144-T148 WeakPolarHBondContact O-CB 3.31Å; Y144-T148 PolarHBondContact O-OG1 2.94Å; Y144-G151 VanDerWaalsContact CD1-CA 3.49Å; Y144-G151 VanDerWaalsContact CZ-O 3.29Å; Y144-G151 PolarHBondContact OH-O 3.35Å; Y144-Q152 HydrophobicContact CD2-CG 3.85Å; Y144-Q152 HydrophobicContact CE2-CG 4.15Å
145	P	88.1	Confident	93.7	Very high	103 Å²	103	63 Å²	63	67%	0.669	32%	0.32	S	S	*	.	S	Bend	trans	-63.6	-20.1	177.7	26.2	-35.1	0	0	0	113.1	L143	L143-P145 WeakPolarHBondContact O-CD 3.34Å
146	H	88	Confident	93.8	Very high	146 Å²	146	59.1 Å²	59.1	68%	0.676	30%	0.303	S	S	*	.	S	Bend	trans	-130.3	148.4	174.9	-56	-44.6	0	0	0	109.9	Y144 T148	Y144-H146 PolarHBondContact O-N 3.36Å; Y144-H146 VanDerWaalsContact O-N 3.15Å; H146-T148 PolarHBondContact O-N 3.27Å
147	F	89.7	Confident	93.8	Very high	121 Å²	121	59.5 Å²	59.5	53%	0.531	31%	0.309	S	S	.	.	S	Bend	trans	52.2	37.2	-177.8	-57.2	-79.2	0	0	0	113.6	L149 L150 G151 Y236	F147-L149 VanDerWaalsContact C-N 3.29Å; F147-L149 PolarHBondContact O-N 2.84Å; F147-L149 VanDerWaalsContact O-N 3.16Å; F147-L150 HydrophobicContact CB-CB 4.46Å; F147-L150 PolarHBondContact O-N 3.25Å; F147-G151 PolarHBondContact O-N 2.88Å; F147-Y236 HydrophobicContact CD1-CD1 4Å; F147-Y236 AromaticContact CD1-CD2 3.77Å; F147-Y236 HydrophobicContact CD1-CD2 3.77Å; F147-Y236 AromaticContact CD1-CE1 3.95Å; F147-Y236 HydrophobicContact CD1-CE1 3.95Å; F147-Y236 AromaticContact CD1-CE2 3.72Å; F147-Y236 HydrophobicContact CD1-CE2 3.72Å; F147-Y236 AromaticContact CD1-CG 3.93Å; F147-Y236 HydrophobicContact CD1-CG 3.93Å; F147-Y236 AromaticContact CD1-CZ 3.81Å; F147-Y236 HydrophobicContact CE1-CD1 4.3Å; F147-Y236 HydrophobicContact CE1-CD2 4.1Å; F147-Y236 HydrophobicContact CE1-CE2 4.49Å; F147-Y236 HydrophobicContact CE1-CG 4.01Å
148	T	91.5	Very high	94	Very high	46 Å²	46	59 Å²	59	28%	0.282	31%	0.309	S	S	.	.	H	α-helix	trans	-48.9	-46.1	-173	-43.9	0	0	0	0	113.3	D141 Y144 H146 L150 G151 Q152	D141-T148 HydrophobicContact CB-CG2 3.88Å; Y144-T148 WeakPolarHBondContact O-CB 3.31Å; Y144-T148 PolarHBondContact O-OG1 2.94Å; H146-T148 PolarHBondContact O-N 3.27Å; T148-L150 VanDerWaalsContact C-N 3.32Å; T148-L150 PolarHBondContact O-N 3.06Å; T148-G151 PolarHBondContact O-N 3.1Å; T148-Q152 HydrophobicContact CG2-CG 4.33Å; T148-Q152 WeakPolarHBondContact O-CB 3.48Å; T148-Q152 WeakPolarHBondContact O-CG 3.46Å; T148-Q152 PolarHBondContact O-N 3.32Å
149	L	93	Very high	94	Very high	29 Å²	29	57.6 Å²	57.6	15%	0.152	30%	0.302	C	S	.	.	H	α-helix	trans	-59.2	-42.7	179.3	-57.7	178.2	0	0	0	112	F147 S153 T201 I202 M206 Y237 F240	F147-L149 VanDerWaalsContact C-N 3.29Å; F147-L149 PolarHBondContact O-N 2.84Å; F147-L149 VanDerWaalsContact O-N 3.16Å; L149-S153 WeakPolarHBondContact O-CB 3.3Å; L149-S153 PolarHBondContact O-N 2.92Å; L149-S153 VanDerWaalsContact O-N 3.07Å; L149-S153 PolarHBondContact O-OG 3.39Å; L149-T201 HydrophobicContact CD2-CG2 4.28Å; L149-I202 HydrophobicContact CD1-CB 4.5Å; L149-M206 HydrophobicContact CD1-CE 3.99Å; L149-Y237 HydrophobicContact CD1-CE1 4.12Å; L149-F240 HydrophobicContact CB-CD1 4.41Å; L149-F240 HydrophobicContact CB-CE1 3.97Å; L149-F240 HydrophobicContact CB-CE2 4.12Å; L149-F240 HydrophobicContact CB-CZ 3.82Å; L149-F240 HydrophobicContact CD1-CD1 4.37Å; L149-F240 HydrophobicContact CD1-CE1 4.29Å
150	L	95.1	Very high	94.1	Very high	57 Å²	57	57.6 Å²	57.6	30%	0.298	30%	0.302	S	S	.	.	H	α-helix	trans	-72	-43.9	178.8	178.4	64	0	0	0	110.8	F147 T148 S153 L154 Y236 F240	F147-L150 HydrophobicContact CB-CB 4.46Å; F147-L150 PolarHBondContact O-N 3.25Å; T148-L150 VanDerWaalsContact C-N 3.32Å; T148-L150 PolarHBondContact O-N 3.06Å; L150-S153 PolarHBondContact O-N 3.45Å; L150-L154 HydrophobicContact CD1-CD1 4.05Å; L150-L154 HydrophobicContact CD1-CG 4.05Å; L150-L154 HydrophobicContact CG-CD1 4.01Å; L150-L154 HydrophobicContact CG-CG 4.39Å; L150-L154 WeakPolarHBondContact O-CG 3.45Å; L150-L154 PolarHBondContact O-N 2.95Å; L150-Y236 HydrophobicContact CB-CE2 3.91Å; L150-Y236 WeakPolarHBondContact CB-OH 3.47Å; L150-Y236 HydrophobicContact CD2-CE2 4.31Å; L150-Y236 PolarHBondContact N-OH 3.46Å; L150-F240 HydrophobicContact CB-CD2 4.29Å; L150-F240 HydrophobicContact CB-CE2 4.44Å; L150-F240 HydrophobicContact CD1-CD2 4.36Å
151	G	96.4	Very high	94.4	Very high	11 Å²	11	58.8 Å²	58.8	11%	0.113	30%	0.304	C	S	.	.	H	α-helix	trans	-55.3	-55.7	176.8	0	0	0	0	0	112.3	Y144 F147 T148 S153 L154 G155	Y144-G151 VanDerWaalsContact CD1-CA 3.49Å; Y144-G151 VanDerWaalsContact CZ-O 3.29Å; Y144-G151 PolarHBondContact OH-O 3.35Å; F147-G151 PolarHBondContact O-N 2.88Å; T148-G151 PolarHBondContact O-N 3.1Å; G151-S153 VanDerWaalsContact C-N 3.31Å; G151-S153 PolarHBondContact O-N 2.99Å; G151-L154 PolarHBondContact O-N 3.02Å; G151-G155 PolarHBondContact O-N 3.36Å
152	Q	96.6	Very high	94.9	Very high	47 Å²	47	55.2 Å²	55.2	22%	0.22	28%	0.284	C	S	.	.	H	α-helix	trans	-61.9	-38.8	177.9	-68.3	-179	-58	0	0	112	V139 Y144 T148 G155 S156	V139-Q152 PolarHBondContact O-NE2 3.25Å; Y144-Q152 HydrophobicContact CD2-CG 3.85Å; Y144-Q152 HydrophobicContact CE2-CG 4.15Å; T148-Q152 HydrophobicContact CG2-CG 4.33Å; T148-Q152 WeakPolarHBondContact O-CB 3.48Å; T148-Q152 WeakPolarHBondContact O-CG 3.46Å; T148-Q152 PolarHBondContact O-N 3.32Å; Q152-G155 PolarHBondContact O-N 3.45Å; Q152-S156 WeakPolarHBondContact O-CB 3.31Å; Q152-S156 PolarHBondContact O-N 3.41Å
153	S	97.4	Very high	95.3	Very high	6 Å²	6	50.5 Å²	50.5	4%	0.042	25%	0.251	C	S	.	.	H	α-helix	trans	-62.3	-46.3	177.2	-67.4	0	0	0	0	112	L149 L150 G151 S156 I157 F180 F240	L149-S153 WeakPolarHBondContact O-CB 3.3Å; L149-S153 PolarHBondContact O-N 2.92Å; L149-S153 VanDerWaalsContact O-N 3.07Å; L149-S153 PolarHBondContact O-OG 3.39Å; L150-S153 PolarHBondContact O-N 3.45Å; G151-S153 VanDerWaalsContact C-N 3.31Å; G151-S153 PolarHBondContact O-N 2.99Å; S153-S156 PolarHBondContact O-N 3.28Å; S153-S156 PolarHBondContact O-OG 2.97Å; S153-I157 PolarHBondContact O-N 2.8Å; S153-F180 VanDerWaalsContact CB-CD2 3.47Å; S153-F180 VanDerWaalsContact CB-CE2 3.48Å; S153-F180 WeakPolarHBondContact O-CB 3.39Å; S153-F180 WeakPolarHBondContact OG-CE2 3.42Å; S153-F240 WeakPolarHBondContact OG-CE2 3.38Å; S153-F240 VanDerWaalsContact OG-CZ 3.28Å; S153-F240 WeakPolarHBondContact OG-CZ 3.47Å
154	L	97.2	Very high	95.4	Very high	78 Å²	78	46.6 Å²	46.6	41%	0.408	23%	0.231	S	C	.	.	H	α-helix	trans	-67	-41.5	175.2	-67.4	175.5	0	0	0	111.6	L150 G151 S156 I157 F158	L150-L154 HydrophobicContact CD1-CD1 4.05Å; L150-L154 HydrophobicContact CD1-CG 4.05Å; L150-L154 HydrophobicContact CG-CD1 4.01Å; L150-L154 HydrophobicContact CG-CG 4.39Å; L150-L154 WeakPolarHBondContact O-CG 3.45Å; L150-L154 PolarHBondContact O-N 2.95Å; G151-L154 PolarHBondContact O-N 3.02Å; L154-S156 PolarHBondContact O-N 3.38Å; L154-I157 HydrophobicContact CD2-CD1 4.09Å; L154-I157 WeakPolarHBondContact O-CB 3.17Å; L154-I157 PolarHBondContact O-N 2.94Å; L154-I157 VanDerWaalsContact O-N 3.07Å; L154-F158 VanDerWaalsContact O-CD2 3.25Å; L154-F158 WeakPolarHBondContact O-CD2 3.38Å
155	G	97.7	Very high	95.4	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.01	24%	0.241	C	C	.	.	H	α-helix	trans	-56.8	-38.4	174	0	0	0	0	0	112.8	L138 G151 Q152 I157 F158 L159	L138-G155 WeakPolarHBondContact O-CA 3.39Å; G151-G155 PolarHBondContact O-N 3.36Å; Q152-G155 PolarHBondContact O-N 3.45Å; G155-I157 VanDerWaalsContact C-N 3.26Å; G155-I157 PolarHBondContact O-N 3.36Å; G155-F158 PolarHBondContact O-N 2.92Å; G155-F158 VanDerWaalsContact O-N 3.14Å; G155-L159 PolarHBondContact O-N 3.35Å
156	S	98.1	Very high	95.7	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.007	23%	0.232	C	C	.	.	H	α-helix	trans	-64.7	-28.2	177.3	81.1	0	0	0	0	113.2	Q152 S153 L154 L159 G160 Y178 F180 T181	Q152-S156 WeakPolarHBondContact O-CB 3.31Å; Q152-S156 PolarHBondContact O-N 3.41Å; S153-S156 PolarHBondContact O-N 3.28Å; S153-S156 PolarHBondContact O-OG 2.97Å; L154-S156 PolarHBondContact O-N 3.38Å; S156-L159 PolarHBondContact O-N 2.96Å; S156-G160 PolarHBondContact O-N 3.24Å; S156-Y178 VanDerWaalsContact CB-CD1 3.48Å; S156-F180 WeakPolarHBondContact OG-CB 3.42Å; S156-T181 WeakPolarHBondContact O-CG2 3.46Å
157	I	98.2	Very high	95.9	Very high	58 Å²	58	42.4 Å²	42.4	30%	0.297	21%	0.207	S	C	.	.	H	α-helix	trans	-64.9	-44.4	173.8	-56.4	175.4	0	0	0	110	S153 L154 G155 G160 W161 F180	S153-I157 PolarHBondContact O-N 2.8Å; L154-I157 HydrophobicContact CD2-CD1 4.09Å; L154-I157 WeakPolarHBondContact O-CB 3.17Å; L154-I157 PolarHBondContact O-N 2.94Å; L154-I157 VanDerWaalsContact O-N 3.07Å; G155-I157 VanDerWaalsContact C-N 3.26Å; G155-I157 PolarHBondContact O-N 3.36Å; I157-G160 PolarHBondContact O-N 3.28Å; I157-W161 WeakPolarHBondContact O-CB 3.37Å; I157-W161 PolarHBondContact O-N 3Å; I157-F180 HydrophobicContact CD1-CB 4.5Å; I157-F180 HydrophobicContact CD1-CD1 4.17Å; I157-F180 HydrophobicContact CG1-CB 3.94Å; I157-F180 HydrophobicContact CG1-CD1 4.5Å
158	F	98.1	Very high	96.2	Very high	123 Å²	123	37.2 Å²	37.2	54%	0.539	19%	0.186	S	C	.	.	H	α-helix	trans	-69.2	-35.7	178.5	-65.8	-74.6	0	0	0	112.6	L138 L154 G155 W161 E162	L138-F158 HydrophobicContact CD1-CB 3.62Å; L138-F158 HydrophobicContact CD1-CG 4.39Å; L154-F158 VanDerWaalsContact O-CD2 3.25Å; L154-F158 WeakPolarHBondContact O-CD2 3.38Å; G155-F158 PolarHBondContact O-N 2.92Å; G155-F158 VanDerWaalsContact O-N 3.14Å; F158-W161 WeakPolarHBondContact O-CB 3.4Å; F158-W161 PolarHBondContact O-N 2.62Å; F158-E162 PolarHBondContact O-N 2.89Å
159	L	98.3	Very high	96.4	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-67.2	-44.4	173.4	-173	61.8	0	0	0	111.3	F68 P70 L133 K135 V139 G155 S156 W161 E162 A163	F68-L159 HydrophobicContact CE1-CD2 4.44Å; F68-L159 HydrophobicContact CE2-CG 4.38Å; F68-L159 HydrophobicContact CZ-CB 4.29Å; F68-L159 HydrophobicContact CZ-CD2 3.85Å; F68-L159 HydrophobicContact CZ-CG 3.79Å; P70-L159 HydrophobicContact CB-CD2 4.15Å; P70-L159 HydrophobicContact CG-CD2 3.81Å; L133-L159 HydrophobicContact CB-CD1 3.58Å; L133-L159 HydrophobicContact CD1-CD1 3.52Å; L133-L159 HydrophobicContact CD1-CD2 4.42Å; L133-L159 HydrophobicContact CD1-CG 3.7Å; L133-L159 HydrophobicContact CG-CD1 4.19Å; K135-L159 HydrophobicContact CB-CD1 4.13Å; V139-L159 HydrophobicContact CG1-CD2 3.96Å; V139-L159 HydrophobicContact CG2-CD2 3.88Å; G155-L159 PolarHBondContact O-N 3.35Å; S156-L159 PolarHBondContact O-N 2.96Å; L159-W161 VanDerWaalsContact C-N 3.26Å; L159-W161 PolarHBondContact O-N 2.95Å; L159-E162 WeakPolarHBondContact O-CB 3.29Å; L159-E162 PolarHBondContact O-N 2.87Å; L159-A163 PolarHBondContact O-N 3.03Å
160	G	98.1	Very high	96.5	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-61.1	-35.4	172.2	0	0	0	0	0	112.2	S156 I157 A163 L164	S156-G160 PolarHBondContact O-N 3.24Å; I157-G160 PolarHBondContact O-N 3.28Å; G160-A163 WeakPolarHBondContact O-CB 3.29Å; G160-A163 PolarHBondContact O-N 2.87Å; G160-L164 WeakPolarHBondContact O-CB 3.48Å; G160-L164 PolarHBondContact O-N 3.24Å
161	W	97.8	Very high	96.6	Very high	81 Å²	81	33.3 Å²	33.3	31%	0.307	16%	0.164	S	C	.	.	H	α-helix	trans	-65.1	-44.7	174.9	-177	-103.2	0	0	0	111.7	I42 I157 F158 L159 A163 L164 M165 L184 I188	I42-W161 HydrophobicContact CD1-CH2 4.22Å; I42-W161 HydrophobicContact CG2-CH2 3.69Å; I42-W161 HydrophobicContact CG2-CZ2 4.41Å; I157-W161 WeakPolarHBondContact O-CB 3.37Å; I157-W161 PolarHBondContact O-N 3Å; F158-W161 WeakPolarHBondContact O-CB 3.4Å; F158-W161 PolarHBondContact O-N 2.62Å; L159-W161 VanDerWaalsContact C-N 3.26Å; L159-W161 PolarHBondContact O-N 2.95Å; W161-A163 VanDerWaalsContact C-N 3.29Å; W161-A163 PolarHBondContact O-N 3.05Å; W161-L164 PolarHBondContact O-N 2.95Å; W161-M165 HydrophobicContact CD2-CG 4.3Å; W161-M165 HydrophobicContact CG-CG 4.5Å; W161-M165 HydrophobicContact CH2-SD 4.49Å; W161-M165 HydrophobicContact CZ2-CG 4.24Å; W161-M165 HydrophobicContact CZ2-SD 3.87Å; W161-M165 WeakPolarHBondContact O-CB 3.23Å; W161-M165 VanDerWaalsContact O-CG 3.26Å; W161-M165 WeakPolarHBondContact O-CG 3.43Å; W161-M165 PolarHBondContact O-N 3.07Å; W161-L184 HydrophobicContact CB-CD2 4.27Å; W161-L184 HydrophobicContact CE3-CD1 3.57Å; W161-L184 HydrophobicContact CE3-CD2 4.47Å; W161-L184 HydrophobicContact CZ3-CD1 3.86Å; W161-L184 VanDerWaalsContact N-CD2 3.33Å; W161-I188 HydrophobicContact CZ3-CD1 4.34Å; W161-I188 HydrophobicContact CZ3-CG2 4.04Å
162	E	97.8	Very high	96.7	Very high	25 Å²	25	32.8 Å²	32.8	12%	0.117	16%	0.158	C	C	.	.	H	α-helix	trans	-57.8	-43.2	173.2	-178.7	-178.5	-158.6	0	0	111.4	L133 R134 K135 F158 L159 Q166	L133-E162 HydrophobicContact CD2-CB 4.5Å; L133-E162 HydrophobicContact CD2-CG 4.05Å; R134-E162 PolarHBondContact N-OE1 3.31Å; R134-E162 PolarHBondContact N-OE2 3.28Å; K135-E162 VanDerWaalsContact CB-OE2 3.23Å; K135-E162 WeakPolarHBondContact CB-OE2 3.09Å; K135-E162 HydrophobicContact CD-CB 4.47Å; K135-E162 WeakPolarHBondContact CG-OE2 3.4Å; K135-E162 PolarHBondContact N-OE2 3.49Å; F158-E162 PolarHBondContact O-N 2.89Å; L159-E162 WeakPolarHBondContact O-CB 3.29Å; L159-E162 PolarHBondContact O-N 2.87Å; E162-Q166 WeakPolarHBondContact O-CG 3.35Å; E162-Q166 PolarHBondContact O-N 2.93Å; E162-Q166 PolarHBondContact O-NE2 3Å
163	A	97.4	Very high	96.8	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-62.7	-50.6	176.4	0	0	0	0	0	112.3	F68 Y101 L133 L159 G160 W161 M165 Q166 C167 F185	F68-A163 HydrophobicContact CD2-CB 4.26Å; F68-A163 HydrophobicContact CE2-CB 3.97Å; Y101-A163 HydrophobicContact CD1-CB 3.48Å; Y101-A163 VanDerWaalsContact CD1-CB 3.48Å; Y101-A163 HydrophobicContact CD2-CB 4.24Å; Y101-A163 HydrophobicContact CE1-CB 3.8Å; Y101-A163 WeakPolarHBondContact CE1-O 3.28Å; Y101-A163 HydrophobicContact CE2-CB 4.49Å; Y101-A163 HydrophobicContact CG-CB 3.74Å; L133-A163 HydrophobicContact CD1-CB 4.09Å; L133-A163 HydrophobicContact CD2-CB 3.82Å; L159-A163 PolarHBondContact O-N 3.03Å; G160-A163 WeakPolarHBondContact O-CB 3.29Å; G160-A163 PolarHBondContact O-N 2.87Å; W161-A163 VanDerWaalsContact C-N 3.29Å; W161-A163 PolarHBondContact O-N 3.05Å; A163-M165 VanDerWaalsContact C-N 3.3Å; A163-M165 PolarHBondContact O-N 3.36Å; A163-Q166 PolarHBondContact O-N 2.72Å; A163-Q166 VanDerWaalsContact O-N 3.1Å; A163-C167 PolarHBondContact O-N 2.9Å; A163-F185 HydrophobicContact CB-CZ 3.98Å
164	L	95.4	Very high	96.9	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-62.4	-36.4	-177.9	-172.8	68.1	0	0	0	112.4	L46 G160 W161 Q166 C167 V168 L184 F185 I188	L46-L164 HydrophobicContact CD1-CD2 3.85Å; L46-L164 HydrophobicContact CD1-CG 4.1Å; G160-L164 WeakPolarHBondContact O-CB 3.48Å; G160-L164 PolarHBondContact O-N 3.24Å; W161-L164 PolarHBondContact O-N 2.95Å; L164-Q166 VanDerWaalsContact C-N 3.28Å; L164-Q166 PolarHBondContact O-N 3.49Å; L164-C167 CarbonylContact O-C 3.45Å; L164-V168 HydrophobicContact CD1-CB 4.34Å; L164-V168 HydrophobicContact CD1-CG1 4.03Å; L164-V168 HydrophobicContact CD1-CG2 4.01Å; L164-V168 HydrophobicContact CG-CG2 4.38Å; L164-V168 VanDerWaalsContact O-CG2 3.23Å; L164-V168 WeakPolarHBondContact O-CG2 3.45Å; L164-L184 HydrophobicContact CD2-CD1 3.7Å; L164-L184 HydrophobicContact CD2-CG 4.08Å; L164-F185 HydrophobicContact CB-CE1 4.14Å; L164-F185 HydrophobicContact CB-CZ 4.01Å; L164-F185 HydrophobicContact CD1-CD1 3.65Å; L164-F185 HydrophobicContact CD1-CE1 3.65Å; L164-F185 HydrophobicContact CD1-CG 4.35Å; L164-F185 HydrophobicContact CD1-CZ 4.34Å; L164-I188 HydrophobicContact CD2-CB 4.32Å; L164-I188 HydrophobicContact CD2-CG2 4.07Å
165	M	93.8	Very high	96.8	Very high	81 Å²	81	26.8 Å²	26.8	40%	0.399	13%	0.128	S	C	.	.	H	α-helix	trans	-69.7	-24.7	177.4	-73.7	-61.9	-60.5	0	0	113.5	L46 W161 A163	L46-M165 HydrophobicContact CD2-SD 3.9Å; W161-M165 HydrophobicContact CD2-CG 4.3Å; W161-M165 HydrophobicContact CG-CG 4.5Å; W161-M165 HydrophobicContact CH2-SD 4.49Å; W161-M165 HydrophobicContact CZ2-CG 4.24Å; W161-M165 HydrophobicContact CZ2-SD 3.87Å; W161-M165 WeakPolarHBondContact O-CB 3.23Å; W161-M165 VanDerWaalsContact O-CG 3.26Å; W161-M165 WeakPolarHBondContact O-CG 3.43Å; W161-M165 PolarHBondContact O-N 3.07Å; A163-M165 VanDerWaalsContact C-N 3.3Å; A163-M165 PolarHBondContact O-N 3.36Å
166	Q	93.7	Very high	96.5	Very high	103 Å²	103	29.1 Å²	29.1	48%	0.481	14%	0.139	S	C	.	.	H	α-helix	trans	-86.5	-42.8	178.2	-72.4	-173.4	73.9	0	0	112.2	V131 E162 A163 L164	V131-Q166 HydrophobicContact CG1-CB 3.68Å; V131-Q166 HydrophobicContact CG1-CG 4.22Å; E162-Q166 WeakPolarHBondContact O-CG 3.35Å; E162-Q166 PolarHBondContact O-N 2.93Å; E162-Q166 PolarHBondContact O-NE2 3Å; A163-Q166 PolarHBondContact O-N 2.72Å; A163-Q166 VanDerWaalsContact O-N 3.1Å; L164-Q166 VanDerWaalsContact C-N 3.28Å; L164-Q166 PolarHBondContact O-N 3.49Å
167	C	93.3	Very high	96.3	Very high	22 Å²	22	29.7 Å²	29.7	15%	0.149	15%	0.145	C	C	.	.			trans	-148.2	129.7	177.3	177	0	0	0	0	109.6	Y101 V131 A163 L164	Y101-C167 HydrophobicContact CE1-CB 4.08Å; Y101-C167 PolarHBondContact OH-O 2.84Å; V131-C167 HydrophobicContact CG2-CB 4.33Å; A163-C167 PolarHBondContact O-N 2.9Å; L164-C167 CarbonylContact O-C 3.45Å
168	V	95	Very high	96.2	Very high	13 Å²	13	28.6 Å²	28.6	8%	0.079	14%	0.137	C	C	.	.			trans	-104.9	110.9	174.5	-175.8	0	0	0	0	108.1	L46 K50 L164 G189	L46-V168 HydrophobicContact CB-CG2 4.03Å; L46-V168 HydrophobicContact CD2-CG2 3.86Å; L46-V168 HydrophobicContact CG-CG2 4.39Å; K50-V168 HydrophobicContact CB-CB 4.28Å; K50-V168 HydrophobicContact CD-CB 4.42Å; K50-V168 HydrophobicContact CD-CG1 4.06Å; L164-V168 HydrophobicContact CD1-CB 4.34Å; L164-V168 HydrophobicContact CD1-CG1 4.03Å; L164-V168 HydrophobicContact CD1-CG2 4.01Å; L164-V168 HydrophobicContact CG-CG2 4.38Å; L164-V168 VanDerWaalsContact O-CG2 3.23Å; L164-V168 WeakPolarHBondContact O-CG2 3.45Å; V168-G189 WeakPolarHBondContact CG1-O 3.46Å
169	P	95.5	Very high	96.1	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.112	C	C	.	.			trans	-82.6	170.7	-175.5	34.7	-34.7	0	0	0	112.5	K50 V64 A66 Y101 V171 F185 C191	K50-P169 PolarHBondContact NZ-O 3.27Å; V64-P169 HydrophobicContact CB-CB 4.49Å; V64-P169 HydrophobicContact CG1-CB 4.09Å; A66-P169 HydrophobicContact CB-CB 3.62Å; A66-P169 HydrophobicContact CB-CG 3.87Å; Y101-P169 WeakPolarHBondContact OH-CD 3.36Å; P169-V171 WeakPolarHBondContact CB-O 3.43Å; P169-F185 HydrophobicContact CG-CD1 4.2Å; P169-F185 HydrophobicContact CG-CE1 4.31Å; P169-C191 PolarHBondContact O-SG 3.46Å; P169-C191 VanDerWaalsContact O-SG 3.39Å
170	D	95.6	Very high	96.1	Very high	48 Å²	48	23.4 Å²	23.4	26%	0.257	12%	0.115	S	C	.	.	S	Bend	trans	-79.8	-47	162.4	-64.9	-67.5	0	0	0	110.4	K50 M63 V64 C191 Q192	K50-D170 WeakPolarHBondContact CE-OD1 3.41Å; K50-D170 VanDerWaalsContact NZ-CA 3.32Å; K50-D170 IonicContact NZ-OD1 3.75Å; K50-D170 PolarHBondContact NZ-OD1 3.4Å; M63-D170 WeakPolarHBondContact CA-OD2 3.31Å; M63-D170 HydrophobicContact CG-CB 3.83Å; V64-D170 PolarHBondContact N-OD2 3.43Å; V64-D170 WeakPolarHBondContact O-CB 3.21Å; V64-D170 PolarHBondContact O-N 2.99Å; D170-C191 WeakPolarHBondContact O-CA 3.43Å; D170-Q192 PolarHBondContact O-N 3.44Å
171	V	98	Very high	96.1	Very high	2 Å²	2	23.4 Å²	23.4	1%	0.012	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	124.1	178.2	-179.4	0	0	0	0	109.2	M63 V64 I65 A66 P169 I173 Q192 L490 F491	M63-V171 HydrophobicContact SD-CG2 4.4Å; V64-V171 PolarHBondContact O-N 2.96Å; V64-V171 VanDerWaalsContact O-N 3.1Å; I65-V171 HydrophobicContact CG1-CB 4.43Å; I65-V171 HydrophobicContact CG2-CB 4.28Å; I65-V171 HydrophobicContact CG2-CG1 4.37Å; A66-V171 PolarHBondContact N-O 3.43Å; P169-V171 WeakPolarHBondContact CB-O 3.43Å; V171-I173 HydrophobicContact CG1-CD1 4.37Å; V171-I173 HydrophobicContact CG1-CG1 4.09Å; V171-Q192 WeakPolarHBondContact CA-O 3.22Å; V171-Q192 HydrophobicContact CG2-CB 4.42Å; V171-L490 HydrophobicContact CG1-CB 3.89Å; V171-L490 HydrophobicContact CG1-CD1 3.86Å; V171-L490 HydrophobicContact CG1-CG 4.44Å; V171-L490 HydrophobicContact CG2-CB 4.35Å; V171-L490 WeakPolarHBondContact CG2-O 3Å; V171-F491 HydrophobicContact CB-CE1 4.28Å; V171-F491 HydrophobicContact CG1-CE1 4.34Å; V171-F491 HydrophobicContact CG1-CZ 4.31Å; V171-F491 HydrophobicContact CG2-CD1 3.96Å; V171-F491 HydrophobicContact CG2-CE1 3.75Å; V171-F491 HydrophobicContact CG2-CZ 4.47Å
172	Y	98.5	Very high	96.1	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	130.3	174.9	172.4	-96.9	0	0	0	109.4	A66 F68 Y101 D174 T181 L182 F185 Q192 V193 G194	A66-Y172 CarbonylContact O-C 3.54Å; A66-Y172 WeakPolarHBondContact O-CA 3.05Å; F68-Y172 HydrophobicContact CB-CE2 3.54Å; F68-Y172 WeakPolarHBondContact CB-OH 3.23Å; F68-Y172 HydrophobicContact CD2-CE2 4.15Å; F68-Y172 HydrophobicContact CG-CE2 4.13Å; F68-Y172 WeakPolarHBondContact CG-OH 3.42Å; Y101-Y172 HydrophobicContact CD2-CE2 4.47Å; Y101-Y172 HydrophobicContact CE2-CD2 4.28Å; Y101-Y172 HydrophobicContact CE2-CE2 4.35Å; Y172-D174 HydrophobicContact CE1-CB 4.08Å; Y172-T181 WeakPolarHBondContact OH-CB 3.49Å; Y172-T181 PolarHBondContact OH-OG1 3.31Å; Y172-L182 HydrophobicContact CD1-CD2 4.46Å; Y172-L182 HydrophobicContact CE1-CD2 4.13Å; Y172-F185 HydrophobicContact CD1-CB 3.86Å; Y172-F185 HydrophobicContact CD1-CD1 4.44Å; Y172-F185 HydrophobicContact CD1-CD2 4.29Å; Y172-F185 AromaticContact CD1-CG 3.95Å; Y172-F185 HydrophobicContact CD1-CG 3.95Å; Y172-F185 HydrophobicContact CD2-CB 4.21Å; Y172-F185 AromaticContact CD2-CD1 3.24Å; Y172-F185 HydrophobicContact CD2-CD1 3.24Å; Y172-F185 AromaticContact CD2-CD2 3.83Å; Y172-F185 HydrophobicContact CD2-CD2 3.83Å; Y172-F185 AromaticContact CD2-CE1 3.41Å; Y172-F185 HydrophobicContact CD2-CE1 3.41Å; Y172-F185 VanDerWaalsContact CD2-CE1 3.41Å; Y172-F185 AromaticContact CD2-CE2 3.97Å; Y172-F185 HydrophobicContact CD2-CE2 3.97Å; Y172-F185 AromaticContact CD2-CG 3.48Å; Y172-F185 HydrophobicContact CD2-CG 3.48Å; Y172-F185 VanDerWaalsContact CD2-CG 3.48Å; Y172-F185 AromaticContact CD2-CZ 3.77Å; Y172-F185 HydrophobicContact CD2-CZ 3.77Å; Y172-F185 HydrophobicContact CE1-CB 4.3Å; Y172-F185 AromaticContact CE1-CD2 3.99Å; Y172-F185 HydrophobicContact CE1-CD2 3.99Å; Y172-F185 HydrophobicContact CE1-CG 4.14Å; Y172-F185 AromaticContact CE2-CD1 3.73Å; Y172-F185 HydrophobicContact CE2-CD1 3.73Å; Y172-F185 AromaticContact CE2-CD2 3.47Å; Y172-F185 HydrophobicContact CE2-CD2 3.47Å; Y172-F185 VanDerWaalsContact CE2-CD2 3.47Å; Y172-F185 AromaticContact CE2-CE1 3.61Å; Y172-F185 HydrophobicContact CE2-CE1 3.61Å; Y172-F185 AromaticContact CE2-CE2 3.36Å; Y172-F185 HydrophobicContact CE2-CE2 3.36Å; Y172-F185 AromaticContact CE2-CG 3.66Å; Y172-F185 HydrophobicContact CE2-CG 3.66Å; Y172-F185 AromaticContact CE2-CZ 3.43Å; Y172-F185 HydrophobicContact CE2-CZ 3.43Å; Y172-F185 VanDerWaalsContact CE2-CZ 3.43Å; Y172-F185 HydrophobicContact CG-CB 3.8Å; Y172-F185 AromaticContact CG-CD1 3.65Å; Y172-F185 HydrophobicContact CG-CD1 3.65Å; Y172-F185 HydrophobicContact CG-CD2 4.2Å; Y172-F185 HydrophobicContact CG-CE1 4.27Å; Y172-F185 AromaticContact CG-CG 3.61Å; Y172-F185 HydrophobicContact CG-CG 3.61Å; Y172-F185 AromaticContact CZ-CD2 3.57Å; Y172-F185 AromaticContact CZ-CE2 3.72Å; Y172-Q192 PolarHBondContact N-O 3.05Å; Y172-V193 HydrophobicContact CD1-CB 4.2Å; Y172-V193 HydrophobicContact CD1-CG1 4.15Å; Y172-V193 CarbonylContact O-C 3.51Å; Y172-V193 VanDerWaalsContact O-CA 3.32Å; Y172-V193 WeakPolarHBondContact O-CA 3.4Å; Y172-G194 PolarHBondContact O-N 3.22Å
173	I	98.6	Very high	96.1	Very high	1 Å²	1	19.7 Å²	19.7	1%	0.005	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	113.9	175.9	-56.5	178.7	0	0	0	109	A66 F67 F68 L89 V171 S175 G194 L490	A66-I173 PolarHBondContact O-N 2.99Å; F67-I173 WeakPolarHBondContact CA-O 3.43Å; F67-I173 HydrophobicContact CD1-CB 4Å; F67-I173 HydrophobicContact CD1-CG2 4.02Å; F67-I173 HydrophobicContact CE1-CB 4.03Å; F67-I173 HydrophobicContact CE1-CD1 4.02Å; F67-I173 HydrophobicContact CE1-CG2 3.84Å; F67-I173 HydrophobicContact CE2-CD1 4.18Å; F67-I173 HydrophobicContact CG-CB 4.44Å; F67-I173 HydrophobicContact CZ-CB 4.47Å; F67-I173 HydrophobicContact CZ-CD1 3.71Å; F68-I173 PolarHBondContact N-O 3.5Å; L89-I173 HydrophobicContact CD1-CD1 4.33Å; V171-I173 HydrophobicContact CG1-CD1 4.37Å; V171-I173 HydrophobicContact CG1-CG1 4.09Å; I173-S175 PolarHBondContact O-N 3.38Å; I173-G194 WeakPolarHBondContact CA-O 3.23Å; I173-L490 HydrophobicContact CD1-CD1 4.36Å; I173-L490 HydrophobicContact CG1-CD1 4.27Å
174	D	98.1	Very high	96.1	Very high	2 Å²	2	20.2 Å²	20.2	1%	0.011	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	113.6	165.2	174.7	18.6	0	0	0	108.7	Y172 M176 G177 Y178 A179 L182 G194 S195 Y196	Y172-D174 HydrophobicContact CE1-CB 4.08Å; D174-M176 PolarHBondContact OD1-N 2.91Å; D174-M176 VanDerWaalsContact OD1-N 3.11Å; D174-G177 PolarHBondContact OD1-N 3.42Å; D174-G177 WeakPolarHBondContact OD2-CA 3.25Å; D174-Y178 VanDerWaalsContact CG-N 3.35Å; D174-Y178 PolarHBondContact OD1-N 3.39Å; D174-Y178 WeakPolarHBondContact OD2-CA 3.47Å; D174-Y178 PolarHBondContact OD2-N 3.3Å; D174-A179 PolarHBondContact OD2-N 3.36Å; D174-L182 HydrophobicContact CB-CD2 4.12Å; D174-G194 PolarHBondContact N-O 3.24Å; D174-S195 CarbonylContact O-C 3.56Å; D174-S195 WeakPolarHBondContact O-CA 3.16Å; D174-Y196 PolarHBondContact O-N 3.23Å
175	S	96.3	Very high	96.2	Very high	2 Å²	2	20.2 Å²	20.2	1%	0.014	11%	0.106	C	C	.	.			trans	-114.1	11.3	-176.5	58.8	0	0	0	0	113	F68 H69 I173 H198	F68-S175 PolarHBondContact O-N 2.86Å; F68-S175 PolarHBondContact O-OG 2.85Å; F68-S175 VanDerWaalsContact O-OG 3.06Å; H69-S175 PolarHBondContact CE1-O 3.23Å; H69-S175 VanDerWaalsContact CE1-O 3.27Å; H69-S175 PolarHBondContact ND1-O 2.85Å; H69-S175 PolarHBondContact ND1-OG 3.06Å; I173-S175 PolarHBondContact O-N 3.38Å; S175-H198 PolarHBondContact O-NE2 3.04Å; S175-H198 VanDerWaalsContact O-NE2 3.08Å
176	M	92	Very high	96.4	Very high	50 Å²	50	18.4 Å²	18.4	25%	0.246	10%	0.096	C	C	.	.	S	Bend	trans	-122.7	-26.3	-179.6	-167.3	68.3	-174.7	0	0	112	Y71 D174 Y178	Y71-M176 HydrophobicContact CD2-CE 3.88Å; Y71-M176 HydrophobicContact CG-CE 4.4Å; D174-M176 PolarHBondContact OD1-N 2.91Å; D174-M176 VanDerWaalsContact OD1-N 3.11Å; M176-Y178 HydrophobicContact CB-CD2 3.94Å; M176-Y178 HydrophobicContact CB-CE2 4.04Å; M176-Y178 HydrophobicContact CG-CD2 4.08Å; M176-Y178 HydrophobicContact CG-CE2 3.66Å
177	G	92.3	Very high	96.5	Very high	13 Å²	13	20.2 Å²	20.2	13%	0.134	10%	0.099	C	C	.	.			trans	105.7	30.6	-179.4	0	0	0	0	0	113.8	D174 A179 T201	D174-G177 PolarHBondContact OD1-N 3.42Å; D174-G177 WeakPolarHBondContact OD2-CA 3.25Å; G177-A179 VanDerWaalsContact C-N 3.35Å; G177-A179 PolarHBondContact O-N 2.87Å; G177-T201 PolarHBondContact O-OG1 3.33Å
178	Y	95.8	Very high	96.6	Very high	34 Å²	34	20.4 Å²	20.4	13%	0.133	10%	0.099	C	C	.	.			trans	-90.9	63.4	171.5	-69.6	-67.2	0	0	0	111.6	F68 P70 Y71 V139 S156 D174 M176 F180 T181	F68-Y178 HydrophobicContact CD1-CD2 4.03Å; F68-Y178 AromaticContact CE1-CD2 3.66Å; F68-Y178 HydrophobicContact CE1-CD2 3.66Å; F68-Y178 HydrophobicContact CE1-CE2 4.49Å; F68-Y178 HydrophobicContact CE1-CG 4.03Å; P70-Y178 HydrophobicContact CB-CE2 4.49Å; P70-Y178 HydrophobicContact CG-CD2 4.08Å; P70-Y178 HydrophobicContact CG-CE2 3.75Å; Y71-Y178 WeakPolarHBondContact CE2-OH 3.21Å; V139-Y178 HydrophobicContact CB-CE1 3.79Å; V139-Y178 HydrophobicContact CG1-CD1 4.35Å; V139-Y178 HydrophobicContact CG1-CE1 3.82Å; V139-Y178 HydrophobicContact CG2-CE1 4.32Å; V139-Y178 WeakPolarHBondContact CG2-OH 3.36Å; S156-Y178 VanDerWaalsContact CB-CD1 3.48Å; D174-Y178 VanDerWaalsContact CG-N 3.35Å; D174-Y178 PolarHBondContact OD1-N 3.39Å; D174-Y178 WeakPolarHBondContact OD2-CA 3.47Å; D174-Y178 PolarHBondContact OD2-N 3.3Å; M176-Y178 HydrophobicContact CB-CD2 3.94Å; M176-Y178 HydrophobicContact CB-CE2 4.04Å; M176-Y178 HydrophobicContact CG-CD2 4.08Å; M176-Y178 HydrophobicContact CG-CE2 3.66Å; Y178-F180 PolarHBondContact O-N 3.33Å; Y178-T181 WeakPolarHBondContact O-CB 3.43Å; Y178-T181 WeakPolarHBondContact O-CG2 3.44Å; Y178-T181 PolarHBondContact O-N 3.44Å; Y178-T181 PolarHBondContact O-OG1 2.99Å
179	A	97	Very high	96.6	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.008	10%	0.095	C	C	.	.	G	3₁₀ helix	trans	-55.6	-26.2	-173.3	0	0	0	0	0	114.7	D174 G177 T181 L182 Y244 V247 W269	D174-A179 PolarHBondContact OD2-N 3.36Å; G177-A179 VanDerWaalsContact C-N 3.35Å; G177-A179 PolarHBondContact O-N 2.87Å; A179-T181 PolarHBondContact O-N 2.8Å; A179-L182 HydrophobicContact CB-CD1 3.95Å; A179-L182 VanDerWaalsContact O-CB 3.3Å; A179-L182 WeakPolarHBondContact O-CB 3.29Å; A179-L182 WeakPolarHBondContact O-CD1 3.47Å; A179-L182 VanDerWaalsContact O-CG 3.24Å; A179-L182 WeakPolarHBondContact O-CG 3.13Å; A179-L182 PolarHBondContact O-N 3.45Å; A179-Y244 HydrophobicContact CB-CD2 4.17Å; A179-Y244 HydrophobicContact CB-CE2 3.68Å; A179-V247 HydrophobicContact CB-CG2 4.19Å; A179-W269 HydrophobicContact CB-CH2 4.1Å; A179-W269 HydrophobicContact CB-CZ2 3.75Å
180	F	97.9	Very high	96.5	Very high	14 Å²	14	21.1 Å²	21.1	6%	0.061	11%	0.108	C	C	.	.	G	3₁₀ helix	trans	-66.9	-13.4	177.2	-80.1	-106.9	0	0	0	113.6	S153 S156 I157 Y178 F240 I243 Y244 V247	S153-F180 VanDerWaalsContact CB-CD2 3.47Å; S153-F180 VanDerWaalsContact CB-CE2 3.48Å; S153-F180 WeakPolarHBondContact O-CB 3.39Å; S153-F180 WeakPolarHBondContact OG-CE2 3.42Å; S156-F180 WeakPolarHBondContact OG-CB 3.42Å; I157-F180 HydrophobicContact CD1-CB 4.5Å; I157-F180 HydrophobicContact CD1-CD1 4.17Å; I157-F180 HydrophobicContact CG1-CB 3.94Å; I157-F180 HydrophobicContact CG1-CD1 4.5Å; Y178-F180 PolarHBondContact O-N 3.33Å; F180-F240 HydrophobicContact CE2-CE2 4.11Å; F180-F240 HydrophobicContact CE2-CZ 4.1Å; F180-F240 AromaticContact CZ-CE2 3.99Å; F180-F240 HydrophobicContact CZ-CE2 3.99Å; F180-F240 HydrophobicContact CZ-CZ 4.42Å; F180-I243 HydrophobicContact CE1-CG2 3.62Å; F180-I243 HydrophobicContact CZ-CG2 3.66Å; F180-Y244 HydrophobicContact CE2-CD2 4.25Å; F180-V247 HydrophobicContact CD1-CG1 4.19Å; F180-V247 HydrophobicContact CD1-CG2 4.44Å; F180-V247 HydrophobicContact CD2-CG2 3.79Å; F180-V247 HydrophobicContact CE1-CG1 4.31Å; F180-V247 HydrophobicContact CE2-CG2 3.9Å; F180-V247 HydrophobicContact CG-CG2 4.08Å; F180-V247 HydrophobicContact CZ-CG2 4.3Å
181	T	98.2	Very high	96.5	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.097	C	C	.	.	G	3₁₀ helix	trans	-77	-23.1	170.1	63.2	0	0	0	0	112.8	F68 S156 Y172 Y178 A179 L184 F185	F68-T181 HydrophobicContact CD1-CG2 4.45Å; F68-T181 HydrophobicContact CE1-CG2 4Å; F68-T181 HydrophobicContact CZ-CG2 4.05Å; S156-T181 WeakPolarHBondContact O-CG2 3.46Å; Y172-T181 WeakPolarHBondContact OH-CB 3.49Å; Y172-T181 PolarHBondContact OH-OG1 3.31Å; Y178-T181 WeakPolarHBondContact O-CB 3.43Å; Y178-T181 WeakPolarHBondContact O-CG2 3.44Å; Y178-T181 PolarHBondContact O-N 3.44Å; Y178-T181 PolarHBondContact O-OG1 2.99Å; A179-T181 PolarHBondContact O-N 2.8Å; T181-L184 WeakPolarHBondContact O-CB 3.47Å; T181-L184 PolarHBondContact O-N 3.15Å; T181-F185 WeakPolarHBondContact O-CD2 3.49Å; T181-F185 PolarHBondContact O-N 3.32Å; T181-F185 VanDerWaalsContact O-N 3.08Å
182	L	98.3	Very high	96.5	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-60.8	-49.4	-172.4	-58.6	163	0	0	0	112.8	Y172 D174 A179 L184 F185 K186 V193 C250 S251 W269	Y172-L182 HydrophobicContact CD1-CD2 4.46Å; Y172-L182 HydrophobicContact CE1-CD2 4.13Å; D174-L182 HydrophobicContact CB-CD2 4.12Å; A179-L182 HydrophobicContact CB-CD1 3.95Å; A179-L182 VanDerWaalsContact O-CB 3.3Å; A179-L182 WeakPolarHBondContact O-CB 3.29Å; A179-L182 WeakPolarHBondContact O-CD1 3.47Å; A179-L182 VanDerWaalsContact O-CG 3.24Å; A179-L182 WeakPolarHBondContact O-CG 3.13Å; A179-L182 PolarHBondContact O-N 3.45Å; L182-L184 PolarHBondContact O-N 2.95Å; L182-F185 PolarHBondContact O-N 3.08Å; L182-K186 VanDerWaalsContact O-CB 3.26Å; L182-K186 WeakPolarHBondContact O-CB 3.42Å; L182-K186 PolarHBondContact O-N 3.1Å; L182-V193 HydrophobicContact CD2-CB 4.32Å; L182-V193 HydrophobicContact CD2-CG2 4.37Å; L182-C250 HydrophobicContact CB-CB 4.4Å; L182-S251 WeakPolarHBondContact CD1-OG 3.28Å; L182-W269 HydrophobicContact CD1-CH2 4.35Å
183	P	97.9	Very high	96.5	Very high	28 Å²	28	22.1 Å²	22.1	18%	0.182	11%	0.112	C	C	.	.	H	α-helix	trans	-63.3	-33.8	179	-19	32.3	0	0	0	112.1	Y187 V247 C250	P183-Y187 HydrophobicContact CB-CD2 3.9Å; P183-Y187 HydrophobicContact CB-CE2 4.1Å; P183-Y187 WeakPolarHBondContact O-CB 3.34Å; P183-Y187 VanDerWaalsContact O-CD2 3.29Å; P183-Y187 WeakPolarHBondContact O-CD2 3.43Å; P183-Y187 PolarHBondContact O-N 2.57Å; P183-V247 HydrophobicContact CG-CB 3.74Å; P183-V247 HydrophobicContact CG-CG1 3.89Å; P183-C250 HydrophobicContact CG-CB 4.32Å
184	L	97.1	Very high	96.5	Very high	11 Å²	11	22.1 Å²	22.1	6%	0.058	11%	0.111	C	C	.	.	I	π-helix	trans	-62.3	-52.1	177.7	167.2	62.4	0	0	0	110.8	W161 L164 T181 L182 I188 G189	W161-L184 HydrophobicContact CB-CD2 4.27Å; W161-L184 HydrophobicContact CE3-CD1 3.57Å; W161-L184 HydrophobicContact CE3-CD2 4.47Å; W161-L184 HydrophobicContact CZ3-CD1 3.86Å; W161-L184 VanDerWaalsContact N-CD2 3.33Å; L164-L184 HydrophobicContact CD2-CD1 3.7Å; L164-L184 HydrophobicContact CD2-CG 4.08Å; T181-L184 WeakPolarHBondContact O-CB 3.47Å; T181-L184 PolarHBondContact O-N 3.15Å; L182-L184 PolarHBondContact O-N 2.95Å; L184-I188 HydrophobicContact CD1-CB 4.04Å; L184-I188 HydrophobicContact CD1-CD1 3.55Å; L184-I188 HydrophobicContact CD1-CG1 4.32Å; L184-I188 HydrophobicContact CD1-CG2 4.49Å; L184-I188 WeakPolarHBondContact O-CA 3.29Å; L184-I188 VanDerWaalsContact O-CB 3.32Å; L184-I188 WeakPolarHBondContact O-CB 3.46Å; L184-I188 PolarHBondContact O-N 3.2Å; L184-G189 PolarHBondContact O-N 3.07Å
185	F	97.8	Very high	96.5	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.111	C	C	.	.	I	π-helix	trans	-69.3	-35.6	179	-80.6	-94.8	0	0	0	112.5	Y101 A163 L164 P169 Y172 T181 L182 G189 G190 C191 V193	Y101-F185 HydrophobicContact CE2-CE1 4.09Å; Y101-F185 HydrophobicContact CE2-CZ 4.22Å; A163-F185 HydrophobicContact CB-CZ 3.98Å; L164-F185 HydrophobicContact CB-CE1 4.14Å; L164-F185 HydrophobicContact CB-CZ 4.01Å; L164-F185 HydrophobicContact CD1-CD1 3.65Å; L164-F185 HydrophobicContact CD1-CE1 3.65Å; L164-F185 HydrophobicContact CD1-CG 4.35Å; L164-F185 HydrophobicContact CD1-CZ 4.34Å; P169-F185 HydrophobicContact CG-CD1 4.2Å; P169-F185 HydrophobicContact CG-CE1 4.31Å; Y172-F185 HydrophobicContact CD1-CB 3.86Å; Y172-F185 HydrophobicContact CD1-CD1 4.44Å; Y172-F185 HydrophobicContact CD1-CD2 4.29Å; Y172-F185 AromaticContact CD1-CG 3.95Å; Y172-F185 HydrophobicContact CD1-CG 3.95Å; Y172-F185 HydrophobicContact CD2-CB 4.21Å; Y172-F185 AromaticContact CD2-CD1 3.24Å; Y172-F185 HydrophobicContact CD2-CD1 3.24Å; Y172-F185 AromaticContact CD2-CD2 3.83Å; Y172-F185 HydrophobicContact CD2-CD2 3.83Å; Y172-F185 AromaticContact CD2-CE1 3.41Å; Y172-F185 HydrophobicContact CD2-CE1 3.41Å; Y172-F185 VanDerWaalsContact CD2-CE1 3.41Å; Y172-F185 AromaticContact CD2-CE2 3.97Å; Y172-F185 HydrophobicContact CD2-CE2 3.97Å; Y172-F185 AromaticContact CD2-CG 3.48Å; Y172-F185 HydrophobicContact CD2-CG 3.48Å; Y172-F185 VanDerWaalsContact CD2-CG 3.48Å; Y172-F185 AromaticContact CD2-CZ 3.77Å; Y172-F185 HydrophobicContact CD2-CZ 3.77Å; Y172-F185 HydrophobicContact CE1-CB 4.3Å; Y172-F185 AromaticContact CE1-CD2 3.99Å; Y172-F185 HydrophobicContact CE1-CD2 3.99Å; Y172-F185 HydrophobicContact CE1-CG 4.14Å; Y172-F185 AromaticContact CE2-CD1 3.73Å; Y172-F185 HydrophobicContact CE2-CD1 3.73Å; Y172-F185 AromaticContact CE2-CD2 3.47Å; Y172-F185 HydrophobicContact CE2-CD2 3.47Å; Y172-F185 VanDerWaalsContact CE2-CD2 3.47Å; Y172-F185 AromaticContact CE2-CE1 3.61Å; Y172-F185 HydrophobicContact CE2-CE1 3.61Å; Y172-F185 AromaticContact CE2-CE2 3.36Å; Y172-F185 HydrophobicContact CE2-CE2 3.36Å; Y172-F185 AromaticContact CE2-CG 3.66Å; Y172-F185 HydrophobicContact CE2-CG 3.66Å; Y172-F185 AromaticContact CE2-CZ 3.43Å; Y172-F185 HydrophobicContact CE2-CZ 3.43Å; Y172-F185 VanDerWaalsContact CE2-CZ 3.43Å; Y172-F185 HydrophobicContact CG-CB 3.8Å; Y172-F185 AromaticContact CG-CD1 3.65Å; Y172-F185 HydrophobicContact CG-CD1 3.65Å; Y172-F185 HydrophobicContact CG-CD2 4.2Å; Y172-F185 HydrophobicContact CG-CE1 4.27Å; Y172-F185 AromaticContact CG-CG 3.61Å; Y172-F185 HydrophobicContact CG-CG 3.61Å; Y172-F185 AromaticContact CZ-CD2 3.57Å; Y172-F185 AromaticContact CZ-CE2 3.72Å; T181-F185 WeakPolarHBondContact O-CD2 3.49Å; T181-F185 PolarHBondContact O-N 3.32Å; T181-F185 VanDerWaalsContact O-N 3.08Å; L182-F185 PolarHBondContact O-N 3.08Å; F185-G189 CarbonylContact O-C 3.3Å; F185-G189 WeakPolarHBondContact O-CA 3.42Å; F185-G189 PolarHBondContact O-N 2.99Å; F185-G190 PolarHBondContact O-N 2.69Å; F185-C191 HydrophobicContact CB-CB 4.48Å; F185-C191 PolarHBondContact O-N 2.73Å; F185-C191 PolarHBondContact O-SG 3.4Å; F185-V193 HydrophobicContact CB-CG1 3.96Å
186	K	97.3	Very high	96.6	Very high	43 Å²	43	22 Å²	22	19%	0.187	11%	0.111	C	C	.	.	I	π-helix	trans	-68.8	-55.1	179	-173.5	61.4	166.5	-179.4	0	112.5	L182 G190 C191 V193 D252	L182-K186 VanDerWaalsContact O-CB 3.26Å; L182-K186 WeakPolarHBondContact O-CB 3.42Å; L182-K186 PolarHBondContact O-N 3.1Å; K186-G190 VanDerWaalsContact O-CA 3.25Å; K186-G190 WeakPolarHBondContact O-CA 3.06Å; K186-G190 PolarHBondContact O-N 3Å; K186-C191 VanDerWaalsContact CD-O 3.32Å; K186-C191 WeakPolarHBondContact CD-O 3.24Å; K186-V193 HydrophobicContact CB-CG1 3.92Å; K186-V193 HydrophobicContact CB-CG2 4.12Å; K186-V193 HydrophobicContact CD-CG1 4.29Å; K186-V193 HydrophobicContact CD-CG2 4.09Å; K186-V193 HydrophobicContact CG-CG2 4.43Å; K186-D252 WeakPolarHBondContact CE-OD1 3.26Å; K186-D252 WeakPolarHBondContact CE-OD2 3.5Å; K186-D252 IonicContact NZ-OD1 3.83Å; K186-D252 PolarHBondContact NZ-OD1 3.19Å; K186-D252 IonicContact NZ-OD2 2.71Å; K186-D252 PolarHBondContact NZ-OD2 3.18Å
187	Y	96	Very high	96.8	Very high	141 Å²	141	19.8 Å²	19.8	55%	0.553	10%	0.1	S	C	*	.	I	π-helix	trans	-92.1	-32.5	-169.8	-59.4	-60.4	0	0	0	113.6	R43 P183 C250	R43-Y187 WeakPolarHBondContact CD-O 3.13Å; R43-Y187 PolarHBondContact NH1-O 2.61Å; P183-Y187 HydrophobicContact CB-CD2 3.9Å; P183-Y187 HydrophobicContact CB-CE2 4.1Å; P183-Y187 WeakPolarHBondContact O-CB 3.34Å; P183-Y187 VanDerWaalsContact O-CD2 3.29Å; P183-Y187 WeakPolarHBondContact O-CD2 3.43Å; P183-Y187 PolarHBondContact O-N 2.57Å; Y187-C250 HydrophobicContact CE2-CB 4.43Å
188	I	95.5	Very high	96.9	Very high	26 Å²	26	20.1 Å²	20.1	13%	0.133	10%	0.098	C	C	.	.	I	π-helix	trans	-95.9	-43.9	178.2	-59.6	164.4	0	0	0	110.3	L39 I42 R43 L46 W161 L164 L184	L39-I188 HydrophobicContact CD2-CD1 3.86Å; L39-I188 HydrophobicContact CD2-CG1 4.4Å; I42-I188 HydrophobicContact CG2-CG2 4.36Å; R43-I188 WeakPolarHBondContact CB-O 3.26Å; R43-I188 WeakPolarHBondContact CG-O 3.3Å; L46-I188 HydrophobicContact CD1-CG2 3.79Å; W161-I188 HydrophobicContact CZ3-CD1 4.34Å; W161-I188 HydrophobicContact CZ3-CG2 4.04Å; L164-I188 HydrophobicContact CD2-CB 4.32Å; L164-I188 HydrophobicContact CD2-CG2 4.07Å; L184-I188 HydrophobicContact CD1-CB 4.04Å; L184-I188 HydrophobicContact CD1-CD1 3.55Å; L184-I188 HydrophobicContact CD1-CG1 4.32Å; L184-I188 HydrophobicContact CD1-CG2 4.49Å; L184-I188 WeakPolarHBondContact O-CA 3.29Å; L184-I188 VanDerWaalsContact O-CB 3.32Å; L184-I188 WeakPolarHBondContact O-CB 3.46Å; L184-I188 PolarHBondContact O-N 3.2Å
189	G	94.5	Very high	96.6	Very high	1 Å²	1	24 Å²	24	1%	0.01	11%	0.113	C	C	.	.	S	Bend	trans	-72.5	-28.5	175.6	0	0	0	0	0	114.2	V168 L184 F185 C191	V168-G189 WeakPolarHBondContact CG1-O 3.46Å; L184-G189 PolarHBondContact O-N 3.07Å; F185-G189 CarbonylContact O-C 3.3Å; F185-G189 WeakPolarHBondContact O-CA 3.42Å; F185-G189 PolarHBondContact O-N 2.99Å; G189-C191 VanDerWaalsContact C-N 3.3Å
190	G	94.4	Very high	96.2	Very high	26 Å²	26	24.2 Å²	24.2	27%	0.268	11%	0.114	S	C	.	.			trans	68.6	28.8	-173.6	0	0	0	0	0	113.2	F185 K186	F185-G190 PolarHBondContact O-N 2.69Å; K186-G190 VanDerWaalsContact O-CA 3.25Å; K186-G190 WeakPolarHBondContact O-CA 3.06Å; K186-G190 PolarHBondContact O-N 3Å
191	C	96.1	Very high	95.8	Very high	2 Å²	2	25 Å²	25	1%	0.014	12%	0.12	C	C	.	.			trans	-85.6	156.9	-178.8	-44.2	0	0	0	0	111.1	P169 D170 F185 K186 G189 V193	P169-C191 PolarHBondContact O-SG 3.46Å; P169-C191 VanDerWaalsContact O-SG 3.39Å; D170-C191 WeakPolarHBondContact O-CA 3.43Å; F185-C191 HydrophobicContact CB-CB 4.48Å; F185-C191 PolarHBondContact O-N 2.73Å; F185-C191 PolarHBondContact O-SG 3.4Å; K186-C191 VanDerWaalsContact CD-O 3.32Å; K186-C191 WeakPolarHBondContact CD-O 3.24Å; G189-C191 VanDerWaalsContact C-N 3.3Å; C191-V193 HydrophobicContact CB-CG1 4.08Å
192	Q	97.8	Very high	95.3	Very high	70 Å²	70	25 Å²	25	33%	0.327	12%	0.12	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	131.9	153.4	-62.4	-63	-14.3	0	0	107.7	D170 V171 Y172 D252 L490	D170-Q192 PolarHBondContact O-N 3.44Å; V171-Q192 WeakPolarHBondContact CA-O 3.22Å; V171-Q192 HydrophobicContact CG2-CB 4.42Å; Y172-Q192 PolarHBondContact N-O 3.05Å; Q192-D252 PolarHBondContact OE1-OD2 3.46Å; Q192-L490 HydrophobicContact CB-CB 4.38Å; Q192-L490 HydrophobicContact CB-CD2 4.19Å
193	V	98.2	Very high	94.7	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	121.6	-172.1	-51.6	0	0	0	0	111.2	Y172 L182 F185 K186 C191 C250 D252	Y172-V193 HydrophobicContact CD1-CB 4.2Å; Y172-V193 HydrophobicContact CD1-CG1 4.15Å; Y172-V193 CarbonylContact O-C 3.51Å; Y172-V193 VanDerWaalsContact O-CA 3.32Å; Y172-V193 WeakPolarHBondContact O-CA 3.4Å; L182-V193 HydrophobicContact CD2-CB 4.32Å; L182-V193 HydrophobicContact CD2-CG2 4.37Å; F185-V193 HydrophobicContact CB-CG1 3.96Å; K186-V193 HydrophobicContact CB-CG1 3.92Å; K186-V193 HydrophobicContact CB-CG2 4.12Å; K186-V193 HydrophobicContact CD-CG1 4.29Å; K186-V193 HydrophobicContact CD-CG2 4.09Å; K186-V193 HydrophobicContact CG-CG2 4.43Å; C191-V193 HydrophobicContact CB-CG1 4.08Å; V193-C250 WeakPolarHBondContact CG2-O 3.33Å; V193-D252 PolarHBondContact N-OD2 3.44Å; V193-D252 WeakPolarHBondContact O-CB 3.41Å; V193-D252 PolarHBondContact O-N 3.36Å
194	G	98.2	Very high	93.8	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	157.1	171.6	0	0	0	0	0	111.5	Y172 I173 D174 V253	Y172-G194 PolarHBondContact O-N 3.22Å; I173-G194 WeakPolarHBondContact CA-O 3.23Å; D174-G194 PolarHBondContact N-O 3.24Å; G194-V253 CarbonylContact C-O 3.56Å; G194-V253 VanDerWaalsContact CA-O 3.27Å; G194-V253 WeakPolarHBondContact CA-O 3.42Å
195	S	97.9	Very high	92.9	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	140.2	169.4	51.5	0	0	0	0	111.2	D174 S251 V253 M255	D174-S195 CarbonylContact O-C 3.56Å; D174-S195 WeakPolarHBondContact O-CA 3.16Å; S195-S251 PolarHBondContact OG-OG 3.47Å; S195-S251 VanDerWaalsContact OG-OG 3.11Å; S195-V253 PolarHBondContact N-O 3.27Å; S195-M255 WeakPolarHBondContact O-CE 3.45Å; S195-M255 PolarHBondContact O-N 3.11Å
196	Y	98	Very high	92.1	Very high	3 Å²	3	28.7 Å²	28.7	1%	0.012	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	104.8	165	-169.7	-75.7	0	0	0	108.3	V81 D174 H198 M255 N257 V278 P280 F479	V81-Y196 HydrophobicContact CB-CE1 4.49Å; V81-Y196 HydrophobicContact CG1-CD1 3.89Å; V81-Y196 HydrophobicContact CG1-CD2 4.01Å; V81-Y196 HydrophobicContact CG1-CE1 3.71Å; V81-Y196 HydrophobicContact CG1-CE2 3.81Å; V81-Y196 HydrophobicContact CG1-CG 4.04Å; V81-Y196 HydrophobicContact CG2-CE1 4.23Å; D174-Y196 PolarHBondContact O-N 3.23Å; Y196-H198 AromaticContact CD1-CE1 3.44Å; Y196-H198 VanDerWaalsContact CD1-CE1 3.44Å; Y196-H198 WeakPolarHBondContact CD1-CE1 3.35Å; Y196-H198 AromaticContact CD1-ND1 3.85Å; Y196-H198 AromaticContact CD1-NE2 3.62Å; Y196-H198 AromaticContact CE1-CE1 3.33Å; Y196-H198 WeakPolarHBondContact CE1-CE1 3.14Å; Y196-H198 AromaticContact CE1-ND1 3.51Å; Y196-H198 AromaticContact CE1-NE2 3.99Å; Y196-M255 CarbonylContact C-O 3.33Å; Y196-M255 WeakPolarHBondContact CA-O 3.44Å; Y196-M255 HydrophobicContact CD2-CB 3.65Å; Y196-M255 HydrophobicContact CD2-SD 4.28Å; Y196-M255 HydrophobicContact CE2-CB 4.28Å; Y196-M255 HydrophobicContact CG-CB 4.32Å; Y196-N257 HydrophobicContact CE1-CB 4.06Å; Y196-V278 HydrophobicContact CE2-CB 4.01Å; Y196-V278 HydrophobicContact CE2-CG1 3.91Å; Y196-V278 PolarHBondContact OH-O 3.22Å; Y196-P280 WeakPolarHBondContact OH-CA 3.09Å; Y196-F479 AromaticContact CE2-CE2 3.9Å; Y196-F479 HydrophobicContact CE2-CE2 3.9Å
197	V	97.1	Very high	91	Very high	2 Å²	2	27.5 Å²	27.5	1%	0.012	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	109.3	-176.4	-175	0	0	0	0	109.4	Y199 V254 M255 V256 N257 T261 I265 W269	V197-Y199 WeakPolarHBondContact CG1-O 3.41Å; V197-V254 HydrophobicContact CG2-CG1 4.32Å; V197-M255 PolarHBondContact N-O 3.38Å; V197-V256 HydrophobicContact CB-CG1 4.32Å; V197-N257 PolarHBondContact O-N 2.86Å; V197-T261 HydrophobicContact CB-CG2 4.21Å; V197-T261 HydrophobicContact CG1-CG2 3.81Å; V197-I265 HydrophobicContact CG1-CD1 4.01Å; V197-I265 HydrophobicContact CG1-CG1 4.23Å; V197-I265 HydrophobicContact CG2-CD1 4.19Å; V197-W269 HydrophobicContact CG2-CH2 3.77Å; V197-W269 HydrophobicContact CG2-CZ2 4.44Å; V197-W269 HydrophobicContact CG2-CZ3 4.17Å
198	H	93.3	Very high	89.9	Confident	21 Å²	21	23.3 Å²	23.3	10%	0.097	13%	0.127	C	C	.	.	S	Bend	trans	-74.1	-37	170.9	-64.3	-74	0	0	0	112.3	V81 S175 Y196 N257 H399	V81-H198 VanDerWaalsContact CG2-CE1 3.48Å; V81-H198 WeakPolarHBondContact CG2-CE1 2.77Å; S175-H198 PolarHBondContact O-NE2 3.04Å; S175-H198 VanDerWaalsContact O-NE2 3.08Å; Y196-H198 AromaticContact CD1-CE1 3.44Å; Y196-H198 VanDerWaalsContact CD1-CE1 3.44Å; Y196-H198 WeakPolarHBondContact CD1-CE1 3.35Å; Y196-H198 AromaticContact CD1-ND1 3.85Å; Y196-H198 AromaticContact CD1-NE2 3.62Å; Y196-H198 AromaticContact CE1-CE1 3.33Å; Y196-H198 WeakPolarHBondContact CE1-CE1 3.14Å; Y196-H198 AromaticContact CE1-ND1 3.51Å; Y196-H198 AromaticContact CE1-NE2 3.99Å; H198-N257 VanDerWaalsContact O-CG 3.3Å; H198-N257 PolarHBondContact O-ND2 3.09Å; H198-N257 PolarHBondContact O-OD1 3.25Å; H198-H399 WeakPolarHBondContact O-CB 3.27Å
199	Y	89.6	Confident	88.8	Confident	114 Å²	114	22.8 Å²	22.8	45%	0.447	13%	0.125	S	C	.	.	S	Bend	trans	-162.7	147.5	173.8	61.6	-84.2	0	0	0	108.3	V197 H399	V197-Y199 WeakPolarHBondContact CG1-O 3.41Å; Y199-H399 WeakPolarHBondContact CB-CE1 3.24Å; Y199-H399 VanDerWaalsContact CB-ND1 3.34Å; Y199-H399 WeakPolarHBondContact CB-ND1 3.35Å; Y199-H399 AromaticContact CD1-CE1 3.75Å; Y199-H399 AromaticContact CD1-ND1 3.79Å; Y199-H399 AromaticContact CG-CE1 3.43Å; Y199-H399 VanDerWaalsContact CG-CE1 3.43Å; Y199-H399 AromaticContact CG-ND1 3.74Å
200	P	89.4	Confident	87.7	Confident	6 Å²	6	22.9 Å²	22.9	4%	0.039	13%	0.126	C	C	.	.			trans	-73.7	143.3	-179.3	33.6	-37.2	0	0	0	110.4	I202 Y244 H264 I265 L268	P200-I202 WeakPolarHBondContact CB-O 3.25Å; P200-I202 PolarHBondContact O-N 2.96Å; P200-I202 VanDerWaalsContact O-N 3.16Å; P200-Y244 VanDerWaalsContact CA-OH 3.32Å; P200-Y244 WeakPolarHBondContact CA-OH 3.12Å; P200-Y244 HydrophobicContact CB-CE1 4.04Å; P200-H264 HydrophobicContact CG-CB 3.96Å; P200-I265 HydrophobicContact CB-CD1 4.2Å; P200-L268 HydrophobicContact CB-CD1 4.43Å
201	T	88.9	Confident	86.4	Confident	30 Å²	30	28 Å²	28	18%	0.184	14%	0.14	C	C	.	.	S	Bend	trans	-56.6	-32.5	177.2	-48.7	0	0	0	0	112.3	L149 G177 F240 Y244	L149-T201 HydrophobicContact CD2-CG2 4.28Å; G177-T201 PolarHBondContact O-OG1 3.33Å; T201-F240 HydrophobicContact CG2-CE1 4.04Å; T201-F240 HydrophobicContact CG2-CZ 3.9Å; T201-Y244 PolarHBondContact N-OH 3.43Å; T201-Y244 VanDerWaalsContact OG1-CE2 3.29Å; T201-Y244 WeakPolarHBondContact OG1-CE2 3.36Å
202	I	89.3	Confident	85.4	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.166	C	C	.	.	S	Bend	trans	-134.2	136.1	168.1	-174	165.4	0	0	0	108.5	L149 P200 M206 Y237 F240 A241 Y244 L268	L149-I202 HydrophobicContact CD1-CB 4.5Å; P200-I202 WeakPolarHBondContact CB-O 3.25Å; P200-I202 PolarHBondContact O-N 2.96Å; P200-I202 VanDerWaalsContact O-N 3.16Å; I202-M206 HydrophobicContact CG1-CB 4.44Å; I202-M206 HydrophobicContact CG1-SD 4.45Å; I202-Y237 HydrophobicContact CD1-CD1 4.31Å; I202-Y237 HydrophobicContact CD1-CD2 4.02Å; I202-Y237 HydrophobicContact CD1-CG 3.82Å; I202-F240 HydrophobicContact CB-CD1 3.94Å; I202-F240 HydrophobicContact CB-CE1 3.94Å; I202-F240 HydrophobicContact CD1-CD1 3.95Å; I202-F240 HydrophobicContact CG2-CD1 3.72Å; I202-F240 HydrophobicContact CG2-CE1 3.78Å; I202-A241 HydrophobicContact CD1-CB 4.34Å; I202-A241 HydrophobicContact CG2-CB 4.21Å; I202-Y244 HydrophobicContact CG2-CD1 3.68Å; I202-Y244 HydrophobicContact CG2-CE1 4.3Å; I202-Y244 HydrophobicContact CG2-CG 4.11Å; I202-L268 WeakPolarHBondContact O-CD1 3.12Å
203	S	85.3	Confident	84.3	Confident	9 Å²	9	33.3 Å²	33.3	6%	0.063	17%	0.168	C	C	.	.			trans	-110.6	161.8	176.9	73.8	0	0	0	0	112.2	D205 M206 L207	S203-D205 PolarHBondContact O-N 3.42Å; S203-D205 PolarHBondContact OG-N 3.01Å; S203-M206 WeakPolarHBondContact O-CB 3.38Å; S203-M206 PolarHBondContact O-N 3.16Å; S203-M206 WeakPolarHBondContact OG-CG 3.49Å; S203-M206 PolarHBondContact OG-N 3.33Å; S203-M206 VanDerWaalsContact OG-N 3.14Å; S203-L207 PolarHBondContact O-N 3.18Å
204	T	77.9	Confident	83	Confident	41 Å²	41	37.3 Å²	37.3	25%	0.252	19%	0.19	S	C	.	.	H	α-helix	trans	-67.4	-22.1	173	65.1	0	0	0	0	112.1	L207 S208 H264 L268	T204-L207 WeakPolarHBondContact O-CB 3.47Å; T204-L207 PolarHBondContact O-N 3.04Å; T204-S208 PolarHBondContact O-N 2.9Å; T204-S208 PolarHBondContact O-OG 2.97Å; T204-H264 PolarHBondContact N-CE1 2.99Å; T204-H264 PolarHBondContact N-ND1 2.94Å; T204-H264 PolarHBondContact OG1-CE1 3.18Å; T204-H264 PolarHBondContact OG1-ND1 3.42Å; T204-L268 HydrophobicContact CG2-CD2 4.4Å; T204-L268 HydrophobicContact CG2-CG 4.41Å
205	D	78.2	Confident	81.4	Confident	39 Å²	39	42.9 Å²	42.9	21%	0.209	22%	0.218	C	C	.	.	H	α-helix	trans	-68.9	-40.4	171.7	-61.7	-44.5	0	0	0	111.2	S203 L207 S208 V209 W260 H264 W396 N397	S203-D205 PolarHBondContact O-N 3.42Å; S203-D205 PolarHBondContact OG-N 3.01Å; D205-L207 VanDerWaalsContact C-N 3.3Å; D205-L207 PolarHBondContact O-N 3.22Å; D205-S208 WeakPolarHBondContact O-CB 2.97Å; D205-S208 PolarHBondContact O-N 3.24Å; D205-S208 VanDerWaalsContact O-N 3.13Å; D205-V209 VanDerWaalsContact O-CG2 3.32Å; D205-V209 WeakPolarHBondContact O-CG2 3.45Å; D205-V209 PolarHBondContact O-N 2.85Å; D205-W260 VanDerWaalsContact OD2-CZ2 3.23Å; D205-W260 WeakPolarHBondContact OD2-CZ2 3.25Å; D205-W260 PolarHBondContact OD2-NE1 3.24Å; D205-H264 IonicContact OD2-CE1 3.43Å; D205-H264 PolarHBondContact OD2-CE1 3.1Å; D205-H264 IonicContact OD2-NE2 2.63Å; D205-H264 PolarHBondContact OD2-NE2 3.14Å; D205-W396 HydrophobicContact CB-CH2 4.18Å; D205-N397 VanDerWaalsContact CG-ND2 3.26Å; D205-N397 PolarHBondContact OD2-ND2 2.91Å
206	M	80.5	Confident	80.1	Confident	28 Å²	28	44.3 Å²	44.3	14%	0.138	23%	0.233	C	C	.	.	H	α-helix	trans	-61.3	-40	174.3	-69.2	177.5	65.3	0	0	111.9	L149 I202 S203 S208 V210 N218 Y237	L149-M206 HydrophobicContact CD1-CE 3.99Å; I202-M206 HydrophobicContact CG1-CB 4.44Å; I202-M206 HydrophobicContact CG1-SD 4.45Å; S203-M206 WeakPolarHBondContact O-CB 3.38Å; S203-M206 PolarHBondContact O-N 3.16Å; S203-M206 WeakPolarHBondContact OG-CG 3.49Å; S203-M206 PolarHBondContact OG-N 3.33Å; S203-M206 VanDerWaalsContact OG-N 3.14Å; M206-S208 VanDerWaalsContact C-N 3.33Å; M206-V210 WeakPolarHBondContact O-CG2 3.43Å; M206-V210 PolarHBondContact O-N 2.77Å; M206-N218 WeakPolarHBondContact CG-ND2 3.37Å; M206-Y237 HydrophobicContact CB-CE2 4.19Å; M206-Y237 HydrophobicContact CE-CE2 4.15Å
207	L	75.3	Confident	78.7	Confident	18 Å²	18	51.3 Å²	51.3	9%	0.094	26%	0.264	C	S	.	.	H	α-helix	trans	-60.9	-44.8	173	-70.7	169.2	0	0	0	111	S203 T204 D205 V210 K211 L234 Y237 Y238 A241	S203-L207 PolarHBondContact O-N 3.18Å; T204-L207 WeakPolarHBondContact O-CB 3.47Å; T204-L207 PolarHBondContact O-N 3.04Å; D205-L207 VanDerWaalsContact C-N 3.3Å; D205-L207 PolarHBondContact O-N 3.22Å; L207-V210 PolarHBondContact O-N 3.02Å; L207-K211 VanDerWaalsContact O-CB 3.29Å; L207-K211 WeakPolarHBondContact O-CB 3.45Å; L207-K211 PolarHBondContact O-N 3.15Å; L207-L234 HydrophobicContact CD2-CD1 4.46Å; L207-Y237 VanDerWaalsContact CD2-CB 3.49Å; L207-Y237 HydrophobicContact CD2-CD2 4.35Å; L207-Y237 HydrophobicContact CD2-CG 4.45Å; L207-Y238 HydrophobicContact CD1-CD1 4.42Å; L207-Y238 HydrophobicContact CD1-CE1 4.25Å; L207-Y238 HydrophobicContact CD2-CD1 4.03Å; L207-Y238 HydrophobicContact CD2-CE1 4.1Å; L207-Y238 HydrophobicContact CD2-CG 4.41Å; L207-A241 HydrophobicContact CD1-CB 4.46Å
208	S	71.9	Confident	77.3	Confident	54 Å²	54	53.1 Å²	53.1	38%	0.378	27%	0.274	S	S	.	.	H	α-helix	trans	-65.8	-40.9	-179.9	-58.2	0	0	0	0	112.4	T204 D205 M206 V210 K211 N212	T204-S208 PolarHBondContact O-N 2.9Å; T204-S208 PolarHBondContact O-OG 2.97Å; D205-S208 WeakPolarHBondContact O-CB 2.97Å; D205-S208 PolarHBondContact O-N 3.24Å; D205-S208 VanDerWaalsContact O-N 3.13Å; M206-S208 VanDerWaalsContact C-N 3.33Å; S208-V210 PolarHBondContact O-N 3.15Å; S208-K211 PolarHBondContact O-N 2.85Å; S208-N212 VanDerWaalsContact O-CB 3.29Å; S208-N212 WeakPolarHBondContact O-CB 3.42Å; S208-N212 VanDerWaalsContact O-CG 3.24Å; S208-N212 PolarHBondContact O-N 3.45Å; S208-N212 PolarHBondContact O-ND2 2.71Å
209	V	73.3	Confident	76.5	Confident	14 Å²	14	52.2 Å²	52.2	9%	0.085	27%	0.269	C	S	.	.	H	α-helix	trans	-59.7	-44.8	176	166.6	0	0	0	0	111.4	D205 Q213 N214 N219 W396	D205-V209 VanDerWaalsContact O-CG2 3.32Å; D205-V209 WeakPolarHBondContact O-CG2 3.45Å; D205-V209 PolarHBondContact O-N 2.85Å; V209-Q213 PolarHBondContact O-N 2.82Å; V209-Q213 VanDerWaalsContact O-N 3.1Å; V209-N214 HydrophobicContact CG1-CB 4.19Å; V209-N214 WeakPolarHBondContact CG1-O 3.43Å; V209-N214 PolarHBondContact O-N 3.15Å; V209-N219 HydrophobicContact CG1-CB 3.75Å; V209-W396 HydrophobicContact CG2-CH2 3.94Å; V209-W396 HydrophobicContact CG2-CZ3 4.4Å
210	V	71.6	Confident	75.5	Confident	3 Å²	3	48.7 Å²	48.7	2%	0.018	26%	0.264	C	S	.	.	H	α-helix	trans	-70.8	-41.8	178.4	178	0	0	0	0	111	M206 L207 S208 N212 Q213 K233 L234 Y237	M206-V210 WeakPolarHBondContact O-CG2 3.43Å; M206-V210 PolarHBondContact O-N 2.77Å; L207-V210 PolarHBondContact O-N 3.02Å; S208-V210 PolarHBondContact O-N 3.15Å; V210-N212 VanDerWaalsContact C-N 3.31Å; V210-N212 PolarHBondContact O-N 3.39Å; V210-Q213 PolarHBondContact O-N 2.89Å; V210-K233 HydrophobicContact CG1-CB 4.15Å; V210-K233 HydrophobicContact CG1-CD 4.14Å; V210-K233 HydrophobicContact CG1-CG 4.03Å; V210-K233 HydrophobicContact CG2-CD 3.92Å; V210-K233 HydrophobicContact CG2-CG 4.29Å; V210-L234 HydrophobicContact CG1-CB 4.13Å; V210-L234 HydrophobicContact CG1-CD1 4.41Å; V210-Y237 HydrophobicContact CG2-CD2 3.9Å; V210-Y237 HydrophobicContact CG2-CE2 3.6Å
211	K	67.4	Low	74.4	Confident	134 Å²	134	50 Å²	50	58%	0.583	28%	0.275	S	S	*	.	H	α-helix	trans	-59.6	-41.4	177.1	-176.6	-177.3	176.9	-174.7	0	112	L207 S208 Q213 L234	L207-K211 VanDerWaalsContact O-CB 3.29Å; L207-K211 WeakPolarHBondContact O-CB 3.45Å; L207-K211 PolarHBondContact O-N 3.15Å; S208-K211 PolarHBondContact O-N 2.85Å; K211-Q213 VanDerWaalsContact C-N 3.34Å; K211-L234 HydrophobicContact CB-CD1 4.36Å
212	N	75.3	Confident	73.6	Confident	101 Å²	101	55.4 Å²	55.4	54%	0.54	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-1.2	-178.7	-63.6	-16	0	0	0	113.4	S208 V210 N214	S208-N212 VanDerWaalsContact O-CB 3.29Å; S208-N212 WeakPolarHBondContact O-CB 3.42Å; S208-N212 VanDerWaalsContact O-CG 3.24Å; S208-N212 PolarHBondContact O-N 3.45Å; S208-N212 PolarHBondContact O-ND2 2.71Å; V210-N212 VanDerWaalsContact C-N 3.31Å; V210-N212 PolarHBondContact O-N 3.39Å; N212-N214 VanDerWaalsContact C-N 3.29Å; N212-N214 PolarHBondContact O-N 3.07Å
213	Q	74.3	Confident	72.5	Confident	82 Å²	82	56.9 Å²	56.9	38%	0.383	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	42.2	-178.2	-59.3	-173.5	-50.1	0	0	112.6	V209 V210 K211 T224 S230	V209-Q213 PolarHBondContact O-N 2.82Å; V209-Q213 VanDerWaalsContact O-N 3.1Å; V210-Q213 PolarHBondContact O-N 2.89Å; K211-Q213 VanDerWaalsContact C-N 3.34Å; Q213-T224 HydrophobicContact CB-CG2 4.02Å; Q213-T224 WeakPolarHBondContact O-CG2 3.32Å; Q213-S230 PolarHBondContact NE2-OG 2.86Å
214	N	69.6	Low	71.5	Confident	84 Å²	84	57.1 Å²	57.1	45%	0.449	31%	0.305	S	S	.	.			trans	-86	135.3	175.8	-71.2	-17.5	0	0	0	110.3	V209 N212 N219	V209-N214 HydrophobicContact CG1-CB 4.19Å; V209-N214 WeakPolarHBondContact CG1-O 3.43Å; V209-N214 PolarHBondContact O-N 3.15Å; N212-N214 VanDerWaalsContact C-N 3.29Å; N212-N214 PolarHBondContact O-N 3.07Å; N214-N219 PolarHBondContact O-ND2 3.32Å
215	I	66.1	Low	71.4	Confident	117 Å²	117	64.8 Å²	64.8	60%	0.6	33%	0.329	S	S	*	.			trans	-72.1	133.1	172.1	-58.8	175.7	0	0	0	108.1	A221 T224	I215-A221 HydrophobicContact CD1-CB 4.02Å; I215-A221 HydrophobicContact CG1-CB 4.38Å; I215-T224 HydrophobicContact CG1-CG2 3.99Å
216	G	69.6	Low	71.6	Confident	30 Å²	30	66 Å²	66	31%	0.309	34%	0.336	S	S	.	.	B	Isolated β-bridge	trans	-155.6	172.7	177.4	0	0	0	0	0	111.3	N218 N219	G216-N218 PolarHBondContact O-N 3.14Å; G216-N218 VanDerWaalsContact O-N 3.13Å; G216-N219 PolarHBondContact N-O 3.24Å; G216-N219 VanDerWaalsContact N-O 3.14Å; G216-N219 CarbonylContact O-C 3.51Å; G216-N219 PolarHBondContact O-N 3.22Å; G216-N219 VanDerWaalsContact O-O 3.09Å
217	F	69.8	Low	71.5	Confident	151 Å²	151	68.6 Å²	68.6	66%	0.662	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-28.3	-180	72.7	-92.6	0	0	0	112.7
218	N	67.9	Low	71.8	Confident	40 Å²	40	74.6 Å²	74.6	21%	0.214	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	4	177.2	60.2	7.1	0	0	0	113.7	M206 G216 K233	M206-N218 WeakPolarHBondContact CG-ND2 3.37Å; G216-N218 PolarHBondContact O-N 3.14Å; G216-N218 VanDerWaalsContact O-N 3.13Å; N218-K233 PolarHBondContact O-NZ 3.46Å
219	N	75.1	Confident	72.2	Confident	1 Å²	1	75.1 Å²	75.1	1%	0.005	38%	0.379	C	S	.	.	B	Isolated β-bridge	trans	-135.9	92.6	178	-161.5	39.1	0	0	0	111.6	V209 N214 G216 T224 K233	V209-N219 HydrophobicContact CG1-CB 3.75Å; N214-N219 PolarHBondContact O-ND2 3.32Å; G216-N219 PolarHBondContact N-O 3.24Å; G216-N219 VanDerWaalsContact N-O 3.14Å; G216-N219 CarbonylContact O-C 3.51Å; G216-N219 PolarHBondContact O-N 3.22Å; G216-N219 VanDerWaalsContact O-O 3.09Å; N219-T224 PolarHBondContact ND2-OG1 3.49Å; N219-K233 PolarHBondContact OD1-NZ 3.44Å
220	A	69.6	Low	72.5	Confident	40 Å²	40	74.9 Å²	74.9	33%	0.331	38%	0.377	S	S	.	.			trans	-64	141.9	-174.3	0	0	0	0	0	112.9	F222 I223 T224	A220-F222 VanDerWaalsContact C-N 3.25Å; A220-F222 HydrophobicContact CB-CD1 3.68Å; A220-F222 HydrophobicContact CB-CE1 3.41Å; A220-F222 VanDerWaalsContact CB-CE1 3.41Å; A220-F222 HydrophobicContact CB-CZ 4.23Å; A220-F222 PolarHBondContact O-N 2.9Å; A220-F222 VanDerWaalsContact O-N 3.13Å; A220-I223 HydrophobicContact CB-CD1 4.45Å; A220-I223 HydrophobicContact CB-CG1 4.47Å; A220-I223 WeakPolarHBondContact O-CB 3.49Å; A220-I223 PolarHBondContact O-N 3.3Å; A220-T224 PolarHBondContact O-N 2.92Å; A220-T224 PolarHBondContact O-OG1 2.91Å
221	A	66.1	Low	73.2	Confident	34 Å²	34	81.6 Å²	81.6	28%	0.281	41%	0.407	S	S	.	.	H	α-helix	trans	-56.9	-32.9	-175.1	0	0	0	0	0	114.2	I215 T224 R225	I215-A221 HydrophobicContact CD1-CB 4.02Å; I215-A221 HydrophobicContact CG1-CB 4.38Å; A221-T224 PolarHBondContact O-N 3.17Å; A221-R225 WeakPolarHBondContact O-CB 3.47Å; A221-R225 WeakPolarHBondContact O-CG 3.33Å; A221-R225 PolarHBondContact O-N 2.82Å
222	F	71.3	Confident	74.1	Confident	144 Å²	144	78.2 Å²	78.2	63%	0.632	40%	0.397	S	S	*	.	H	α-helix	trans	-70.7	-30.8	178.5	73	-92.8	0	0	0	113	A220	A220-F222 VanDerWaalsContact C-N 3.25Å; A220-F222 HydrophobicContact CB-CD1 3.68Å; A220-F222 HydrophobicContact CB-CE1 3.41Å; A220-F222 VanDerWaalsContact CB-CE1 3.41Å; A220-F222 HydrophobicContact CB-CZ 4.23Å; A220-F222 PolarHBondContact O-N 2.9Å; A220-F222 VanDerWaalsContact O-N 3.13Å
223	I	65.7	Low	74.7	Confident	30 Å²	30	74.7 Å²	74.7	15%	0.154	38%	0.377	C	S	.	.	H	α-helix	trans	-71.5	-45.1	174.3	-58.9	179.7	0	0	0	108.8	A220 R225 N226 L229 S230 K233	A220-I223 HydrophobicContact CB-CD1 4.45Å; A220-I223 HydrophobicContact CB-CG1 4.47Å; A220-I223 WeakPolarHBondContact O-CB 3.49Å; A220-I223 PolarHBondContact O-N 3.3Å; I223-R225 VanDerWaalsContact C-N 3.33Å; I223-R225 PolarHBondContact O-N 3.4Å; I223-N226 PolarHBondContact O-N 3.06Å; I223-N226 VanDerWaalsContact O-N 3.14Å; I223-L229 HydrophobicContact CG2-CB 4.26Å; I223-S230 PolarHBondContact O-OG 3.11Å; I223-K233 HydrophobicContact CD1-CD 4.16Å; I223-K233 HydrophobicContact CG2-CB 4.42Å; I223-K233 HydrophobicContact CG2-CD 3.92Å
224	T	64.4	Low	75.3	Confident	15 Å²	15	72.4 Å²	72.4	9%	0.092	37%	0.367	C	S	.	.	H	α-helix	trans	-57.9	-42.3	178.2	-63.4	0	0	0	0	112.8	Q213 I215 N219 A220 A221 N226	Q213-T224 HydrophobicContact CB-CG2 4.02Å; Q213-T224 WeakPolarHBondContact O-CG2 3.32Å; I215-T224 HydrophobicContact CG1-CG2 3.99Å; N219-T224 PolarHBondContact ND2-OG1 3.49Å; A220-T224 PolarHBondContact O-N 2.92Å; A220-T224 PolarHBondContact O-OG1 2.91Å; A221-T224 PolarHBondContact O-N 3.17Å; T224-N226 PolarHBondContact O-N 3.28Å
225	R	76.5	Confident	76.3	Confident	202 Å²	202	74.1 Å²	74.1	76%	0.762	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-12.8	179.8	-71.4	170.7	-174.5	-176.8	1.7	113.9	A221 I223	A221-R225 WeakPolarHBondContact O-CB 3.47Å; A221-R225 WeakPolarHBondContact O-CG 3.33Å; A221-R225 PolarHBondContact O-N 2.82Å; I223-R225 VanDerWaalsContact C-N 3.33Å; I223-R225 PolarHBondContact O-N 3.4Å
226	N	81.6	Confident	77.6	Confident	64 Å²	64	70 Å²	70	34%	0.342	35%	0.352	S	S	.	.			trans	-115.2	107.8	-178.2	-172.9	-39	0	0	0	111.1	I223 T224 F228 L229 S230	I223-N226 PolarHBondContact O-N 3.06Å; I223-N226 VanDerWaalsContact O-N 3.14Å; T224-N226 PolarHBondContact O-N 3.28Å; N226-F228 VanDerWaalsContact C-N 3.26Å; N226-F228 PolarHBondContact O-N 3.23Å; N226-F228 WeakPolarHBondContact OD1-CB 3.33Å; N226-F228 PolarHBondContact OD1-N 2.63Å; N226-L229 HydrophobicContact CB-CB 4.06Å; N226-L229 HydrophobicContact CB-CD1 3.89Å; N226-L229 HydrophobicContact CB-CG 4Å; N226-L229 PolarHBondContact O-N 3.08Å; N226-L229 PolarHBondContact OD1-N 3.43Å; N226-S230 PolarHBondContact O-N 3.43Å; N226-S230 PolarHBondContact O-OG 3.27Å
227	P	78.3	Confident	78.7	Confident	83 Å²	83	69.3 Å²	69.3	54%	0.539	34%	0.34	S	S	.	.	H	α-helix	trans	-58.9	-32.4	-179.1	-26.3	35	0	0	0	114.4	K231	P227-K231 WeakPolarHBondContact O-CG 3.44Å; P227-K231 PolarHBondContact O-N 2.8Å
228	F	83.3	Confident	79.8	Confident	143 Å²	143	67.8 Å²	67.8	63%	0.627	33%	0.331	S	S	*	.	H	α-helix	trans	-70.4	-47.9	177.7	176.4	-97.4	0	0	0	111.3	N226 S230 K231 V232	N226-F228 VanDerWaalsContact C-N 3.26Å; N226-F228 PolarHBondContact O-N 3.23Å; N226-F228 WeakPolarHBondContact OD1-CB 3.33Å; N226-F228 PolarHBondContact OD1-N 2.63Å; F228-S230 VanDerWaalsContact C-N 3.28Å; F228-S230 PolarHBondContact O-N 2.74Å; F228-K231 WeakPolarHBondContact O-CB 3.34Å; F228-K231 PolarHBondContact O-N 3.09Å; F228-K231 VanDerWaalsContact O-N 3.14Å; F228-V232 HydrophobicContact CD1-CG2 4.31Å; F228-V232 HydrophobicContact CE1-CG2 3.88Å; F228-V232 HydrophobicContact CE2-CG2 4.35Å; F228-V232 HydrophobicContact CZ-CG2 3.9Å; F228-V232 WeakPolarHBondContact O-CG2 3.41Å; F228-V232 PolarHBondContact O-N 3.28Å
229	L	80.3	Confident	81.1	Confident	66 Å²	66	70.8 Å²	70.8	35%	0.346	35%	0.346	S	S	.	.	H	α-helix	trans	-63.2	-37	177	-64	178.9	0	0	0	111.7	I223 N226 V232 K233	I223-L229 HydrophobicContact CG2-CB 4.26Å; N226-L229 HydrophobicContact CB-CB 4.06Å; N226-L229 HydrophobicContact CB-CD1 3.89Å; N226-L229 HydrophobicContact CB-CG 4Å; N226-L229 PolarHBondContact O-N 3.08Å; N226-L229 PolarHBondContact OD1-N 3.43Å; L229-V232 PolarHBondContact O-N 3.22Å; L229-K233 WeakPolarHBondContact O-CB 3.47Å; L229-K233 PolarHBondContact O-N 2.98Å
230	S	79.6	Confident	82.1	Confident	8 Å²	8	70.8 Å²	70.8	6%	0.056	35%	0.346	C	S	.	.	H	α-helix	trans	-59.6	-45.6	172.4	-66.1	0	0	0	0	111.7	Q213 I223 N226 F228 K233 L234	Q213-S230 PolarHBondContact NE2-OG 2.86Å; I223-S230 PolarHBondContact O-OG 3.11Å; N226-S230 PolarHBondContact O-N 3.43Å; N226-S230 PolarHBondContact O-OG 3.27Å; F228-S230 VanDerWaalsContact C-N 3.28Å; F228-S230 PolarHBondContact O-N 2.74Å; S230-K233 PolarHBondContact O-N 3.48Å; S230-L234 WeakPolarHBondContact O-CB 3.4Å; S230-L234 PolarHBondContact O-N 3.35Å
231	K	84.7	Confident	83.3	Confident	145 Å²	145	69.3 Å²	69.3	63%	0.63	33%	0.334	S	S	*	.	H	α-helix	trans	-62.9	-45.2	176	-76.8	178.8	-177.9	-178.9	0	112.5	P227 F228 L234 I235	P227-K231 WeakPolarHBondContact O-CG 3.44Å; P227-K231 PolarHBondContact O-N 2.8Å; F228-K231 WeakPolarHBondContact O-CB 3.34Å; F228-K231 PolarHBondContact O-N 3.09Å; F228-K231 VanDerWaalsContact O-N 3.14Å; K231-L234 PolarHBondContact O-N 3.41Å; K231-I235 WeakPolarHBondContact O-CG1 3.48Å; K231-I235 PolarHBondContact O-N 3.38Å
232	V	87.2	Confident	84.7	Confident	63 Å²	63	74 Å²	74	38%	0.382	35%	0.348	S	S	.	.	H	α-helix	trans	-60.8	-46.3	177.3	172.2	0	0	0	0	110.7	F228 L229 L234 I235 Y236	F228-V232 HydrophobicContact CD1-CG2 4.31Å; F228-V232 HydrophobicContact CE1-CG2 3.88Å; F228-V232 HydrophobicContact CE2-CG2 4.35Å; F228-V232 HydrophobicContact CZ-CG2 3.9Å; F228-V232 WeakPolarHBondContact O-CG2 3.41Å; F228-V232 PolarHBondContact O-N 3.28Å; L229-V232 PolarHBondContact O-N 3.22Å; V232-L234 VanDerWaalsContact C-N 3.29Å; V232-L234 PolarHBondContact O-N 3.1Å; V232-I235 PolarHBondContact O-N 2.78Å; V232-Y236 PolarHBondContact O-N 3.23Å
233	K	87.5	Confident	86	Confident	26 Å²	26	69.8 Å²	69.8	11%	0.113	33%	0.332	C	S	.	.	H	α-helix	trans	-61	-39.2	176.3	-175.3	174.6	178.7	-179.5	0	111.8	V210 N218 N219 I223 L229 S230 Y236 Y237	V210-K233 HydrophobicContact CG1-CB 4.15Å; V210-K233 HydrophobicContact CG1-CD 4.14Å; V210-K233 HydrophobicContact CG1-CG 4.03Å; V210-K233 HydrophobicContact CG2-CD 3.92Å; V210-K233 HydrophobicContact CG2-CG 4.29Å; N218-K233 PolarHBondContact O-NZ 3.46Å; N219-K233 PolarHBondContact OD1-NZ 3.44Å; I223-K233 HydrophobicContact CD1-CD 4.16Å; I223-K233 HydrophobicContact CG2-CB 4.42Å; I223-K233 HydrophobicContact CG2-CD 3.92Å; L229-K233 WeakPolarHBondContact O-CB 3.47Å; L229-K233 PolarHBondContact O-N 2.98Å; S230-K233 PolarHBondContact O-N 3.48Å; K233-Y236 WeakPolarHBondContact O-CB 3.26Å; K233-Y236 PolarHBondContact O-N 3.37Å; K233-Y237 WeakPolarHBondContact CE-OH 3.31Å; K233-Y237 HydrophobicContact CG-CD1 4.25Å; K233-Y237 HydrophobicContact CG-CE1 4.08Å; K233-Y237 WeakPolarHBondContact O-CB 3.49Å; K233-Y237 PolarHBondContact O-N 3.25Å
234	L	87.8	Confident	87.5	Confident	34 Å²	34	68.4 Å²	68.4	18%	0.178	33%	0.325	C	S	.	.	H	α-helix	trans	-65.8	-43.5	178.3	-172.6	62.4	0	0	0	112	L207 V210 K211 S230 K231 V232 Y236 Y237 Y238	L207-L234 HydrophobicContact CD2-CD1 4.46Å; V210-L234 HydrophobicContact CG1-CB 4.13Å; V210-L234 HydrophobicContact CG1-CD1 4.41Å; K211-L234 HydrophobicContact CB-CD1 4.36Å; S230-L234 WeakPolarHBondContact O-CB 3.4Å; S230-L234 PolarHBondContact O-N 3.35Å; K231-L234 PolarHBondContact O-N 3.41Å; V232-L234 VanDerWaalsContact C-N 3.29Å; V232-L234 PolarHBondContact O-N 3.1Å; L234-Y236 VanDerWaalsContact C-N 3.33Å; L234-Y236 PolarHBondContact O-N 2.77Å; L234-Y237 PolarHBondContact O-N 3.14Å; L234-Y238 HydrophobicContact CD1-CD2 4.09Å; L234-Y238 HydrophobicContact CD1-CE2 3.58Å; L234-Y238 HydrophobicContact CD2-CE2 3.96Å; L234-Y238 HydrophobicContact CG-CD2 3.86Å; L234-Y238 HydrophobicContact CG-CE2 3.49Å; L234-Y238 VanDerWaalsContact CG-CE2 3.49Å; L234-Y238 VanDerWaalsContact O-CD2 3.22Å; L234-Y238 WeakPolarHBondContact O-CD2 3.38Å; L234-Y238 PolarHBondContact O-N 3.01Å
235	I	90	Very high	89.1	Confident	120 Å²	120	68 Å²	68	62%	0.615	32%	0.323	S	S	*	.	H	α-helix	trans	-59.6	-46.5	173.8	-67.7	167.5	0	0	0	110.2	K231 V232 Y237 Y238 L239	K231-I235 WeakPolarHBondContact O-CG1 3.48Å; K231-I235 PolarHBondContact O-N 3.38Å; V232-I235 PolarHBondContact O-N 2.78Å; I235-Y237 VanDerWaalsContact C-N 3.35Å; I235-Y237 PolarHBondContact O-N 3.14Å; I235-Y238 PolarHBondContact O-N 2.92Å; I235-L239 WeakPolarHBondContact O-CB 3.35Å; I235-L239 PolarHBondContact O-N 2.99Å
236	Y	93.1	Very high	90.1	Very high	31 Å²	31	62.8 Å²	62.8	12%	0.122	31%	0.31	C	S	.	.	H	α-helix	trans	-57.1	-46.9	175.5	164	-117.7	0	0	0	111.8	F147 L150 V232 K233 L234 L239 F240	F147-Y236 HydrophobicContact CD1-CD1 4Å; F147-Y236 AromaticContact CD1-CD2 3.77Å; F147-Y236 HydrophobicContact CD1-CD2 3.77Å; F147-Y236 AromaticContact CD1-CE1 3.95Å; F147-Y236 HydrophobicContact CD1-CE1 3.95Å; F147-Y236 AromaticContact CD1-CE2 3.72Å; F147-Y236 HydrophobicContact CD1-CE2 3.72Å; F147-Y236 AromaticContact CD1-CG 3.93Å; F147-Y236 HydrophobicContact CD1-CG 3.93Å; F147-Y236 AromaticContact CD1-CZ 3.81Å; F147-Y236 HydrophobicContact CE1-CD1 4.3Å; F147-Y236 HydrophobicContact CE1-CD2 4.1Å; F147-Y236 HydrophobicContact CE1-CE2 4.49Å; F147-Y236 HydrophobicContact CE1-CG 4.01Å; L150-Y236 HydrophobicContact CB-CE2 3.91Å; L150-Y236 WeakPolarHBondContact CB-OH 3.47Å; L150-Y236 HydrophobicContact CD2-CE2 4.31Å; L150-Y236 PolarHBondContact N-OH 3.46Å; V232-Y236 PolarHBondContact O-N 3.23Å; K233-Y236 WeakPolarHBondContact O-CB 3.26Å; K233-Y236 PolarHBondContact O-N 3.37Å; L234-Y236 VanDerWaalsContact C-N 3.33Å; L234-Y236 PolarHBondContact O-N 2.77Å; Y236-L239 PolarHBondContact O-N 2.86Å; Y236-F240 HydrophobicContact CE2-CB 4.27Å; Y236-F240 VanDerWaalsContact O-CB 3.26Å; Y236-F240 WeakPolarHBondContact O-CB 3.35Å; Y236-F240 PolarHBondContact O-N 2.86Å
237	Y	92.5	Very high	90.8	Very high	16 Å²	16	60.6 Å²	60.6	6%	0.063	30%	0.299	C	S	.	.	H	α-helix	trans	-66.1	-38.4	179.9	-83.2	17.7	0	0	0	112.5	L149 I202 M206 L207 V210 K233 L234 I235 F240 A241	L149-Y237 HydrophobicContact CD1-CE1 4.12Å; I202-Y237 HydrophobicContact CD1-CD1 4.31Å; I202-Y237 HydrophobicContact CD1-CD2 4.02Å; I202-Y237 HydrophobicContact CD1-CG 3.82Å; M206-Y237 HydrophobicContact CB-CE2 4.19Å; M206-Y237 HydrophobicContact CE-CE2 4.15Å; L207-Y237 VanDerWaalsContact CD2-CB 3.49Å; L207-Y237 HydrophobicContact CD2-CD2 4.35Å; L207-Y237 HydrophobicContact CD2-CG 4.45Å; V210-Y237 HydrophobicContact CG2-CD2 3.9Å; V210-Y237 HydrophobicContact CG2-CE2 3.6Å; K233-Y237 WeakPolarHBondContact CE-OH 3.31Å; K233-Y237 HydrophobicContact CG-CD1 4.25Å; K233-Y237 HydrophobicContact CG-CE1 4.08Å; K233-Y237 WeakPolarHBondContact O-CB 3.49Å; K233-Y237 PolarHBondContact O-N 3.25Å; L234-Y237 PolarHBondContact O-N 3.14Å; I235-Y237 VanDerWaalsContact C-N 3.35Å; I235-Y237 PolarHBondContact O-N 3.14Å; Y237-F240 PolarHBondContact O-N 3.21Å; Y237-A241 WeakPolarHBondContact O-CB 3.3Å; Y237-A241 PolarHBondContact O-N 3.34Å
238	Y	93	Very high	91.7	Very high	118 Å²	118	56.7 Å²	56.7	46%	0.463	27%	0.274	S	S	.	.	H	α-helix	trans	-65.5	-44.4	174.5	-79.2	-57	0	0	0	112.3	L207 L234 I235 F240 A241 F242	L207-Y238 HydrophobicContact CD1-CD1 4.42Å; L207-Y238 HydrophobicContact CD1-CE1 4.25Å; L207-Y238 HydrophobicContact CD2-CD1 4.03Å; L207-Y238 HydrophobicContact CD2-CE1 4.1Å; L207-Y238 HydrophobicContact CD2-CG 4.41Å; L234-Y238 HydrophobicContact CD1-CD2 4.09Å; L234-Y238 HydrophobicContact CD1-CE2 3.58Å; L234-Y238 HydrophobicContact CD2-CE2 3.96Å; L234-Y238 HydrophobicContact CG-CD2 3.86Å; L234-Y238 HydrophobicContact CG-CE2 3.49Å; L234-Y238 VanDerWaalsContact CG-CE2 3.49Å; L234-Y238 VanDerWaalsContact O-CD2 3.22Å; L234-Y238 WeakPolarHBondContact O-CD2 3.38Å; L234-Y238 PolarHBondContact O-N 3.01Å; I235-Y238 PolarHBondContact O-N 2.92Å; Y238-F240 VanDerWaalsContact C-N 3.34Å; Y238-A241 PolarHBondContact O-N 3.39Å; Y238-F242 WeakPolarHBondContact O-CB 3.27Å; Y238-F242 PolarHBondContact O-N 2.63Å
239	L	94.7	Very high	92.4	Very high	103 Å²	103	52.2 Å²	52.2	54%	0.539	26%	0.26	S	S	.	.	H	α-helix	trans	-62.1	-44.9	176	179.6	63.1	0	0	0	110.9	I235 Y236 F242 I243	I235-L239 WeakPolarHBondContact O-CB 3.35Å; I235-L239 PolarHBondContact O-N 2.99Å; Y236-L239 PolarHBondContact O-N 2.86Å; L239-F242 PolarHBondContact O-N 2.92Å; L239-I243 HydrophobicContact CD1-CD1 4.25Å; L239-I243 HydrophobicContact CG-CD1 4.12Å; L239-I243 WeakPolarHBondContact O-CG1 3.32Å; L239-I243 PolarHBondContact O-N 3.43Å
240	F	96	Very high	93.2	Very high	2 Å²	2	49.8 Å²	49.8	1%	0.009	25%	0.249	C	C	.	.	H	α-helix	trans	-64.1	-44.7	177.8	-176.6	-95.1	0	0	0	111.7	L149 L150 S153 F180 T201 I202 Y236 Y237 Y238 F242 I243 Y244	L149-F240 HydrophobicContact CB-CD1 4.41Å; L149-F240 HydrophobicContact CB-CE1 3.97Å; L149-F240 HydrophobicContact CB-CE2 4.12Å; L149-F240 HydrophobicContact CB-CZ 3.82Å; L149-F240 HydrophobicContact CD1-CD1 4.37Å; L149-F240 HydrophobicContact CD1-CE1 4.29Å; L150-F240 HydrophobicContact CB-CD2 4.29Å; L150-F240 HydrophobicContact CB-CE2 4.44Å; L150-F240 HydrophobicContact CD1-CD2 4.36Å; S153-F240 WeakPolarHBondContact OG-CE2 3.38Å; S153-F240 VanDerWaalsContact OG-CZ 3.28Å; S153-F240 WeakPolarHBondContact OG-CZ 3.47Å; F180-F240 HydrophobicContact CE2-CE2 4.11Å; F180-F240 HydrophobicContact CE2-CZ 4.1Å; F180-F240 AromaticContact CZ-CE2 3.99Å; F180-F240 HydrophobicContact CZ-CE2 3.99Å; F180-F240 HydrophobicContact CZ-CZ 4.42Å; T201-F240 HydrophobicContact CG2-CE1 4.04Å; T201-F240 HydrophobicContact CG2-CZ 3.9Å; I202-F240 HydrophobicContact CB-CD1 3.94Å; I202-F240 HydrophobicContact CB-CE1 3.94Å; I202-F240 HydrophobicContact CD1-CD1 3.95Å; I202-F240 HydrophobicContact CG2-CD1 3.72Å; I202-F240 HydrophobicContact CG2-CE1 3.78Å; Y236-F240 HydrophobicContact CE2-CB 4.27Å; Y236-F240 VanDerWaalsContact O-CB 3.26Å; Y236-F240 WeakPolarHBondContact O-CB 3.35Å; Y236-F240 PolarHBondContact O-N 2.86Å; Y237-F240 PolarHBondContact O-N 3.21Å; Y238-F240 VanDerWaalsContact C-N 3.34Å; F240-F242 VanDerWaalsContact C-N 3.29Å; F240-F242 PolarHBondContact O-N 2.68Å; F240-I243 PolarHBondContact O-N 3.03Å; F240-Y244 WeakPolarHBondContact O-CB 3.48Å; F240-Y244 PolarHBondContact O-N 2.89Å
241	A	95.3	Very high	94	Very high	9 Å²	9	49.8 Å²	49.8	7%	0.074	25%	0.249	C	C	.	.	H	α-helix	trans	-59.5	-39.8	175.8	0	0	0	0	0	112.1	I202 L207 Y237 Y238 Y244 G245 L268	I202-A241 HydrophobicContact CD1-CB 4.34Å; I202-A241 HydrophobicContact CG2-CB 4.21Å; L207-A241 HydrophobicContact CD1-CB 4.46Å; Y237-A241 WeakPolarHBondContact O-CB 3.3Å; Y237-A241 PolarHBondContact O-N 3.34Å; Y238-A241 PolarHBondContact O-N 3.39Å; A241-Y244 PolarHBondContact O-N 3.48Å; A241-G245 PolarHBondContact O-N 3.34Å; A241-L268 HydrophobicContact CB-CD2 3.92Å
242	F	96.6	Very high	94.7	Very high	132 Å²	132	45.1 Å²	45.1	58%	0.579	23%	0.231	S	C	*	.	H	α-helix	trans	-62.1	-50.2	174.4	175.7	-103.5	0	0	0	111.7	Y238 L239 F240 Y244 G245 L246	Y238-F242 WeakPolarHBondContact O-CB 3.27Å; Y238-F242 PolarHBondContact O-N 2.63Å; L239-F242 PolarHBondContact O-N 2.92Å; F240-F242 VanDerWaalsContact C-N 3.29Å; F240-F242 PolarHBondContact O-N 2.68Å; F242-Y244 VanDerWaalsContact C-N 3.34Å; F242-Y244 PolarHBondContact O-N 2.95Å; F242-G245 PolarHBondContact O-N 3.44Å; F242-L246 HydrophobicContact CD1-CD1 4.13Å; F242-L246 HydrophobicContact CE1-CD1 3.52Å; F242-L246 HydrophobicContact CE1-CG 4.25Å; F242-L246 HydrophobicContact CZ-CD1 3.76Å; F242-L246 HydrophobicContact CZ-CD2 4.35Å; F242-L246 HydrophobicContact CZ-CG 4.2Å; F242-L246 WeakPolarHBondContact O-CG 3.47Å; F242-L246 PolarHBondContact O-N 3.35Å
243	I	97.4	Very high	95.2	Very high	56 Å²	56	42.2 Å²	42.2	29%	0.287	21%	0.213	S	C	.	.	H	α-helix	trans	-63	-42.9	177.9	-63.1	167	0	0	0	110.7	F180 L239 F240 G245 L246 V247	F180-I243 HydrophobicContact CE1-CG2 3.62Å; F180-I243 HydrophobicContact CZ-CG2 3.66Å; L239-I243 HydrophobicContact CD1-CD1 4.25Å; L239-I243 HydrophobicContact CG-CD1 4.12Å; L239-I243 WeakPolarHBondContact O-CG1 3.32Å; L239-I243 PolarHBondContact O-N 3.43Å; F240-I243 PolarHBondContact O-N 3.03Å; I243-G245 VanDerWaalsContact C-N 3.29Å; I243-G245 PolarHBondContact O-N 2.81Å; I243-L246 WeakPolarHBondContact O-CB 3.28Å; I243-L246 PolarHBondContact O-N 2.86Å; I243-L246 VanDerWaalsContact O-N 3.12Å; I243-V247 HydrophobicContact CG2-CG1 4.41Å; I243-V247 PolarHBondContact O-N 3.13Å
244	Y	97.4	Very high	95.7	Very high	1 Å²	1	41 Å²	41	0%	0.004	21%	0.207	C	C	.	.	H	α-helix	trans	-58	-41.6	175.8	179.6	-117.6	0	0	0	111.7	A179 F180 P200 T201 I202 F240 A241 F242 V247 G248 L268 W269	A179-Y244 HydrophobicContact CB-CD2 4.17Å; A179-Y244 HydrophobicContact CB-CE2 3.68Å; F180-Y244 HydrophobicContact CE2-CD2 4.25Å; P200-Y244 VanDerWaalsContact CA-OH 3.32Å; P200-Y244 WeakPolarHBondContact CA-OH 3.12Å; P200-Y244 HydrophobicContact CB-CE1 4.04Å; T201-Y244 PolarHBondContact N-OH 3.43Å; T201-Y244 VanDerWaalsContact OG1-CE2 3.29Å; T201-Y244 WeakPolarHBondContact OG1-CE2 3.36Å; I202-Y244 HydrophobicContact CG2-CD1 3.68Å; I202-Y244 HydrophobicContact CG2-CE1 4.3Å; I202-Y244 HydrophobicContact CG2-CG 4.11Å; F240-Y244 WeakPolarHBondContact O-CB 3.48Å; F240-Y244 PolarHBondContact O-N 2.89Å; A241-Y244 PolarHBondContact O-N 3.48Å; F242-Y244 VanDerWaalsContact C-N 3.34Å; F242-Y244 PolarHBondContact O-N 2.95Å; Y244-V247 WeakPolarHBondContact O-CG2 3.39Å; Y244-G248 PolarHBondContact O-N 3.14Å; Y244-L268 HydrophobicContact CD1-CD1 4.25Å; Y244-L268 HydrophobicContact CE1-CD1 4.12Å; Y244-W269 AromaticContact CD1-CD1 3.97Å; Y244-W269 AromaticContact CD1-NE1 3.31Å; Y244-W269 VanDerWaalsContact CD1-NE1 3.31Å; Y244-W269 AromaticContact CE1-CD1 3.88Å; Y244-W269 AromaticContact CE1-CE2 3.85Å; Y244-W269 HydrophobicContact CE1-CZ2 4.2Å; Y244-W269 AromaticContact CE1-NE1 2.97Å; Y244-W269 AromaticContact CE2-CZ2 3.83Å; Y244-W269 HydrophobicContact CE2-CZ2 3.83Å; Y244-W269 AromaticContact CE2-NE1 3.82Å; Y244-W269 AromaticContact CG-NE1 3.86Å; Y244-W269 AromaticContact CZ-CE2 3.68Å; Y244-W269 AromaticContact CZ-CZ2 3.54Å; Y244-W269 AromaticContact CZ-NE1 3.26Å; Y244-W269 VanDerWaalsContact CZ-NE1 3.26Å; Y244-W269 PolarHBondContact O-NE1 2.92Å; Y244-W269 VanDerWaalsContact OH-CZ2 3.31Å; Y244-W269 WeakPolarHBondContact OH-CZ2 2.94Å
245	G	97.4	Very high	96.2	Very high	6 Å²	6	39.3 Å²	39.3	6%	0.062	20%	0.199	C	C	.	.	H	α-helix	trans	-61.3	-43.8	172.6	0	0	0	0	0	113.4	A241 F242 I243 S249 L268	A241-G245 PolarHBondContact O-N 3.34Å; F242-G245 PolarHBondContact O-N 3.44Å; I243-G245 VanDerWaalsContact C-N 3.29Å; I243-G245 PolarHBondContact O-N 2.81Å; G245-S249 VanDerWaalsContact O-CB 3.31Å; G245-S249 WeakPolarHBondContact O-CB 3.45Å; G245-S249 PolarHBondContact O-N 3.21Å; G245-S249 PolarHBondContact O-OG 3.44Å; G245-L268 VanDerWaalsContact CA-O 3.27Å; G245-L268 WeakPolarHBondContact CA-O 3.2Å
246	L	97.9	Very high	96.6	Very high	92 Å²	92	33.6 Å²	33.6	48%	0.482	17%	0.17	S	C	.	.	H	α-helix	trans	-64.7	-42.4	177.7	-69.1	-179	0	0	0	113.3	F242 I243 S249 C250	F242-L246 HydrophobicContact CD1-CD1 4.13Å; F242-L246 HydrophobicContact CE1-CD1 3.52Å; F242-L246 HydrophobicContact CE1-CG 4.25Å; F242-L246 HydrophobicContact CZ-CD1 3.76Å; F242-L246 HydrophobicContact CZ-CD2 4.35Å; F242-L246 HydrophobicContact CZ-CG 4.2Å; F242-L246 WeakPolarHBondContact O-CG 3.47Å; F242-L246 PolarHBondContact O-N 3.35Å; I243-L246 WeakPolarHBondContact O-CB 3.28Å; I243-L246 PolarHBondContact O-N 2.86Å; I243-L246 VanDerWaalsContact O-N 3.12Å; L246-S249 PolarHBondContact O-OG 3.31Å; L246-C250 PolarHBondContact O-SG 3.32Å
247	V	97.8	Very high	96.8	Very high	19 Å²	19	32.6 Å²	32.6	12%	0.115	17%	0.166	C	C	.	.	H	α-helix	trans	-75.4	-37.7	-179.9	-58.1	0	0	0	0	111.5	A179 F180 P183 I243 Y244 C250	A179-V247 HydrophobicContact CB-CG2 4.19Å; F180-V247 HydrophobicContact CD1-CG1 4.19Å; F180-V247 HydrophobicContact CD1-CG2 4.44Å; F180-V247 HydrophobicContact CD2-CG2 3.79Å; F180-V247 HydrophobicContact CE1-CG1 4.31Å; F180-V247 HydrophobicContact CE2-CG2 3.9Å; F180-V247 HydrophobicContact CG-CG2 4.08Å; F180-V247 HydrophobicContact CZ-CG2 4.3Å; P183-V247 HydrophobicContact CG-CB 3.74Å; P183-V247 HydrophobicContact CG-CG1 3.89Å; I243-V247 HydrophobicContact CG2-CG1 4.41Å; I243-V247 PolarHBondContact O-N 3.13Å; Y244-V247 WeakPolarHBondContact O-CG2 3.39Å; V247-C250 VanDerWaalsContact O-CB 3.31Å; V247-C250 WeakPolarHBondContact O-CB 3.45Å; V247-C250 PolarHBondContact O-N 3.48Å
248	G	97.1	Very high	97	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-65.2	-37.1	177.2	0	0	0	0	0	113.3	Y244 C250 S251	Y244-G248 PolarHBondContact O-N 3.14Å; G248-C250 PolarHBondContact O-N 2.75Å; G248-C250 VanDerWaalsContact O-N 3.08Å; G248-S251 WeakPolarHBondContact O-CB 3.31Å; G248-S251 PolarHBondContact O-N 3.08Å; G248-S251 VanDerWaalsContact O-N 3.09Å; G248-S251 PolarHBondContact O-OG 3.46Å
249	S	97.1	Very high	97.2	Very high	49 Å²	49	27.6 Å²	27.6	34%	0.343	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-7.9	178.1	71	0	0	0	0	114.5	G245 L246 S251	G245-S249 VanDerWaalsContact O-CB 3.31Å; G245-S249 WeakPolarHBondContact O-CB 3.45Å; G245-S249 PolarHBondContact O-N 3.21Å; G245-S249 PolarHBondContact O-OG 3.44Å; L246-S249 PolarHBondContact O-OG 3.31Å; S249-S251 PolarHBondContact O-N 3.43Å
250	C	97.1	Very high	97.3	Very high	16 Å²	16	23.7 Å²	23.7	11%	0.108	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-5.9	171.4	-61.9	0	0	0	0	113.4	L182 P183 Y187 V193 L246 V247 G248	L182-C250 HydrophobicContact CB-CB 4.4Å; P183-C250 HydrophobicContact CG-CB 4.32Å; Y187-C250 HydrophobicContact CE2-CB 4.43Å; V193-C250 WeakPolarHBondContact CG2-O 3.33Å; L246-C250 PolarHBondContact O-SG 3.32Å; V247-C250 VanDerWaalsContact O-CB 3.31Å; V247-C250 WeakPolarHBondContact O-CB 3.45Å; V247-C250 PolarHBondContact O-N 3.48Å; G248-C250 PolarHBondContact O-N 2.75Å; G248-C250 VanDerWaalsContact O-N 3.08Å
251	S	97.1	Very high	97.3	Very high	8 Å²	8	23.6 Å²	23.6	6%	0.056	13%	0.129	C	C	.	.			trans	-69.3	131	176.1	-61.1	0	0	0	0	113.1	L182 S195 G248 S249	L182-S251 WeakPolarHBondContact CD1-OG 3.28Å; S195-S251 PolarHBondContact OG-OG 3.47Å; S195-S251 VanDerWaalsContact OG-OG 3.11Å; G248-S251 WeakPolarHBondContact O-CB 3.31Å; G248-S251 PolarHBondContact O-N 3.08Å; G248-S251 VanDerWaalsContact O-N 3.09Å; G248-S251 PolarHBondContact O-OG 3.46Å; S249-S251 PolarHBondContact O-N 3.43Å
252	D	98	Very high	97.4	Very high	47 Å²	47	24.8 Å²	24.8	25%	0.251	13%	0.134	S	C	.	.	S	Bend	trans	-76.7	-31.5	170.4	-61	-64.5	0	0	0	111.9	K186 Q192 V193 C274 L490	K186-D252 WeakPolarHBondContact CE-OD1 3.26Å; K186-D252 WeakPolarHBondContact CE-OD2 3.5Å; K186-D252 IonicContact NZ-OD1 3.83Å; K186-D252 PolarHBondContact NZ-OD1 3.19Å; K186-D252 IonicContact NZ-OD2 2.71Å; K186-D252 PolarHBondContact NZ-OD2 3.18Å; Q192-D252 PolarHBondContact OE1-OD2 3.46Å; V193-D252 PolarHBondContact N-OD2 3.44Å; V193-D252 WeakPolarHBondContact O-CB 3.41Å; V193-D252 PolarHBondContact O-N 3.36Å; D252-C274 WeakPolarHBondContact O-CB 3.48Å; D252-L490 HydrophobicContact CB-CD2 3.72Å
253	V	98.1	Very high	97.3	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.006	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	131	174.3	175.4	0	0	0	0	108.9	G194 S195 M255 S486 K489 L490	G194-V253 CarbonylContact C-O 3.56Å; G194-V253 VanDerWaalsContact CA-O 3.27Å; G194-V253 WeakPolarHBondContact CA-O 3.42Å; S195-V253 PolarHBondContact N-O 3.27Å; V253-M255 HydrophobicContact CG1-CG 4.25Å; V253-S486 WeakPolarHBondContact CG1-O 3.41Å; V253-K489 HydrophobicContact CG2-CB 3.81Å; V253-K489 HydrophobicContact CG2-CD 4.43Å; V253-L490 HydrophobicContact CB-CD1 4.41Å; V253-L490 HydrophobicContact CB-CD2 3.99Å; V253-L490 HydrophobicContact CB-CG 4.14Å; V253-L490 HydrophobicContact CG2-CD2 3.72Å; V253-L490 HydrophobicContact CG2-CG 3.79Å
254	V	98.5	Very high	97.2	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	126.5	173.3	-174.1	0	0	0	0	108.8	V197 V256 I265 W269 V271 C274 T275 N276	V197-V254 HydrophobicContact CG2-CG1 4.32Å; V254-V256 HydrophobicContact CG1-CG1 4.19Å; V254-I265 HydrophobicContact CG1-CG2 4.05Å; V254-W269 HydrophobicContact CG1-CE3 4.23Å; V254-W269 HydrophobicContact CG1-CZ3 3.94Å; V254-W269 HydrophobicContact CG2-CE3 4.1Å; V254-W269 HydrophobicContact CG2-CZ3 4Å; V254-V271 HydrophobicContact CG2-CG2 4Å; V254-C274 PolarHBondContact N-O 2.94Å; V254-T275 HydrophobicContact CB-CG2 4.15Å; V254-T275 HydrophobicContact CG1-CG2 4.04Å; V254-T275 CarbonylContact O-C 3.58Å; V254-T275 VanDerWaalsContact O-CA 3.3Å; V254-T275 WeakPolarHBondContact O-CA 3.41Å; V254-N276 PolarHBondContact O-N 2.73Å
255	M	98.4	Very high	97.2	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	133.6	173.2	-64.8	164	-74.6	0	0	108.2	S195 Y196 V197 V253 N276 V278 F483 V487	S195-M255 WeakPolarHBondContact O-CE 3.45Å; S195-M255 PolarHBondContact O-N 3.11Å; Y196-M255 CarbonylContact C-O 3.33Å; Y196-M255 WeakPolarHBondContact CA-O 3.44Å; Y196-M255 HydrophobicContact CD2-CB 3.65Å; Y196-M255 HydrophobicContact CD2-SD 4.28Å; Y196-M255 HydrophobicContact CE2-CB 4.28Å; Y196-M255 HydrophobicContact CG-CB 4.32Å; V197-M255 PolarHBondContact N-O 3.38Å; V253-M255 HydrophobicContact CG1-CG 4.25Å; M255-N276 WeakPolarHBondContact CA-O 3.44Å; M255-V278 HydrophobicContact CB-CB 4.26Å; M255-V278 HydrophobicContact CB-CG2 4Å; M255-V278 HydrophobicContact CG-CB 4.5Å; M255-V278 HydrophobicContact CG-CG2 3.76Å; M255-V278 HydrophobicContact SD-CG2 4.31Å; M255-F483 HydrophobicContact CE-CD2 4.47Å; M255-F483 HydrophobicContact CE-CE2 3.98Å; M255-F483 HydrophobicContact SD-CD2 3.57Å; M255-F483 VanDerWaalsContact SD-CD2 3.57Å; M255-F483 HydrophobicContact SD-CE2 3.67Å; M255-V487 HydrophobicContact CE-CG1 3.59Å; M255-V487 HydrophobicContact SD-CG1 3.5Å; M255-V487 VanDerWaalsContact SD-CG1 3.5Å
256	V	98	Very high	97.1	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	142.5	178.5	-62.8	0	0	0	0	110	V197 V254 S258 T261 L262 I265 T275 N276 I277 V278	V197-V256 HydrophobicContact CB-CG1 4.32Å; V254-V256 HydrophobicContact CG1-CG1 4.19Å; V256-S258 VanDerWaalsContact C-N 3.31Å; V256-S258 PolarHBondContact O-N 2.87Å; V256-T261 HydrophobicContact CB-CG2 3.84Å; V256-T261 HydrophobicContact CG1-CG2 3.96Å; V256-L262 HydrophobicContact CG2-CB 3.7Å; V256-L262 HydrophobicContact CG2-CD1 3.89Å; V256-L262 HydrophobicContact CG2-CG 4.39Å; V256-I265 HydrophobicContact CG1-CB 4.2Å; V256-I265 HydrophobicContact CG1-CG1 3.96Å; V256-I265 HydrophobicContact CG1-CG2 4.39Å; V256-T275 HydrophobicContact CG1-CG2 4Å; V256-T275 HydrophobicContact CG2-CG2 4.27Å; V256-N276 PolarHBondContact N-O 3.38Å; V256-I277 HydrophobicContact CG2-CB 4.48Å; V256-I277 HydrophobicContact CG2-CG1 3.93Å; V256-I277 WeakPolarHBondContact O-CA 3.44Å; V256-V278 PolarHBondContact O-N 3.27Å
257	N	96.9	Very high	97	Very high	9 Å²	9	22.2 Å²	22.2	5%	0.048	13%	0.13	C	C	.	.	S	Bend	trans	-79.4	-6.8	-171.8	69.5	-19.7	0	0	0	115.4	Y196 V197 H198 T261 V278 Y279 P280 F400	Y196-N257 HydrophobicContact CE1-CB 4.06Å; V197-N257 PolarHBondContact O-N 2.86Å; H198-N257 VanDerWaalsContact O-CG 3.3Å; H198-N257 PolarHBondContact O-ND2 3.09Å; H198-N257 PolarHBondContact O-OD1 3.25Å; N257-T261 VanDerWaalsContact OD1-CB 3.27Å; N257-T261 WeakPolarHBondContact OD1-CB 3.4Å; N257-T261 PolarHBondContact OD1-OG1 3.47Å; N257-V278 WeakPolarHBondContact CA-O 3.36Å; N257-Y279 WeakPolarHBondContact O-CD1 3.46Å; N257-P280 WeakPolarHBondContact O-CD 3.27Å; N257-F400 VanDerWaalsContact O-CD2 3.22Å; N257-F400 WeakPolarHBondContact O-CD2 3.37Å
258	S	97.4	Very high	96.9	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.13	C	C	.	.	S	Bend	trans	-164.8	165	-175.3	70.9	0	0	0	0	112	V256 W260 T261 L262 H399 D425	V256-S258 VanDerWaalsContact C-N 3.31Å; V256-S258 PolarHBondContact O-N 2.87Å; S258-W260 PolarHBondContact O-N 3.5Å; S258-W260 PolarHBondContact OG-N 2.89Å; S258-T261 PolarHBondContact O-N 3.27Å; S258-T261 PolarHBondContact OG-N 2.84Å; S258-T261 PolarHBondContact OG-OG1 3Å; S258-L262 WeakPolarHBondContact O-CB 3.44Å; S258-L262 PolarHBondContact O-N 3.34Å; S258-H399 WeakPolarHBondContact CB-O 3.42Å; S258-H399 PolarHBondContact OG-O 2.85Å; S258-D425 WeakPolarHBondContact CB-OD2 3.31Å
259	S	97.8	Very high	96.9	Very high	30 Å²	30	22.7 Å²	22.7	21%	0.21	13%	0.132	C	C	.	.	H	α-helix	trans	-63.8	-32.1	171.1	-63.4	0	0	0	0	111.7	L262 N263 D425	S259-L262 WeakPolarHBondContact O-CB 3.34Å; S259-L262 PolarHBondContact O-N 3.38Å; S259-N263 VanDerWaalsContact O-CG 3.25Å; S259-N263 PolarHBondContact O-N 3.13Å; S259-N263 VanDerWaalsContact O-N 3.08Å; S259-N263 PolarHBondContact O-ND2 3.09Å; S259-D425 VanDerWaalsContact CB-OD1 3.24Å; S259-D425 WeakPolarHBondContact CB-OD1 3.41Å; S259-D425 WeakPolarHBondContact CB-OD2 3.49Å; S259-D425 PolarHBondContact N-OD1 2.92Å; S259-D425 PolarHBondContact N-OD2 3.16Å; S259-D425 PolarHBondContact OG-OD1 2.94Å
260	W	95.6	Very high	96.8	Very high	21 Å²	21	28.6 Å²	28.6	8%	0.08	15%	0.151	C	C	.	.	H	α-helix	trans	-62.3	-50.3	174	-177.3	84.5	0	0	0	111.2	D205 S258 L262 N263 H264 N397 H399 L424	D205-W260 VanDerWaalsContact OD2-CZ2 3.23Å; D205-W260 WeakPolarHBondContact OD2-CZ2 3.25Å; D205-W260 PolarHBondContact OD2-NE1 3.24Å; S258-W260 PolarHBondContact O-N 3.5Å; S258-W260 PolarHBondContact OG-N 2.89Å; W260-L262 VanDerWaalsContact C-N 3.33Å; W260-L262 PolarHBondContact O-N 3.2Å; W260-N263 PolarHBondContact O-N 3.25Å; W260-H264 AromaticContact CD2-CD2 3.64Å; W260-H264 AromaticContact CD2-NE2 3.77Å; W260-H264 AromaticContact CE2-CD2 3.46Å; W260-H264 VanDerWaalsContact CE2-CD2 3.46Å; W260-H264 AromaticContact CE2-NE2 3.1Å; W260-H264 AromaticContact CE3-CD2 3.85Å; W260-H264 AromaticContact CH2-CD2 3.76Å; W260-H264 AromaticContact CH2-NE2 3.81Å; W260-H264 AromaticContact CZ2-CD2 3.55Å; W260-H264 AromaticContact CZ2-NE2 3.15Å; W260-H264 WeakPolarHBondContact CZ2-NE2 3.49Å; W260-H264 AromaticContact CZ3-CD2 3.89Å; W260-H264 AromaticContact NE1-CD2 3.96Å; W260-H264 AromaticContact NE1-NE2 3.31Å; W260-H264 PolarHBondContact NE1-NE2 3.49Å; W260-H264 PolarHBondContact O-CD2 3.05Å; W260-H264 PolarHBondContact O-N 3.05Å; W260-N397 HydrophobicContact CZ2-CB 3.88Å; W260-H399 HydrophobicContact CE3-CB 4.38Å; W260-H399 AromaticContact CH2-CD2 3.66Å; W260-H399 HydrophobicContact CZ3-CB 4.27Å; W260-H399 AromaticContact CZ3-CD2 3.38Å; W260-H399 WeakPolarHBondContact CZ3-CD2 3.38Å; W260-L424 HydrophobicContact CB-CD1 3.86Å
261	T	96.1	Very high	96.7	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-65.2	-38.5	178.3	-59.5	0	0	0	0	111.3	V197 V256 N257 S258 N263 H264 I265	V197-T261 HydrophobicContact CB-CG2 4.21Å; V197-T261 HydrophobicContact CG1-CG2 3.81Å; V256-T261 HydrophobicContact CB-CG2 3.84Å; V256-T261 HydrophobicContact CG1-CG2 3.96Å; N257-T261 VanDerWaalsContact OD1-CB 3.27Å; N257-T261 WeakPolarHBondContact OD1-CB 3.4Å; N257-T261 PolarHBondContact OD1-OG1 3.47Å; S258-T261 PolarHBondContact O-N 3.27Å; S258-T261 PolarHBondContact OG-N 2.84Å; S258-T261 PolarHBondContact OG-OG1 3Å; T261-N263 PolarHBondContact O-N 3.4Å; T261-H264 PolarHBondContact O-N 3.17Å; T261-I265 HydrophobicContact CG2-CG1 4.26Å; T261-I265 WeakPolarHBondContact O-CG1 3.45Å; T261-I265 PolarHBondContact O-N 3.36Å
262	L	97.2	Very high	96.5	Very high	34 Å²	34	30.4 Å²	30.4	18%	0.178	17%	0.171	C	C	.	.	H	α-helix	trans	-52.8	-53.2	173.7	-180	65.4	0	0	0	111.1	V256 S258 S259 W260 H264 I265 L266 T275 I277	V256-L262 HydrophobicContact CG2-CB 3.7Å; V256-L262 HydrophobicContact CG2-CD1 3.89Å; V256-L262 HydrophobicContact CG2-CG 4.39Å; S258-L262 WeakPolarHBondContact O-CB 3.44Å; S258-L262 PolarHBondContact O-N 3.34Å; S259-L262 WeakPolarHBondContact O-CB 3.34Å; S259-L262 PolarHBondContact O-N 3.38Å; W260-L262 VanDerWaalsContact C-N 3.33Å; W260-L262 PolarHBondContact O-N 3.2Å; L262-H264 VanDerWaalsContact C-N 3.29Å; L262-H264 PolarHBondContact O-N 3.26Å; L262-I265 PolarHBondContact O-N 3.11Å; L262-I265 VanDerWaalsContact O-N 3.12Å; L262-L266 HydrophobicContact CD1-CD1 3.93Å; L262-L266 HydrophobicContact CD1-CD2 4.18Å; L262-L266 HydrophobicContact CD1-CG 3.85Å; L262-L266 HydrophobicContact CD2-CD1 4.29Å; L262-L266 HydrophobicContact CG-CD1 3.8Å; L262-L266 HydrophobicContact CG-CG 4.08Å; L262-L266 WeakPolarHBondContact O-CG 3.36Å; L262-L266 PolarHBondContact O-N 3.4Å; L262-T275 HydrophobicContact CD1-CG2 3.42Å; L262-T275 VanDerWaalsContact CD1-CG2 3.42Å; L262-I277 HydrophobicContact CB-CD1 4.41Å; L262-I277 HydrophobicContact CB-CG1 4.2Å; L262-I277 HydrophobicContact CD2-CD1 3.73Å; L262-I277 HydrophobicContact CD2-CG1 3.87Å; L262-I277 HydrophobicContact CG-CG1 4.43Å
263	N	95.6	Very high	96.3	Very high	91 Å²	91	34.8 Å²	34.8	49%	0.487	19%	0.194	S	C	.	.	H	α-helix	trans	-59.6	-39.7	-176.1	-70.9	-27.3	0	0	0	112.3	S259 W260 T261 S267	S259-N263 VanDerWaalsContact O-CG 3.25Å; S259-N263 PolarHBondContact O-N 3.13Å; S259-N263 VanDerWaalsContact O-N 3.08Å; S259-N263 PolarHBondContact O-ND2 3.09Å; W260-N263 PolarHBondContact O-N 3.25Å; T261-N263 PolarHBondContact O-N 3.4Å; N263-S267 WeakPolarHBondContact O-CB 3.15Å; N263-S267 PolarHBondContact O-N 3.44Å; N263-S267 VanDerWaalsContact O-N 3.13Å
264	H	95.3	Very high	96.2	Very high	7 Å²	7	35.3 Å²	35.3	3%	0.032	20%	0.198	C	C	.	.	H	α-helix	trans	-66.2	-44.8	175.1	-73.6	-65.2	0	0	0	112.3	P200 T204 D205 W260 T261 L262 S267 L268	P200-H264 HydrophobicContact CG-CB 3.96Å; T204-H264 PolarHBondContact N-CE1 2.99Å; T204-H264 PolarHBondContact N-ND1 2.94Å; T204-H264 PolarHBondContact OG1-CE1 3.18Å; T204-H264 PolarHBondContact OG1-ND1 3.42Å; D205-H264 IonicContact OD2-CE1 3.43Å; D205-H264 PolarHBondContact OD2-CE1 3.1Å; D205-H264 IonicContact OD2-NE2 2.63Å; D205-H264 PolarHBondContact OD2-NE2 3.14Å; W260-H264 AromaticContact CD2-CD2 3.64Å; W260-H264 AromaticContact CD2-NE2 3.77Å; W260-H264 AromaticContact CE2-CD2 3.46Å; W260-H264 VanDerWaalsContact CE2-CD2 3.46Å; W260-H264 AromaticContact CE2-NE2 3.1Å; W260-H264 AromaticContact CE3-CD2 3.85Å; W260-H264 AromaticContact CH2-CD2 3.76Å; W260-H264 AromaticContact CH2-NE2 3.81Å; W260-H264 AromaticContact CZ2-CD2 3.55Å; W260-H264 AromaticContact CZ2-NE2 3.15Å; W260-H264 WeakPolarHBondContact CZ2-NE2 3.49Å; W260-H264 AromaticContact CZ3-CD2 3.89Å; W260-H264 AromaticContact NE1-CD2 3.96Å; W260-H264 AromaticContact NE1-NE2 3.31Å; W260-H264 PolarHBondContact NE1-NE2 3.49Å; W260-H264 PolarHBondContact O-CD2 3.05Å; W260-H264 PolarHBondContact O-N 3.05Å; T261-H264 PolarHBondContact O-N 3.17Å; L262-H264 VanDerWaalsContact C-N 3.29Å; L262-H264 PolarHBondContact O-N 3.26Å; H264-S267 PolarHBondContact O-N 3.34Å; H264-L268 HydrophobicContact CB-CD1 4.48Å; H264-L268 WeakPolarHBondContact O-CB 3.42Å; H264-L268 WeakPolarHBondContact O-CD1 3.45Å; H264-L268 WeakPolarHBondContact O-CG 3.37Å; H264-L268 PolarHBondContact O-N 3.44Å
265	I	96.9	Very high	96.1	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-67.5	-40.8	-179.4	-68.8	-64.3	0	0	0	111.7	V197 P200 V254 V256 T261 L262 S267 L268 W269 T275	V197-I265 HydrophobicContact CG1-CD1 4.01Å; V197-I265 HydrophobicContact CG1-CG1 4.23Å; V197-I265 HydrophobicContact CG2-CD1 4.19Å; P200-I265 HydrophobicContact CB-CD1 4.2Å; V254-I265 HydrophobicContact CG1-CG2 4.05Å; V256-I265 HydrophobicContact CG1-CB 4.2Å; V256-I265 HydrophobicContact CG1-CG1 3.96Å; V256-I265 HydrophobicContact CG1-CG2 4.39Å; T261-I265 HydrophobicContact CG2-CG1 4.26Å; T261-I265 WeakPolarHBondContact O-CG1 3.45Å; T261-I265 PolarHBondContact O-N 3.36Å; L262-I265 PolarHBondContact O-N 3.11Å; L262-I265 VanDerWaalsContact O-N 3.12Å; I265-S267 VanDerWaalsContact C-N 3.3Å; I265-S267 PolarHBondContact O-N 3.02Å; I265-L268 PolarHBondContact O-N 2.96Å; I265-W269 HydrophobicContact CD1-CD2 3.79Å; I265-W269 HydrophobicContact CD1-CE3 4.25Å; I265-W269 HydrophobicContact CD1-CG 4.23Å; I265-W269 HydrophobicContact CD1-CH2 4.35Å; I265-W269 HydrophobicContact CD1-CZ2 3.9Å; I265-W269 HydrophobicContact CG2-CB 4.23Å; I265-W269 HydrophobicContact CG2-CD2 4.01Å; I265-W269 HydrophobicContact CG2-CE3 3.91Å; I265-W269 HydrophobicContact CG2-CG 4.17Å; I265-W269 WeakPolarHBondContact O-CA 3.49Å; I265-W269 WeakPolarHBondContact O-CB 3.3Å; I265-W269 PolarHBondContact O-N 2.82Å; I265-T275 HydrophobicContact CG2-CG2 4.35Å
266	L	96.2	Very high	96.1	Very high	64 Å²	64	38.5 Å²	38.5	34%	0.335	22%	0.216	S	C	.	.	H	α-helix	trans	-61	-40.7	174.4	-67.4	-177.4	0	0	0	111.8	L262 K270	L262-L266 HydrophobicContact CD1-CD1 3.93Å; L262-L266 HydrophobicContact CD1-CD2 4.18Å; L262-L266 HydrophobicContact CD1-CG 3.85Å; L262-L266 HydrophobicContact CD2-CD1 4.29Å; L262-L266 HydrophobicContact CG-CD1 3.8Å; L262-L266 HydrophobicContact CG-CG 4.08Å; L262-L266 WeakPolarHBondContact O-CG 3.36Å; L262-L266 PolarHBondContact O-N 3.4Å; L266-K270 WeakPolarHBondContact O-CA 3.47Å; L266-K270 PolarHBondContact O-N 2.76Å
267	S	95.3	Very high	96.1	Very high	70 Å²	70	41.1 Å²	41.1	49%	0.49	23%	0.229	S	C	.	.	H	α-helix	trans	-66.3	-44.3	177.5	-172.9	0	0	0	0	112.6	N263 H264 I265	N263-S267 WeakPolarHBondContact O-CB 3.15Å; N263-S267 PolarHBondContact O-N 3.44Å; N263-S267 VanDerWaalsContact O-N 3.13Å; H264-S267 PolarHBondContact O-N 3.34Å; I265-S267 VanDerWaalsContact C-N 3.3Å; I265-S267 PolarHBondContact O-N 3.02Å
268	L	95.8	Very high	96.2	Very high	22 Å²	22	40.7 Å²	40.7	12%	0.115	23%	0.226	C	C	.	.	H	α-helix	trans	-86.4	-49.9	-171.5	-66.5	166.6	0	0	0	112.8	P200 I202 T204 A241 Y244 G245 H264 I265	P200-L268 HydrophobicContact CB-CD1 4.43Å; I202-L268 WeakPolarHBondContact O-CD1 3.12Å; T204-L268 HydrophobicContact CG2-CD2 4.4Å; T204-L268 HydrophobicContact CG2-CG 4.41Å; A241-L268 HydrophobicContact CB-CD2 3.92Å; Y244-L268 HydrophobicContact CD1-CD1 4.25Å; Y244-L268 HydrophobicContact CE1-CD1 4.12Å; G245-L268 VanDerWaalsContact CA-O 3.27Å; G245-L268 WeakPolarHBondContact CA-O 3.2Å; H264-L268 HydrophobicContact CB-CD1 4.48Å; H264-L268 WeakPolarHBondContact O-CB 3.42Å; H264-L268 WeakPolarHBondContact O-CD1 3.45Å; H264-L268 WeakPolarHBondContact O-CG 3.37Å; H264-L268 PolarHBondContact O-N 3.44Å; I265-L268 PolarHBondContact O-N 2.96Å
269	W	96.8	Very high	96.2	Very high	7 Å²	7	43.1 Å²	43.1	3%	0.027	24%	0.236	C	C	.	.	H	α-helix	trans	-91.5	-23.2	-171.8	-63.8	9.7	0	0	0	112.6	A179 L182 V197 Y244 V254 I265 V271	A179-W269 HydrophobicContact CB-CH2 4.1Å; A179-W269 HydrophobicContact CB-CZ2 3.75Å; L182-W269 HydrophobicContact CD1-CH2 4.35Å; V197-W269 HydrophobicContact CG2-CH2 3.77Å; V197-W269 HydrophobicContact CG2-CZ2 4.44Å; V197-W269 HydrophobicContact CG2-CZ3 4.17Å; Y244-W269 AromaticContact CD1-CD1 3.97Å; Y244-W269 AromaticContact CD1-NE1 3.31Å; Y244-W269 VanDerWaalsContact CD1-NE1 3.31Å; Y244-W269 AromaticContact CE1-CD1 3.88Å; Y244-W269 AromaticContact CE1-CE2 3.85Å; Y244-W269 HydrophobicContact CE1-CZ2 4.2Å; Y244-W269 AromaticContact CE1-NE1 2.97Å; Y244-W269 AromaticContact CE2-CZ2 3.83Å; Y244-W269 HydrophobicContact CE2-CZ2 3.83Å; Y244-W269 AromaticContact CE2-NE1 3.82Å; Y244-W269 AromaticContact CG-NE1 3.86Å; Y244-W269 AromaticContact CZ-CE2 3.68Å; Y244-W269 AromaticContact CZ-CZ2 3.54Å; Y244-W269 AromaticContact CZ-NE1 3.26Å; Y244-W269 VanDerWaalsContact CZ-NE1 3.26Å; Y244-W269 PolarHBondContact O-NE1 2.92Å; Y244-W269 VanDerWaalsContact OH-CZ2 3.31Å; Y244-W269 WeakPolarHBondContact OH-CZ2 2.94Å; V254-W269 HydrophobicContact CG1-CE3 4.23Å; V254-W269 HydrophobicContact CG1-CZ3 3.94Å; V254-W269 HydrophobicContact CG2-CE3 4.1Å; V254-W269 HydrophobicContact CG2-CZ3 4Å; I265-W269 HydrophobicContact CD1-CD2 3.79Å; I265-W269 HydrophobicContact CD1-CE3 4.25Å; I265-W269 HydrophobicContact CD1-CG 4.23Å; I265-W269 HydrophobicContact CD1-CH2 4.35Å; I265-W269 HydrophobicContact CD1-CZ2 3.9Å; I265-W269 HydrophobicContact CG2-CB 4.23Å; I265-W269 HydrophobicContact CG2-CD2 4.01Å; I265-W269 HydrophobicContact CG2-CE3 3.91Å; I265-W269 HydrophobicContact CG2-CG 4.17Å; I265-W269 WeakPolarHBondContact O-CA 3.49Å; I265-W269 WeakPolarHBondContact O-CB 3.3Å; I265-W269 PolarHBondContact O-N 2.82Å; W269-V271 VanDerWaalsContact C-N 3.29Å; W269-V271 HydrophobicContact CB-CG2 3.75Å; W269-V271 HydrophobicContact CE3-CG2 4.26Å; W269-V271 PolarHBondContact O-N 3.31Å
270	K	95.3	Very high	96.2	Very high	174 Å²	174	41.8 Å²	41.8	76%	0.757	23%	0.227	S	C	*	.			trans	57.5	36.2	178.1	-55.6	-178.6	177.2	-179.7	0	114.1	L266	L266-K270 WeakPolarHBondContact O-CA 3.47Å; L266-K270 PolarHBondContact O-N 2.76Å
271	V	94.1	Very high	96.1	Very high	14 Å²	14	40.8 Å²	40.8	9%	0.085	22%	0.223	C	C	.	.			trans	-116.6	47.9	-177.4	-69.7	0	0	0	0	113.2	V254 W269 N273 C274 T275	V254-V271 HydrophobicContact CG2-CG2 4Å; W269-V271 VanDerWaalsContact C-N 3.29Å; W269-V271 HydrophobicContact CB-CG2 3.75Å; W269-V271 HydrophobicContact CE3-CG2 4.26Å; W269-V271 PolarHBondContact O-N 3.31Å; V271-N273 PolarHBondContact O-N 2.83Å; V271-N273 VanDerWaalsContact O-N 3.17Å; V271-C274 PolarHBondContact O-N 2.86Å; V271-T275 PolarHBondContact O-N 2.99Å; V271-T275 PolarHBondContact O-OG1 2.99Å
272	G	93.3	Very high	95.9	Very high	47 Å²	47	40.8 Å²	40.8	49%	0.485	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-62.3	-23.6	-176.3	0	0	0	0	0	115.1	C274	G272-C274 VanDerWaalsContact C-N 3.32Å; G272-C274 PolarHBondContact O-N 2.88Å
273	N	93.8	Very high	95.4	Very high	139 Å²	139	40.9 Å²	40.9	74%	0.743	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	-72.3	-20	178.6	62.8	-31.7	0	0	0	114.4	V271	V271-N273 PolarHBondContact O-N 2.83Å; V271-N273 VanDerWaalsContact O-N 3.17Å
274	C	95.4	Very high	95.2	Very high	13 Å²	13	37 Å²	37	9%	0.088	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-119.8	9.8	177.5	70	0	0	0	0	113.6	D252 V254 V271 G272	D252-C274 WeakPolarHBondContact O-CB 3.48Å; V254-C274 PolarHBondContact N-O 2.94Å; V271-C274 PolarHBondContact O-N 2.86Å; G272-C274 VanDerWaalsContact C-N 3.32Å; G272-C274 PolarHBondContact O-N 2.88Å
275	T	97.9	Very high	95	Very high	13 Å²	13	41.7 Å²	41.7	8%	0.08	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	125.5	-179.1	-54.1	0	0	0	0	111.6	V254 V256 L262 I265 V271	V254-T275 HydrophobicContact CB-CG2 4.15Å; V254-T275 HydrophobicContact CG1-CG2 4.04Å; V254-T275 CarbonylContact O-C 3.58Å; V254-T275 VanDerWaalsContact O-CA 3.3Å; V254-T275 WeakPolarHBondContact O-CA 3.41Å; V256-T275 HydrophobicContact CG1-CG2 4Å; V256-T275 HydrophobicContact CG2-CG2 4.27Å; L262-T275 HydrophobicContact CD1-CG2 3.42Å; L262-T275 VanDerWaalsContact CD1-CG2 3.42Å; I265-T275 HydrophobicContact CG2-CG2 4.35Å; V271-T275 PolarHBondContact O-N 2.99Å; V271-T275 PolarHBondContact O-OG1 2.99Å
276	N	97.6	Very high	94.6	Very high	54 Å²	54	43.3 Å²	43.3	29%	0.289	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	144.3	176.1	-56.9	-45.8	0	0	0	110.8	V254 M255 V256 S486	V254-N276 PolarHBondContact O-N 2.73Å; M255-N276 WeakPolarHBondContact CA-O 3.44Å; V256-N276 PolarHBondContact N-O 3.38Å; N276-S486 WeakPolarHBondContact CB-OG 3.45Å; N276-S486 PolarHBondContact ND2-OG 2.99Å
277	I	98.2	Very high	94.3	Very high	54 Å²	54	40.3 Å²	40.3	28%	0.277	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	127.4	167	-62.3	174.9	0	0	0	108.3	V256 L262 Y279	V256-I277 HydrophobicContact CG2-CB 4.48Å; V256-I277 HydrophobicContact CG2-CG1 3.93Å; V256-I277 WeakPolarHBondContact O-CA 3.44Å; L262-I277 HydrophobicContact CB-CD1 4.41Å; L262-I277 HydrophobicContact CB-CG1 4.2Å; L262-I277 HydrophobicContact CD2-CD1 3.73Å; L262-I277 HydrophobicContact CD2-CG1 3.87Å; L262-I277 HydrophobicContact CG-CG1 4.43Å; I277-Y279 HydrophobicContact CG2-CD1 3.9Å; I277-Y279 HydrophobicContact CG2-CD2 4.41Å; I277-Y279 HydrophobicContact CG2-CE1 3.63Å; I277-Y279 HydrophobicContact CG2-CE2 4.18Å; I277-Y279 HydrophobicContact CG2-CG 4.28Å
278	V	98.2	Very high	94.2	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.208	C	C	.	.			trans	-131.1	99.2	170.2	179.5	0	0	0	0	105.8	Y196 M255 V256 N257 F479 F483 S486	Y196-V278 HydrophobicContact CE2-CB 4.01Å; Y196-V278 HydrophobicContact CE2-CG1 3.91Å; Y196-V278 PolarHBondContact OH-O 3.22Å; M255-V278 HydrophobicContact CB-CB 4.26Å; M255-V278 HydrophobicContact CB-CG2 4Å; M255-V278 HydrophobicContact CG-CB 4.5Å; M255-V278 HydrophobicContact CG-CG2 3.76Å; M255-V278 HydrophobicContact SD-CG2 4.31Å; V256-V278 PolarHBondContact O-N 3.27Å; N257-V278 WeakPolarHBondContact CA-O 3.36Å; V278-F479 HydrophobicContact CG1-CD2 3.61Å; V278-F479 HydrophobicContact CG1-CE2 3.64Å; V278-F483 HydrophobicContact CG1-CB 4.06Å; V278-S486 WeakPolarHBondContact CG2-OG 3.3Å
279	Y	98	Very high	93.9	Very high	51 Å²	51	43.3 Å²	43.3	20%	0.2	23%	0.23	C	C	.	.			trans	-62.4	142.6	179.3	-66	-56.8	0	0	0	110.6	N257 I277 F400 D425 F474 F479	N257-Y279 WeakPolarHBondContact O-CD1 3.46Å; I277-Y279 HydrophobicContact CG2-CD1 3.9Å; I277-Y279 HydrophobicContact CG2-CD2 4.41Å; I277-Y279 HydrophobicContact CG2-CE1 3.63Å; I277-Y279 HydrophobicContact CG2-CE2 4.18Å; I277-Y279 HydrophobicContact CG2-CG 4.28Å; Y279-F400 HydrophobicContact CD1-CD2 4.02Å; Y279-F400 AromaticContact CD1-CE2 3.52Å; Y279-F400 HydrophobicContact CD1-CE2 3.52Å; Y279-F400 HydrophobicContact CD1-CZ 4.42Å; Y279-F400 HydrophobicContact CE1-CE2 4.17Å; Y279-F400 HydrophobicContact CG-CE2 4.19Å; Y279-D425 HydrophobicContact CE1-CB 3.82Å; Y279-D425 VanDerWaalsContact CE1-OD1 3.29Å; Y279-D425 WeakPolarHBondContact CE1-OD1 3.48Å; Y279-D425 PolarHBondContact OH-OD1 2.85Å; Y279-F474 HydrophobicContact CD1-CD1 4.28Å; Y279-F474 AromaticContact CD1-CE1 3.94Å; Y279-F474 HydrophobicContact CD1-CE1 3.94Å; Y279-F474 AromaticContact CD2-CD1 3.85Å; Y279-F474 HydrophobicContact CD2-CD1 3.85Å; Y279-F474 AromaticContact CD2-CE1 3.74Å; Y279-F474 HydrophobicContact CD2-CE1 3.74Å; Y279-F474 HydrophobicContact CE1-CE1 4.17Å; Y279-F474 AromaticContact CE2-CE1 3.98Å; Y279-F474 HydrophobicContact CE2-CE1 3.98Å; Y279-F474 AromaticContact CG-CD1 3.71Å; Y279-F474 HydrophobicContact CG-CD1 3.71Å; Y279-F474 AromaticContact CG-CE1 3.72Å; Y279-F474 HydrophobicContact CG-CE1 3.72Å; Y279-F479 WeakPolarHBondContact O-CD2 3.47Å
280	P	96.7	Very high	93.4	Very high	3 Å²	3	43.6 Å²	43.6	2%	0.019	23%	0.231	C	C	.	.			trans	-65.5	148.9	-178.1	29.5	-33.5	0	0	0	110.8	V81 Y196 N257 C282 F400 I402	V81-P280 HydrophobicContact CG2-CB 3.99Å; Y196-P280 WeakPolarHBondContact OH-CA 3.09Å; N257-P280 WeakPolarHBondContact O-CD 3.27Å; P280-C282 PolarHBondContact O-N 2.94Å; P280-F400 HydrophobicContact CG-CB 4.24Å; P280-F400 HydrophobicContact CG-CD1 3.11Å; P280-F400 HydrophobicContact CG-CD2 4.28Å; P280-F400 HydrophobicContact CG-CE1 3.36Å; P280-F400 HydrophobicContact CG-CE2 4.47Å; P280-F400 HydrophobicContact CG-CG 3.61Å; P280-F400 HydrophobicContact CG-CZ 4.06Å; P280-I402 HydrophobicContact CB-CD1 4.12Å; P280-I402 HydrophobicContact CB-CG1 4.35Å; P280-I402 HydrophobicContact CG-CD1 4.28Å; P280-I402 HydrophobicContact CG-CG1 3.98Å
281	P	95	Very high	93	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.219	C	C	.	.			trans	-68.1	114.7	178.2	27.3	-29.8	0	0	0	109.9	R80 V81 C84 D476 F479	R80-P281 VanDerWaalsContact CD-O 3.3Å; R80-P281 WeakPolarHBondContact CD-O 3.45Å; R80-P281 HydrophobicContact CG-CG 4.3Å; R80-P281 PolarHBondContact NE-O 3Å; V81-P281 HydrophobicContact CG2-CG 4.48Å; C84-P281 HydrophobicContact CB-CB 4.15Å; C84-P281 HydrophobicContact CB-CG 3.71Å; P281-D476 WeakPolarHBondContact CB-OD1 3.4Å; P281-F479 HydrophobicContact CB-CB 3.76Å; P281-F479 HydrophobicContact CB-CD1 3.86Å; P281-F479 HydrophobicContact CB-CD2 4.4Å; P281-F479 HydrophobicContact CB-CG 3.73Å; P281-F479 HydrophobicContact CG-CB 4.45Å; P281-F479 HydrophobicContact CG-CD1 3.88Å; P281-F479 HydrophobicContact CG-CD2 4.21Å; P281-F479 HydrophobicContact CG-CE1 4.14Å; P281-F479 HydrophobicContact CG-CE2 4.41Å; P281-F479 HydrophobicContact CG-CG 3.89Å; P281-F479 HydrophobicContact CG-CZ 4.38Å
282	C	92.4	Very high	92.4	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-99.9	134.6	171.6	-62.3	0	0	0	0	109.1	P280 V284 V405 F474	P280-C282 PolarHBondContact O-N 2.94Å; C282-V284 HydrophobicContact CB-CG1 3.77Å; C282-V284 PolarHBondContact O-N 2.97Å; C282-V405 HydrophobicContact CB-CB 4.41Å; C282-V405 HydrophobicContact CB-CG1 3.9Å; C282-F474 HydrophobicContact CB-CB 4.28Å; C282-F474 VanDerWaalsContact CB-O 3.3Å; C282-F474 WeakPolarHBondContact CB-O 3.32Å; C282-F474 PolarHBondContact N-O 3.4Å
283	D	86.3	Confident	91.3	Very high	36 Å²	36	41.6 Å²	41.6	19%	0.193	22%	0.219	C	C	.	.			trans	-76	62.9	173.6	-173.4	14.8	0	0	0	110.9	Q285 T286 F287	D283-Q285 PolarHBondContact O-N 2.82Å; D283-T286 PolarHBondContact OD1-OG1 2.65Å; D283-T286 VanDerWaalsContact OD1-OG1 3.13Å; D283-T286 WeakPolarHBondContact OD2-CB 3.45Å; D283-T286 PolarHBondContact OD2-OG1 2.84Å; D283-F287 VanDerWaalsContact O-CD2 3.23Å; D283-F287 WeakPolarHBondContact O-CD2 3.37Å
284	V	91.1	Very high	89.7	Confident	8 Å²	8	42.7 Å²	42.7	5%	0.048	22%	0.22	C	C	.	.	H	α-helix	trans	-63.6	-32.5	-173.8	-63.3	0	0	0	0	111.9	C282 T286 F287 L288 V405 A409 V471	C282-V284 HydrophobicContact CB-CG1 3.77Å; C282-V284 PolarHBondContact O-N 2.97Å; V284-T286 PolarHBondContact O-N 2.79Å; V284-F287 PolarHBondContact O-N 2.89Å; V284-L288 HydrophobicContact CB-CD1 4.29Å; V284-L288 HydrophobicContact CG2-CD1 4.26Å; V284-L288 WeakPolarHBondContact O-CB 3.38Å; V284-L288 VanDerWaalsContact O-CG 3.24Å; V284-L288 WeakPolarHBondContact O-CG 2.98Å; V284-L288 PolarHBondContact O-N 2.84Å; V284-V405 HydrophobicContact CG1-CG1 3.83Å; V284-A409 HydrophobicContact CB-CB 4.35Å; V284-V471 HydrophobicContact CB-CG2 4.05Å; V284-V471 HydrophobicContact CG1-CB 4.04Å; V284-V471 HydrophobicContact CG1-CG2 4.01Å
285	Q	90.4	Very high	87.9	Confident	106 Å²	106	50.9 Å²	50.9	50%	0.495	25%	0.254	S	S	.	.	H	α-helix	trans	-62.6	-47	-174.5	-170.7	60.6	50.7	0	0	111.3	D283 F287 L288 D289	D283-Q285 PolarHBondContact O-N 2.82Å; Q285-F287 PolarHBondContact O-N 2.93Å; Q285-F287 VanDerWaalsContact O-N 3.11Å; Q285-L288 PolarHBondContact O-N 3.14Å; Q285-D289 PolarHBondContact NE2-OD1 2.87Å; Q285-D289 PolarHBondContact O-N 3.23Å
286	T	87.8	Confident	86.2	Confident	34 Å²	34	53.7 Å²	53.7	21%	0.209	27%	0.265	C	S	.	.	H	α-helix	trans	-57.2	-31	179.7	-59.8	0	0	0	0	112.9	D283 V284 F378	D283-T286 PolarHBondContact OD1-OG1 2.65Å; D283-T286 VanDerWaalsContact OD1-OG1 3.13Å; D283-T286 WeakPolarHBondContact OD2-CB 3.45Å; D283-T286 PolarHBondContact OD2-OG1 2.84Å; V284-T286 PolarHBondContact O-N 2.79Å; T286-F378 HydrophobicContact CG2-CE1 3.4Å; T286-F378 HydrophobicContact CG2-CZ 3.46Å; T286-F378 VanDerWaalsContact CG2-CZ 3.46Å
287	F	90.9	Very high	84.4	Confident	2 Å²	2	58.5 Å²	58.5	1%	0.009	29%	0.287	C	S	.	.	H	α-helix	trans	-89.9	-28.6	175.6	-62.8	-78.9	0	0	0	113.1	D283 V284 Q285 D289 I290 F378 L385 E406 A409 A410 R468	D283-F287 VanDerWaalsContact O-CD2 3.23Å; D283-F287 WeakPolarHBondContact O-CD2 3.37Å; V284-F287 PolarHBondContact O-N 2.89Å; Q285-F287 PolarHBondContact O-N 2.93Å; Q285-F287 VanDerWaalsContact O-N 3.11Å; F287-D289 PolarHBondContact O-N 2.94Å; F287-I290 HydrophobicContact CD1-CD1 4.11Å; F287-I290 VanDerWaalsContact O-CB 3.32Å; F287-I290 WeakPolarHBondContact O-CB 3.29Å; F287-I290 WeakPolarHBondContact O-CG1 3.34Å; F287-I290 PolarHBondContact O-N 2.83Å; F287-F378 HydrophobicContact CE1-CE2 4.05Å; F287-F378 HydrophobicContact CE1-CZ 4.12Å; F287-F378 HydrophobicContact CE2-CE2 4.35Å; F287-F378 HydrophobicContact CE2-CZ 4.34Å; F287-F378 AromaticContact CZ-CE2 3.6Å; F287-F378 HydrophobicContact CZ-CE2 3.6Å; F287-F378 AromaticContact CZ-CZ 3.85Å; F287-F378 HydrophobicContact CZ-CZ 3.85Å; F287-L385 HydrophobicContact CD1-CD1 3.79Å; F287-L385 HydrophobicContact CE1-CD1 3.54Å; F287-E406 HydrophobicContact CD2-CB 3.94Å; F287-E406 HydrophobicContact CD2-CG 3.92Å; F287-E406 HydrophobicContact CE1-CB 4.31Å; F287-E406 HydrophobicContact CE2-CB 3.65Å; F287-E406 HydrophobicContact CE2-CG 3.4Å; F287-E406 HydrophobicContact CG-CB 4.4Å; F287-E406 HydrophobicContact CZ-CB 3.82Å; F287-E406 HydrophobicContact CZ-CG 3.9Å; F287-A409 CarbonylContact C-O 3.55Å; F287-A409 HydrophobicContact CB-CB 3.65Å; F287-A409 VanDerWaalsContact O-O 3.1Å; F287-A410 HydrophobicContact CB-CB 4.2Å; F287-A410 HydrophobicContact CD1-CB 4.14Å; F287-R468 PolarHBondContact O-NH2 3.1Å
288	L	92.6	Very high	82.8	Confident	46 Å²	46	59.6 Å²	59.6	24%	0.241	30%	0.297	C	S	.	.	H	α-helix	trans	-65.2	-27	172.5	-74.6	171.9	0	0	0	112.2	V284 Q285 I290 A409 R468 V471	V284-L288 HydrophobicContact CB-CD1 4.29Å; V284-L288 HydrophobicContact CG2-CD1 4.26Å; V284-L288 WeakPolarHBondContact O-CB 3.38Å; V284-L288 VanDerWaalsContact O-CG 3.24Å; V284-L288 WeakPolarHBondContact O-CG 2.98Å; V284-L288 PolarHBondContact O-N 2.84Å; Q285-L288 PolarHBondContact O-N 3.14Å; L288-I290 PolarHBondContact O-N 2.93Å; L288-A409 HydrophobicContact CG-CB 4.37Å; L288-R468 HydrophobicContact CD2-CB 3.9Å; L288-R468 HydrophobicContact CD2-CG 4.03Å; L288-R468 VanDerWaalsContact O-CZ 3.32Å; L288-R468 PolarHBondContact O-NH1 3.06Å; L288-R468 PolarHBondContact O-NH2 3.36Å; L288-V471 HydrophobicContact CD1-CG2 4.39Å; L288-V471 HydrophobicContact CD2-CG2 4.27Å
289	D	89.6	Confident	81.5	Confident	108 Å²	108	65 Å²	65	58%	0.578	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-14.6	175.7	-64.2	-18.5	0	0	0	113	Q285 F287 P291	Q285-D289 PolarHBondContact NE2-OD1 2.87Å; Q285-D289 PolarHBondContact O-N 3.23Å; F287-D289 PolarHBondContact O-N 2.94Å; D289-P291 WeakPolarHBondContact O-CD 3.5Å
290	I	87.7	Confident	80.8	Confident	13 Å²	13	63.2 Å²	63.2	7%	0.067	33%	0.329	C	S	.	.	S	Bend	trans	-66.7	124.3	172.5	-59.4	172.8	0	0	0	108.5	F287 L288 L292 K382 A410 R468	F287-I290 HydrophobicContact CD1-CD1 4.11Å; F287-I290 VanDerWaalsContact O-CB 3.32Å; F287-I290 WeakPolarHBondContact O-CB 3.29Å; F287-I290 WeakPolarHBondContact O-CG1 3.34Å; F287-I290 PolarHBondContact O-N 2.83Å; L288-I290 PolarHBondContact O-N 2.93Å; I290-L292 PolarHBondContact O-N 3.11Å; I290-K382 HydrophobicContact CD1-CB 4.21Å; I290-K382 HydrophobicContact CD1-CG 4.15Å; I290-A410 HydrophobicContact CD1-CB 3.84Å; I290-R468 PolarHBondContact O-NH1 3.17Å; I290-R468 PolarHBondContact O-NH2 3.37Å
291	P	85.4	Confident	80.5	Confident	76 Å²	76	64.5 Å²	64.5	49%	0.494	33%	0.334	S	S	.	.			trans	-64.7	133.6	-179.9	-21	32.3	0	0	0	111.8	D289 H293	D289-P291 WeakPolarHBondContact O-CD 3.5Å; P291-H293 VanDerWaalsContact C-N 3.28Å; P291-H293 PolarHBondContact O-N 3.2Å
292	L	82.6	Confident	80.5	Confident	42 Å²	42	65.6 Å²	65.6	22%	0.22	34%	0.34	C	S	.	.			trans	-74	86.5	165.7	-78.2	175.2	0	0	0	108.5	I290 E294 L461 R464 K465	I290-L292 PolarHBondContact O-N 3.11Å; L292-E294 PolarHBondContact O-N 3.29Å; L292-L461 HydrophobicContact CB-CD1 4.46Å; L292-L461 HydrophobicContact CD1-CD1 4.42Å; L292-R464 HydrophobicContact CD2-CB 4.18Å; L292-K465 HydrophobicContact CD1-CG 3.99Å
293	H	69.7	Low	80.7	Confident	76 Å²	76	65.6 Å²	65.6	35%	0.352	34%	0.34	S	S	.	.			trans	-65.2	127.5	174.9	-63.7	-67.2	0	0	0	110.6	P291 R464	P291-H293 VanDerWaalsContact C-N 3.28Å; P291-H293 PolarHBondContact O-N 3.2Å; H293-R464 PolarHBondContact O-NH1 3.25Å
294	E	59.4	Low	81.3	Confident	162 Å²	162	63.9 Å²	63.9	76%	0.757	33%	0.331	S	S	*	.	S	Bend	trans	-72.8	-31.9	173.6	-67	-174.9	165.3	0	0	111.6	L292 L461	L292-E294 PolarHBondContact O-N 3.29Å; E294-L461 HydrophobicContact CG-CD2 4.26Å
295	K	58	Low	81.6	Confident	185 Å²	185	63.7 Å²	63.7	80%	0.804	33%	0.33	S	S	*	.	S	Bend	trans	-116.3	125.4	172.8	-110.3	179.1	177.5	176.6	0	109.5
296	K	62	Low	81.8	Confident	71 Å²	71	60.2 Å²	60.2	31%	0.309	32%	0.316	S	S	.	.			trans	-64.4	145	172.3	-69	-168	172.4	-155.1	0	110.8	T298 G300 E387 T389	K296-T298 VanDerWaalsContact CB-O 3.32Å; K296-T298 WeakPolarHBondContact CB-O 3.44Å; K296-T298 PolarHBondContact O-N 2.8Å; K296-G300 WeakPolarHBondContact CD-O 3.42Å; K296-G300 PolarHBondContact NZ-O 3.41Å; K296-E387 PolarHBondContact NZ-O 2.98Å; K296-T389 PolarHBondContact NZ-OG1 2.94Å
297	M	60.9	Low	81.9	Confident	155 Å²	155	59.4 Å²	59.4	76%	0.764	32%	0.315	S	S	*	.	S	Bend	trans	-67	-31.6	171.8	-70	-178.3	62.4	0	0	111.2
298	T	63.5	Low	81.9	Confident	77 Å²	77	62.2 Å²	62.2	47%	0.472	33%	0.328	S	S	.	.	S	Bend	trans	-111.9	131.6	180	55.3	0	0	0	0	112	K296 G300 E387	K296-T298 VanDerWaalsContact CB-O 3.32Å; K296-T298 WeakPolarHBondContact CB-O 3.44Å; K296-T298 PolarHBondContact O-N 2.8Å; T298-G300 PolarHBondContact O-N 2.8Å; T298-E387 PolarHBondContact OG1-OE2 3.43Å
299	P	71.5	Confident	82	Confident	114 Å²	114	60 Å²	60	74%	0.74	32%	0.317	S	S	*	.	S	Bend	trans	-62.4	123.6	167.9	-16.9	29.3	0	0	0	109	S336	P299-S336 PolarHBondContact O-OG 2.8Å; P299-S336 VanDerWaalsContact O-OG 3.05Å
300	G	84.1	Confident	82	Confident	13 Å²	13	57.8 Å²	57.8	13%	0.134	30%	0.3	C	S	.	.	S	Bend	trans	140.9	173.1	-177.2	0	0	0	0	0	115.7	K296 T298 S336	K296-G300 WeakPolarHBondContact CD-O 3.42Å; K296-G300 PolarHBondContact NZ-O 3.41Å; T298-G300 PolarHBondContact O-N 2.8Å; G300-S336 CarbonylContact C-O 3.55Å; G300-S336 WeakPolarHBondContact CA-O 3.46Å
301	H	90.1	Very high	82.2	Confident	30 Å²	30	60.2 Å²	60.2	14%	0.139	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	125.2	171.9	-70.2	-68.6	0	0	0	110	S336 L337 K338 T389 L453 R460	H301-S336 PolarHBondContact N-O 3.41Å; H301-L337 HydrophobicContact CB-CD1 3.61Å; H301-L337 WeakPolarHBondContact O-CA 3.33Å; H301-K338 PolarHBondContact O-N 3.48Å; H301-T389 PolarHBondContact ND1-OG1 2.94Å; H301-T389 VanDerWaalsContact ND1-OG1 3.08Å; H301-L453 HydrophobicContact CB-CD2 3.67Å; H301-L453 VanDerWaalsContact CG-CD2 3.41Å; H301-R460 PolarHBondContact CE1-NH1 2.79Å; H301-R460 VanDerWaalsContact CE1-NH1 3.3Å
302	L	94.2	Very high	82.4	Confident	23 Å²	23	59.3 Å²	59.3	12%	0.12	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	129	172.8	172.9	64.4	0	0	0	108.8	V304 K338 V340 Y384 E387 A388 T389 I390	L302-V304 HydrophobicContact CD1-CG1 4.27Å; L302-V304 HydrophobicContact CD2-CG1 3.91Å; L302-V304 HydrophobicContact CG-CG1 3.86Å; L302-K338 HydrophobicContact CD1-CB 4.31Å; L302-V340 HydrophobicContact CD1-CB 4.11Å; L302-V340 HydrophobicContact CD1-CG2 3.32Å; L302-Y384 HydrophobicContact CD2-CD1 4.05Å; L302-Y384 WeakPolarHBondContact CD2-O 3.26Å; L302-E387 HydrophobicContact CD2-CB 4.07Å; L302-A388 HydrophobicContact CD2-CB 4.3Å; L302-A388 HydrophobicContact CG-CB 4.39Å; L302-T389 PolarHBondContact N-OG1 2.95Å; L302-T389 PolarHBondContact O-N 3.3Å; L302-T389 PolarHBondContact O-OG1 3.12Å; L302-I390 PolarHBondContact O-N 3.39Å
303	L	97.4	Very high	83	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	131.9	167.4	-81.7	55.9	0	0	0	107.3	F322 L337 K338 L339 V340 I390 L392 I449	L303-F322 HydrophobicContact CD2-CD2 3.85Å; L303-F322 HydrophobicContact CD2-CE2 4.06Å; L303-L337 HydrophobicContact CD1-CD1 3.62Å; L303-K338 PolarHBondContact N-O 2.88Å; L303-L339 HydrophobicContact CB-CD1 3.93Å; L303-L339 CarbonylContact O-C 3.5Å; L303-L339 WeakPolarHBondContact O-CA 3.4Å; L303-V340 PolarHBondContact O-N 3.49Å; L303-I390 WeakPolarHBondContact CA-O 3.36Å; L303-I390 HydrophobicContact CD1-CB 4.36Å; L303-I390 HydrophobicContact CD1-CD1 4.16Å; L303-I390 HydrophobicContact CG-CB 4.07Å; L303-I390 HydrophobicContact CG-CD1 4.38Å; L303-I390 HydrophobicContact CG-CG2 4.5Å; L303-L392 HydrophobicContact CB-CD1 4.46Å; L303-L392 HydrophobicContact CD2-CD1 4.22Å; L303-I449 HydrophobicContact CD2-CD1 4Å; L303-I449 HydrophobicContact CD2-CG1 4.37Å; L303-I449 HydrophobicContact CD2-CG2 3.93Å
304	V	97.9	Very high	84.2	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	145.8	178.1	-65.5	0	0	0	0	110.4	L302 V340 I342 L385 A388 I390 G391 L392 T412	L302-V304 HydrophobicContact CD1-CG1 4.27Å; L302-V304 HydrophobicContact CD2-CG1 3.91Å; L302-V304 HydrophobicContact CG-CG1 3.86Å; V304-V340 CarbonylContact C-O 3.52Å; V304-V340 WeakPolarHBondContact CA-O 3.44Å; V304-V340 HydrophobicContact CG1-CB 4.48Å; V304-I342 HydrophobicContact CG1-CD1 4.48Å; V304-L385 HydrophobicContact CG2-CD2 3.99Å; V304-A388 HydrophobicContact CB-CB 4.21Å; V304-A388 HydrophobicContact CG1-CB 3.65Å; V304-A388 HydrophobicContact CG2-CB 3.51Å; V304-I390 PolarHBondContact N-O 2.78Å; V304-G391 CarbonylContact O-C 3.57Å; V304-G391 WeakPolarHBondContact O-CA 3.1Å; V304-L392 PolarHBondContact O-N 3.49Å; V304-T412 HydrophobicContact CG2-CG2 4.46Å
305	S	97.7	Very high	86	Confident	4 Å²	4	51.2 Å²	51.2	3%	0.028	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	127.7	169.2	-178.6	0	0	0	0	107.8	Q318 V340 L341 I342	S305-Q318 PolarHBondContact OG-NE2 3.39Å; S305-Q318 PolarHBondContact OG-OE1 3.14Å; S305-V340 PolarHBondContact N-O 2.62Å; S305-L341 VanDerWaalsContact CB-CD2 3.48Å; S305-I342 WeakPolarHBondContact O-CA 3.4Å; S305-I342 PolarHBondContact O-N 3.03Å
306	V	94.8	Very high	87.9	Confident	33 Å²	33	44.7 Å²	44.7	20%	0.2	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	112.5	-176.7	-174.3	0	0	0	0	108.9	I342 L381 L385	V306-I342 WeakPolarHBondContact CA-O 3.47Å; V306-L381 HydrophobicContact CG1-CD1 4.05Å; V306-L381 HydrophobicContact CG2-CD1 3.87Å; V306-L385 HydrophobicContact CG2-CD2 4.05Å
307	G	90.3	Very high	89.7	Confident	18 Å²	18	42 Å²	42	19%	0.186	23%	0.234	C	C	.	.	S	Bend	trans	173.2	155	178.5	0	0	0	0	0	113.2	I342 G343	G307-I342 PolarHBondContact N-O 3.39Å; G307-G343 WeakPolarHBondContact O-CA 3.42Å
308	Q	90.9	Very high	91.5	Very high	61 Å²	61	34.9 Å²	34.9	29%	0.285	20%	0.199	S	C	.	.			trans	-59.2	145.2	174.6	-65.2	178.4	0.8	0	0	111.4	R310 K313 H315 R346	Q308-R310 VanDerWaalsContact C-N 3.3Å; Q308-R310 HydrophobicContact CB-CG 3.75Å; Q308-R310 PolarHBondContact O-N 2.67Å; Q308-K313 WeakPolarHBondContact O-CG 3.15Å; Q308-H315 PolarHBondContact O-CE1 3.31Å; Q308-H315 VanDerWaalsContact O-CE1 3.3Å; Q308-R346 VanDerWaalsContact OE1-CZ 3.29Å
309	F	93.6	Very high	93.1	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.176	C	C	.	.	S	Bend	trans	-74.6	79.1	179.6	-69.3	-75.6	0	0	0	112.2	L341 G343 G344 R353 V354 L357 F372 I374	F309-L341 HydrophobicContact CE1-CB 4.19Å; F309-L341 HydrophobicContact CZ-CB 4.35Å; F309-G343 WeakPolarHBondContact CE2-O 3.45Å; F309-G344 PolarHBondContact N-O 3.27Å; F309-G344 VanDerWaalsContact N-O 3.15Å; F309-R353 WeakPolarHBondContact O-CD 3.26Å; F309-R353 PolarHBondContact O-NH1 2.62Å; F309-V354 HydrophobicContact CB-CG2 3.94Å; F309-V354 HydrophobicContact CD1-CG2 3.73Å; F309-V354 HydrophobicContact CD2-CG2 3.49Å; F309-V354 VanDerWaalsContact CD2-CG2 3.49Å; F309-V354 HydrophobicContact CE1-CG2 4.05Å; F309-V354 HydrophobicContact CE2-CG2 3.82Å; F309-V354 HydrophobicContact CG-CG2 3.43Å; F309-V354 VanDerWaalsContact CG-CG2 3.43Å; F309-V354 HydrophobicContact CZ-CG2 4.09Å; F309-L357 HydrophobicContact CD1-CD1 3.85Å; F309-L357 HydrophobicContact CE1-CD1 4.17Å; F309-F372 HydrophobicContact CE1-CD1 4.21Å; F309-F372 HydrophobicContact CZ-CD1 4.32Å; F309-I374 HydrophobicContact CE2-CG1 4.24Å
310	R	91.3	Very high	94.4	Very high	60 Å²	60	30.5 Å²	30.5	23%	0.226	16%	0.159	C	C	.	.			trans	-120.5	155.7	-175.1	-54.4	-67.3	-70.5	177.8	-4.9	112.8	Q308 E312 K313 R346 D350	Q308-R310 VanDerWaalsContact C-N 3.3Å; Q308-R310 HydrophobicContact CB-CG 3.75Å; Q308-R310 PolarHBondContact O-N 2.67Å; R310-E312 VanDerWaalsContact C-N 3.32Å; R310-E312 HydrophobicContact CB-CG 4.27Å; R310-E312 WeakPolarHBondContact CB-OE1 3.23Å; R310-E312 WeakPolarHBondContact CB-OE2 3.48Å; R310-E312 IonicContact NE-OE1 2.57Å; R310-E312 PolarHBondContact O-N 2.81Å; R310-K313 HydrophobicContact CB-CG 4.2Å; R310-K313 PolarHBondContact O-N 3.11Å; R310-R346 VanDerWaalsContact NE-NH2 3.17Å; R310-R346 VanDerWaalsContact NH1-NH2 3.18Å; R310-D350 WeakPolarHBondContact CD-OD1 3.11Å; R310-D350 IonicContact CZ-OD1 2.62Å; R310-D350 IonicContact NH1-OD1 2.98Å; R310-D350 PolarHBondContact NH1-OD1 3.36Å; R310-D350 IonicContact NH1-OD2 2.67Å
311	P	90.7	Very high	95.1	Very high	65 Å²	65	30 Å²	30	42%	0.422	15%	0.153	S	C	.	.	G	3₁₀ helix	trans	-55.8	-45.7	177.4	-24.3	33.9	0	0	0	113	K313 N314 R353	P311-K313 PolarHBondContact O-N 3.04Å; P311-N314 PolarHBondContact O-N 3.4Å; P311-R353 VanDerWaalsContact CD-CZ 3.41Å
312	E	90.8	Very high	95.4	Very high	56 Å²	56	28.5 Å²	28.5	26%	0.262	15%	0.146	S	C	.	.	G	3₁₀ helix	trans	-63.1	-24.6	-176.5	63.2	-84.4	-168.5	0	0	113.3	R310 N314 M395	R310-E312 VanDerWaalsContact C-N 3.32Å; R310-E312 HydrophobicContact CB-CG 4.27Å; R310-E312 WeakPolarHBondContact CB-OE1 3.23Å; R310-E312 WeakPolarHBondContact CB-OE2 3.48Å; R310-E312 IonicContact NE-OE1 2.57Å; R310-E312 PolarHBondContact O-N 2.81Å; E312-N314 VanDerWaalsContact C-N 3.26Å; E312-N314 PolarHBondContact O-N 3.12Å; E312-M395 HydrophobicContact CB-CE 4.11Å; E312-M395 HydrophobicContact CB-SD 4.32Å; E312-M395 HydrophobicContact CG-CE 4.05Å; E312-M395 HydrophobicContact CG-SD 4.02Å; E312-M395 WeakPolarHBondContact O-CA 3.32Å; E312-M395 WeakPolarHBondContact O-CB 3.44Å; E312-M395 VanDerWaalsContact O-CG 3.26Å; E312-M395 WeakPolarHBondContact O-CG 3.39Å
313	K	93.7	Very high	95.5	Very high	43 Å²	43	27.6 Å²	27.6	19%	0.187	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-73.8	-16.4	179.4	-63.5	-58.1	179.7	-172.9	0	113.9	Q308 R310 P311 H315 T394 M395 E398	Q308-K313 WeakPolarHBondContact O-CG 3.15Å; R310-K313 HydrophobicContact CB-CG 4.2Å; R310-K313 PolarHBondContact O-N 3.11Å; P311-K313 PolarHBondContact O-N 3.04Å; K313-H315 VanDerWaalsContact C-N 3.31Å; K313-H315 WeakPolarHBondContact CB-CE1 3.35Å; K313-H315 PolarHBondContact O-N 2.71Å; K313-T394 PolarHBondContact O-OG1 3.17Å; K313-M395 HydrophobicContact CD-CB 4.16Å; K313-M395 HydrophobicContact CD-SD 3.92Å; K313-M395 PolarHBondContact NZ-SD 2.84Å; K313-M395 VanDerWaalsContact NZ-SD 3.43Å; K313-E398 IonicContact NZ-OE1 3.85Å; K313-E398 PolarHBondContact NZ-OE1 2.79Å; K313-E398 IonicContact NZ-OE2 3.49Å; K313-E398 PolarHBondContact NZ-OE2 3.35Å
314	N	95.8	Very high	95.4	Very high	63 Å²	63	31 Å²	31	34%	0.337	16%	0.157	S	C	.	.			trans	52.3	42.3	175.3	-160	9.7	0	0	0	114.6	P311 E312 P316 L317 T394	P311-N314 PolarHBondContact O-N 3.4Å; E312-N314 VanDerWaalsContact C-N 3.26Å; E312-N314 PolarHBondContact O-N 3.12Å; N314-P316 VanDerWaalsContact O-N 3.17Å; N314-L317 VanDerWaalsContact O-CB 3.31Å; N314-L317 WeakPolarHBondContact O-CB 3.38Å; N314-L317 PolarHBondContact O-N 3.13Å; N314-T394 PolarHBondContact O-OG1 3.34Å; N314-T394 VanDerWaalsContact O-OG1 3.14Å
315	H	97.8	Very high	95.2	Very high	4 Å²	4	31 Å²	31	2%	0.019	16%	0.157	C	C	.	.	H	α-helix	trans	-49.9	-33	171.8	-58.8	93.9	0	0	0	114.8	Q308 K313 L317 Q318 I319 L357	Q308-H315 PolarHBondContact O-CE1 3.31Å; Q308-H315 VanDerWaalsContact O-CE1 3.3Å; K313-H315 VanDerWaalsContact C-N 3.31Å; K313-H315 WeakPolarHBondContact CB-CE1 3.35Å; K313-H315 PolarHBondContact O-N 2.71Å; H315-L317 PolarHBondContact O-N 3.29Å; H315-Q318 WeakPolarHBondContact O-CB 3.34Å; H315-Q318 PolarHBondContact O-N 3Å; H315-Q318 VanDerWaalsContact O-N 3.09Å; H315-I319 PolarHBondContact O-N 3.31Å; H315-L357 HydrophobicContact CB-CD1 3.67Å; H315-L357 HydrophobicContact CB-CD2 3.76Å; H315-L357 HydrophobicContact CB-CG 4.39Å
316	P	98.1	Very high	94.9	Very high	49 Å²	49	32.5 Å²	32.5	32%	0.318	16%	0.164	S	C	.	.	H	α-helix	trans	-55.9	-36.7	174	-27.8	37.2	0	0	0	113.8	N314 Q318 I319 R320 L357 L360	N314-P316 VanDerWaalsContact O-N 3.17Å; P316-Q318 VanDerWaalsContact C-N 3.31Å; P316-Q318 PolarHBondContact O-N 2.98Å; P316-I319 PolarHBondContact O-N 2.94Å; P316-R320 WeakPolarHBondContact O-CB 3.32Å; P316-R320 WeakPolarHBondContact O-CG 3.42Å; P316-R320 PolarHBondContact O-N 3.3Å; P316-L357 HydrophobicContact CG-CD2 3.75Å; P316-L360 HydrophobicContact CB-CD2 3.85Å
317	L	98.2	Very high	94.6	Very high	15 Å²	15	36.6 Å²	36.6	8%	0.079	19%	0.185	C	C	.	.	H	α-helix	trans	-59.9	-42.1	176.2	177.6	56.6	0	0	0	111.3	N314 H315 R320 A321 T394 E442 Y445	N314-L317 VanDerWaalsContact O-CB 3.31Å; N314-L317 WeakPolarHBondContact O-CB 3.38Å; N314-L317 PolarHBondContact O-N 3.13Å; H315-L317 PolarHBondContact O-N 3.29Å; L317-R320 PolarHBondContact O-N 3Å; L317-A321 VanDerWaalsContact O-CB 3.25Å; L317-A321 WeakPolarHBondContact O-CB 3.49Å; L317-A321 PolarHBondContact O-N 3.13Å; L317-T394 HydrophobicContact CB-CG2 4.18Å; L317-T394 HydrophobicContact CD2-CG2 3.84Å; L317-T394 HydrophobicContact CG-CG2 3.92Å; L317-E442 HydrophobicContact CD1-CB 4.09Å; L317-E442 HydrophobicContact CD1-CG 3.32Å; L317-Y445 HydrophobicContact CD2-CD2 4.24Å; L317-Y445 HydrophobicContact CD2-CE2 3.9Å; L317-Y445 HydrophobicContact CG-CD2 4.4Å; L317-Y445 HydrophobicContact CG-CE2 4.47Å
318	Q	98.3	Very high	94.1	Very high	4 Å²	4	41.2 Å²	41.2	2%	0.019	20%	0.2	C	C	.	.	H	α-helix	trans	-63.1	-46.8	179.1	-56.8	176.9	11.4	0	0	111.4	S305 H315 P316 F322 L392 T394	S305-Q318 PolarHBondContact OG-NE2 3.39Å; S305-Q318 PolarHBondContact OG-OE1 3.14Å; H315-Q318 WeakPolarHBondContact O-CB 3.34Å; H315-Q318 PolarHBondContact O-N 3Å; H315-Q318 VanDerWaalsContact O-N 3.09Å; P316-Q318 VanDerWaalsContact C-N 3.31Å; P316-Q318 PolarHBondContact O-N 2.98Å; Q318-F322 VanDerWaalsContact O-CB 3.23Å; Q318-F322 WeakPolarHBondContact O-CB 3.4Å; Q318-F322 PolarHBondContact O-N 2.98Å; Q318-L392 HydrophobicContact CB-CD1 4.3Å; Q318-T394 HydrophobicContact CB-CG2 4.5Å; Q318-T394 HydrophobicContact CG-CG2 3.3Å; Q318-T394 WeakPolarHBondContact CG-OG1 3.47Å; Q318-T394 PolarHBondContact NE2-OG1 3.5Å
319	I	98.6	Very high	92.9	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-65.1	-44.1	-179.7	-61.8	175.2	0	0	0	110.5	H315 P316 F322 A323 L339 L341 L357 L360 L364 I366 F372	H315-I319 PolarHBondContact O-N 3.31Å; P316-I319 PolarHBondContact O-N 2.94Å; I319-F322 PolarHBondContact O-N 3.07Å; I319-A323 PolarHBondContact O-N 3.09Å; I319-L339 HydrophobicContact CG1-CD2 4.38Å; I319-L341 HydrophobicContact CD1-CD1 3.83Å; I319-L341 HydrophobicContact CG1-CD1 3.94Å; I319-L357 HydrophobicContact CD1-CB 3.89Å; I319-L357 HydrophobicContact CD1-CD2 3.8Å; I319-L357 HydrophobicContact CD1-CG 4.4Å; I319-L360 HydrophobicContact CB-CD2 4.21Å; I319-L360 HydrophobicContact CD1-CD2 4.32Å; I319-L360 HydrophobicContact CG2-CD2 4.24Å; I319-L360 HydrophobicContact CG2-CG 4.14Å; I319-L364 HydrophobicContact CG2-CD1 3.91Å; I319-I366 HydrophobicContact CG2-CD1 3.81Å; I319-F372 HydrophobicContact CD1-CZ 4.2Å
320	R	98.6	Very high	90.9	Very high	100 Å²	100	49.8 Å²	49.8	38%	0.377	24%	0.241	S	C	.	.	H	α-helix	trans	-66.5	-43.8	179	-70.8	178.7	-173.1	-82.6	-2.6	112.7	P316 L317 F322 A323 K324 L364 E442	P316-R320 WeakPolarHBondContact O-CB 3.32Å; P316-R320 WeakPolarHBondContact O-CG 3.42Å; P316-R320 PolarHBondContact O-N 3.3Å; L317-R320 PolarHBondContact O-N 3Å; R320-F322 VanDerWaalsContact C-N 3.3Å; R320-F322 PolarHBondContact O-N 3.3Å; R320-A323 PolarHBondContact O-N 3.25Å; R320-K324 PolarHBondContact O-N 2.98Å; R320-L364 HydrophobicContact CG-CD1 4.09Å; R320-E442 HydrophobicContact CB-CG 4.03Å; R320-E442 WeakPolarHBondContact CD-OE1 3.45Å
321	A	98	Very high	88.8	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.008	27%	0.271	C	S	.	.	H	α-helix	trans	-62	-40.1	174.7	0	0	0	0	0	111.5	L317 K324 L325 E442 Y445 A446	L317-A321 VanDerWaalsContact O-CB 3.25Å; L317-A321 WeakPolarHBondContact O-CB 3.49Å; L317-A321 PolarHBondContact O-N 3.13Å; A321-K324 PolarHBondContact O-N 2.74Å; A321-L325 PolarHBondContact O-N 3Å; A321-E442 WeakPolarHBondContact CB-O 3.26Å; A321-Y445 HydrophobicContact CB-CG 4.48Å; A321-A446 WeakPolarHBondContact O-CB 3.47Å
322	F	97.4	Very high	86.6	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-65.2	-42.5	175.6	-173	-115.8	0	0	0	112.5	L303 Q318 I319 R320 K324 L325 L326 L337 L339 I366 V370	L303-F322 HydrophobicContact CD2-CD2 3.85Å; L303-F322 HydrophobicContact CD2-CE2 4.06Å; Q318-F322 VanDerWaalsContact O-CB 3.23Å; Q318-F322 WeakPolarHBondContact O-CB 3.4Å; Q318-F322 PolarHBondContact O-N 2.98Å; I319-F322 PolarHBondContact O-N 3.07Å; R320-F322 VanDerWaalsContact C-N 3.3Å; R320-F322 PolarHBondContact O-N 3.3Å; F322-K324 PolarHBondContact O-N 3.29Å; F322-L325 HydrophobicContact CD2-CD2 4.28Å; F322-L325 WeakPolarHBondContact O-CB 3.47Å; F322-L325 PolarHBondContact O-N 3.07Å; F322-L326 HydrophobicContact CD1-CD1 4.05Å; F322-L326 HydrophobicContact CE1-CD1 3.68Å; F322-L326 HydrophobicContact CE1-CG 4.38Å; F322-L326 HydrophobicContact CZ-CD1 4.06Å; F322-L326 HydrophobicContact CZ-CD2 4.41Å; F322-L326 HydrophobicContact CZ-CG 4.36Å; F322-L326 WeakPolarHBondContact O-CG 3.49Å; F322-L326 PolarHBondContact O-N 2.89Å; F322-L337 HydrophobicContact CE2-CD1 4.35Å; F322-L337 HydrophobicContact CE2-CD2 3.76Å; F322-L337 HydrophobicContact CE2-CG 3.71Å; F322-L337 HydrophobicContact CZ-CD2 4.31Å; F322-L337 HydrophobicContact CZ-CG 4.03Å; F322-L339 HydrophobicContact CB-CD2 3.94Å; F322-L339 HydrophobicContact CD1-CB 3.76Å; F322-L339 HydrophobicContact CD1-CD2 4.04Å; F322-L339 HydrophobicContact CD2-CB 4.2Å; F322-L339 HydrophobicContact CE1-CB 3.71Å; F322-L339 HydrophobicContact CE2-CB 4.17Å; F322-L339 HydrophobicContact CG-CB 4.01Å; F322-L339 HydrophobicContact CG-CD2 4.01Å; F322-L339 HydrophobicContact CZ-CB 3.94Å; F322-I366 HydrophobicContact CD1-CD1 3.95Å; F322-V370 HydrophobicContact CD1-CG2 4.1Å; F322-V370 HydrophobicContact CE1-CG2 4.21Å
323	A	96.4	Very high	84.5	Confident	4 Å²	4	62.1 Å²	62.1	3%	0.033	32%	0.319	C	S	.	.	H	α-helix	trans	-60.7	-44.4	173.8	0	0	0	0	0	112.1	I319 R320 L325 L326 N327 L364 I366	I319-A323 PolarHBondContact O-N 3.09Å; R320-A323 PolarHBondContact O-N 3.25Å; A323-L325 VanDerWaalsContact C-N 3.34Å; A323-L325 PolarHBondContact O-N 2.71Å; A323-L326 PolarHBondContact O-N 3.49Å; A323-N327 PolarHBondContact O-N 2.97Å; A323-N327 PolarHBondContact O-ND2 3.49Å; A323-L364 HydrophobicContact CB-CB 4.17Å; A323-L364 HydrophobicContact CB-CD1 4.02Å; A323-L364 HydrophobicContact CB-CD2 4.5Å; A323-L364 HydrophobicContact CB-CG 4.47Å; A323-I366 HydrophobicContact CB-CD1 3.76Å; A323-I366 HydrophobicContact CB-CG1 4.39Å; A323-I366 HydrophobicContact CB-CG2 4.16Å
324	K	95.3	Very high	82.7	Confident	70 Å²	70	63.7 Å²	63.7	30%	0.304	34%	0.335	S	S	.	.	H	α-helix	trans	-58.2	-44.3	174.8	-84.8	169.6	164.6	-81.1	0	112.3	R320 A321 F322 N327 K328 E442 E443 A446	R320-K324 PolarHBondContact O-N 2.98Å; A321-K324 PolarHBondContact O-N 2.74Å; F322-K324 PolarHBondContact O-N 3.29Å; K324-N327 PolarHBondContact O-N 3.12Å; K324-K328 PolarHBondContact O-N 3.21Å; K324-E442 HydrophobicContact CD-CB 3.91Å; K324-E442 WeakPolarHBondContact CE-OE2 3.16Å; K324-E443 IonicContact NZ-OE2 2.65Å; K324-E443 PolarHBondContact NZ-OE2 2.93Å; K324-A446 HydrophobicContact CB-CB 4Å
325	L	93.9	Very high	81.2	Confident	2 Å²	2	63.6 Å²	63.6	1%	0.01	34%	0.338	C	S	.	.	H	α-helix	trans	-59.3	-46	175.9	170.9	70.5	0	0	0	111.9	A321 F322 A323 N327 K328 K329 L337 A446 I449 A450 L453	A321-L325 PolarHBondContact O-N 3Å; F322-L325 HydrophobicContact CD2-CD2 4.28Å; F322-L325 WeakPolarHBondContact O-CB 3.47Å; F322-L325 PolarHBondContact O-N 3.07Å; A323-L325 VanDerWaalsContact C-N 3.34Å; A323-L325 PolarHBondContact O-N 2.71Å; L325-N327 VanDerWaalsContact C-N 3.32Å; L325-N327 PolarHBondContact O-N 3.43Å; L325-K328 PolarHBondContact O-N 3.11Å; L325-K329 HydrophobicContact CD1-CD 4.36Å; L325-K329 PolarHBondContact O-N 3.26Å; L325-L337 HydrophobicContact CD2-CD2 3.81Å; L325-L337 HydrophobicContact CG-CD2 4.48Å; L325-A446 HydrophobicContact CB-CB 4.34Å; L325-I449 HydrophobicContact CD1-CG2 4.47Å; L325-I449 HydrophobicContact CD2-CB 4.06Å; L325-I449 HydrophobicContact CD2-CG2 3.31Å; L325-I449 HydrophobicContact CG-CG2 4.49Å; L325-A450 HydrophobicContact CD1-CB 3.73Å; L325-L453 HydrophobicContact CD2-CD1 4.36Å
326	L	91.6	Very high	80.6	Confident	34 Å²	34	67.1 Å²	67.1	18%	0.178	36%	0.363	C	S	.	.	H	α-helix	trans	-62.4	-39.8	178.3	-70.3	175.3	0	0	0	111.5	F322 A323 K329 L337 I366 Y369	F322-L326 HydrophobicContact CD1-CD1 4.05Å; F322-L326 HydrophobicContact CE1-CD1 3.68Å; F322-L326 HydrophobicContact CE1-CG 4.38Å; F322-L326 HydrophobicContact CZ-CD1 4.06Å; F322-L326 HydrophobicContact CZ-CD2 4.41Å; F322-L326 HydrophobicContact CZ-CG 4.36Å; F322-L326 WeakPolarHBondContact O-CG 3.49Å; F322-L326 PolarHBondContact O-N 2.89Å; A323-L326 PolarHBondContact O-N 3.49Å; L326-K329 CarbonylContact O-C 3.51Å; L326-K329 PolarHBondContact O-N 2.89Å; L326-K329 VanDerWaalsContact O-O 3.09Å; L326-L337 HydrophobicContact CD2-CD2 4Å; L326-I366 HydrophobicContact CD1-CB 4.11Å; L326-I366 HydrophobicContact CD1-CG2 3.66Å; L326-Y369 HydrophobicContact CD1-CD2 3.96Å; L326-Y369 HydrophobicContact CD1-CG 4.07Å
327	N	87.1	Confident	80.2	Confident	119 Å²	119	65.6 Å²	65.6	64%	0.636	35%	0.352	S	S	*	.	H	α-helix	trans	-67	-35.8	177.4	-69.9	-18.3	0	0	0	113.2	A323 K324 L325	A323-N327 PolarHBondContact O-N 2.97Å; A323-N327 PolarHBondContact O-ND2 3.49Å; K324-N327 PolarHBondContact O-N 3.12Å; L325-N327 VanDerWaalsContact C-N 3.32Å; L325-N327 PolarHBondContact O-N 3.43Å
328	K	80.6	Confident	80	Confident	115 Å²	115	69.8 Å²	69.8	50%	0.5	37%	0.37	S	S	.	.	H	α-helix	trans	-70.3	-32.7	174.9	-74.5	-172	177.8	-173.7	0	112.3	K324 L325 M330 E443 E447	K324-K328 PolarHBondContact O-N 3.21Å; L325-K328 PolarHBondContact O-N 3.11Å; K328-M330 PolarHBondContact O-N 3.27Å; K328-E443 WeakPolarHBondContact CE-OE1 3.26Å; K328-E443 IonicContact NZ-OE1 2.72Å; K328-E443 PolarHBondContact NZ-OE1 3.49Å; K328-E447 IonicContact NZ-OE1 3.63Å; K328-E447 PolarHBondContact NZ-OE1 3.1Å; K328-E447 VanDerWaalsContact NZ-OE1 3.1Å
329	K	65.9	Low	80	Confident	68 Å²	68	69.6 Å²	69.6	30%	0.296	37%	0.369	S	S	.	.	S	Bend	trans	-88.9	73.4	174.7	-72.9	-170.4	171.4	-168.3	0	110	L325 L326 V331	L325-K329 HydrophobicContact CD1-CD 4.36Å; L325-K329 PolarHBondContact O-N 3.26Å; L326-K329 CarbonylContact O-C 3.51Å; L326-K329 PolarHBondContact O-N 2.89Å; L326-K329 VanDerWaalsContact O-O 3.09Å; K329-V331 VanDerWaalsContact C-N 3.34Å; K329-V331 PolarHBondContact O-N 3.19Å
330	M	51.6	Low	80	Confident	173 Å²	173	69.7 Å²	69.7	85%	0.852	37%	0.37	S	S	*	.			trans	-63.1	100.8	165.4	-88.3	-150.6	141.2	0	0	109.8	K328 E332	K328-M330 PolarHBondContact O-N 3.27Å; M330-E332 PolarHBondContact O-N 3.43Å
331	V	47	Very low	80	Confident	141 Å²	141	65 Å²	65	86%	0.855	35%	0.352	S	S	*	.	S	Bend	trans	14.9	65.6	151	-163.6	0	0	0	0	116.1	K329	K329-V331 VanDerWaalsContact C-N 3.34Å; K329-V331 PolarHBondContact O-N 3.19Å
332	E	44.6	Very low	79.9	Confident	173 Å²	173	65.3 Å²	65.3	81%	0.808	35%	0.353	S	S	*	.	S	Bend	trans	-135	103.4	156.6	-70.1	-171.7	172.8	0	0	108	M330 S334	M330-E332 PolarHBondContact O-N 3.43Å; E332-S334 PolarHBondContact O-N 3.45Å
333	S	47.1	Very low	79.7	Confident	126 Å²	126	65.7 Å²	65.7	88%	0.881	36%	0.358	S	S	*	.	S	Bend	trans	73.5	15.3	163.5	-29.1	0	0	0	0	118.9
334	S	55.8	Low	79.3	Confident	76 Å²	76	66.5 Å²	66.5	53%	0.531	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-79.2	137.3	175.8	-107.4	0	0	0	0	112.3	E332	E332-S334 PolarHBondContact O-N 3.45Å
335	P	63.1	Low	79	Confident	61 Å²	61	63.8 Å²	63.8	40%	0.396	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-64.6	154.7	172	32	-36.9	0	0	0	110	L337	P335-L337 PolarHBondContact O-N 3.22Å
336	S	84.6	Confident	78.4	Confident	78 Å²	78	69.9 Å²	69.9	55%	0.545	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-51.6	125.2	-173.1	59.8	0	0	0	0	112.1	P299 G300 H301	P299-S336 PolarHBondContact O-OG 2.8Å; P299-S336 VanDerWaalsContact O-OG 3.05Å; G300-S336 CarbonylContact C-O 3.55Å; G300-S336 WeakPolarHBondContact CA-O 3.46Å; H301-S336 PolarHBondContact N-O 3.41Å
337	L	90.8	Very high	78	Confident	17 Å²	17	71.3 Å²	71.3	9%	0.089	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	125.6	-178.2	-179.2	67.9	0	0	0	109.7	H301 L303 F322 L325 L326 P335 Y369 L453	H301-L337 HydrophobicContact CB-CD1 3.61Å; H301-L337 WeakPolarHBondContact O-CA 3.33Å; L303-L337 HydrophobicContact CD1-CD1 3.62Å; F322-L337 HydrophobicContact CE2-CD1 4.35Å; F322-L337 HydrophobicContact CE2-CD2 3.76Å; F322-L337 HydrophobicContact CE2-CG 3.71Å; F322-L337 HydrophobicContact CZ-CD2 4.31Å; F322-L337 HydrophobicContact CZ-CG 4.03Å; L325-L337 HydrophobicContact CD2-CD2 3.81Å; L325-L337 HydrophobicContact CG-CD2 4.48Å; L326-L337 HydrophobicContact CD2-CD2 4Å; P335-L337 PolarHBondContact O-N 3.22Å; L337-Y369 WeakPolarHBondContact O-CD1 3.39Å; L337-L453 HydrophobicContact CD1-CD1 3.91Å; L337-L453 HydrophobicContact CD2-CD1 4.25Å
338	K	94.8	Very high	78.2	Confident	104 Å²	104	73.5 Å²	73.5	45%	0.452	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	148.7	178.5	-70.3	-171.7	174.2	-172.9	0	112.1	H301 L302 L303 Y369	H301-K338 PolarHBondContact O-N 3.48Å; L302-K338 HydrophobicContact CD1-CB 4.31Å; L303-K338 PolarHBondContact N-O 2.88Å; K338-Y369 WeakPolarHBondContact CA-O 3.05Å
339	L	97.7	Very high	78.6	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	122	168.4	173.1	61.6	0	0	0	109.3	L303 I319 F322 L341 Y369 V370 E371 L392	L303-L339 HydrophobicContact CB-CD1 3.93Å; L303-L339 CarbonylContact O-C 3.5Å; L303-L339 WeakPolarHBondContact O-CA 3.4Å; I319-L339 HydrophobicContact CG1-CD2 4.38Å; F322-L339 HydrophobicContact CB-CD2 3.94Å; F322-L339 HydrophobicContact CD1-CB 3.76Å; F322-L339 HydrophobicContact CD1-CD2 4.04Å; F322-L339 HydrophobicContact CD2-CB 4.2Å; F322-L339 HydrophobicContact CE1-CB 3.71Å; F322-L339 HydrophobicContact CE2-CB 4.17Å; F322-L339 HydrophobicContact CG-CB 4.01Å; F322-L339 HydrophobicContact CG-CD2 4.01Å; F322-L339 HydrophobicContact CZ-CB 3.94Å; L339-L341 HydrophobicContact CD1-CD2 4.18Å; L339-L341 HydrophobicContact CD2-CD2 4.34Å; L339-L341 HydrophobicContact CG-CD2 4.26Å; L339-L341 HydrophobicContact CG-CG 4.37Å; L339-Y369 PolarHBondContact N-O 3.43Å; L339-V370 HydrophobicContact CB-CG2 4.42Å; L339-V370 HydrophobicContact CD2-CG2 4.41Å; L339-V370 CarbonylContact O-C 3.55Å; L339-V370 VanDerWaalsContact O-CA 3.31Å; L339-V370 WeakPolarHBondContact O-CA 3.46Å; L339-E371 PolarHBondContact O-N 3.35Å; L339-L392 HydrophobicContact CD1-CD1 3.81Å
340	V	98.1	Very high	79.8	Confident	1 Å²	1	69.5 Å²	69.5	1%	0.006	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	118.2	175	-176.1	0	0	0	0	109.3	L302 L303 V304 S305 I342 E371 K373 Y384	L302-V340 HydrophobicContact CD1-CB 4.11Å; L302-V340 HydrophobicContact CD1-CG2 3.32Å; L303-V340 PolarHBondContact O-N 3.49Å; V304-V340 CarbonylContact C-O 3.52Å; V304-V340 WeakPolarHBondContact CA-O 3.44Å; V304-V340 HydrophobicContact CG1-CB 4.48Å; S305-V340 PolarHBondContact N-O 2.62Å; V340-I342 HydrophobicContact CG1-CD1 4.15Å; V340-I342 HydrophobicContact CG1-CG1 3.66Å; V340-E371 CarbonylContact C-O 3.58Å; V340-E371 WeakPolarHBondContact CA-O 3.31Å; V340-E371 HydrophobicContact CG1-CB 4.38Å; V340-E371 HydrophobicContact CG1-CG 4.5Å; V340-E371 HydrophobicContact CG2-CB 4.05Å; V340-K373 HydrophobicContact CG1-CB 4.44Å; V340-K373 HydrophobicContact CG1-CG 3.77Å; V340-Y384 HydrophobicContact CB-CD1 4.28Å; V340-Y384 HydrophobicContact CB-CE1 4.35Å; V340-Y384 HydrophobicContact CG1-CD1 3.94Å; V340-Y384 HydrophobicContact CG1-CE1 3.86Å; V340-Y384 HydrophobicContact CG2-CD1 4.07Å; V340-Y384 HydrophobicContact CG2-CE1 3.83Å
341	L	98.4	Very high	81.8	Confident	1 Å²	1	66.6 Å²	66.6	1%	0.005	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	108.8	175.5	-61.3	175.7	0	0	0	108.9	S305 F309 I319 L339 V370 E371 F372 K373	S305-L341 VanDerWaalsContact CB-CD2 3.48Å; F309-L341 HydrophobicContact CE1-CB 4.19Å; F309-L341 HydrophobicContact CZ-CB 4.35Å; I319-L341 HydrophobicContact CD1-CD1 3.83Å; I319-L341 HydrophobicContact CG1-CD1 3.94Å; L339-L341 HydrophobicContact CD1-CD2 4.18Å; L339-L341 HydrophobicContact CD2-CD2 4.34Å; L339-L341 HydrophobicContact CG-CD2 4.26Å; L339-L341 HydrophobicContact CG-CG 4.37Å; L341-V370 HydrophobicContact CD1-CG1 4.23Å; L341-E371 PolarHBondContact N-O 3Å; L341-F372 HydrophobicContact CB-CD1 4.14Å; L341-F372 HydrophobicContact CB-CE1 4.37Å; L341-F372 HydrophobicContact CD1-CD1 4.05Å; L341-F372 HydrophobicContact CD1-CE1 3.43Å; L341-F372 VanDerWaalsContact CD1-CE1 3.43Å; L341-F372 HydrophobicContact CD1-CZ 3.82Å; L341-F372 HydrophobicContact CG-CE1 4.47Å; L341-K373 PolarHBondContact O-N 2.86Å
342	I	97.1	Very high	84.1	Confident	8 Å²	8	64.6 Å²	64.6	4%	0.041	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	121.1	-175.8	-48.6	176.8	0	0	0	109.3	V304 S305 V306 G307 V340 K373 I376 L381 Y384	V304-I342 HydrophobicContact CG1-CD1 4.48Å; S305-I342 WeakPolarHBondContact O-CA 3.4Å; S305-I342 PolarHBondContact O-N 3.03Å; V306-I342 WeakPolarHBondContact CA-O 3.47Å; G307-I342 PolarHBondContact N-O 3.39Å; V340-I342 HydrophobicContact CG1-CD1 4.15Å; V340-I342 HydrophobicContact CG1-CG1 3.66Å; I342-K373 WeakPolarHBondContact CA-O 3.27Å; I342-K373 HydrophobicContact CB-CB 4.35Å; I342-K373 HydrophobicContact CG1-CB 4.06Å; I342-K373 HydrophobicContact CG1-CG 4.5Å; I342-K373 HydrophobicContact CG2-CB 4.18Å; I342-I376 HydrophobicContact CD1-CD1 4.44Å; I342-I376 HydrophobicContact CG2-CD1 3.52Å; I342-I376 HydrophobicContact CG2-CG1 3.75Å; I342-L381 HydrophobicContact CD1-CD1 3.96Å; I342-L381 HydrophobicContact CG2-CD1 4.01Å; I342-Y384 HydrophobicContact CD1-CD1 4.4Å; I342-Y384 HydrophobicContact CD1-CD2 4.14Å; I342-Y384 HydrophobicContact CD1-CG 3.76Å
343	G	91.6	Very high	86.6	Confident	9 Å²	9	58.7 Å²	58.7	9%	0.093	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.8	157.9	-173	0	0	0	0	0	115.9	G307 F309 K373 I374 N375	G307-G343 WeakPolarHBondContact O-CA 3.42Å; F309-G343 WeakPolarHBondContact CE2-O 3.45Å; G343-K373 PolarHBondContact N-O 3.43Å; G343-I374 WeakPolarHBondContact O-CA 3.21Å; G343-N375 PolarHBondContact O-N 3.4Å
344	G	88	Confident	89	Confident	20 Å²	20	52.7 Å²	52.7	21%	0.206	28%	0.275	C	S	.	.			trans	-84.7	142.3	172.8	0	0	0	0	0	112.7	F309 N375	F309-G344 PolarHBondContact N-O 3.27Å; F309-G344 VanDerWaalsContact N-O 3.15Å; G344-N375 WeakPolarHBondContact CA-OD1 3.46Å
345	C	90.3	Very high	90.9	Very high	14 Å²	14	52.5 Å²	52.5	10%	0.095	27%	0.268	C	S	.	.			trans	-114.6	122.8	164.7	-73.9	0	0	0	0	109	D350 E351 I374 N375	C345-D350 HydrophobicContact CB-CB 3.96Å; C345-E351 HydrophobicContact CB-CG 4.18Å; C345-I374 HydrophobicContact CB-CG2 3.92Å; C345-N375 PolarHBondContact N-OD1 2.81Å; C345-N375 PolarHBondContact O-ND2 3.38Å
346	R	80.4	Confident	92.6	Very high	129 Å²	129	55.4 Å²	55.4	49%	0.487	28%	0.276	S	S	.	.			trans	-101.6	-23.1	-176.4	-61	178.5	-64.1	175.6	-1	113.2	Q308 R310 D350	Q308-R346 VanDerWaalsContact OE1-CZ 3.29Å; R310-R346 VanDerWaalsContact NE-NH2 3.17Å; R310-R346 VanDerWaalsContact NH1-NH2 3.18Å; R346-D350 PolarHBondContact N-OD2 2.92Å; R346-D350 IonicContact NE-OD2 3.1Å
347	N	84.3	Confident	93.2	Very high	64 Å²	64	51.9 Å²	51.9	34%	0.342	25%	0.251	S	S	.	.	S	Bend	trans	-152.6	176.4	-174.3	64.4	22.7	0	0	0	110.9	D349 D350 E351	N347-D349 PolarHBondContact O-N 3.02Å; N347-D349 WeakPolarHBondContact OD1-CB 3.38Å; N347-D349 PolarHBondContact OD1-N 2.68Å; N347-D349 VanDerWaalsContact OD1-N 3.12Å; N347-D350 PolarHBondContact O-N 3.01Å; N347-D350 PolarHBondContact OD1-N 2.64Å; N347-E351 PolarHBondContact O-N 2.98Å
348	K	89.5	Confident	93.6	Very high	166 Å²	166	55.4 Å²	55.4	72%	0.722	26%	0.263	S	S	*	.	H	α-helix	trans	-59.1	-31.3	179.2	-67.2	-176.2	177.2	-178.6	0	113.3	E351 L352	K348-E351 PolarHBondContact O-N 2.78Å; K348-L352 WeakPolarHBondContact O-CB 3.46Å; K348-L352 VanDerWaalsContact O-CG 3.26Å; K348-L352 WeakPolarHBondContact O-CG 3.4Å; K348-L352 PolarHBondContact O-N 3.18Å
349	D	89.4	Confident	93.7	Very high	99 Å²	99	58.1 Å²	58.1	53%	0.529	27%	0.271	S	S	.	.	H	α-helix	trans	-70.1	-37.7	179.3	-62.5	-30.6	0	0	0	112.2	N347 R353	N347-D349 PolarHBondContact O-N 3.02Å; N347-D349 WeakPolarHBondContact OD1-CB 3.38Å; N347-D349 PolarHBondContact OD1-N 2.68Å; N347-D349 VanDerWaalsContact OD1-N 3.12Å; D349-R353 WeakPolarHBondContact O-CB 3.2Å; D349-R353 PolarHBondContact O-N 2.91Å; D349-R353 VanDerWaalsContact O-N 3.1Å; D349-R353 PolarHBondContact O-NH1 3.3Å
350	D	92.1	Very high	93.8	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-66.1	-41.5	173.7	-63.9	-13.4	0	0	0	110.1	R310 C345 R346 N347 R353 V354	R310-D350 WeakPolarHBondContact CD-OD1 3.11Å; R310-D350 IonicContact CZ-OD1 2.62Å; R310-D350 IonicContact NH1-OD1 2.98Å; R310-D350 PolarHBondContact NH1-OD1 3.36Å; R310-D350 IonicContact NH1-OD2 2.67Å; C345-D350 HydrophobicContact CB-CB 3.96Å; R346-D350 PolarHBondContact N-OD2 2.92Å; R346-D350 IonicContact NE-OD2 3.1Å; N347-D350 PolarHBondContact O-N 3.01Å; N347-D350 PolarHBondContact OD1-N 2.64Å; D350-R353 WeakPolarHBondContact O-CB 3.18Å; D350-R353 PolarHBondContact O-N 3.31Å; D350-R353 IonicContact OD1-NH1 3.13Å; D350-R353 PolarHBondContact OD1-NH1 3.33Å; D350-V354 PolarHBondContact O-N 3.29Å; D350-V354 VanDerWaalsContact O-N 3.11Å
351	E	93.5	Very high	93.8	Very high	111 Å²	111	59.2 Å²	59.2	52%	0.519	28%	0.276	S	S	.	.	H	α-helix	trans	-62.5	-45.6	174.9	-68.8	174.5	-170.9	0	0	112.9	C345 N347 K348 R353 V354 N355	C345-E351 HydrophobicContact CB-CG 4.18Å; N347-E351 PolarHBondContact O-N 2.98Å; K348-E351 PolarHBondContact O-N 2.78Å; E351-R353 PolarHBondContact O-N 3.46Å; E351-V354 PolarHBondContact O-N 3.09Å; E351-N355 PolarHBondContact O-N 2.95Å; E351-N355 VanDerWaalsContact O-N 3.13Å; E351-N355 PolarHBondContact O-ND2 3.14Å
352	L	95.5	Very high	93.8	Very high	100 Å²	100	64.6 Å²	64.6	52%	0.524	30%	0.301	S	S	.	.	H	α-helix	trans	-58.5	-38.9	175.4	-76.1	171.3	0	0	0	111.3	K348 N355 Q356	K348-L352 WeakPolarHBondContact O-CB 3.46Å; K348-L352 VanDerWaalsContact O-CG 3.26Å; K348-L352 WeakPolarHBondContact O-CG 3.4Å; K348-L352 PolarHBondContact O-N 3.18Å; L352-N355 PolarHBondContact O-N 3.46Å; L352-Q356 WeakPolarHBondContact O-CG 3.25Å; L352-Q356 PolarHBondContact O-N 3.44Å
353	R	95.8	Very high	93.8	Very high	48 Å²	48	70.6 Å²	70.6	18%	0.181	33%	0.333	C	S	.	.	H	α-helix	trans	-64.6	-41.5	176.7	-172.3	170.9	-62.6	93.6	16.2	112.2	F309 P311 D349 D350 E351 N355 Q356 L357	F309-R353 WeakPolarHBondContact O-CD 3.26Å; F309-R353 PolarHBondContact O-NH1 2.62Å; P311-R353 VanDerWaalsContact CD-CZ 3.41Å; D349-R353 WeakPolarHBondContact O-CB 3.2Å; D349-R353 PolarHBondContact O-N 2.91Å; D349-R353 VanDerWaalsContact O-N 3.1Å; D349-R353 PolarHBondContact O-NH1 3.3Å; D350-R353 WeakPolarHBondContact O-CB 3.18Å; D350-R353 PolarHBondContact O-N 3.31Å; D350-R353 IonicContact OD1-NH1 3.13Å; D350-R353 PolarHBondContact OD1-NH1 3.33Å; E351-R353 PolarHBondContact O-N 3.46Å; R353-N355 VanDerWaalsContact C-N 3.28Å; R353-N355 PolarHBondContact O-N 3.22Å; R353-Q356 WeakPolarHBondContact O-CB 3.32Å; R353-Q356 PolarHBondContact O-N 3.34Å; R353-L357 HydrophobicContact CG-CD1 4.39Å; R353-L357 VanDerWaalsContact O-CG 3.3Å; R353-L357 WeakPolarHBondContact O-CG 3.24Å; R353-L357 PolarHBondContact O-N 3.36Å
354	V	97.1	Very high	94.1	Very high	1 Å²	1	72.9 Å²	72.9	1%	0.006	34%	0.343	C	S	.	.	H	α-helix	trans	-58.9	-43.1	174.1	177.5	0	0	0	0	110.9	F309 D350 E351 Q356 L357 R358 F372 I374	F309-V354 HydrophobicContact CB-CG2 3.94Å; F309-V354 HydrophobicContact CD1-CG2 3.73Å; F309-V354 HydrophobicContact CD2-CG2 3.49Å; F309-V354 VanDerWaalsContact CD2-CG2 3.49Å; F309-V354 HydrophobicContact CE1-CG2 4.05Å; F309-V354 HydrophobicContact CE2-CG2 3.82Å; F309-V354 HydrophobicContact CG-CG2 3.43Å; F309-V354 VanDerWaalsContact CG-CG2 3.43Å; F309-V354 HydrophobicContact CZ-CG2 4.09Å; D350-V354 PolarHBondContact O-N 3.29Å; D350-V354 VanDerWaalsContact O-N 3.11Å; E351-V354 PolarHBondContact O-N 3.09Å; V354-Q356 VanDerWaalsContact C-N 3.32Å; V354-Q356 PolarHBondContact O-N 2.96Å; V354-L357 PolarHBondContact O-N 3.08Å; V354-L357 VanDerWaalsContact O-N 3.14Å; V354-R358 PolarHBondContact O-N 3.32Å; V354-F372 HydrophobicContact CG1-CB 4.46Å; V354-F372 HydrophobicContact CG1-CD1 3.88Å; V354-F372 HydrophobicContact CG1-CE1 4.46Å; V354-F372 HydrophobicContact CG1-CG 4.32Å; V354-I374 HydrophobicContact CB-CD1 4.46Å; V354-I374 HydrophobicContact CG1-CD1 3.84Å; V354-I374 HydrophobicContact CG1-CG1 4.46Å; V354-I374 HydrophobicContact CG2-CD1 4.33Å
355	N	97	Very high	94.5	Very high	71 Å²	71	74.4 Å²	74.4	38%	0.38	36%	0.359	S	S	.	.	H	α-helix	trans	-64.1	-36.6	177.4	-67.2	-28.5	0	0	0	112.6	E351 L352 R353 L357 R358 R359	E351-N355 PolarHBondContact O-N 2.95Å; E351-N355 VanDerWaalsContact O-N 3.13Å; E351-N355 PolarHBondContact O-ND2 3.14Å; L352-N355 PolarHBondContact O-N 3.46Å; R353-N355 VanDerWaalsContact C-N 3.28Å; R353-N355 PolarHBondContact O-N 3.22Å; N355-L357 VanDerWaalsContact C-N 3.34Å; N355-R358 PolarHBondContact O-N 3.18Å; N355-R358 PolarHBondContact OD1-NH1 2.85Å; N355-R359 WeakPolarHBondContact O-CG 3.3Å; N355-R359 PolarHBondContact O-N 3.16Å; N355-R359 VanDerWaalsContact O-N 3.1Å
356	Q	97.8	Very high	94.7	Very high	122 Å²	122	74 Å²	74	57%	0.57	36%	0.356	S	S	*	.	H	α-helix	trans	-64.2	-38.4	172.5	-70.1	169.6	-11.3	0	0	112.2	L352 R353 V354 R359 L360	L352-Q356 WeakPolarHBondContact O-CG 3.25Å; L352-Q356 PolarHBondContact O-N 3.44Å; R353-Q356 WeakPolarHBondContact O-CB 3.32Å; R353-Q356 PolarHBondContact O-N 3.34Å; V354-Q356 VanDerWaalsContact C-N 3.32Å; V354-Q356 PolarHBondContact O-N 2.96Å; Q356-R359 PolarHBondContact O-N 3.3Å; Q356-L360 WeakPolarHBondContact O-CB 3.15Å; Q356-L360 PolarHBondContact O-N 3.29Å
357	L	98.3	Very high	95.5	Very high	4 Å²	4	71.8 Å²	71.8	2%	0.021	35%	0.351	C	S	.	.	H	α-helix	trans	-69.7	-35.6	177.3	-66.2	169.5	0	0	0	112.5	F309 H315 P316 I319 R353 V354 N355 L360 S361 F372	F309-L357 HydrophobicContact CD1-CD1 3.85Å; F309-L357 HydrophobicContact CE1-CD1 4.17Å; H315-L357 HydrophobicContact CB-CD1 3.67Å; H315-L357 HydrophobicContact CB-CD2 3.76Å; H315-L357 HydrophobicContact CB-CG 4.39Å; P316-L357 HydrophobicContact CG-CD2 3.75Å; I319-L357 HydrophobicContact CD1-CB 3.89Å; I319-L357 HydrophobicContact CD1-CD2 3.8Å; I319-L357 HydrophobicContact CD1-CG 4.4Å; R353-L357 HydrophobicContact CG-CD1 4.39Å; R353-L357 VanDerWaalsContact O-CG 3.3Å; R353-L357 WeakPolarHBondContact O-CG 3.24Å; R353-L357 PolarHBondContact O-N 3.36Å; V354-L357 PolarHBondContact O-N 3.08Å; V354-L357 VanDerWaalsContact O-N 3.14Å; N355-L357 VanDerWaalsContact C-N 3.34Å; L357-L360 PolarHBondContact O-N 3.02Å; L357-S361 PolarHBondContact O-N 2.93Å; L357-S361 PolarHBondContact O-OG 3.39Å; L357-F372 HydrophobicContact CB-CE1 3.51Å; L357-F372 HydrophobicContact CB-CZ 3.72Å; L357-F372 HydrophobicContact CD1-CE1 4.24Å
358	R	98.3	Very high	96	Very high	91 Å²	91	75.9 Å²	75.9	34%	0.343	37%	0.368	S	S	.	.	H	α-helix	trans	-61.3	-50.7	171.8	-73.7	178.2	179.3	135.6	-3.7	111.2	V354 N355 L360 S361 E362 F372	V354-R358 PolarHBondContact O-N 3.32Å; N355-R358 PolarHBondContact O-N 3.18Å; N355-R358 PolarHBondContact OD1-NH1 2.85Å; R358-L360 VanDerWaalsContact C-N 3.3Å; R358-L360 PolarHBondContact O-N 3.34Å; R358-S361 WeakPolarHBondContact O-CA 3.46Å; R358-S361 VanDerWaalsContact O-CB 3.31Å; R358-S361 WeakPolarHBondContact O-CB 3.44Å; R358-S361 PolarHBondContact O-N 3.41Å; R358-E362 PolarHBondContact O-N 3Å; R358-F372 HydrophobicContact CB-CE2 4.39Å; R358-F372 HydrophobicContact CG-CD2 3.72Å; R358-F372 HydrophobicContact CG-CE2 3.58Å; R358-F372 HydrophobicContact CG-CG 4.25Å; R358-F372 HydrophobicContact CG-CZ 4.01Å
359	R	98.4	Very high	96.2	Very high	162 Å²	162	73.4 Å²	73.4	61%	0.611	36%	0.355	S	S	*	.	H	α-helix	trans	-57.3	-42.5	174.5	-70.8	178.7	-173.5	175.5	1.1	112.3	N355 Q356 S361 E362 D363	N355-R359 WeakPolarHBondContact O-CG 3.3Å; N355-R359 PolarHBondContact O-N 3.16Å; N355-R359 VanDerWaalsContact O-N 3.1Å; Q356-R359 PolarHBondContact O-N 3.3Å; R359-S361 PolarHBondContact O-N 3.42Å; R359-E362 WeakPolarHBondContact O-CB 3.35Å; R359-E362 PolarHBondContact O-N 3.48Å; R359-E362 VanDerWaalsContact O-N 3.11Å; R359-D363 WeakPolarHBondContact O-CB 3.29Å; R359-D363 VanDerWaalsContact O-CG 3.22Å; R359-D363 PolarHBondContact O-N 2.83Å
360	L	98.5	Very high	96.6	Very high	21 Å²	21	69.3 Å²	69.3	11%	0.11	33%	0.334	C	S	.	.	H	α-helix	trans	-58.7	-36.8	174.8	177.5	62.5	0	0	0	112.1	P316 I319 Q356 L357 R358 L364	P316-L360 HydrophobicContact CB-CD2 3.85Å; I319-L360 HydrophobicContact CB-CD2 4.21Å; I319-L360 HydrophobicContact CD1-CD2 4.32Å; I319-L360 HydrophobicContact CG2-CD2 4.24Å; I319-L360 HydrophobicContact CG2-CG 4.14Å; Q356-L360 WeakPolarHBondContact O-CB 3.15Å; Q356-L360 PolarHBondContact O-N 3.29Å; L357-L360 PolarHBondContact O-N 3.02Å; R358-L360 VanDerWaalsContact C-N 3.3Å; R358-L360 PolarHBondContact O-N 3.34Å; L360-L364 HydrophobicContact CD1-CD1 3.81Å; L360-L364 HydrophobicContact CD1-CG 4.18Å; L360-L364 HydrophobicContact CG-CD1 3.96Å; L360-L364 WeakPolarHBondContact O-CB 3.31Å; L360-L364 WeakPolarHBondContact O-CD1 3.32Å; L360-L364 WeakPolarHBondContact O-CG 3.31Å; L360-L364 PolarHBondContact O-N 3.13Å; L360-L364 VanDerWaalsContact O-N 3.14Å
361	S	98.1	Very high	96.9	Very high	2 Å²	2	72.2 Å²	72.2	1%	0.014	35%	0.347	C	S	.	.	H	α-helix	trans	-69.7	-37.1	177.1	-51	0	0	0	0	111.6	L357 R358 R359 G365 I366 Q367	L357-S361 PolarHBondContact O-N 2.93Å; L357-S361 PolarHBondContact O-OG 3.39Å; R358-S361 WeakPolarHBondContact O-CA 3.46Å; R358-S361 VanDerWaalsContact O-CB 3.31Å; R358-S361 WeakPolarHBondContact O-CB 3.44Å; R358-S361 PolarHBondContact O-N 3.41Å; R359-S361 PolarHBondContact O-N 3.42Å; S361-G365 PolarHBondContact O-N 3.44Å; S361-I366 PolarHBondContact O-N 3.1Å; S361-Q367 PolarHBondContact O-N 3.11Å
362	E	97.9	Very high	97.1	Very high	114 Å²	114	68.3 Å²	68.3	53%	0.533	33%	0.329	S	S	.	.	H	α-helix	trans	-66.6	-47.6	173.5	-66	165.2	-174.4	0	0	111.7	R358 R359 L364 G365 Q367	R358-E362 PolarHBondContact O-N 3Å; R359-E362 WeakPolarHBondContact O-CB 3.35Å; R359-E362 PolarHBondContact O-N 3.48Å; R359-E362 VanDerWaalsContact O-N 3.11Å; E362-L364 PolarHBondContact O-N 2.83Å; E362-G365 PolarHBondContact O-N 3.25Å; E362-Q367 HydrophobicContact CG-CB 4.09Å; E362-Q367 HydrophobicContact CG-CG 4.37Å
363	D	98.1	Very high	97.2	Very high	134 Å²	134	65.5 Å²	65.5	72%	0.717	31%	0.312	S	S	*	.	H	α-helix	trans	-59.9	-31.4	178.4	-69.6	-21.7	0	0	0	111.9	R359	R359-D363 WeakPolarHBondContact O-CB 3.29Å; R359-D363 VanDerWaalsContact O-CG 3.22Å; R359-D363 PolarHBondContact O-N 2.83Å
364	L	97.5	Very high	97.1	Very high	58 Å²	58	66 Å²	66	30%	0.304	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-4.7	176.1	-67.6	171.3	0	0	0	113.2	I319 R320 A323 L360 E362 I366	I319-L364 HydrophobicContact CG2-CD1 3.91Å; R320-L364 HydrophobicContact CG-CD1 4.09Å; A323-L364 HydrophobicContact CB-CB 4.17Å; A323-L364 HydrophobicContact CB-CD1 4.02Å; A323-L364 HydrophobicContact CB-CD2 4.5Å; A323-L364 HydrophobicContact CB-CG 4.47Å; L360-L364 HydrophobicContact CD1-CD1 3.81Å; L360-L364 HydrophobicContact CD1-CG 4.18Å; L360-L364 HydrophobicContact CG-CD1 3.96Å; L360-L364 WeakPolarHBondContact O-CB 3.31Å; L360-L364 WeakPolarHBondContact O-CD1 3.32Å; L360-L364 WeakPolarHBondContact O-CG 3.31Å; L360-L364 PolarHBondContact O-N 3.13Å; L360-L364 VanDerWaalsContact O-N 3.14Å; E362-L364 PolarHBondContact O-N 2.83Å; L364-I366 VanDerWaalsContact C-N 3.35Å; L364-I366 HydrophobicContact CB-CG1 4.01Å; L364-I366 PolarHBondContact O-N 2.96Å
365	G	96.4	Very high	96.8	Very high	52 Å²	52	71 Å²	71	54%	0.536	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.7	24.9	179.1	0	0	0	0	0	115	S361 E362 Q367	S361-G365 PolarHBondContact O-N 3.44Å; E362-G365 PolarHBondContact O-N 3.25Å; G365-Q367 VanDerWaalsContact C-OE1 3.24Å
366	I	95.7	Very high	96.6	Very high	6 Å²	6	69.2 Å²	69.2	3%	0.031	33%	0.334	C	S	.	.			trans	-119.5	12.6	-174.6	60.8	158.5	0	0	0	113.8	I319 F322 A323 L326 S361 L364 E368 Y369 V370	I319-I366 HydrophobicContact CG2-CD1 3.81Å; F322-I366 HydrophobicContact CD1-CD1 3.95Å; A323-I366 HydrophobicContact CB-CD1 3.76Å; A323-I366 HydrophobicContact CB-CG1 4.39Å; A323-I366 HydrophobicContact CB-CG2 4.16Å; L326-I366 HydrophobicContact CD1-CB 4.11Å; L326-I366 HydrophobicContact CD1-CG2 3.66Å; S361-I366 PolarHBondContact O-N 3.1Å; L364-I366 VanDerWaalsContact C-N 3.35Å; L364-I366 HydrophobicContact CB-CG1 4.01Å; L364-I366 PolarHBondContact O-N 2.96Å; I366-E368 PolarHBondContact O-N 3.24Å; I366-E368 VanDerWaalsContact O-N 3.16Å; I366-Y369 HydrophobicContact CB-CD2 4.43Å; I366-Y369 PolarHBondContact O-N 3.02Å; I366-V370 HydrophobicContact CD1-CG2 3.78Å; I366-V370 HydrophobicContact CG1-CG2 4.17Å; I366-V370 PolarHBondContact O-N 3.35Å
367	Q	96.3	Very high	96.2	Very high	81 Å²	81	67.4 Å²	67.4	38%	0.379	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-56.2	-32.1	-176.1	70.3	-76.9	6.1	0	0	113.9	S361 E362 G365 Y369 V370	S361-Q367 PolarHBondContact O-N 3.11Å; E362-Q367 HydrophobicContact CG-CB 4.09Å; E362-Q367 HydrophobicContact CG-CG 4.37Å; G365-Q367 VanDerWaalsContact C-OE1 3.24Å; Q367-Y369 PolarHBondContact O-N 3.43Å; Q367-V370 PolarHBondContact O-N 2.59Å
368	E	94.1	Very high	95.6	Very high	150 Å²	150	71.5 Å²	71.5	70%	0.701	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-69.8	-16.6	177.2	-60.7	-57.9	133.5	0	0	113.3	I366	I366-E368 PolarHBondContact O-N 3.24Å; I366-E368 VanDerWaalsContact O-N 3.16Å
369	Y	95.1	Very high	95.1	Very high	114 Å²	114	72 Å²	72	45%	0.447	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-105.4	-5	-179.2	-55	-80.1	0	0	0	113	L326 L337 K338 L339 I366 Q367	L326-Y369 HydrophobicContact CD1-CD2 3.96Å; L326-Y369 HydrophobicContact CD1-CG 4.07Å; L337-Y369 WeakPolarHBondContact O-CD1 3.39Å; K338-Y369 WeakPolarHBondContact CA-O 3.05Å; L339-Y369 PolarHBondContact N-O 3.43Å; I366-Y369 HydrophobicContact CB-CD2 4.43Å; I366-Y369 PolarHBondContact O-N 3.02Å; Q367-Y369 PolarHBondContact O-N 3.43Å
370	V	97.2	Very high	94.7	Very high	14 Å²	14	67.2 Å²	67.2	9%	0.085	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	121.6	-177.9	-175.3	0	0	0	0	110.5	F322 L339 L341 I366 Q367 F372	F322-V370 HydrophobicContact CD1-CG2 4.1Å; F322-V370 HydrophobicContact CE1-CG2 4.21Å; L339-V370 HydrophobicContact CB-CG2 4.42Å; L339-V370 HydrophobicContact CD2-CG2 4.41Å; L339-V370 CarbonylContact O-C 3.55Å; L339-V370 VanDerWaalsContact O-CA 3.31Å; L339-V370 WeakPolarHBondContact O-CA 3.46Å; L341-V370 HydrophobicContact CD1-CG1 4.23Å; I366-V370 HydrophobicContact CD1-CG2 3.78Å; I366-V370 HydrophobicContact CG1-CG2 4.17Å; I366-V370 PolarHBondContact O-N 3.35Å; Q367-V370 PolarHBondContact O-N 2.59Å; V370-F372 HydrophobicContact CG1-CD2 4.3Å; V370-F372 HydrophobicContact CG1-CE2 3.63Å; V370-F372 HydrophobicContact CG1-CZ 3.94Å
371	E	97.4	Very high	94.4	Very high	60 Å²	60	67.2 Å²	67.2	28%	0.28	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	141.3	176.9	-176.5	174.3	-173.1	0	0	111	L339 V340 L341 K373 Y384	L339-E371 PolarHBondContact O-N 3.35Å; V340-E371 CarbonylContact C-O 3.58Å; V340-E371 WeakPolarHBondContact CA-O 3.31Å; V340-E371 HydrophobicContact CG1-CB 4.38Å; V340-E371 HydrophobicContact CG1-CG 4.5Å; V340-E371 HydrophobicContact CG2-CB 4.05Å; L341-E371 PolarHBondContact N-O 3Å; E371-K373 HydrophobicContact CG-CD 4.39Å; E371-K373 HydrophobicContact CG-CG 4.48Å; E371-K373 WeakPolarHBondContact OE1-CE 3.33Å; E371-K373 IonicContact OE1-NZ 2.72Å; E371-K373 PolarHBondContact OE1-NZ 3.31Å; E371-Y384 PolarHBondContact OE1-OH 3.38Å
372	F	98.1	Very high	94	Very high	29 Å²	29	69.7 Å²	69.7	13%	0.127	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	118.2	177.9	-67.4	-95.8	0	0	0	110.1	F309 I319 L341 V354 L357 R358 V370	F309-F372 HydrophobicContact CE1-CD1 4.21Å; F309-F372 HydrophobicContact CZ-CD1 4.32Å; I319-F372 HydrophobicContact CD1-CZ 4.2Å; L341-F372 HydrophobicContact CB-CD1 4.14Å; L341-F372 HydrophobicContact CB-CE1 4.37Å; L341-F372 HydrophobicContact CD1-CD1 4.05Å; L341-F372 HydrophobicContact CD1-CE1 3.43Å; L341-F372 VanDerWaalsContact CD1-CE1 3.43Å; L341-F372 HydrophobicContact CD1-CZ 3.82Å; L341-F372 HydrophobicContact CG-CE1 4.47Å; V354-F372 HydrophobicContact CG1-CB 4.46Å; V354-F372 HydrophobicContact CG1-CD1 3.88Å; V354-F372 HydrophobicContact CG1-CE1 4.46Å; V354-F372 HydrophobicContact CG1-CG 4.32Å; L357-F372 HydrophobicContact CB-CE1 3.51Å; L357-F372 HydrophobicContact CB-CZ 3.72Å; L357-F372 HydrophobicContact CD1-CE1 4.24Å; R358-F372 HydrophobicContact CB-CE2 4.39Å; R358-F372 HydrophobicContact CG-CD2 3.72Å; R358-F372 HydrophobicContact CG-CE2 3.58Å; R358-F372 HydrophobicContact CG-CG 4.25Å; R358-F372 HydrophobicContact CG-CZ 4.01Å; V370-F372 HydrophobicContact CG1-CD2 4.3Å; V370-F372 HydrophobicContact CG1-CE2 3.63Å; V370-F372 HydrophobicContact CG1-CZ 3.94Å
373	K	97.5	Very high	93.6	Very high	42 Å²	42	69.3 Å²	69.3	18%	0.183	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	106.3	176.8	-69.8	-51.9	-153.3	-164.3	0	110.5	V340 L341 I342 G343 E371 I376 E380 Y384	V340-K373 HydrophobicContact CG1-CB 4.44Å; V340-K373 HydrophobicContact CG1-CG 3.77Å; L341-K373 PolarHBondContact O-N 2.86Å; I342-K373 WeakPolarHBondContact CA-O 3.27Å; I342-K373 HydrophobicContact CB-CB 4.35Å; I342-K373 HydrophobicContact CG1-CB 4.06Å; I342-K373 HydrophobicContact CG1-CG 4.5Å; I342-K373 HydrophobicContact CG2-CB 4.18Å; G343-K373 PolarHBondContact N-O 3.43Å; E371-K373 HydrophobicContact CG-CD 4.39Å; E371-K373 HydrophobicContact CG-CG 4.48Å; E371-K373 WeakPolarHBondContact OE1-CE 3.33Å; E371-K373 IonicContact OE1-NZ 2.72Å; E371-K373 PolarHBondContact OE1-NZ 3.31Å; K373-I376 HydrophobicContact CB-CD1 4.14Å; K373-I376 HydrophobicContact CB-CG2 3.73Å; K373-I376 HydrophobicContact CD-CG2 4.16Å; K373-I376 HydrophobicContact CG-CG2 4.33Å; K373-E380 WeakPolarHBondContact CE-OE1 3.23Å; K373-E380 IonicContact NZ-OE1 2.94Å; K373-Y384 HydrophobicContact CD-CE2 4.36Å; K373-Y384 VanDerWaalsContact CE-CE2 3.44Å; K373-Y384 WeakPolarHBondContact CE-OH 3.43Å; K373-Y384 HydrophobicContact CG-CE2 4.06Å; K373-Y384 PolarHBondContact NZ-OH 3.02Å
374	I	95.5	Very high	93.4	Very high	59 Å²	59	65 Å²	65	30%	0.303	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	127	-172.9	-48.6	173.1	0	0	0	109.4	F309 G343 C345 V354 I376	F309-I374 HydrophobicContact CE2-CG1 4.24Å; G343-I374 WeakPolarHBondContact O-CA 3.21Å; C345-I374 HydrophobicContact CB-CG2 3.92Å; V354-I374 HydrophobicContact CB-CD1 4.46Å; V354-I374 HydrophobicContact CG1-CD1 3.84Å; V354-I374 HydrophobicContact CG1-CG1 4.46Å; V354-I374 HydrophobicContact CG2-CD1 4.33Å; I374-I376 PolarHBondContact O-N 3.25Å; I374-I376 VanDerWaalsContact O-N 3.13Å
375	N	90.3	Very high	93.2	Very high	104 Å²	104	62.3 Å²	62.3	56%	0.556	32%	0.317	S	S	*	.	S	Bend	trans	51.8	35.3	174.7	-63.2	-37.5	0	0	0	113.6	G343 G344 C345	G343-N375 PolarHBondContact O-N 3.4Å; G344-N375 WeakPolarHBondContact CA-OD1 3.46Å; C345-N375 PolarHBondContact N-OD1 2.81Å; C345-N375 PolarHBondContact O-ND2 3.38Å
376	I	92.7	Very high	92.9	Very high	34 Å²	34	61 Å²	61	17%	0.174	30%	0.3	C	S	.	.			trans	-68	151.5	-179.3	63.4	170	0	0	0	111.6	I342 K373 I374 E380 L381 Y384	I342-I376 HydrophobicContact CD1-CD1 4.44Å; I342-I376 HydrophobicContact CG2-CD1 3.52Å; I342-I376 HydrophobicContact CG2-CG1 3.75Å; K373-I376 HydrophobicContact CB-CD1 4.14Å; K373-I376 HydrophobicContact CB-CG2 3.73Å; K373-I376 HydrophobicContact CD-CG2 4.16Å; K373-I376 HydrophobicContact CG-CG2 4.33Å; I374-I376 PolarHBondContact O-N 3.25Å; I374-I376 VanDerWaalsContact O-N 3.13Å; I376-E380 HydrophobicContact CB-CB 4.29Å; I376-E380 HydrophobicContact CB-CG 4.43Å; I376-E380 HydrophobicContact CD1-CB 4.11Å; I376-E380 HydrophobicContact CD1-CG 4.03Å; I376-L381 HydrophobicContact CD1-CB 4.16Å; I376-Y384 HydrophobicContact CD1-CD2 4.1Å
377	P	89	Confident	92.6	Very high	84 Å²	84	62.3 Å²	62.3	55%	0.545	31%	0.306	S	S	.	.			trans	-59.2	152.9	173.4	-22.6	34.2	0	0	0	112.4	D379 E380 L381	P377-D379 VanDerWaalsContact C-N 3.28Å; P377-D379 PolarHBondContact O-N 2.91Å; P377-E380 WeakPolarHBondContact CD-OE2 3.48Å; P377-E380 WeakPolarHBondContact O-CB 3.32Å; P377-E380 PolarHBondContact O-N 3.42Å; P377-L381 PolarHBondContact O-N 2.78Å; P377-L381 VanDerWaalsContact O-N 3.08Å
378	F	85.4	Confident	92.4	Very high	91 Å²	91	58.5 Å²	58.5	40%	0.399	29%	0.289	S	S	.	.	H	α-helix	trans	-58.5	-36.9	-179.3	-177.3	-103.9	0	0	0	113.4	T286 F287 E380 L381 K382	T286-F378 HydrophobicContact CG2-CE1 3.4Å; T286-F378 HydrophobicContact CG2-CZ 3.46Å; T286-F378 VanDerWaalsContact CG2-CZ 3.46Å; F287-F378 HydrophobicContact CE1-CE2 4.05Å; F287-F378 HydrophobicContact CE1-CZ 4.12Å; F287-F378 HydrophobicContact CE2-CE2 4.35Å; F287-F378 HydrophobicContact CE2-CZ 4.34Å; F287-F378 AromaticContact CZ-CE2 3.6Å; F287-F378 HydrophobicContact CZ-CE2 3.6Å; F287-F378 AromaticContact CZ-CZ 3.85Å; F287-F378 HydrophobicContact CZ-CZ 3.85Å; F378-E380 VanDerWaalsContact C-N 3.33Å; F378-E380 PolarHBondContact O-N 2.81Å; F378-L381 HydrophobicContact CD2-CD2 4.3Å; F378-L381 WeakPolarHBondContact O-CB 3.3Å; F378-L381 PolarHBondContact O-N 3.41Å; F378-K382 HydrophobicContact CD1-CD 4.24Å; F378-K382 HydrophobicContact CD1-CG 4.48Å; F378-K382 HydrophobicContact CE1-CD 3.68Å; F378-K382 HydrophobicContact CE1-CG 4.05Å; F378-K382 HydrophobicContact CZ-CD 4.24Å; F378-K382 HydrophobicContact CZ-CG 4.26Å; F378-K382 PolarHBondContact O-N 3.48Å
379	D	87.1	Confident	92.4	Very high	101 Å²	101	51.9 Å²	51.9	54%	0.54	26%	0.258	S	S	.	.	H	α-helix	trans	-66	-35.1	176.3	-67.2	-41.9	0	0	0	112.7	P377 K382 N383	P377-D379 VanDerWaalsContact C-N 3.28Å; P377-D379 PolarHBondContact O-N 2.91Å; D379-K382 PolarHBondContact O-N 2.88Å; D379-K382 WeakPolarHBondContact OD1-CE 3.38Å; D379-K382 IonicContact OD1-NZ 3.89Å; D379-K382 PolarHBondContact OD1-NZ 3.31Å; D379-N383 PolarHBondContact O-N 2.97Å; D379-N383 PolarHBondContact O-ND2 3.06Å
380	E	91.1	Very high	92.6	Very high	61 Å²	61	46.4 Å²	46.4	29%	0.285	24%	0.237	S	C	.	.	H	α-helix	trans	-69.1	-39.7	174.6	-167.5	-177.3	160.9	0	0	111	K373 I376 P377 F378 K382 N383 Y384	K373-E380 WeakPolarHBondContact CE-OE1 3.23Å; K373-E380 IonicContact NZ-OE1 2.94Å; I376-E380 HydrophobicContact CB-CB 4.29Å; I376-E380 HydrophobicContact CB-CG 4.43Å; I376-E380 HydrophobicContact CD1-CB 4.11Å; I376-E380 HydrophobicContact CD1-CG 4.03Å; P377-E380 WeakPolarHBondContact CD-OE2 3.48Å; P377-E380 WeakPolarHBondContact O-CB 3.32Å; P377-E380 PolarHBondContact O-N 3.42Å; F378-E380 VanDerWaalsContact C-N 3.33Å; F378-E380 PolarHBondContact O-N 2.81Å; E380-K382 VanDerWaalsContact C-N 3.32Å; E380-K382 PolarHBondContact O-N 3.31Å; E380-N383 WeakPolarHBondContact O-CB 3.43Å; E380-N383 PolarHBondContact O-N 2.66Å; E380-Y384 HydrophobicContact CG-CD2 4.25Å; E380-Y384 HydrophobicContact CG-CE2 4.02Å; E380-Y384 WeakPolarHBondContact O-CD2 3.37Å; E380-Y384 PolarHBondContact O-N 3.01Å; E380-Y384 VanDerWaalsContact O-N 3.16Å
381	L	91.6	Very high	92.6	Very high	22 Å²	22	45.8 Å²	45.8	12%	0.115	23%	0.233	C	C	.	.	H	α-helix	trans	-56.7	-45.4	172.8	170.4	65.2	0	0	0	111.5	V306 I342 I376 P377 F378 N383 Y384 L385	V306-L381 HydrophobicContact CG1-CD1 4.05Å; V306-L381 HydrophobicContact CG2-CD1 3.87Å; I342-L381 HydrophobicContact CD1-CD1 3.96Å; I342-L381 HydrophobicContact CG2-CD1 4.01Å; I376-L381 HydrophobicContact CD1-CB 4.16Å; P377-L381 PolarHBondContact O-N 2.78Å; P377-L381 VanDerWaalsContact O-N 3.08Å; F378-L381 HydrophobicContact CD2-CD2 4.3Å; F378-L381 WeakPolarHBondContact O-CB 3.3Å; F378-L381 PolarHBondContact O-N 3.41Å; L381-N383 VanDerWaalsContact C-N 3.29Å; L381-N383 PolarHBondContact O-N 3.23Å; L381-Y384 PolarHBondContact O-N 2.86Å; L381-L385 HydrophobicContact CD1-CD1 4.04Å; L381-L385 HydrophobicContact CD1-CG 4.07Å; L381-L385 HydrophobicContact CG-CD1 3.99Å; L381-L385 HydrophobicContact CG-CG 4.41Å; L381-L385 WeakPolarHBondContact O-CG 3.23Å; L381-L385 PolarHBondContact O-N 3.01Å
382	K	90.1	Very high	92.7	Very high	54 Å²	54	43.2 Å²	43.2	24%	0.235	22%	0.221	C	C	.	.	H	α-helix	trans	-58.9	-39.9	177.3	-73.3	-174.8	-66.7	-179	0	112.3	I290 F378 D379 E380 Y384 L385 S386	I290-K382 HydrophobicContact CD1-CB 4.21Å; I290-K382 HydrophobicContact CD1-CG 4.15Å; F378-K382 HydrophobicContact CD1-CD 4.24Å; F378-K382 HydrophobicContact CD1-CG 4.48Å; F378-K382 HydrophobicContact CE1-CD 3.68Å; F378-K382 HydrophobicContact CE1-CG 4.05Å; F378-K382 HydrophobicContact CZ-CD 4.24Å; F378-K382 HydrophobicContact CZ-CG 4.26Å; F378-K382 PolarHBondContact O-N 3.48Å; D379-K382 PolarHBondContact O-N 2.88Å; D379-K382 WeakPolarHBondContact OD1-CE 3.38Å; D379-K382 IonicContact OD1-NZ 3.89Å; D379-K382 PolarHBondContact OD1-NZ 3.31Å; E380-K382 VanDerWaalsContact C-N 3.32Å; E380-K382 PolarHBondContact O-N 3.31Å; K382-Y384 PolarHBondContact O-N 3.08Å; K382-L385 PolarHBondContact O-N 2.88Å; K382-S386 WeakPolarHBondContact O-CB 3.45Å; K382-S386 PolarHBondContact O-N 3.45Å; K382-S386 PolarHBondContact O-OG 3.17Å
383	N	90.1	Very high	92.7	Very high	105 Å²	105	42.8 Å²	42.8	56%	0.561	22%	0.22	S	C	*	.	H	α-helix	trans	-64	-39.7	177.5	-64.4	-20.6	0	0	0	112.2	D379 E380 L381 S386 E387	D379-N383 PolarHBondContact O-N 2.97Å; D379-N383 PolarHBondContact O-ND2 3.06Å; E380-N383 WeakPolarHBondContact O-CB 3.43Å; E380-N383 PolarHBondContact O-N 2.66Å; L381-N383 VanDerWaalsContact C-N 3.29Å; L381-N383 PolarHBondContact O-N 3.23Å; N383-S386 PolarHBondContact O-OG 2.66Å; N383-E387 PolarHBondContact O-N 2.71Å
384	Y	93.3	Very high	92.7	Very high	44 Å²	44	40.9 Å²	40.9	17%	0.173	21%	0.211	C	C	.	.	H	α-helix	trans	-65.8	-42.6	174.1	-84.5	-75	0	0	0	111.9	L302 V340 I342 E371 K373 I376 E380 L381 K382 E387 A388	L302-Y384 HydrophobicContact CD2-CD1 4.05Å; L302-Y384 WeakPolarHBondContact CD2-O 3.26Å; V340-Y384 HydrophobicContact CB-CD1 4.28Å; V340-Y384 HydrophobicContact CB-CE1 4.35Å; V340-Y384 HydrophobicContact CG1-CD1 3.94Å; V340-Y384 HydrophobicContact CG1-CE1 3.86Å; V340-Y384 HydrophobicContact CG2-CD1 4.07Å; V340-Y384 HydrophobicContact CG2-CE1 3.83Å; I342-Y384 HydrophobicContact CD1-CD1 4.4Å; I342-Y384 HydrophobicContact CD1-CD2 4.14Å; I342-Y384 HydrophobicContact CD1-CG 3.76Å; E371-Y384 PolarHBondContact OE1-OH 3.38Å; K373-Y384 HydrophobicContact CD-CE2 4.36Å; K373-Y384 VanDerWaalsContact CE-CE2 3.44Å; K373-Y384 WeakPolarHBondContact CE-OH 3.43Å; K373-Y384 HydrophobicContact CG-CE2 4.06Å; K373-Y384 PolarHBondContact NZ-OH 3.02Å; I376-Y384 HydrophobicContact CD1-CD2 4.1Å; E380-Y384 HydrophobicContact CG-CD2 4.25Å; E380-Y384 HydrophobicContact CG-CE2 4.02Å; E380-Y384 WeakPolarHBondContact O-CD2 3.37Å; E380-Y384 PolarHBondContact O-N 3.01Å; E380-Y384 VanDerWaalsContact O-N 3.16Å; L381-Y384 PolarHBondContact O-N 2.86Å; K382-Y384 PolarHBondContact O-N 3.08Å; Y384-E387 PolarHBondContact O-N 2.85Å; Y384-A388 WeakPolarHBondContact O-CB 3.42Å; Y384-A388 PolarHBondContact O-N 3.18Å; Y384-A388 VanDerWaalsContact O-N 3.1Å
385	L	92.9	Very high	92.7	Very high	2 Å²	2	38.7 Å²	38.7	1%	0.01	20%	0.2	C	C	.	.	H	α-helix	trans	-66.1	-36.7	178.8	-69.7	175.1	0	0	0	112.6	F287 V304 V306 L381 K382 E387 A388 A410 T412	F287-L385 HydrophobicContact CD1-CD1 3.79Å; F287-L385 HydrophobicContact CE1-CD1 3.54Å; V304-L385 HydrophobicContact CG2-CD2 3.99Å; V306-L385 HydrophobicContact CG2-CD2 4.05Å; L381-L385 HydrophobicContact CD1-CD1 4.04Å; L381-L385 HydrophobicContact CD1-CG 4.07Å; L381-L385 HydrophobicContact CG-CD1 3.99Å; L381-L385 HydrophobicContact CG-CG 4.41Å; L381-L385 WeakPolarHBondContact O-CG 3.23Å; L381-L385 PolarHBondContact O-N 3.01Å; K382-L385 PolarHBondContact O-N 2.88Å; L385-E387 VanDerWaalsContact C-N 3.32Å; L385-E387 PolarHBondContact O-N 3.13Å; L385-A388 PolarHBondContact O-N 2.99Å; L385-A410 HydrophobicContact CB-CB 3.8Å; L385-A410 HydrophobicContact CD1-CB 3.99Å; L385-A410 HydrophobicContact CG-CB 4.34Å; L385-T412 HydrophobicContact CD2-CG2 4.24Å
386	S	89.9	Confident	92.8	Very high	25 Å²	25	39.3 Å²	39.3	18%	0.175	20%	0.195	C	C	.	.	H	α-helix	trans	-66.1	-33	179.5	65.8	0	0	0	0	113	K382 N383	K382-S386 WeakPolarHBondContact O-CB 3.45Å; K382-S386 PolarHBondContact O-N 3.45Å; K382-S386 PolarHBondContact O-OG 3.17Å; N383-S386 PolarHBondContact O-OG 2.66Å
387	E	89.6	Confident	92.8	Very high	32 Å²	32	38.5 Å²	38.5	15%	0.15	19%	0.191	C	C	.	.	H	α-helix	trans	-88.9	-16.1	178.4	-67.8	-62.9	119.5	0	0	113.3	K296 T298 L302 N383 Y384 L385	K296-E387 PolarHBondContact NZ-O 2.98Å; T298-E387 PolarHBondContact OG1-OE2 3.43Å; L302-E387 HydrophobicContact CD2-CB 4.07Å; N383-E387 PolarHBondContact O-N 2.71Å; Y384-E387 PolarHBondContact O-N 2.85Å; L385-E387 VanDerWaalsContact C-N 3.32Å; L385-E387 PolarHBondContact O-N 3.13Å
388	A	93.5	Very high	93	Very high	2 Å²	2	35.4 Å²	35.4	2%	0.017	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	136.3	-175.8	0	0	0	0	0	112.7	L302 V304 Y384 L385 T412	L302-A388 HydrophobicContact CD2-CB 4.3Å; L302-A388 HydrophobicContact CG-CB 4.39Å; V304-A388 HydrophobicContact CB-CB 4.21Å; V304-A388 HydrophobicContact CG1-CB 3.65Å; V304-A388 HydrophobicContact CG2-CB 3.51Å; Y384-A388 WeakPolarHBondContact O-CB 3.42Å; Y384-A388 PolarHBondContact O-N 3.18Å; Y384-A388 VanDerWaalsContact O-N 3.1Å; L385-A388 PolarHBondContact O-N 2.99Å; A388-T412 HydrophobicContact CB-CG2 3.73Å
389	T	94.1	Very high	93.3	Very high	10 Å²	10	33.3 Å²	33.3	6%	0.061	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	-45.9	170.1	-33.7	0	0	0	0	110.5	K296 H301 L302 I413 L453	K296-T389 PolarHBondContact NZ-OG1 2.94Å; H301-T389 PolarHBondContact ND1-OG1 2.94Å; H301-T389 VanDerWaalsContact ND1-OG1 3.08Å; L302-T389 PolarHBondContact N-OG1 2.95Å; L302-T389 PolarHBondContact O-N 3.3Å; L302-T389 PolarHBondContact O-OG1 3.12Å; T389-I413 PolarHBondContact O-N 3.25Å; T389-L453 HydrophobicContact CG2-CD2 4.46Å
390	I	97.6	Very high	93.7	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	130.6	-170.3	-62.6	168.4	0	0	0	108.5	L302 L303 V304 L392 I413 L415 I449 I452 L453	L302-I390 PolarHBondContact O-N 3.39Å; L303-I390 WeakPolarHBondContact CA-O 3.36Å; L303-I390 HydrophobicContact CD1-CB 4.36Å; L303-I390 HydrophobicContact CD1-CD1 4.16Å; L303-I390 HydrophobicContact CG-CB 4.07Å; L303-I390 HydrophobicContact CG-CD1 4.38Å; L303-I390 HydrophobicContact CG-CG2 4.5Å; V304-I390 PolarHBondContact N-O 2.78Å; I390-L392 HydrophobicContact CG2-CD2 3.78Å; I390-L392 HydrophobicContact CG2-CG 4.32Å; I390-I413 VanDerWaalsContact CA-O 3.23Å; I390-I413 WeakPolarHBondContact CA-O 3.4Å; I390-L415 HydrophobicContact CG2-CB 4.12Å; I390-I449 HydrophobicContact CD1-CB 4.49Å; I390-I449 HydrophobicContact CD1-CG2 3.89Å; I390-I452 HydrophobicContact CD1-CB 3.89Å; I390-I452 HydrophobicContact CD1-CD1 4.14Å; I390-I452 HydrophobicContact CD1-CG2 3.74Å; I390-I452 HydrophobicContact CG1-CB 4.37Å; I390-I452 HydrophobicContact CG1-CD1 4.34Å; I390-I452 HydrophobicContact CG1-CG2 3.72Å; I390-L453 HydrophobicContact CD1-CD2 4.04Å; I390-L453 HydrophobicContact CD1-CG 4.26Å
391	G	98.2	Very high	93.9	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	123.5	165.2	0	0	0	0	0	109.8	V304 I413 I414 L415	V304-G391 CarbonylContact O-C 3.57Å; V304-G391 WeakPolarHBondContact O-CA 3.1Å; G391-I413 PolarHBondContact N-O 3.47Å; G391-I414 WeakPolarHBondContact O-CD1 3.28Å; G391-L415 PolarHBondContact O-N 3.4Å
392	L	98.3	Very high	93.9	Very high	7 Å²	7	26.7 Å²	26.7	4%	0.037	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	137.6	179.7	-65.3	-178.7	0	0	0	111.2	L303 V304 Q318 L339 I390 L415 Y445 I449	L303-L392 HydrophobicContact CB-CD1 4.46Å; L303-L392 HydrophobicContact CD2-CD1 4.22Å; V304-L392 PolarHBondContact O-N 3.49Å; Q318-L392 HydrophobicContact CB-CD1 4.3Å; L339-L392 HydrophobicContact CD1-CD1 3.81Å; I390-L392 HydrophobicContact CG2-CD2 3.78Å; I390-L392 HydrophobicContact CG2-CG 4.32Å; L392-L415 WeakPolarHBondContact CA-O 3.37Å; L392-L415 HydrophobicContact CD2-CB 4.09Å; L392-L415 HydrophobicContact CD2-CD2 3.96Å; L392-L415 HydrophobicContact CD2-CG 4.24Å; L392-Y445 HydrophobicContact CD2-CD1 4.42Å; L392-I449 HydrophobicContact CD2-CD1 4.15Å; L392-I449 HydrophobicContact CD2-CG1 4.3Å
393	H	98.3	Very high	94	Very high	20 Å²	20	25.2 Å²	25.2	9%	0.093	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	120.6	172.5	175.5	-78.7	0	0	0	110.4	E398 V404 L415 A416 H417 Y445	H393-E398 IonicContact CD2-OE2 2.85Å; H393-E398 VanDerWaalsContact CE1-CB 3.42Å; H393-E398 WeakPolarHBondContact CE1-CB 3.31Å; H393-E398 IonicContact CE1-OE2 3.62Å; H393-E398 PolarHBondContact CE1-OE2 3.02Å; H393-E398 IonicContact NE2-OE2 2.6Å; H393-E398 PolarHBondContact NE2-OE2 3.22Å; H393-V404 HydrophobicContact CB-CG2 3.92Å; H393-L415 PolarHBondContact N-O 3.45Å; H393-A416 HydrophobicContact CB-CB 4.13Å; H393-A416 CarbonylContact O-C 3.59Å; H393-A416 VanDerWaalsContact O-C 3.3Å; H393-A416 VanDerWaalsContact O-CA 3.23Å; H393-A416 WeakPolarHBondContact O-CA 3.49Å; H393-H417 PolarHBondContact O-N 3.14Å; H393-Y445 PolarHBondContact O-OH 2.78Å
394	T	97.6	Very high	94.3	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.006	10%	0.101	C	C	.	.			trans	-119.9	8	-169.4	45.3	0	0	0	0	114.5	K313 N314 L317 Q318 W396 Y445	K313-T394 PolarHBondContact O-OG1 3.17Å; N314-T394 PolarHBondContact O-OG1 3.34Å; N314-T394 VanDerWaalsContact O-OG1 3.14Å; L317-T394 HydrophobicContact CB-CG2 4.18Å; L317-T394 HydrophobicContact CD2-CG2 3.84Å; L317-T394 HydrophobicContact CG-CG2 3.92Å; Q318-T394 HydrophobicContact CB-CG2 4.5Å; Q318-T394 HydrophobicContact CG-CG2 3.3Å; Q318-T394 WeakPolarHBondContact CG-OG1 3.47Å; Q318-T394 PolarHBondContact NE2-OG1 3.5Å; T394-W396 PolarHBondContact O-N 2.89Å; T394-W396 VanDerWaalsContact O-N 3.14Å; T394-Y445 HydrophobicContact CG2-CD1 4.46Å; T394-Y445 HydrophobicContact CG2-CE1 3.78Å; T394-Y445 HydrophobicContact CG2-CE2 4.16Å
395	M	95.5	Very high	94.5	Very high	13 Å²	13	18.1 Å²	18.1	6%	0.064	9%	0.093	C	C	.	.			trans	-70	115	179	175.8	167.6	174.1	0	0	109.7	E312 K313 N397 E398	E312-M395 HydrophobicContact CB-CE 4.11Å; E312-M395 HydrophobicContact CB-SD 4.32Å; E312-M395 HydrophobicContact CG-CE 4.05Å; E312-M395 HydrophobicContact CG-SD 4.02Å; E312-M395 WeakPolarHBondContact O-CA 3.32Å; E312-M395 WeakPolarHBondContact O-CB 3.44Å; E312-M395 VanDerWaalsContact O-CG 3.26Å; E312-M395 WeakPolarHBondContact O-CG 3.39Å; K313-M395 HydrophobicContact CD-CB 4.16Å; K313-M395 HydrophobicContact CD-SD 3.92Å; K313-M395 PolarHBondContact NZ-SD 2.84Å; K313-M395 VanDerWaalsContact NZ-SD 3.43Å; M395-N397 PolarHBondContact O-N 2.95Å; M395-E398 HydrophobicContact CB-CB 4.04Å; M395-E398 HydrophobicContact CG-CB 3.88Å; M395-E398 PolarHBondContact O-N 3.33Å; M395-E398 HydrophobicContact SD-CB 4.15Å; M395-E398 HydrophobicContact SD-CG 4.38Å
396	W	93.6	Very high	94.6	Very high	118 Å²	118	20.1 Å²	20.1	45%	0.447	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	129.5	170.2	179	75.5	0	0	0	109.8	D205 V209 T394 E398 H417	D205-W396 HydrophobicContact CB-CH2 4.18Å; V209-W396 HydrophobicContact CG2-CH2 3.94Å; V209-W396 HydrophobicContact CG2-CZ3 4.4Å; T394-W396 PolarHBondContact O-N 2.89Å; T394-W396 VanDerWaalsContact O-N 3.14Å; W396-E398 PolarHBondContact O-N 2.93Å; W396-H417 AromaticContact CD1-CE1 3.42Å; W396-H417 VanDerWaalsContact CD1-CE1 3.42Å; W396-H417 AromaticContact CD1-NE2 3.73Å
397	N	92	Very high	94.8	Very high	17 Å²	17	19.2 Å²	19.2	9%	0.091	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	41.6	-179	-69.8	-6	0	0	0	112.3	D205 W260 M395 H399 S419	D205-N397 VanDerWaalsContact CG-ND2 3.26Å; D205-N397 PolarHBondContact OD2-ND2 2.91Å; W260-N397 HydrophobicContact CZ2-CB 3.88Å; M395-N397 PolarHBondContact O-N 2.95Å; N397-H399 PolarHBondContact O-CD2 3.42Å; N397-H399 PolarHBondContact O-N 3.46Å; N397-S419 PolarHBondContact N-OG 3.29Å; N397-S419 WeakPolarHBondContact OD1-CB 3.48Å; N397-S419 PolarHBondContact OD1-OG 3.07Å
398	E	93.4	Very high	95.2	Very high	19 Å²	19	17.7 Å²	17.7	9%	0.089	9%	0.089	C	C	.	.			trans	-54.5	127.7	167.3	177.6	76.1	-105	0	0	109.7	K313 H393 M395 W396 F400 G420 G421 P422	K313-E398 IonicContact NZ-OE1 3.85Å; K313-E398 PolarHBondContact NZ-OE1 2.79Å; K313-E398 IonicContact NZ-OE2 3.49Å; K313-E398 PolarHBondContact NZ-OE2 3.35Å; H393-E398 IonicContact CD2-OE2 2.85Å; H393-E398 VanDerWaalsContact CE1-CB 3.42Å; H393-E398 WeakPolarHBondContact CE1-CB 3.31Å; H393-E398 IonicContact CE1-OE2 3.62Å; H393-E398 PolarHBondContact CE1-OE2 3.02Å; H393-E398 IonicContact NE2-OE2 2.6Å; H393-E398 PolarHBondContact NE2-OE2 3.22Å; M395-E398 HydrophobicContact CB-CB 4.04Å; M395-E398 HydrophobicContact CG-CB 3.88Å; M395-E398 PolarHBondContact O-N 3.33Å; M395-E398 HydrophobicContact SD-CB 4.15Å; M395-E398 HydrophobicContact SD-CG 4.38Å; W396-E398 PolarHBondContact O-N 2.93Å; E398-F400 PolarHBondContact O-N 3.24Å; E398-G420 CarbonylContact O-C 3.54Å; E398-G420 VanDerWaalsContact O-CA 3.28Å; E398-G420 WeakPolarHBondContact O-CA 3.2Å; E398-G421 PolarHBondContact O-N 2.88Å; E398-P422 HydrophobicContact CB-CG 3.91Å; E398-P422 HydrophobicContact CG-CG 4.09Å; E398-P422 WeakPolarHBondContact O-CD 3.16Å
399	H	92.4	Very high	95.3	Very high	46 Å²	46	17.6 Å²	17.6	21%	0.213	9%	0.088	C	C	.	.	S	Bend	trans	-65.3	-47.3	-168.5	-46.4	139	0	0	0	111.2	H198 Y199 S258 W260 N397	H198-H399 WeakPolarHBondContact O-CB 3.27Å; Y199-H399 WeakPolarHBondContact CB-CE1 3.24Å; Y199-H399 VanDerWaalsContact CB-ND1 3.34Å; Y199-H399 WeakPolarHBondContact CB-ND1 3.35Å; Y199-H399 AromaticContact CD1-CE1 3.75Å; Y199-H399 AromaticContact CD1-ND1 3.79Å; Y199-H399 AromaticContact CG-CE1 3.43Å; Y199-H399 VanDerWaalsContact CG-CE1 3.43Å; Y199-H399 AromaticContact CG-ND1 3.74Å; S258-H399 WeakPolarHBondContact CB-O 3.42Å; S258-H399 PolarHBondContact OG-O 2.85Å; W260-H399 HydrophobicContact CE3-CB 4.38Å; W260-H399 AromaticContact CH2-CD2 3.66Å; W260-H399 HydrophobicContact CZ3-CB 4.27Å; W260-H399 AromaticContact CZ3-CD2 3.38Å; W260-H399 WeakPolarHBondContact CZ3-CD2 3.38Å; N397-H399 PolarHBondContact O-CD2 3.42Å; N397-H399 PolarHBondContact O-N 3.46Å
400	F	95.2	Very high	95.3	Very high	4 Å²	4	17.2 Å²	17.2	2%	0.018	9%	0.086	C	C	.	.	S	Bend	trans	-131.1	-72.6	170.7	177.4	-104.8	0	0	0	110.2	N257 Y279 P280 E398 I402 V405 G421 P422 I426 F474	N257-F400 VanDerWaalsContact O-CD2 3.22Å; N257-F400 WeakPolarHBondContact O-CD2 3.37Å; Y279-F400 HydrophobicContact CD1-CD2 4.02Å; Y279-F400 AromaticContact CD1-CE2 3.52Å; Y279-F400 HydrophobicContact CD1-CE2 3.52Å; Y279-F400 HydrophobicContact CD1-CZ 4.42Å; Y279-F400 HydrophobicContact CE1-CE2 4.17Å; Y279-F400 HydrophobicContact CG-CE2 4.19Å; P280-F400 HydrophobicContact CG-CB 4.24Å; P280-F400 HydrophobicContact CG-CD1 3.11Å; P280-F400 HydrophobicContact CG-CD2 4.28Å; P280-F400 HydrophobicContact CG-CE1 3.36Å; P280-F400 HydrophobicContact CG-CE2 4.47Å; P280-F400 HydrophobicContact CG-CG 3.61Å; P280-F400 HydrophobicContact CG-CZ 4.06Å; E398-F400 PolarHBondContact O-N 3.24Å; F400-I402 HydrophobicContact CD1-CG1 3.98Å; F400-I402 HydrophobicContact CE1-CG1 4.24Å; F400-V405 HydrophobicContact CE1-CG2 3.79Å; F400-V405 HydrophobicContact CZ-CG2 3.83Å; F400-G421 CarbonylContact O-C 3.37Å; F400-P422 VanDerWaalsContact O-CD 3.23Å; F400-P422 WeakPolarHBondContact O-CD 3.44Å; F400-I426 HydrophobicContact CD1-CD1 4.37Å; F400-I426 HydrophobicContact CD2-CD1 4.27Å; F400-I426 HydrophobicContact CD2-CG1 4.48Å; F400-I426 HydrophobicContact CE1-CD1 4.2Å; F400-I426 HydrophobicContact CE2-CD1 4.08Å; F400-I426 HydrophobicContact CE2-CG1 3.97Å; F400-I426 HydrophobicContact CG-CD1 4.42Å; F400-I426 HydrophobicContact CZ-CD1 4.06Å; F400-I426 HydrophobicContact CZ-CG1 4.13Å; F400-I426 WeakPolarHBondContact O-CD1 3.44Å; F400-F474 AromaticContact CE2-CD1 3.94Å; F400-F474 HydrophobicContact CE2-CD1 3.94Å; F400-F474 AromaticContact CE2-CE1 3.72Å; F400-F474 HydrophobicContact CE2-CE1 3.72Å; F400-F474 HydrophobicContact CE2-CZ 4.33Å; F400-F474 HydrophobicContact CZ-CB 4.45Å; F400-F474 AromaticContact CZ-CD1 3.54Å; F400-F474 HydrophobicContact CZ-CD1 3.54Å; F400-F474 HydrophobicContact CZ-CD2 4.48Å; F400-F474 AromaticContact CZ-CE1 3.75Å; F400-F474 HydrophobicContact CZ-CE1 3.75Å; F400-F474 AromaticContact CZ-CG 3.92Å; F400-F474 HydrophobicContact CZ-CG 3.92Å; F400-F474 HydrophobicContact CZ-CZ 4.3Å
401	G	93.8	Very high	95.2	Very high	7 Å²	7	17.2 Å²	17.2	7%	0.072	9%	0.086	C	C	.	.			trans	107.4	63.9	179.7	0	0	0	0	0	114	G403 V404 V405	G401-G403 VanDerWaalsContact C-N 3.27Å; G401-G403 PolarHBondContact O-N 2.98Å; G401-V404 WeakPolarHBondContact O-CA 3.44Å; G401-V404 VanDerWaalsContact O-CB 3.28Å; G401-V404 WeakPolarHBondContact O-CB 3.5Å; G401-V404 PolarHBondContact O-N 3.36Å; G401-V405 PolarHBondContact O-N 3.1Å
402	I	92.5	Very high	95	Very high	35 Å²	35	17.2 Å²	17.2	18%	0.179	9%	0.086	C	C	.	.	H	α-helix	trans	-52.9	-45.5	176.8	-65.5	175.4	0	0	0	111	P280 F400 V404 V405 E406	P280-I402 HydrophobicContact CB-CD1 4.12Å; P280-I402 HydrophobicContact CB-CG1 4.35Å; P280-I402 HydrophobicContact CG-CD1 4.28Å; P280-I402 HydrophobicContact CG-CG1 3.98Å; F400-I402 HydrophobicContact CD1-CG1 3.98Å; F400-I402 HydrophobicContact CE1-CG1 4.24Å; I402-V404 PolarHBondContact O-N 2.87Å; I402-V405 WeakPolarHBondContact O-CA 3.49Å; I402-V405 WeakPolarHBondContact O-CB 3.44Å; I402-V405 PolarHBondContact O-N 3.4Å; I402-E406 HydrophobicContact CG2-CG 4.13Å; I402-E406 WeakPolarHBondContact CG2-OE1 3.5Å; I402-E406 WeakPolarHBondContact O-CG 3.39Å; I402-E406 PolarHBondContact O-N 3.01Å
403	G	92.3	Very high	95	Very high	22 Å²	22	16.9 Å²	16.9	23%	0.227	8%	0.084	C	C	.	.	H	α-helix	trans	-62.2	-23.5	177.7	0	0	0	0	0	114.7	G401 C407	G401-G403 VanDerWaalsContact C-N 3.27Å; G401-G403 PolarHBondContact O-N 2.98Å; G403-C407 VanDerWaalsContact O-CB 3.31Å; G403-C407 WeakPolarHBondContact O-CB 3.44Å; G403-C407 PolarHBondContact O-N 3.4Å; G403-C407 PolarHBondContact O-SG 3.48Å
404	V	96.8	Very high	95	Very high	1 Å²	1	16 Å²	16	1%	0.006	8%	0.08	C	C	.	.	H	α-helix	trans	-71	-45.1	172.6	-174.4	0	0	0	0	109.6	H393 G401 I402 C407 M408 I414 P422 I426 V427	H393-V404 HydrophobicContact CB-CG2 3.92Å; G401-V404 WeakPolarHBondContact O-CA 3.44Å; G401-V404 VanDerWaalsContact O-CB 3.28Å; G401-V404 WeakPolarHBondContact O-CB 3.5Å; G401-V404 PolarHBondContact O-N 3.36Å; I402-V404 PolarHBondContact O-N 2.87Å; V404-C407 PolarHBondContact O-N 2.95Å; V404-M408 WeakPolarHBondContact O-CG 3.32Å; V404-M408 PolarHBondContact O-N 2.91Å; V404-I414 HydrophobicContact CG1-CB 4.38Å; V404-I414 HydrophobicContact CG1-CD1 4.29Å; V404-I414 HydrophobicContact CG1-CG1 3.91Å; V404-I414 HydrophobicContact CG1-CG2 3.64Å; V404-P422 HydrophobicContact CG2-CG 4.39Å; V404-I426 HydrophobicContact CB-CD1 4.25Å; V404-I426 HydrophobicContact CB-CG2 4.36Å; V404-I426 HydrophobicContact CG1-CG2 3.78Å; V404-V427 HydrophobicContact CG1-CG2 4.29Å
405	V	96.9	Very high	95	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-62.1	-44.2	175.4	-178.8	0	0	0	0	111.2	C282 V284 F400 G401 I402 C407 M408 A409 I426 V471 F474	C282-V405 HydrophobicContact CB-CB 4.41Å; C282-V405 HydrophobicContact CB-CG1 3.9Å; V284-V405 HydrophobicContact CG1-CG1 3.83Å; F400-V405 HydrophobicContact CE1-CG2 3.79Å; F400-V405 HydrophobicContact CZ-CG2 3.83Å; G401-V405 PolarHBondContact O-N 3.1Å; I402-V405 WeakPolarHBondContact O-CA 3.49Å; I402-V405 WeakPolarHBondContact O-CB 3.44Å; I402-V405 PolarHBondContact O-N 3.4Å; V405-C407 PolarHBondContact O-N 3.22Å; V405-M408 PolarHBondContact O-N 2.98Å; V405-A409 WeakPolarHBondContact O-CB 3.38Å; V405-A409 PolarHBondContact O-N 3.03Å; V405-I426 HydrophobicContact CG2-CD1 3.81Å; V405-I426 HydrophobicContact CG2-CG1 4.07Å; V405-I426 HydrophobicContact CG2-CG2 4.08Å; V405-V471 HydrophobicContact CG1-CB 3.96Å; V405-V471 HydrophobicContact CG1-CG1 3.94Å; V405-F474 HydrophobicContact CB-CD2 4.41Å; V405-F474 HydrophobicContact CG1-CB 3.98Å; V405-F474 HydrophobicContact CG1-CD2 3.75Å; V405-F474 HydrophobicContact CG1-CG 4.26Å; V405-F474 HydrophobicContact CG2-CD2 3.7Å; V405-F474 HydrophobicContact CG2-CE2 4.09Å; V405-F474 HydrophobicContact CG2-CG 4.18Å
406	E	94.1	Very high	95.2	Very high	43 Å²	43	15.4 Å²	15.4	20%	0.201	8%	0.077	C	C	.	.	H	α-helix	trans	-61.1	-44	177.7	-66.9	174	159.7	0	0	111.5	F287 I402 M408 A409 A410	F287-E406 HydrophobicContact CD2-CB 3.94Å; F287-E406 HydrophobicContact CD2-CG 3.92Å; F287-E406 HydrophobicContact CE1-CB 4.31Å; F287-E406 HydrophobicContact CE2-CB 3.65Å; F287-E406 HydrophobicContact CE2-CG 3.4Å; F287-E406 HydrophobicContact CG-CB 4.4Å; F287-E406 HydrophobicContact CZ-CB 3.82Å; F287-E406 HydrophobicContact CZ-CG 3.9Å; I402-E406 HydrophobicContact CG2-CG 4.13Å; I402-E406 WeakPolarHBondContact CG2-OE1 3.5Å; I402-E406 WeakPolarHBondContact O-CG 3.39Å; I402-E406 PolarHBondContact O-N 3.01Å; E406-M408 PolarHBondContact O-N 3.44Å; E406-A409 PolarHBondContact O-N 3.12Å; E406-A410 WeakPolarHBondContact O-CB 3.35Å; E406-A410 PolarHBondContact O-N 3.09Å
407	C	95.9	Very high	95.4	Very high	7 Å²	7	10.6 Å²	10.6	5%	0.047	6%	0.059	C	C	.	.	H	α-helix	trans	-63.3	-39.1	174.4	-77.4	0	0	0	0	112.8	G403 V404 V405 A410 G411 T412 I414	G403-C407 VanDerWaalsContact O-CB 3.31Å; G403-C407 WeakPolarHBondContact O-CB 3.44Å; G403-C407 PolarHBondContact O-N 3.4Å; G403-C407 PolarHBondContact O-SG 3.48Å; V404-C407 PolarHBondContact O-N 2.95Å; V405-C407 PolarHBondContact O-N 3.22Å; C407-A410 PolarHBondContact O-N 3.12Å; C407-G411 PolarHBondContact O-N 2.99Å; C407-T412 VanDerWaalsContact C-OG1 3.25Å; C407-T412 WeakPolarHBondContact CB-OG1 3.37Å; C407-T412 WeakPolarHBondContact O-CB 3.45Å; C407-T412 PolarHBondContact O-N 3.35Å; C407-T412 PolarHBondContact O-OG1 3.42Å; C407-I414 HydrophobicContact CB-CD1 3.34Å; C407-I414 HydrophobicContact CB-CG1 4.09Å
408	M	96.8	Very high	95.7	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-64.6	-45	173.1	-71.4	174.9	71.1	0	0	111.2	V404 V405 E406 A410 G411 I414 I426 A467 R468 S470 V471	V404-M408 WeakPolarHBondContact O-CG 3.32Å; V404-M408 PolarHBondContact O-N 2.91Å; V405-M408 PolarHBondContact O-N 2.98Å; E406-M408 PolarHBondContact O-N 3.44Å; M408-A410 VanDerWaalsContact C-N 3.3Å; M408-A410 PolarHBondContact O-N 3.29Å; M408-G411 WeakPolarHBondContact O-CA 3.46Å; M408-G411 PolarHBondContact O-N 3.34Å; M408-I414 HydrophobicContact CG-CB 4.12Å; M408-I414 HydrophobicContact CG-CG1 3.5Å; M408-I414 VanDerWaalsContact CG-CG1 3.5Å; M408-I426 HydrophobicContact SD-CG2 3.35Å; M408-I426 WeakPolarHBondContact SD-CG2 3.29Å; M408-A467 HydrophobicContact CB-CB 4.23Å; M408-A467 HydrophobicContact CE-CB 3.71Å; M408-A467 HydrophobicContact CG-CB 4.33Å; M408-R468 WeakPolarHBondContact O-CG 3.39Å; M408-S470 WeakPolarHBondContact CE-OG 3.25Å; M408-V471 HydrophobicContact CB-CG1 3.69Å; M408-V471 HydrophobicContact CE-CG1 4.45Å
409	A	96.1	Very high	95.8	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-62.5	-36.7	177.8	0	0	0	0	0	111.9	V284 F287 L288 V405 E406 G411 R468 V471	V284-A409 HydrophobicContact CB-CB 4.35Å; F287-A409 CarbonylContact C-O 3.55Å; F287-A409 HydrophobicContact CB-CB 3.65Å; F287-A409 VanDerWaalsContact O-O 3.1Å; L288-A409 HydrophobicContact CG-CB 4.37Å; V405-A409 WeakPolarHBondContact O-CB 3.38Å; V405-A409 PolarHBondContact O-N 3.03Å; E406-A409 PolarHBondContact O-N 3.12Å; A409-G411 PolarHBondContact O-N 2.89Å; A409-R468 PolarHBondContact O-NE 2.87Å; A409-R468 PolarHBondContact O-NH2 3.36Å; A409-V471 HydrophobicContact CB-CG2 3.99Å
410	A	94.9	Very high	96	Very high	1 Å²	1	9.3 Å²	9.3	1%	0.008	6%	0.057	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-8	174.1	0	0	0	0	0	113.3	F287 I290 L385 E406 C407 M408	F287-A410 HydrophobicContact CB-CB 4.2Å; F287-A410 HydrophobicContact CD1-CB 4.14Å; I290-A410 HydrophobicContact CD1-CB 3.84Å; L385-A410 HydrophobicContact CB-CB 3.8Å; L385-A410 HydrophobicContact CD1-CB 3.99Å; L385-A410 HydrophobicContact CG-CB 4.34Å; E406-A410 WeakPolarHBondContact O-CB 3.35Å; E406-A410 PolarHBondContact O-N 3.09Å; C407-A410 PolarHBondContact O-N 3.12Å; M408-A410 VanDerWaalsContact C-N 3.3Å; M408-A410 PolarHBondContact O-N 3.29Å
411	G	93.9	Very high	96.1	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	6%	0.056	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.5	31.9	178.6	0	0	0	0	0	113.2	C407 M408 A409 R464	C407-G411 PolarHBondContact O-N 2.99Å; M408-G411 WeakPolarHBondContact O-CA 3.46Å; M408-G411 PolarHBondContact O-N 3.34Å; A409-G411 PolarHBondContact O-N 2.89Å; G411-R464 WeakPolarHBondContact O-CG 3.39Å; G411-R464 VanDerWaalsContact O-CZ 3.31Å; G411-R464 PolarHBondContact O-NE 3.3Å; G411-R464 PolarHBondContact O-NH2 3.2Å; G411-R464 VanDerWaalsContact O-NH2 3.14Å
412	T	95.1	Very high	96.3	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	5%	0.052	C	C	.	.			trans	-87.2	151.2	165.9	70.3	0	0	0	0	110	V304 L385 A388 C407 I414	V304-T412 HydrophobicContact CG2-CG2 4.46Å; L385-T412 HydrophobicContact CD2-CG2 4.24Å; A388-T412 HydrophobicContact CB-CG2 3.73Å; C407-T412 VanDerWaalsContact C-OG1 3.25Å; C407-T412 WeakPolarHBondContact CB-OG1 3.37Å; C407-T412 WeakPolarHBondContact O-CB 3.45Å; C407-T412 PolarHBondContact O-N 3.35Å; C407-T412 PolarHBondContact O-OG1 3.42Å; T412-I414 PolarHBondContact O-N 2.9Å
413	I	97.8	Very high	96.5	Very high	1 Å²	1	11.1 Å²	11.1	1%	0.005	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	112.8	167.2	-63.1	177.2	0	0	0	107.3	T389 I390 G391 F437 I452 R460 I463 R464	T389-I413 PolarHBondContact O-N 3.25Å; I390-I413 VanDerWaalsContact CA-O 3.23Å; I390-I413 WeakPolarHBondContact CA-O 3.4Å; G391-I413 PolarHBondContact N-O 3.47Å; I413-F437 HydrophobicContact CG2-CD2 3.74Å; I413-F437 HydrophobicContact CG2-CE2 3.77Å; I413-I452 HydrophobicContact CB-CG2 4.31Å; I413-I452 HydrophobicContact CD1-CG2 3.8Å; I413-I452 HydrophobicContact CG2-CD1 4.03Å; I413-I452 HydrophobicContact CG2-CG1 4.33Å; I413-I452 HydrophobicContact CG2-CG2 4.08Å; I413-R460 HydrophobicContact CD1-CB 3.65Å; I413-R460 HydrophobicContact CD1-CG 3.57Å; I413-I463 HydrophobicContact CG1-CG2 4.27Å; I413-I463 HydrophobicContact CG2-CG2 4.24Å; I413-R464 HydrophobicContact CD1-CG 4.48Å; I413-R464 HydrophobicContact CG1-CG 3.79Å
414	I	98.1	Very high	96.8	Very high	2 Å²	2	13.6 Å²	13.6	1%	0.01	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	133.8	178.4	-82.1	-49.2	0	0	0	111.3	G391 V404 C407 M408 T412 A416 V427 G436 F437	G391-I414 WeakPolarHBondContact O-CD1 3.28Å; V404-I414 HydrophobicContact CG1-CB 4.38Å; V404-I414 HydrophobicContact CG1-CD1 4.29Å; V404-I414 HydrophobicContact CG1-CG1 3.91Å; V404-I414 HydrophobicContact CG1-CG2 3.64Å; C407-I414 HydrophobicContact CB-CD1 3.34Å; C407-I414 HydrophobicContact CB-CG1 4.09Å; M408-I414 HydrophobicContact CG-CB 4.12Å; M408-I414 HydrophobicContact CG-CG1 3.5Å; M408-I414 VanDerWaalsContact CG-CG1 3.5Å; T412-I414 PolarHBondContact O-N 2.9Å; I414-A416 HydrophobicContact CG2-CB 3.84Å; I414-V427 HydrophobicContact CG2-CG2 3.6Å; I414-G436 CarbonylContact O-C 3.52Å; I414-G436 WeakPolarHBondContact O-CA 3.25Å; I414-F437 PolarHBondContact O-N 2.8Å
415	L	98.7	Very high	96.8	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	102.8	161.7	173.6	56.9	0	0	0	108.1	I390 G391 L392 H393 F437 A439 Y445 T448 I449 I452	I390-L415 HydrophobicContact CG2-CB 4.12Å; G391-L415 PolarHBondContact O-N 3.4Å; L392-L415 WeakPolarHBondContact CA-O 3.37Å; L392-L415 HydrophobicContact CD2-CB 4.09Å; L392-L415 HydrophobicContact CD2-CD2 3.96Å; L392-L415 HydrophobicContact CD2-CG 4.24Å; H393-L415 PolarHBondContact N-O 3.45Å; L415-F437 WeakPolarHBondContact CA-O 3.46Å; L415-F437 HydrophobicContact CD1-CB 3.8Å; L415-A439 HydrophobicContact CD1-CB 3.79Å; L415-Y445 HydrophobicContact CD1-CD1 4.42Å; L415-Y445 HydrophobicContact CD1-CE1 4.37Å; L415-Y445 HydrophobicContact CD2-CD1 3.63Å; L415-Y445 HydrophobicContact CD2-CE1 4.19Å; L415-Y445 HydrophobicContact CD2-CG 4.49Å; L415-Y445 HydrophobicContact CG-CD1 3.74Å; L415-Y445 HydrophobicContact CG-CE1 3.77Å; L415-T448 HydrophobicContact CD1-CG2 3.61Å; L415-T448 HydrophobicContact CD2-CG2 4.08Å; L415-T448 HydrophobicContact CG-CG2 4.45Å; L415-I449 HydrophobicContact CD2-CD1 4.36Å; L415-I449 HydrophobicContact CD2-CG1 3.58Å; L415-I452 HydrophobicContact CB-CD1 4.37Å
416	A	98.5	Very high	96.9	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	167.6	-175.5	0	0	0	0	0	112.5	H393 I414 P422 V427 F437 L438 A439 Y445	H393-A416 HydrophobicContact CB-CB 4.13Å; H393-A416 CarbonylContact O-C 3.59Å; H393-A416 VanDerWaalsContact O-C 3.3Å; H393-A416 VanDerWaalsContact O-CA 3.23Å; H393-A416 WeakPolarHBondContact O-CA 3.49Å; I414-A416 HydrophobicContact CG2-CB 3.84Å; A416-P422 HydrophobicContact CB-CB 3.77Å; A416-V427 HydrophobicContact CB-CG2 4.24Å; A416-F437 PolarHBondContact N-O 3.48Å; A416-L438 HydrophobicContact CB-CD2 4.12Å; A416-L438 CarbonylContact O-C 3.55Å; A416-L438 VanDerWaalsContact O-CA 3.26Å; A416-L438 WeakPolarHBondContact O-CA 3.48Å; A416-A439 PolarHBondContact O-N 3.14Å; A416-Y445 VanDerWaalsContact C-OH 3.23Å; A416-Y445 PolarHBondContact O-OH 3.32Å
417	H	98.4	Very high	97.1	Very high	17 Å²	17	12.2 Å²	12.2	8%	0.079	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	137.6	173.9	-169.8	-72.3	0	0	0	110.6	H393 W396 S419 A439 Y445	H393-H417 PolarHBondContact O-N 3.14Å; W396-H417 AromaticContact CD1-CE1 3.42Å; W396-H417 VanDerWaalsContact CD1-CE1 3.42Å; W396-H417 AromaticContact CD1-NE2 3.73Å; H417-S419 PolarHBondContact CE1-OG 3.3Å; H417-S419 PolarHBondContact ND1-N 3.32Å; H417-S419 PolarHBondContact ND1-OG 3.31Å; H417-S419 PolarHBondContact O-N 3.48Å; H417-A439 CarbonylContact C-O 3.58Å; H417-A439 VanDerWaalsContact CA-O 3.29Å; H417-A439 WeakPolarHBondContact CA-O 3.22Å; H417-Y445 WeakPolarHBondContact CA-OH 3.43Å; H417-Y445 PolarHBondContact N-OH 3.07Å
418	N	97.9	Very high	97.1	Very high	39 Å²	39	13.6 Å²	13.6	21%	0.209	7%	0.071	C	C	.	.	S	Bend	trans	-73.6	50	177.9	-167	20	0	0	0	113.3	K423 L438 A439 E440	N418-K423 PolarHBondContact ND2-NZ 3.36Å; N418-K423 WeakPolarHBondContact O-CD 3.29Å; N418-K423 PolarHBondContact O-NZ 3.34Å; N418-K423 WeakPolarHBondContact OD1-CD 3.46Å; N418-K423 WeakPolarHBondContact OD1-CE 3.44Å; N418-K423 PolarHBondContact OD1-NZ 3.39Å; N418-L438 HydrophobicContact CB-CB 3.89Å; N418-L438 WeakPolarHBondContact OD1-CD1 3.44Å; N418-A439 PolarHBondContact N-O 2.85Å; N418-E440 HydrophobicContact CB-CG 3.5Å; N418-E440 PolarHBondContact ND2-OE1 2.84Å
419	S	96.2	Very high	97.1	Very high	14 Å²	14	18.3 Å²	18.3	10%	0.098	10%	0.102	C	C	.	.	S	Bend	trans	-157.1	176.5	171.7	71.2	0	0	0	0	111.9	N397 H417 P422 K423	N397-S419 PolarHBondContact N-OG 3.29Å; N397-S419 WeakPolarHBondContact OD1-CB 3.48Å; N397-S419 PolarHBondContact OD1-OG 3.07Å; H417-S419 PolarHBondContact CE1-OG 3.3Å; H417-S419 PolarHBondContact ND1-N 3.32Å; H417-S419 PolarHBondContact ND1-OG 3.31Å; H417-S419 PolarHBondContact O-N 3.48Å; S419-P422 WeakPolarHBondContact O-CD 3.29Å; S419-K423 PolarHBondContact O-N 3.15Å
420	G	95.7	Very high	97.1	Very high	3 Å²	3	20.8 Å²	20.8	3%	0.031	11%	0.113	C	C	.	.	H	α-helix	trans	66	-158.4	176.3	0	0	0	0	0	115	E398 P422 K423 L424	E398-G420 CarbonylContact O-C 3.54Å; E398-G420 VanDerWaalsContact O-CA 3.28Å; E398-G420 WeakPolarHBondContact O-CA 3.2Å; G420-P422 VanDerWaalsContact C-CD 3.48Å; G420-K423 PolarHBondContact O-N 2.89Å; G420-L424 WeakPolarHBondContact O-CG 2.91Å; G420-L424 PolarHBondContact O-N 3.02Å
421	G	97.1	Very high	97	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-58.3	-37.1	173.6	0	0	0	0	0	114.6	E398 F400 K423 L424 D425 I426	E398-G421 PolarHBondContact O-N 2.88Å; F400-G421 CarbonylContact O-C 3.37Å; G421-K423 VanDerWaalsContact C-N 3.31Å; G421-K423 PolarHBondContact O-N 3.26Å; G421-L424 PolarHBondContact O-N 3.34Å; G421-D425 WeakPolarHBondContact O-CB 3.47Å; G421-D425 PolarHBondContact O-N 2.7Å; G421-I426 PolarHBondContact O-N 3.13Å; G421-I426 VanDerWaalsContact O-N 3.11Å
422	P	97.6	Very high	97	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.189	C	C	.	.	I	π-helix	trans	-55.9	-44.4	175.2	-29	37.3	0	0	0	113	E398 F400 V404 A416 S419 G420 V427	E398-P422 HydrophobicContact CB-CG 3.91Å; E398-P422 HydrophobicContact CG-CG 4.09Å; E398-P422 WeakPolarHBondContact O-CD 3.16Å; F400-P422 VanDerWaalsContact O-CD 3.23Å; F400-P422 WeakPolarHBondContact O-CD 3.44Å; V404-P422 HydrophobicContact CG2-CG 4.39Å; A416-P422 HydrophobicContact CB-CB 3.77Å; S419-P422 WeakPolarHBondContact O-CD 3.29Å; G420-P422 VanDerWaalsContact C-CD 3.48Å; P422-V427 WeakPolarHBondContact O-CB 3.37Å; P422-V427 WeakPolarHBondContact O-CG2 3.38Å; P422-V427 PolarHBondContact O-N 3.39Å
423	K	97.8	Very high	97	Very high	84 Å²	84	36 Å²	36	37%	0.365	21%	0.206	S	C	.	.	I	π-helix	trans	-73.3	-47.2	177.8	175.3	-178.4	-166	152.4	0	113.4	N418 S419 G420 G421 V428 L438	N418-K423 PolarHBondContact ND2-NZ 3.36Å; N418-K423 WeakPolarHBondContact O-CD 3.29Å; N418-K423 PolarHBondContact O-NZ 3.34Å; N418-K423 WeakPolarHBondContact OD1-CD 3.46Å; N418-K423 WeakPolarHBondContact OD1-CE 3.44Å; N418-K423 PolarHBondContact OD1-NZ 3.39Å; S419-K423 PolarHBondContact O-N 3.15Å; G420-K423 PolarHBondContact O-N 2.89Å; G421-K423 VanDerWaalsContact C-N 3.31Å; G421-K423 PolarHBondContact O-N 3.26Å; K423-V428 WeakPolarHBondContact O-CG1 3.24Å; K423-L438 HydrophobicContact CB-CD1 4.04Å; K423-L438 HydrophobicContact CG-CD1 3.93Å
424	L	97.6	Very high	97	Very high	74 Å²	74	40 Å²	40	39%	0.387	23%	0.226	S	C	.	.	I	π-helix	trans	-83	-29.4	-167.3	-63.8	-179.6	0	0	0	112.9	W260 G420 G421	W260-L424 HydrophobicContact CB-CD1 3.86Å; G420-L424 WeakPolarHBondContact O-CG 2.91Å; G420-L424 PolarHBondContact O-N 3.02Å; G421-L424 PolarHBondContact O-N 3.34Å
425	D	97.9	Very high	97	Very high	2 Å²	2	40 Å²	40	1%	0.011	23%	0.227	C	C	.	.	I	π-helix	trans	-123.5	-42.2	-168.5	-60.2	-78.7	0	0	0	112.6	S258 S259 Y279 G421 V428 R473	S258-D425 WeakPolarHBondContact CB-OD2 3.31Å; S259-D425 VanDerWaalsContact CB-OD1 3.24Å; S259-D425 WeakPolarHBondContact CB-OD1 3.41Å; S259-D425 WeakPolarHBondContact CB-OD2 3.49Å; S259-D425 PolarHBondContact N-OD1 2.92Å; S259-D425 PolarHBondContact N-OD2 3.16Å; S259-D425 PolarHBondContact OG-OD1 2.94Å; Y279-D425 HydrophobicContact CE1-CB 3.82Å; Y279-D425 VanDerWaalsContact CE1-OD1 3.29Å; Y279-D425 WeakPolarHBondContact CE1-OD1 3.48Å; Y279-D425 PolarHBondContact OH-OD1 2.85Å; G421-D425 WeakPolarHBondContact O-CB 3.47Å; G421-D425 PolarHBondContact O-N 2.7Å; D425-V428 WeakPolarHBondContact O-CG2 3.32Å; D425-R473 PolarHBondContact O-NH1 2.97Å; D425-R473 PolarHBondContact O-NH2 3.25Å
426	I	98.1	Very high	97	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.231	C	C	.	.	I	π-helix	trans	-92.5	-60.8	-165.8	-59.3	171.9	0	0	0	112.2	F400 V404 V405 M408 G421 V428 R473 F474	F400-I426 HydrophobicContact CD1-CD1 4.37Å; F400-I426 HydrophobicContact CD2-CD1 4.27Å; F400-I426 HydrophobicContact CD2-CG1 4.48Å; F400-I426 HydrophobicContact CE1-CD1 4.2Å; F400-I426 HydrophobicContact CE2-CD1 4.08Å; F400-I426 HydrophobicContact CE2-CG1 3.97Å; F400-I426 HydrophobicContact CG-CD1 4.42Å; F400-I426 HydrophobicContact CZ-CD1 4.06Å; F400-I426 HydrophobicContact CZ-CG1 4.13Å; F400-I426 WeakPolarHBondContact O-CD1 3.44Å; V404-I426 HydrophobicContact CB-CD1 4.25Å; V404-I426 HydrophobicContact CB-CG2 4.36Å; V404-I426 HydrophobicContact CG1-CG2 3.78Å; V405-I426 HydrophobicContact CG2-CD1 3.81Å; V405-I426 HydrophobicContact CG2-CG1 4.07Å; V405-I426 HydrophobicContact CG2-CG2 4.08Å; M408-I426 HydrophobicContact SD-CG2 3.35Å; M408-I426 WeakPolarHBondContact SD-CG2 3.29Å; G421-I426 PolarHBondContact O-N 3.13Å; G421-I426 VanDerWaalsContact O-N 3.11Å; I426-V428 PolarHBondContact O-N 3.25Å; I426-R473 PolarHBondContact O-NH2 2.83Å; I426-R473 VanDerWaalsContact O-NH2 3.16Å; I426-F474 HydrophobicContact CG1-CE2 4.32Å; I426-F474 HydrophobicContact CG1-CZ 4.11Å
427	V	98.1	Very high	97	Very high	13 Å²	13	42 Å²	42	8%	0.079	24%	0.238	C	C	.	.	S	Bend	trans	-88.6	61.7	-175.8	-167.2	0	0	0	0	109.5	V404 I414 A416 P422 G436 L438	V404-V427 HydrophobicContact CG1-CG2 4.29Å; I414-V427 HydrophobicContact CG2-CG2 3.6Å; A416-V427 HydrophobicContact CB-CG2 4.24Å; P422-V427 WeakPolarHBondContact O-CB 3.37Å; P422-V427 WeakPolarHBondContact O-CG2 3.38Å; P422-V427 PolarHBondContact O-N 3.39Å; V427-G436 VanDerWaalsContact CG1-C 3.4Å; V427-L438 HydrophobicContact CB-CD2 3.97Å; V427-L438 HydrophobicContact CB-CG 4.38Å; V427-L438 HydrophobicContact CG1-CD2 4.24Å; V427-L438 HydrophobicContact CG1-CG 4.26Å; V427-L438 HydrophobicContact CG2-CD2 4.24Å
428	V	97.3	Very high	97	Very high	36 Å²	36	43.7 Å²	43.7	22%	0.218	25%	0.247	C	C	.	.	S	Bend	trans	-117.2	153.1	178.7	-60.4	0	0	0	0	109.8	K423 D425 I426 H430 T435	K423-V428 WeakPolarHBondContact O-CG1 3.24Å; D425-V428 WeakPolarHBondContact O-CG2 3.32Å; I426-V428 PolarHBondContact O-N 3.25Å; V428-H430 PolarHBondContact O-N 2.81Å; V428-T435 PolarHBondContact N-OG1 3.03Å; V428-T435 WeakPolarHBondContact O-CG2 3.34Å; V428-T435 PolarHBondContact O-OG1 3.41Å
429	P	96.5	Very high	97	Very high	99 Å²	99	42 Å²	42	64%	0.643	24%	0.239	S	C	*	.			trans	-56.5	140.2	177.8	-25.1	34.6	0	0	0	112.3	D433	P429-D433 CarbonylContact C-O 3.48Å; P429-D433 WeakPolarHBondContact CA-O 3.39Å
430	H	95.3	Very high	96.9	Very high	51 Å²	51	46.3 Å²	46.3	24%	0.236	26%	0.257	C	S	.	.	B	Isolated β-bridge	trans	-122	119.4	175.5	-176.8	69.2	0	0	0	108.6	V428 G432 D433 T435	V428-H430 PolarHBondContact O-N 2.81Å; H430-G432 PolarHBondContact O-N 3.17Å; H430-G432 VanDerWaalsContact O-N 3.17Å; H430-D433 PolarHBondContact N-O 3.36Å; H430-D433 PolarHBondContact O-N 3.18Å; H430-T435 HydrophobicContact CB-CG2 3.65Å
431	E	93.8	Very high	97	Very high	181 Å²	181	48.5 Å²	48.5	85%	0.846	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	31.3	-173.9	-56.7	-173.9	159.9	0	0	113.6	D433	E431-D433 VanDerWaalsContact C-N 3.26Å; E431-D433 PolarHBondContact O-N 3.43Å
432	G	92.8	Very high	97	Very high	72 Å²	72	51.8 Å²	51.8	74%	0.742	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.3	-10	-177.3	0	0	0	0	0	114.7	H430	H430-G432 PolarHBondContact O-N 3.17Å; H430-G432 VanDerWaalsContact O-N 3.17Å
433	D	96.3	Very high	97	Very high	68 Å²	68	54.5 Å²	54.5	36%	0.364	30%	0.3	S	S	.	.	B	Isolated β-bridge	trans	-89.8	150.7	178.1	-84.7	-29.1	0	0	0	112.8	P429 H430 E431 Q462 S466	P429-D433 CarbonylContact C-O 3.48Å; P429-D433 WeakPolarHBondContact CA-O 3.39Å; H430-D433 PolarHBondContact N-O 3.36Å; H430-D433 PolarHBondContact O-N 3.18Å; E431-D433 VanDerWaalsContact C-N 3.26Å; E431-D433 PolarHBondContact O-N 3.43Å; D433-Q462 PolarHBondContact OD1-NE2 3Å; D433-Q462 PolarHBondContact OD2-NE2 2.99Å; D433-S466 WeakPolarHBondContact CB-OG 3.38Å
434	I	97.3	Very high	97	Very high	85 Å²	85	53.5 Å²	53.5	44%	0.436	30%	0.299	S	S	.	.			trans	-74.7	133.7	177.8	-60.6	172.4	0	0	0	110	G436	I434-G436 WeakPolarHBondContact CG2-O 3.49Å
435	T	97.9	Very high	97	Very high	3 Å²	3	50 Å²	50	2%	0.018	28%	0.28	C	S	.	.			trans	-105.3	-10.8	179.9	56.4	0	0	0	0	113.7	V428 H430 A467	V428-T435 PolarHBondContact N-OG1 3.03Å; V428-T435 WeakPolarHBondContact O-CG2 3.34Å; V428-T435 PolarHBondContact O-OG1 3.41Å; H430-T435 HydrophobicContact CB-CG2 3.65Å; T435-A467 VanDerWaalsContact O-CB 3.31Å; T435-A467 WeakPolarHBondContact O-CB 3.47Å
436	G	98.2	Very high	97	Very high	9 Å²	9	50 Å²	50	9%	0.093	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.3	-166	179.7	0	0	0	0	0	111.5	I414 V427 I434	I414-G436 CarbonylContact O-C 3.52Å; I414-G436 WeakPolarHBondContact O-CA 3.25Å; V427-G436 VanDerWaalsContact CG1-C 3.4Å; I434-G436 WeakPolarHBondContact CG2-O 3.49Å
437	F	98.7	Very high	96.9	Very high	32 Å²	32	54.7 Å²	54.7	14%	0.14	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	157.7	-175.7	-61.5	-90.8	0	0	0	111.8	I413 I414 L415 A416 T448 I452 M455 I463	I413-F437 HydrophobicContact CG2-CD2 3.74Å; I413-F437 HydrophobicContact CG2-CE2 3.77Å; I414-F437 PolarHBondContact O-N 2.8Å; L415-F437 WeakPolarHBondContact CA-O 3.46Å; L415-F437 HydrophobicContact CD1-CB 3.8Å; A416-F437 PolarHBondContact N-O 3.48Å; F437-T448 HydrophobicContact CB-CG2 3.63Å; F437-T448 HydrophobicContact CD1-CG2 4.1Å; F437-T448 HydrophobicContact CG-CG2 3.93Å; F437-I452 HydrophobicContact CB-CD1 4.47Å; F437-I452 HydrophobicContact CD2-CD1 3.59Å; F437-I452 HydrophobicContact CD2-CG1 3.69Å; F437-I452 HydrophobicContact CE2-CD1 4.1Å; F437-I452 HydrophobicContact CE2-CG1 3.69Å; F437-I452 HydrophobicContact CG-CD1 4.14Å; F437-I452 HydrophobicContact CG-CG1 4.34Å; F437-I452 HydrophobicContact CZ-CG1 4.32Å; F437-M455 HydrophobicContact CE1-CE 4.16Å; F437-M455 HydrophobicContact CE2-CE 4.35Å; F437-M455 HydrophobicContact CZ-CE 3.52Å; F437-M455 HydrophobicContact CZ-SD 4.42Å; F437-I463 HydrophobicContact CE2-CD1 3.91Å; F437-I463 HydrophobicContact CZ-CD1 3.86Å
438	L	98.7	Very high	96.9	Very high	52 Å²	52	55.2 Å²	55.2	27%	0.272	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	140.3	179.7	-63.6	173.2	0	0	0	110	A416 N418 K423 V427	A416-L438 HydrophobicContact CB-CD2 4.12Å; A416-L438 CarbonylContact O-C 3.55Å; A416-L438 VanDerWaalsContact O-CA 3.26Å; A416-L438 WeakPolarHBondContact O-CA 3.48Å; N418-L438 HydrophobicContact CB-CB 3.89Å; N418-L438 WeakPolarHBondContact OD1-CD1 3.44Å; K423-L438 HydrophobicContact CB-CD1 4.04Å; K423-L438 HydrophobicContact CG-CD1 3.93Å; V427-L438 HydrophobicContact CB-CD2 3.97Å; V427-L438 HydrophobicContact CB-CG 4.38Å; V427-L438 HydrophobicContact CG1-CD2 4.24Å; V427-L438 HydrophobicContact CG1-CG 4.26Å; V427-L438 HydrophobicContact CG2-CD2 4.24Å
439	A	98.3	Very high	96.9	Very high	4 Å²	4	53.6 Å²	53.6	3%	0.033	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	159.7	177	0	0	0	0	0	111.8	L415 A416 H417 N418 D444 Y445	L415-A439 HydrophobicContact CD1-CB 3.79Å; A416-A439 PolarHBondContact O-N 3.14Å; H417-A439 CarbonylContact C-O 3.58Å; H417-A439 VanDerWaalsContact CA-O 3.29Å; H417-A439 WeakPolarHBondContact CA-O 3.22Å; N418-A439 PolarHBondContact N-O 2.85Å; A439-D444 HydrophobicContact CB-CB 3.89Å; A439-Y445 HydrophobicContact CB-CD1 4.09Å; A439-Y445 HydrophobicContact CB-CD2 3.54Å; A439-Y445 HydrophobicContact CB-CE1 4.17Å; A439-Y445 HydrophobicContact CB-CE2 3.61Å; A439-Y445 HydrophobicContact CB-CG 3.77Å
440	E	95.1	Very high	96.8	Very high	105 Å²	105	50.5 Å²	50.5	49%	0.491	28%	0.279	S	S	.	.			trans	-119.8	-51.2	-177.2	-66.9	-178.1	-170.3	0	0	112	N418	N418-E440 HydrophobicContact CB-CG 3.5Å; N418-E440 PolarHBondContact ND2-OE1 2.84Å
441	S	97	Very high	96.9	Very high	49 Å²	49	52.7 Å²	52.7	34%	0.343	29%	0.289	S	S	.	.	S	Bend	trans	-103	163.7	-174.3	73.8	0	0	0	0	113.5	E443 D444 Y445	S441-E443 PolarHBondContact O-N 2.97Å; S441-E443 VanDerWaalsContact O-N 3.13Å; S441-E443 PolarHBondContact OG-N 3.33Å; S441-D444 WeakPolarHBondContact CB-OD2 3.36Å; S441-D444 PolarHBondContact N-OD2 2.83Å; S441-D444 PolarHBondContact O-N 3.38Å; S441-D444 VanDerWaalsContact O-N 3.14Å; S441-D444 PolarHBondContact OG-N 3.26Å; S441-D444 PolarHBondContact OG-OD1 3.45Å; S441-D444 PolarHBondContact OG-OD2 3.49Å; S441-Y445 VanDerWaalsContact O-CD2 3.3Å; S441-Y445 WeakPolarHBondContact O-CD2 3.26Å; S441-Y445 PolarHBondContact O-N 3.39Å
442	E	97.1	Very high	97	Very high	69 Å²	69	44 Å²	44	32%	0.322	25%	0.248	S	C	.	.	H	α-helix	trans	-49.9	-37.4	172.8	-75.5	177.3	-159.3	0	0	112.7	L317 R320 A321 K324 A446	L317-E442 HydrophobicContact CD1-CB 4.09Å; L317-E442 HydrophobicContact CD1-CG 3.32Å; R320-E442 HydrophobicContact CB-CG 4.03Å; R320-E442 WeakPolarHBondContact CD-OE1 3.45Å; A321-E442 WeakPolarHBondContact CB-O 3.26Å; K324-E442 HydrophobicContact CD-CB 3.91Å; K324-E442 WeakPolarHBondContact CE-OE2 3.16Å; E442-A446 WeakPolarHBondContact O-CB 3.28Å; E442-A446 PolarHBondContact O-N 2.93Å; E442-A446 VanDerWaalsContact O-N 3.15Å
443	E	96.8	Very high	96.9	Very high	57 Å²	57	41.3 Å²	41.3	27%	0.266	22%	0.217	S	C	.	.	H	α-helix	trans	-70.7	-49.4	179.8	-161.1	61.6	-145	0	0	111.3	K324 K328 S441 Y445 A446 E447	K324-E443 IonicContact NZ-OE2 2.65Å; K324-E443 PolarHBondContact NZ-OE2 2.93Å; K328-E443 WeakPolarHBondContact CE-OE1 3.26Å; K328-E443 IonicContact NZ-OE1 2.72Å; K328-E443 PolarHBondContact NZ-OE1 3.49Å; S441-E443 PolarHBondContact O-N 2.97Å; S441-E443 VanDerWaalsContact O-N 3.13Å; S441-E443 PolarHBondContact OG-N 3.33Å; E443-Y445 VanDerWaalsContact C-N 3.28Å; E443-Y445 PolarHBondContact O-N 3.22Å; E443-A446 PolarHBondContact O-N 3.37Å; E443-A446 VanDerWaalsContact O-N 3.08Å; E443-E447 WeakPolarHBondContact O-CG 3.33Å; E443-E447 PolarHBondContact O-N 3.26Å
444	D	97.5	Very high	96.7	Very high	62 Å²	62	42.6 Å²	42.6	33%	0.332	23%	0.231	S	C	.	.	H	α-helix	trans	-59.8	-40.9	179.4	-53.9	-36.5	0	0	0	111.2	A439 S441 T448	A439-D444 HydrophobicContact CB-CB 3.89Å; S441-D444 WeakPolarHBondContact CB-OD2 3.36Å; S441-D444 PolarHBondContact N-OD2 2.83Å; S441-D444 PolarHBondContact O-N 3.38Å; S441-D444 VanDerWaalsContact O-N 3.14Å; S441-D444 PolarHBondContact OG-N 3.26Å; S441-D444 PolarHBondContact OG-OD1 3.45Å; S441-D444 PolarHBondContact OG-OD2 3.49Å; D444-T448 WeakPolarHBondContact O-CB 3.47Å; D444-T448 PolarHBondContact O-N 3.29Å; D444-T448 PolarHBondContact O-OG1 2.86Å
445	Y	98.5	Very high	96.5	Very high	1 Å²	1	39.8 Å²	39.8	0%	0.004	22%	0.216	C	C	.	.	H	α-helix	trans	-62.1	-48.4	174.7	-88.3	-87.2	0	0	0	111.1	L317 A321 L392 H393 T394 L415 A416 H417 A439 S441 E443 E447 T448 I449	L317-Y445 HydrophobicContact CD2-CD2 4.24Å; L317-Y445 HydrophobicContact CD2-CE2 3.9Å; L317-Y445 HydrophobicContact CG-CD2 4.4Å; L317-Y445 HydrophobicContact CG-CE2 4.47Å; A321-Y445 HydrophobicContact CB-CG 4.48Å; L392-Y445 HydrophobicContact CD2-CD1 4.42Å; H393-Y445 PolarHBondContact O-OH 2.78Å; T394-Y445 HydrophobicContact CG2-CD1 4.46Å; T394-Y445 HydrophobicContact CG2-CE1 3.78Å; T394-Y445 HydrophobicContact CG2-CE2 4.16Å; L415-Y445 HydrophobicContact CD1-CD1 4.42Å; L415-Y445 HydrophobicContact CD1-CE1 4.37Å; L415-Y445 HydrophobicContact CD2-CD1 3.63Å; L415-Y445 HydrophobicContact CD2-CE1 4.19Å; L415-Y445 HydrophobicContact CD2-CG 4.49Å; L415-Y445 HydrophobicContact CG-CD1 3.74Å; L415-Y445 HydrophobicContact CG-CE1 3.77Å; A416-Y445 VanDerWaalsContact C-OH 3.23Å; A416-Y445 PolarHBondContact O-OH 3.32Å; H417-Y445 WeakPolarHBondContact CA-OH 3.43Å; H417-Y445 PolarHBondContact N-OH 3.07Å; A439-Y445 HydrophobicContact CB-CD1 4.09Å; A439-Y445 HydrophobicContact CB-CD2 3.54Å; A439-Y445 HydrophobicContact CB-CE1 4.17Å; A439-Y445 HydrophobicContact CB-CE2 3.61Å; A439-Y445 HydrophobicContact CB-CG 3.77Å; S441-Y445 VanDerWaalsContact O-CD2 3.3Å; S441-Y445 WeakPolarHBondContact O-CD2 3.26Å; S441-Y445 PolarHBondContact O-N 3.39Å; E443-Y445 VanDerWaalsContact C-N 3.28Å; E443-Y445 PolarHBondContact O-N 3.22Å; Y445-E447 PolarHBondContact O-N 3.42Å; Y445-T448 PolarHBondContact O-N 3.22Å; Y445-I449 WeakPolarHBondContact O-CB 3.44Å; Y445-I449 WeakPolarHBondContact O-CD1 3.22Å; Y445-I449 WeakPolarHBondContact O-CG1 3.49Å; Y445-I449 PolarHBondContact O-N 2.88Å
446	A	97.4	Very high	96.2	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.008	24%	0.235	C	C	.	.	H	α-helix	trans	-60.9	-44.1	-179.5	0	0	0	0	0	111.9	A321 K324 L325 E442 E443 A450	A321-A446 WeakPolarHBondContact O-CB 3.47Å; K324-A446 HydrophobicContact CB-CB 4Å; L325-A446 HydrophobicContact CB-CB 4.34Å; E442-A446 WeakPolarHBondContact O-CB 3.28Å; E442-A446 PolarHBondContact O-N 2.93Å; E442-A446 VanDerWaalsContact O-N 3.15Å; E443-A446 PolarHBondContact O-N 3.37Å; E443-A446 VanDerWaalsContact O-N 3.08Å; A446-A450 WeakPolarHBondContact O-CB 3.11Å; A446-A450 PolarHBondContact O-N 3.39Å
447	E	96.6	Very high	95.8	Very high	99 Å²	99	44.4 Å²	44.4	46%	0.463	25%	0.25	S	S	.	.	H	α-helix	trans	-67.8	-43	178.7	-69.2	-174.2	168.8	0	0	112.3	K328 E443 Y445 A450 H451	K328-E447 IonicContact NZ-OE1 3.63Å; K328-E447 PolarHBondContact NZ-OE1 3.1Å; K328-E447 VanDerWaalsContact NZ-OE1 3.1Å; E443-E447 WeakPolarHBondContact O-CG 3.33Å; E443-E447 PolarHBondContact O-N 3.26Å; Y445-E447 PolarHBondContact O-N 3.42Å; E447-A450 WeakPolarHBondContact O-CB 3.49Å; E447-A450 PolarHBondContact O-N 2.88Å; E447-H451 WeakPolarHBondContact O-CB 3.22Å; E447-H451 PolarHBondContact O-N 3.4Å
448	T	98.2	Very high	95.5	Very high	25 Å²	25	49.1 Å²	49.1	15%	0.153	27%	0.273	C	S	.	.	H	α-helix	trans	-67.8	-38.2	178.8	-54.9	0	0	0	0	111.3	L415 F437 D444 Y445 H451 I452	L415-T448 HydrophobicContact CD1-CG2 3.61Å; L415-T448 HydrophobicContact CD2-CG2 4.08Å; L415-T448 HydrophobicContact CG-CG2 4.45Å; F437-T448 HydrophobicContact CB-CG2 3.63Å; F437-T448 HydrophobicContact CD1-CG2 4.1Å; F437-T448 HydrophobicContact CG-CG2 3.93Å; D444-T448 WeakPolarHBondContact O-CB 3.47Å; D444-T448 PolarHBondContact O-N 3.29Å; D444-T448 PolarHBondContact O-OG1 2.86Å; Y445-T448 PolarHBondContact O-N 3.22Å; T448-H451 WeakPolarHBondContact O-CB 3.36Å; T448-H451 PolarHBondContact O-N 2.87Å; T448-I452 HydrophobicContact CG2-CD1 4.09Å; T448-I452 VanDerWaalsContact O-CG1 3.26Å; T448-I452 WeakPolarHBondContact O-CG1 3.35Å; T448-I452 PolarHBondContact O-N 3.49Å
449	I	97.3	Very high	95.4	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.005	28%	0.278	C	S	.	.	H	α-helix	trans	-60.3	-49.2	171	-66.4	161	0	0	0	109.7	L303 L325 I390 L392 L415 Y445 H451 I452 L453	L303-I449 HydrophobicContact CD2-CD1 4Å; L303-I449 HydrophobicContact CD2-CG1 4.37Å; L303-I449 HydrophobicContact CD2-CG2 3.93Å; L325-I449 HydrophobicContact CD1-CG2 4.47Å; L325-I449 HydrophobicContact CD2-CB 4.06Å; L325-I449 HydrophobicContact CD2-CG2 3.31Å; L325-I449 HydrophobicContact CG-CG2 4.49Å; I390-I449 HydrophobicContact CD1-CB 4.49Å; I390-I449 HydrophobicContact CD1-CG2 3.89Å; L392-I449 HydrophobicContact CD2-CD1 4.15Å; L392-I449 HydrophobicContact CD2-CG1 4.3Å; L415-I449 HydrophobicContact CD2-CD1 4.36Å; L415-I449 HydrophobicContact CD2-CG1 3.58Å; Y445-I449 WeakPolarHBondContact O-CB 3.44Å; Y445-I449 WeakPolarHBondContact O-CD1 3.22Å; Y445-I449 WeakPolarHBondContact O-CG1 3.49Å; Y445-I449 PolarHBondContact O-N 2.88Å; I449-H451 VanDerWaalsContact C-N 3.26Å; I449-H451 PolarHBondContact O-N 3.2Å; I449-I452 PolarHBondContact O-N 3.38Å; I449-L453 HydrophobicContact CG2-CD1 3.81Å; I449-L453 HydrophobicContact CG2-CG 4.11Å; I449-L453 WeakPolarHBondContact O-CB 3.45Å; I449-L453 VanDerWaalsContact O-CG 3.23Å; I449-L453 WeakPolarHBondContact O-CG 3.33Å; I449-L453 PolarHBondContact O-N 3.27Å
450	A	95	Very high	95.2	Very high	34 Å²	34	52.5 Å²	52.5	28%	0.281	28%	0.283	S	S	.	.	H	α-helix	trans	-57.1	-42	178.7	0	0	0	0	0	111.9	L325 A446 E447 L453 S454	L325-A450 HydrophobicContact CD1-CB 3.73Å; A446-A450 WeakPolarHBondContact O-CB 3.11Å; A446-A450 PolarHBondContact O-N 3.39Å; E447-A450 WeakPolarHBondContact O-CB 3.49Å; E447-A450 PolarHBondContact O-N 2.88Å; A450-L453 PolarHBondContact O-N 2.95Å; A450-S454 PolarHBondContact O-N 2.96Å; A450-S454 PolarHBondContact O-OG 2.95Å
451	H	95.9	Very high	95.1	Very high	97 Å²	97	48.7 Å²	48.7	45%	0.449	27%	0.266	S	S	.	.	H	α-helix	trans	-61.4	-49.5	175.7	178.9	57.3	0	0	0	112.4	E447 T448 I449 L453 S454 M455	E447-H451 WeakPolarHBondContact O-CB 3.22Å; E447-H451 PolarHBondContact O-N 3.4Å; T448-H451 WeakPolarHBondContact O-CB 3.36Å; T448-H451 PolarHBondContact O-N 2.87Å; I449-H451 VanDerWaalsContact C-N 3.26Å; I449-H451 PolarHBondContact O-N 3.2Å; H451-L453 VanDerWaalsContact C-N 3.26Å; H451-L453 PolarHBondContact O-N 3.46Å; H451-S454 PolarHBondContact O-N 3.21Å; H451-S454 PolarHBondContact O-OG 2.9Å; H451-M455 VanDerWaalsContact CD2-CE 3.43Å; H451-M455 WeakPolarHBondContact CD2-CE 3.28Å; H451-M455 WeakPolarHBondContact NE2-CE 3.33Å; H451-M455 WeakPolarHBondContact O-CG 3.45Å; H451-M455 PolarHBondContact O-N 3.14Å
452	I	95.8	Very high	95	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-61.1	-38.6	177.5	-63.8	161.1	0	0	0	110.9	I390 I413 L415 F437 T448 I449 S454 M455 R460	I390-I452 HydrophobicContact CD1-CB 3.89Å; I390-I452 HydrophobicContact CD1-CD1 4.14Å; I390-I452 HydrophobicContact CD1-CG2 3.74Å; I390-I452 HydrophobicContact CG1-CB 4.37Å; I390-I452 HydrophobicContact CG1-CD1 4.34Å; I390-I452 HydrophobicContact CG1-CG2 3.72Å; I413-I452 HydrophobicContact CB-CG2 4.31Å; I413-I452 HydrophobicContact CD1-CG2 3.8Å; I413-I452 HydrophobicContact CG2-CD1 4.03Å; I413-I452 HydrophobicContact CG2-CG1 4.33Å; I413-I452 HydrophobicContact CG2-CG2 4.08Å; L415-I452 HydrophobicContact CB-CD1 4.37Å; F437-I452 HydrophobicContact CB-CD1 4.47Å; F437-I452 HydrophobicContact CD2-CD1 3.59Å; F437-I452 HydrophobicContact CD2-CG1 3.69Å; F437-I452 HydrophobicContact CE2-CD1 4.1Å; F437-I452 HydrophobicContact CE2-CG1 3.69Å; F437-I452 HydrophobicContact CG-CD1 4.14Å; F437-I452 HydrophobicContact CG-CG1 4.34Å; F437-I452 HydrophobicContact CZ-CG1 4.32Å; T448-I452 HydrophobicContact CG2-CD1 4.09Å; T448-I452 VanDerWaalsContact O-CG1 3.26Å; T448-I452 WeakPolarHBondContact O-CG1 3.35Å; T448-I452 PolarHBondContact O-N 3.49Å; I449-I452 PolarHBondContact O-N 3.38Å; I452-S454 VanDerWaalsContact C-N 3.34Å; I452-M455 PolarHBondContact O-N 3.41Å; I452-R460 WeakPolarHBondContact O-CD 3.48Å; I452-R460 PolarHBondContact O-NH1 3.39Å
453	L	92.6	Very high	95.1	Very high	14 Å²	14	46.9 Å²	46.9	7%	0.073	25%	0.253	C	S	.	.	H	α-helix	trans	-69.4	-30.1	179.3	-66.6	-178	0	0	0	112.9	H301 L325 L337 T389 I390 I449 A450 H451 R460	H301-L453 HydrophobicContact CB-CD2 3.67Å; H301-L453 VanDerWaalsContact CG-CD2 3.41Å; L325-L453 HydrophobicContact CD2-CD1 4.36Å; L337-L453 HydrophobicContact CD1-CD1 3.91Å; L337-L453 HydrophobicContact CD2-CD1 4.25Å; T389-L453 HydrophobicContact CG2-CD2 4.46Å; I390-L453 HydrophobicContact CD1-CD2 4.04Å; I390-L453 HydrophobicContact CD1-CG 4.26Å; I449-L453 HydrophobicContact CG2-CD1 3.81Å; I449-L453 HydrophobicContact CG2-CG 4.11Å; I449-L453 WeakPolarHBondContact O-CB 3.45Å; I449-L453 VanDerWaalsContact O-CG 3.23Å; I449-L453 WeakPolarHBondContact O-CG 3.33Å; I449-L453 PolarHBondContact O-N 3.27Å; A450-L453 PolarHBondContact O-N 2.95Å; H451-L453 VanDerWaalsContact C-N 3.26Å; H451-L453 PolarHBondContact O-N 3.46Å; L453-R460 PolarHBondContact O-NH1 3.24Å
454	S	91.6	Very high	95	Very high	95 Å²	95	46 Å²	46	66%	0.664	25%	0.247	S	C	*	.	H	α-helix	trans	-81.7	-13.7	178.1	70	0	0	0	0	114.2	A450 H451 I452	A450-S454 PolarHBondContact O-N 2.96Å; A450-S454 PolarHBondContact O-OG 2.95Å; H451-S454 PolarHBondContact O-N 3.21Å; H451-S454 PolarHBondContact O-OG 2.9Å; I452-S454 VanDerWaalsContact C-N 3.34Å
455	M	93.1	Very high	95	Very high	27 Å²	27	48.5 Å²	48.5	13%	0.133	26%	0.255	C	S	.	.	S	Bend	trans	-62.7	149.4	174.3	-67.8	-174.6	-177.8	0	0	112.7	F437 H451 I452 K459 R460 I463	F437-M455 HydrophobicContact CE1-CE 4.16Å; F437-M455 HydrophobicContact CE2-CE 4.35Å; F437-M455 HydrophobicContact CZ-CE 3.52Å; F437-M455 HydrophobicContact CZ-SD 4.42Å; H451-M455 VanDerWaalsContact CD2-CE 3.43Å; H451-M455 WeakPolarHBondContact CD2-CE 3.28Å; H451-M455 WeakPolarHBondContact NE2-CE 3.33Å; H451-M455 WeakPolarHBondContact O-CG 3.45Å; H451-M455 PolarHBondContact O-N 3.14Å; I452-M455 PolarHBondContact O-N 3.41Å; M455-K459 HydrophobicContact CB-CB 4.48Å; M455-K459 HydrophobicContact SD-CG 4.1Å; M455-R460 HydrophobicContact CB-CG 3.82Å; M455-R460 VanDerWaalsContact O-CZ 3.23Å; M455-R460 PolarHBondContact O-NH1 3.22Å; M455-R460 PolarHBondContact O-NH2 3.31Å; M455-I463 HydrophobicContact CE-CD1 4.4Å; M455-I463 HydrophobicContact SD-CD1 3.85Å
456	S	91.6	Very high	94.9	Very high	59 Å²	59	49 Å²	49	41%	0.413	26%	0.258	S	S	.	.			trans	-61.9	156.6	170.7	91.7	0	0	0	0	111.4	E458 K459 R460	S456-E458 WeakPolarHBondContact CB-OE2 3.47Å; S456-E458 PolarHBondContact O-N 3.32Å; S456-E458 PolarHBondContact OG-N 2.97Å; S456-E458 PolarHBondContact OG-OE2 3.43Å; S456-K459 PolarHBondContact O-N 2.92Å; S456-K459 PolarHBondContact OG-N 3.42Å; S456-K459 VanDerWaalsContact OG-N 3.15Å; S456-R460 PolarHBondContact O-N 3.14Å; S456-R460 VanDerWaalsContact O-N 3.09Å
457	A	89.8	Confident	94.9	Very high	50 Å²	50	49 Å²	49	41%	0.413	26%	0.258	S	S	.	.	H	α-helix	trans	-60.1	-37	177.3	0	0	0	0	0	111.6	R460 L461	A457-R460 PolarHBondContact O-N 2.99Å; A457-L461 WeakPolarHBondContact O-CB 3.42Å; A457-L461 PolarHBondContact O-N 3.48Å
458	E	92.6	Very high	94.9	Very high	130 Å²	130	46 Å²	46	61%	0.607	24%	0.243	S	C	*	.	H	α-helix	trans	-65	-45.6	178.9	-56.3	70.7	-150.3	0	0	110.9	S456 R460 L461 Q462	S456-E458 WeakPolarHBondContact CB-OE2 3.47Å; S456-E458 PolarHBondContact O-N 3.32Å; S456-E458 PolarHBondContact OG-N 2.97Å; S456-E458 PolarHBondContact OG-OE2 3.43Å; E458-R460 PolarHBondContact O-N 3.06Å; E458-L461 PolarHBondContact O-N 3.41Å; E458-Q462 PolarHBondContact O-N 3.44Å
459	K	94.8	Very high	94.8	Very high	87 Å²	87	47.2 Å²	47.2	38%	0.378	26%	0.255	S	S	.	.	H	α-helix	trans	-65.9	-42	179.2	-172.3	64.3	-174.9	174	0	111.5	M455 S456 L461 Q462 I463	M455-K459 HydrophobicContact CB-CB 4.48Å; M455-K459 HydrophobicContact SD-CG 4.1Å; S456-K459 PolarHBondContact O-N 2.92Å; S456-K459 PolarHBondContact OG-N 3.42Å; S456-K459 VanDerWaalsContact OG-N 3.15Å; K459-L461 VanDerWaalsContact C-N 3.32Å; K459-L461 PolarHBondContact O-N 3.32Å; K459-Q462 WeakPolarHBondContact O-CB 3.39Å; K459-Q462 PolarHBondContact O-N 3.24Å; K459-I463 WeakPolarHBondContact O-CG1 3.38Å; K459-I463 PolarHBondContact O-N 2.96Å; K459-I463 VanDerWaalsContact O-N 3.15Å
460	R	94.6	Very high	94.7	Very high	40 Å²	40	47.1 Å²	47.1	15%	0.151	25%	0.254	C	S	.	.	H	α-helix	trans	-59.9	-43.8	173.2	-73.5	-169.4	-72.9	-131.4	0.8	111.6	H301 I413 I452 L453 M455 S456 A457 E458 Q462 I463 R464	H301-R460 PolarHBondContact CE1-NH1 2.79Å; H301-R460 VanDerWaalsContact CE1-NH1 3.3Å; I413-R460 HydrophobicContact CD1-CB 3.65Å; I413-R460 HydrophobicContact CD1-CG 3.57Å; I452-R460 WeakPolarHBondContact O-CD 3.48Å; I452-R460 PolarHBondContact O-NH1 3.39Å; L453-R460 PolarHBondContact O-NH1 3.24Å; M455-R460 HydrophobicContact CB-CG 3.82Å; M455-R460 VanDerWaalsContact O-CZ 3.23Å; M455-R460 PolarHBondContact O-NH1 3.22Å; M455-R460 PolarHBondContact O-NH2 3.31Å; S456-R460 PolarHBondContact O-N 3.14Å; S456-R460 VanDerWaalsContact O-N 3.09Å; A457-R460 PolarHBondContact O-N 2.99Å; E458-R460 PolarHBondContact O-N 3.06Å; R460-Q462 VanDerWaalsContact C-N 3.34Å; R460-Q462 PolarHBondContact O-N 3.14Å; R460-I463 PolarHBondContact O-N 2.96Å; R460-R464 WeakPolarHBondContact O-CD 3.47Å; R460-R464 WeakPolarHBondContact O-CG 3.32Å; R460-R464 PolarHBondContact O-N 2.93Å
461	L	94.1	Very high	94.8	Very high	26 Å²	26	45.5 Å²	45.5	14%	0.136	24%	0.241	C	C	.	.	H	α-helix	trans	-62.8	-39.1	177.4	-176.4	61.7	0	0	0	112.1	L292 E294 A457 E458 K459 R464 K465	L292-L461 HydrophobicContact CB-CD1 4.46Å; L292-L461 HydrophobicContact CD1-CD1 4.42Å; E294-L461 HydrophobicContact CG-CD2 4.26Å; A457-L461 WeakPolarHBondContact O-CB 3.42Å; A457-L461 PolarHBondContact O-N 3.48Å; E458-L461 PolarHBondContact O-N 3.41Å; K459-L461 VanDerWaalsContact C-N 3.32Å; K459-L461 PolarHBondContact O-N 3.32Å; L461-R464 PolarHBondContact O-N 2.89Å; L461-K465 HydrophobicContact CD1-CG 4.44Å; L461-K465 HydrophobicContact CG-CD 4.33Å; L461-K465 WeakPolarHBondContact O-CB 3.35Å; L461-K465 WeakPolarHBondContact O-CG 3.36Å; L461-K465 PolarHBondContact O-N 2.88Å
462	Q	95.3	Very high	94.8	Very high	76 Å²	76	44.4 Å²	44.4	36%	0.355	24%	0.244	S	C	.	.	H	α-helix	trans	-59.1	-49.1	174.6	-171.5	-170.4	0.8	0	0	111.2	D433 E458 K459 R460 R464 K465 S466	D433-Q462 PolarHBondContact OD1-NE2 3Å; D433-Q462 PolarHBondContact OD2-NE2 2.99Å; E458-Q462 PolarHBondContact O-N 3.44Å; K459-Q462 WeakPolarHBondContact O-CB 3.39Å; K459-Q462 PolarHBondContact O-N 3.24Å; R460-Q462 VanDerWaalsContact C-N 3.34Å; R460-Q462 PolarHBondContact O-N 3.14Å; Q462-R464 VanDerWaalsContact C-N 3.35Å; Q462-R464 PolarHBondContact O-N 3.44Å; Q462-K465 PolarHBondContact O-N 2.97Å; Q462-S466 PolarHBondContact O-N 2.97Å
463	I	97.3	Very high	94.8	Very high	4 Å²	4	47.7 Å²	47.7	2%	0.021	26%	0.257	C	S	.	.	H	α-helix	trans	-60.8	-44.8	178.4	-64.2	169.7	0	0	0	110.5	I413 F437 M455 K459 R460 K465 S466 A467	I413-I463 HydrophobicContact CG1-CG2 4.27Å; I413-I463 HydrophobicContact CG2-CG2 4.24Å; F437-I463 HydrophobicContact CE2-CD1 3.91Å; F437-I463 HydrophobicContact CZ-CD1 3.86Å; M455-I463 HydrophobicContact CE-CD1 4.4Å; M455-I463 HydrophobicContact SD-CD1 3.85Å; K459-I463 WeakPolarHBondContact O-CG1 3.38Å; K459-I463 PolarHBondContact O-N 2.96Å; K459-I463 VanDerWaalsContact O-N 3.15Å; R460-I463 PolarHBondContact O-N 2.96Å; I463-K465 VanDerWaalsContact C-N 3.34Å; I463-K465 PolarHBondContact O-N 3.31Å; I463-S466 PolarHBondContact O-N 2.89Å; I463-A467 WeakPolarHBondContact O-CB 3.44Å; I463-A467 PolarHBondContact O-N 2.89Å
464	R	96.4	Very high	95	Very high	37 Å²	37	47.1 Å²	47.1	14%	0.14	25%	0.253	C	S	.	.	H	α-helix	trans	-59.1	-42.3	176.5	-66.7	164.8	73.6	-173.8	13	112	L292 H293 G411 I413 R460 L461 Q462 R468	L292-R464 HydrophobicContact CD2-CB 4.18Å; H293-R464 PolarHBondContact O-NH1 3.25Å; G411-R464 WeakPolarHBondContact O-CG 3.39Å; G411-R464 VanDerWaalsContact O-CZ 3.31Å; G411-R464 PolarHBondContact O-NE 3.3Å; G411-R464 PolarHBondContact O-NH2 3.2Å; G411-R464 VanDerWaalsContact O-NH2 3.14Å; I413-R464 HydrophobicContact CD1-CG 4.48Å; I413-R464 HydrophobicContact CG1-CG 3.79Å; R460-R464 WeakPolarHBondContact O-CD 3.47Å; R460-R464 WeakPolarHBondContact O-CG 3.32Å; R460-R464 PolarHBondContact O-N 2.93Å; L461-R464 PolarHBondContact O-N 2.89Å; Q462-R464 VanDerWaalsContact C-N 3.35Å; Q462-R464 PolarHBondContact O-N 3.44Å; R464-R468 WeakPolarHBondContact O-CG 3.45Å; R464-R468 PolarHBondContact O-N 3.42Å
465	K	95.9	Very high	95.2	Very high	116 Å²	116	43.2 Å²	43.2	50%	0.504	23%	0.226	S	C	.	.	H	α-helix	trans	-65.7	-46.1	177.9	-75.9	178.2	178.4	179.7	0	111.6	L292 L461 Q462 I463 R468 A469	L292-K465 HydrophobicContact CD1-CG 3.99Å; L461-K465 HydrophobicContact CD1-CG 4.44Å; L461-K465 HydrophobicContact CG-CD 4.33Å; L461-K465 WeakPolarHBondContact O-CB 3.35Å; L461-K465 WeakPolarHBondContact O-CG 3.36Å; L461-K465 PolarHBondContact O-N 2.88Å; Q462-K465 PolarHBondContact O-N 2.97Å; I463-K465 VanDerWaalsContact C-N 3.34Å; I463-K465 PolarHBondContact O-N 3.31Å; K465-R468 PolarHBondContact O-N 2.84Å; K465-A469 PolarHBondContact O-N 2.87Å
466	S	97.1	Very high	95.2	Very high	11 Å²	11	43 Å²	43	8%	0.077	23%	0.226	C	C	.	.	H	α-helix	trans	-61.2	-45	176.2	179.1	0	0	0	0	111.4	D433 Q462 I463 R468 A469 S470	D433-S466 WeakPolarHBondContact CB-OG 3.38Å; Q462-S466 PolarHBondContact O-N 2.97Å; I463-S466 PolarHBondContact O-N 2.89Å; S466-R468 PolarHBondContact O-N 3.32Å; S466-A469 PolarHBondContact O-N 3.37Å; S466-S470 PolarHBondContact O-N 3.49Å
467	A	97.3	Very high	95.4	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-55.1	-50.6	174.2	0	0	0	0	0	112	M408 T435 I463 A469 S470 V471	M408-A467 HydrophobicContact CB-CB 4.23Å; M408-A467 HydrophobicContact CE-CB 3.71Å; M408-A467 HydrophobicContact CG-CB 4.33Å; T435-A467 VanDerWaalsContact O-CB 3.31Å; T435-A467 WeakPolarHBondContact O-CB 3.47Å; I463-A467 WeakPolarHBondContact O-CB 3.44Å; I463-A467 PolarHBondContact O-N 2.89Å; A467-A469 PolarHBondContact O-N 3.25Å; A467-S470 WeakPolarHBondContact O-CB 3.47Å; A467-S470 PolarHBondContact O-N 2.93Å; A467-S470 VanDerWaalsContact O-N 3.15Å; A467-S470 PolarHBondContact O-OG 3.42Å; A467-V471 WeakPolarHBondContact O-CG1 3.5Å; A467-V471 PolarHBondContact O-N 3.45Å
468	R	96.3	Very high	95.8	Very high	38 Å²	38	47.8 Å²	47.8	14%	0.143	23%	0.233	C	C	.	.	H	α-helix	trans	-63.1	-38	177.8	-72.9	-176.2	114.8	-171.6	19	113.5	F287 L288 I290 M408 A409 R464 K465 S466 S470 V471	F287-R468 PolarHBondContact O-NH2 3.1Å; L288-R468 HydrophobicContact CD2-CB 3.9Å; L288-R468 HydrophobicContact CD2-CG 4.03Å; L288-R468 VanDerWaalsContact O-CZ 3.32Å; L288-R468 PolarHBondContact O-NH1 3.06Å; L288-R468 PolarHBondContact O-NH2 3.36Å; I290-R468 PolarHBondContact O-NH1 3.17Å; I290-R468 PolarHBondContact O-NH2 3.37Å; M408-R468 WeakPolarHBondContact O-CG 3.39Å; A409-R468 PolarHBondContact O-NE 2.87Å; A409-R468 PolarHBondContact O-NH2 3.36Å; R464-R468 WeakPolarHBondContact O-CG 3.45Å; R464-R468 PolarHBondContact O-N 3.42Å; K465-R468 PolarHBondContact O-N 2.84Å; S466-R468 PolarHBondContact O-N 3.32Å; R468-S470 PolarHBondContact O-N 2.81Å; R468-V471 VanDerWaalsContact O-CG2 3.31Å; R468-V471 WeakPolarHBondContact O-CG2 3.39Å; R468-V471 PolarHBondContact O-N 3.47Å
469	A	96.2	Very high	96	Very high	49 Å²	49	41.8 Å²	41.8	41%	0.405	21%	0.205	S	C	.	.	H	α-helix	trans	-62.7	-35.8	175.5	0	0	0	0	0	111.3	K465 S466 A467 V471 S472	K465-A469 PolarHBondContact O-N 2.87Å; S466-A469 PolarHBondContact O-N 3.37Å; A467-A469 PolarHBondContact O-N 3.25Å; A469-V471 PolarHBondContact O-N 3.5Å; A469-S472 PolarHBondContact O-OG 2.93Å
470	S	96.8	Very high	96.2	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-73.2	-18.6	-177.1	83.6	0	0	0	0	115.9	M408 S466 A467 R468 R473	M408-S470 WeakPolarHBondContact CE-OG 3.25Å; S466-S470 PolarHBondContact O-N 3.49Å; A467-S470 WeakPolarHBondContact O-CB 3.47Å; A467-S470 PolarHBondContact O-N 2.93Å; A467-S470 VanDerWaalsContact O-N 3.15Å; A467-S470 PolarHBondContact O-OG 3.42Å; R468-S470 PolarHBondContact O-N 2.81Å; S470-R473 WeakPolarHBondContact O-CD 3.4Å; S470-R473 WeakPolarHBondContact O-CG 3.32Å; S470-R473 PolarHBondContact O-NE 3.41Å
471	V	97.1	Very high	96.3	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-82.2	-13.6	-169.6	-60.7	0	0	0	0	114.3	V284 L288 V405 M408 A409 A467 R468 A469 R473 F474	V284-V471 HydrophobicContact CB-CG2 4.05Å; V284-V471 HydrophobicContact CG1-CB 4.04Å; V284-V471 HydrophobicContact CG1-CG2 4.01Å; L288-V471 HydrophobicContact CD1-CG2 4.39Å; L288-V471 HydrophobicContact CD2-CG2 4.27Å; V405-V471 HydrophobicContact CG1-CB 3.96Å; V405-V471 HydrophobicContact CG1-CG1 3.94Å; M408-V471 HydrophobicContact CB-CG1 3.69Å; M408-V471 HydrophobicContact CE-CG1 4.45Å; A409-V471 HydrophobicContact CB-CG2 3.99Å; A467-V471 WeakPolarHBondContact O-CG1 3.5Å; A467-V471 PolarHBondContact O-N 3.45Å; R468-V471 VanDerWaalsContact O-CG2 3.31Å; R468-V471 WeakPolarHBondContact O-CG2 3.39Å; R468-V471 PolarHBondContact O-N 3.47Å; A469-V471 PolarHBondContact O-N 3.5Å; V471-R473 PolarHBondContact O-N 3.36Å; V471-R473 VanDerWaalsContact O-N 3.16Å; V471-F474 WeakPolarHBondContact O-CB 3.39Å; V471-F474 PolarHBondContact O-N 3.42Å
472	S	94.4	Very high	96.5	Very high	73 Å²	73	42.6 Å²	42.6	51%	0.51	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-56.6	-32.1	-178	56.1	0	0	0	0	113.3	A469 F474 S475	A469-S472 PolarHBondContact O-OG 2.93Å; S472-F474 PolarHBondContact O-N 2.83Å; S472-F474 VanDerWaalsContact O-N 3.13Å; S472-S475 WeakPolarHBondContact O-CB 3.47Å; S472-S475 PolarHBondContact O-N 3.32Å; S472-S475 PolarHBondContact O-OG 3.35Å
473	R	95.4	Very high	96.7	Very high	70 Å²	70	39 Å²	39	26%	0.264	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-65.3	-7.3	173.9	70.8	-167.6	165.3	128.6	2.2	115.1	D425 I426 S470 V471 E478	D425-R473 PolarHBondContact O-NH1 2.97Å; D425-R473 PolarHBondContact O-NH2 3.25Å; I426-R473 PolarHBondContact O-NH2 2.83Å; I426-R473 VanDerWaalsContact O-NH2 3.16Å; S470-R473 WeakPolarHBondContact O-CD 3.4Å; S470-R473 WeakPolarHBondContact O-CG 3.32Å; S470-R473 PolarHBondContact O-NE 3.41Å; V471-R473 PolarHBondContact O-N 3.36Å; V471-R473 VanDerWaalsContact O-N 3.16Å; R473-E478 WeakPolarHBondContact O-CG 3.24Å
474	F	97.1	Very high	96.7	Very high	1 Å²	1	40 Å²	40	0%	0.004	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-112.7	8.7	175.9	-51	-54.5	0	0	0	112.2	Y279 C282 F400 V405 I426 V471 S472	Y279-F474 HydrophobicContact CD1-CD1 4.28Å; Y279-F474 AromaticContact CD1-CE1 3.94Å; Y279-F474 HydrophobicContact CD1-CE1 3.94Å; Y279-F474 AromaticContact CD2-CD1 3.85Å; Y279-F474 HydrophobicContact CD2-CD1 3.85Å; Y279-F474 AromaticContact CD2-CE1 3.74Å; Y279-F474 HydrophobicContact CD2-CE1 3.74Å; Y279-F474 HydrophobicContact CE1-CE1 4.17Å; Y279-F474 AromaticContact CE2-CE1 3.98Å; Y279-F474 HydrophobicContact CE2-CE1 3.98Å; Y279-F474 AromaticContact CG-CD1 3.71Å; Y279-F474 HydrophobicContact CG-CD1 3.71Å; Y279-F474 AromaticContact CG-CE1 3.72Å; Y279-F474 HydrophobicContact CG-CE1 3.72Å; C282-F474 HydrophobicContact CB-CB 4.28Å; C282-F474 VanDerWaalsContact CB-O 3.3Å; C282-F474 WeakPolarHBondContact CB-O 3.32Å; C282-F474 PolarHBondContact N-O 3.4Å; F400-F474 AromaticContact CE2-CD1 3.94Å; F400-F474 HydrophobicContact CE2-CD1 3.94Å; F400-F474 AromaticContact CE2-CE1 3.72Å; F400-F474 HydrophobicContact CE2-CE1 3.72Å; F400-F474 HydrophobicContact CE2-CZ 4.33Å; F400-F474 HydrophobicContact CZ-CB 4.45Å; F400-F474 AromaticContact CZ-CD1 3.54Å; F400-F474 HydrophobicContact CZ-CD1 3.54Å; F400-F474 HydrophobicContact CZ-CD2 4.48Å; F400-F474 AromaticContact CZ-CE1 3.75Å; F400-F474 HydrophobicContact CZ-CE1 3.75Å; F400-F474 AromaticContact CZ-CG 3.92Å; F400-F474 HydrophobicContact CZ-CG 3.92Å; F400-F474 HydrophobicContact CZ-CZ 4.3Å; V405-F474 HydrophobicContact CB-CD2 4.41Å; V405-F474 HydrophobicContact CG1-CB 3.98Å; V405-F474 HydrophobicContact CG1-CD2 3.75Å; V405-F474 HydrophobicContact CG1-CG 4.26Å; V405-F474 HydrophobicContact CG2-CD2 3.7Å; V405-F474 HydrophobicContact CG2-CE2 4.09Å; V405-F474 HydrophobicContact CG2-CG 4.18Å; I426-F474 HydrophobicContact CG1-CE2 4.32Å; I426-F474 HydrophobicContact CG1-CZ 4.11Å; V471-F474 WeakPolarHBondContact O-CB 3.39Å; V471-F474 PolarHBondContact O-N 3.42Å; S472-F474 PolarHBondContact O-N 2.83Å; S472-F474 VanDerWaalsContact O-N 3.13Å
475	S	95.9	Very high	96.7	Very high	14 Å²	14	42.3 Å²	42.3	10%	0.098	23%	0.23	C	C	.	.	B	Isolated β-bridge	trans	-66.8	161.4	-179.1	64	0	0	0	0	112.9	S472 Q477 E478 F479	S472-S475 WeakPolarHBondContact O-CB 3.47Å; S472-S475 PolarHBondContact O-N 3.32Å; S472-S475 PolarHBondContact O-OG 3.35Å; S475-Q477 PolarHBondContact O-N 2.86Å; S475-E478 PolarHBondContact O-N 3.22Å; S475-E478 PolarHBondContact OG-N 2.94Å; S475-F479 PolarHBondContact O-N 3.2Å
476	D	94.6	Very high	96.8	Very high	22 Å²	22	37.1 Å²	37.1	12%	0.118	21%	0.208	C	C	.	.	H	α-helix	trans	-54.9	-37.5	171.4	-81.4	20	0	0	0	112.8	R80 R87 P281 E480	R80-D476 IonicContact CZ-OD1 3.02Å; R80-D476 IonicContact CZ-OD2 3.59Å; R80-D476 IonicContact NH2-OD1 2.64Å; R80-D476 PolarHBondContact NH2-OD1 3.16Å; R80-D476 IonicContact NH2-OD2 3.4Å; R80-D476 PolarHBondContact NH2-OD2 3.44Å; R87-D476 IonicContact NH2-OD2 3.74Å; R87-D476 PolarHBondContact NH2-OD2 3.33Å; P281-D476 WeakPolarHBondContact CB-OD1 3.4Å; D476-E480 WeakPolarHBondContact O-CB 3.19Å; D476-E480 PolarHBondContact O-N 3.15Å
477	Q	95.4	Very high	96.8	Very high	131 Å²	131	36.6 Å²	36.6	61%	0.612	21%	0.205	S	C	*	.	H	α-helix	trans	-67.2	-46.3	179.6	-65.9	80.6	-3.1	0	0	110.8	S475 E480 V481	S475-Q477 PolarHBondContact O-N 2.86Å; Q477-E480 PolarHBondContact O-N 3.48Å; Q477-V481 WeakPolarHBondContact O-CG2 3.35Å; Q477-V481 PolarHBondContact O-N 2.86Å
478	E	97.3	Very high	96.7	Very high	79 Å²	79	40.5 Å²	40.5	37%	0.369	22%	0.223	S	C	.	.	H	α-helix	trans	-66	-40.2	178.2	-171	58.2	-148.4	0	0	111.4	R473 S475 E480 V481 T482	R473-E478 WeakPolarHBondContact O-CG 3.24Å; S475-E478 PolarHBondContact O-N 3.22Å; S475-E478 PolarHBondContact OG-N 2.94Å; E478-E480 VanDerWaalsContact C-N 3.35Å; E478-E480 PolarHBondContact O-N 3.37Å; E478-V481 PolarHBondContact O-N 3.24Å; E478-T482 HydrophobicContact CG-CG2 4.44Å; E478-T482 WeakPolarHBondContact O-CB 3.31Å; E478-T482 WeakPolarHBondContact O-CG2 3.33Å; E478-T482 PolarHBondContact O-N 3.25Å; E478-T482 PolarHBondContact O-OG1 2.89Å; E478-T482 VanDerWaalsContact OE1-CG2 3.31Å; E478-T482 WeakPolarHBondContact OE1-CG2 3.49Å
479	F	97.9	Very high	96.5	Very high	4 Å²	4	43.5 Å²	43.5	2%	0.018	24%	0.237	C	C	.	.	H	α-helix	trans	-57.5	-47.6	171.3	172	-99.4	0	0	0	111.4	V81 C84 A85 Y196 V278 Y279 P281 S475 V481 T482 F483	V81-F479 HydrophobicContact CG1-CE2 3.99Å; V81-F479 HydrophobicContact CG1-CZ 3.81Å; C84-F479 HydrophobicContact CB-CD1 3.77Å; C84-F479 HydrophobicContact CB-CE1 3.51Å; C84-F479 HydrophobicContact CB-CZ 4.48Å; A85-F479 HydrophobicContact CB-CE1 4.34Å; A85-F479 HydrophobicContact CB-CZ 4.18Å; Y196-F479 AromaticContact CE2-CE2 3.9Å; Y196-F479 HydrophobicContact CE2-CE2 3.9Å; V278-F479 HydrophobicContact CG1-CD2 3.61Å; V278-F479 HydrophobicContact CG1-CE2 3.64Å; Y279-F479 WeakPolarHBondContact O-CD2 3.47Å; P281-F479 HydrophobicContact CB-CB 3.76Å; P281-F479 HydrophobicContact CB-CD1 3.86Å; P281-F479 HydrophobicContact CB-CD2 4.4Å; P281-F479 HydrophobicContact CB-CG 3.73Å; P281-F479 HydrophobicContact CG-CB 4.45Å; P281-F479 HydrophobicContact CG-CD1 3.88Å; P281-F479 HydrophobicContact CG-CD2 4.21Å; P281-F479 HydrophobicContact CG-CE1 4.14Å; P281-F479 HydrophobicContact CG-CE2 4.41Å; P281-F479 HydrophobicContact CG-CG 3.89Å; P281-F479 HydrophobicContact CG-CZ 4.38Å; S475-F479 PolarHBondContact O-N 3.2Å; F479-V481 PolarHBondContact O-N 2.8Å; F479-T482 PolarHBondContact O-N 2.92Å; F479-T482 PolarHBondContact O-OG1 2.93Å; F479-F483 HydrophobicContact CD2-CB 4.49Å; F479-F483 HydrophobicContact CE1-CB 4.27Å; F479-F483 HydrophobicContact CE1-CG 4.36Å; F479-F483 HydrophobicContact CE2-CB 4.26Å; F479-F483 HydrophobicContact CE2-CD2 4.36Å; F479-F483 HydrophobicContact CZ-CB 4.14Å; F479-F483 AromaticContact CZ-CD2 3.97Å; F479-F483 HydrophobicContact CZ-CD2 3.97Å; F479-F483 HydrophobicContact CZ-CG 4.11Å; F479-F483 WeakPolarHBondContact O-CA 3.09Å; F479-F483 WeakPolarHBondContact O-CB 3.19Å; F479-F483 PolarHBondContact O-N 3.37Å
480	E	97.6	Very high	96.5	Very high	39 Å²	39	41.3 Å²	41.3	18%	0.182	22%	0.218	C	C	.	.	H	α-helix	trans	-58.2	-46.3	179.7	177.9	167.8	153.3	0	0	111.7	A88 K91 D476 Q477 E478 L484	A88-E480 HydrophobicContact CB-CB 4.37Å; A88-E480 HydrophobicContact CB-CG 3.77Å; K91-E480 WeakPolarHBondContact CD-OE1 3.35Å; K91-E480 VanDerWaalsContact NZ-CD 3.26Å; K91-E480 IonicContact NZ-OE1 2.72Å; K91-E480 PolarHBondContact NZ-OE1 2.8Å; K91-E480 IonicContact NZ-OE2 2.94Å; K91-E480 PolarHBondContact NZ-OE2 2.82Å; D476-E480 WeakPolarHBondContact O-CB 3.19Å; D476-E480 PolarHBondContact O-N 3.15Å; Q477-E480 PolarHBondContact O-N 3.48Å; E478-E480 VanDerWaalsContact C-N 3.35Å; E478-E480 PolarHBondContact O-N 3.37Å; E480-L484 HydrophobicContact CG-CD1 3.97Å; E480-L484 VanDerWaalsContact O-CB 3.28Å; E480-L484 WeakPolarHBondContact O-CB 3.37Å; E480-L484 WeakPolarHBondContact O-CG 3.46Å; E480-L484 PolarHBondContact O-N 3.14Å
481	V	97.9	Very high	96.2	Very high	93 Å²	93	42.7 Å²	42.7	56%	0.564	22%	0.224	S	C	*	.	H	α-helix	trans	-62.7	-52.9	178.9	172	0	0	0	0	111.5	Q477 E478 F479 L484 S485	Q477-V481 WeakPolarHBondContact O-CG2 3.35Å; Q477-V481 PolarHBondContact O-N 2.86Å; E478-V481 PolarHBondContact O-N 3.24Å; F479-V481 PolarHBondContact O-N 2.8Å; V481-L484 PolarHBondContact O-N 3.4Å; V481-S485 WeakPolarHBondContact O-CB 3.18Å; V481-S485 PolarHBondContact O-N 3.33Å
482	T	97.9	Very high	95.2	Very high	37 Å²	37	52.3 Å²	52.3	23%	0.227	27%	0.266	C	S	.	.	H	α-helix	trans	-69.6	-37.8	-175.9	53.2	0	0	0	0	112.6	E478 F479 S486	E478-T482 HydrophobicContact CG-CG2 4.44Å; E478-T482 WeakPolarHBondContact O-CB 3.31Å; E478-T482 WeakPolarHBondContact O-CG2 3.33Å; E478-T482 PolarHBondContact O-N 3.25Å; E478-T482 PolarHBondContact O-OG1 2.89Å; E478-T482 VanDerWaalsContact OE1-CG2 3.31Å; E478-T482 WeakPolarHBondContact OE1-CG2 3.49Å; F479-T482 PolarHBondContact O-N 2.92Å; F479-T482 PolarHBondContact O-OG1 2.93Å; T482-S486 WeakPolarHBondContact O-CB 3.41Å; T482-S486 PolarHBondContact O-N 3.38Å; T482-S486 PolarHBondContact O-OG 2.97Å
483	F	98.4	Very high	95.2	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.009	25%	0.254	C	S	.	.	H	α-helix	trans	-60.9	-54.4	173.3	176.1	-94.7	0	0	0	110.5	F67 A85 A88 L89 M255 V278 F479 S485 S486 V487	F67-F483 HydrophobicContact CZ-CZ 4.35Å; A85-F483 HydrophobicContact CB-CD1 4.47Å; A85-F483 HydrophobicContact CB-CD2 4.28Å; A85-F483 HydrophobicContact CB-CE1 3.96Å; A85-F483 HydrophobicContact CB-CE2 3.72Å; A85-F483 HydrophobicContact CB-CZ 3.55Å; A88-F483 HydrophobicContact CB-CD1 4.21Å; L89-F483 HydrophobicContact CD1-CE1 4.12Å; L89-F483 HydrophobicContact CD1-CZ 4.22Å; L89-F483 HydrophobicContact CD2-CE1 4.01Å; L89-F483 HydrophobicContact CG-CE1 3.79Å; L89-F483 HydrophobicContact CG-CZ 4.39Å; M255-F483 HydrophobicContact CE-CD2 4.47Å; M255-F483 HydrophobicContact CE-CE2 3.98Å; M255-F483 HydrophobicContact SD-CD2 3.57Å; M255-F483 VanDerWaalsContact SD-CD2 3.57Å; M255-F483 HydrophobicContact SD-CE2 3.67Å; V278-F483 HydrophobicContact CG1-CB 4.06Å; F479-F483 HydrophobicContact CD2-CB 4.49Å; F479-F483 HydrophobicContact CE1-CB 4.27Å; F479-F483 HydrophobicContact CE1-CG 4.36Å; F479-F483 HydrophobicContact CE2-CB 4.26Å; F479-F483 HydrophobicContact CE2-CD2 4.36Å; F479-F483 HydrophobicContact CZ-CB 4.14Å; F479-F483 AromaticContact CZ-CD2 3.97Å; F479-F483 HydrophobicContact CZ-CD2 3.97Å; F479-F483 HydrophobicContact CZ-CG 4.11Å; F479-F483 WeakPolarHBondContact O-CA 3.09Å; F479-F483 WeakPolarHBondContact O-CB 3.19Å; F479-F483 PolarHBondContact O-N 3.37Å; F483-S485 VanDerWaalsContact C-N 3.31Å; F483-S485 PolarHBondContact O-N 3.37Å; F483-S486 WeakPolarHBondContact O-CB 3.37Å; F483-S486 PolarHBondContact O-N 2.98Å; F483-S486 VanDerWaalsContact O-N 3.07Å; F483-V487 HydrophobicContact CD1-CG2 4.23Å; F483-V487 HydrophobicContact CD2-CG1 4.22Å; F483-V487 HydrophobicContact CE1-CG1 4.12Å; F483-V487 HydrophobicContact CE1-CG2 3.86Å; F483-V487 HydrophobicContact CE2-CG1 3.73Å; F483-V487 HydrophobicContact CZ-CG1 3.67Å; F483-V487 HydrophobicContact CZ-CG2 4.23Å; F483-V487 WeakPolarHBondContact O-CG2 3.5Å; F483-V487 PolarHBondContact O-N 3.35Å
484	L	98.1	Very high	95.2	Very high	25 Å²	25	50.3 Å²	50.3	13%	0.131	25%	0.253	C	S	.	.	H	α-helix	trans	-62.1	-37.5	-178.1	-72.2	176.8	0	0	0	112.9	A88 L89 K92 E480 V481 E488	A88-L484 HydrophobicContact CB-CD1 4.37Å; A88-L484 HydrophobicContact CB-CD2 4.15Å; A88-L484 HydrophobicContact CB-CG 4.14Å; L89-L484 HydrophobicContact CD2-CD2 3.94Å; K92-L484 HydrophobicContact CB-CD1 4.38Å; K92-L484 HydrophobicContact CB-CD2 4.06Å; K92-L484 HydrophobicContact CD-CB 4.43Å; K92-L484 HydrophobicContact CD-CD1 4.34Å; K92-L484 HydrophobicContact CD-CD2 3.9Å; K92-L484 HydrophobicContact CD-CG 4.45Å; E480-L484 HydrophobicContact CG-CD1 3.97Å; E480-L484 VanDerWaalsContact O-CB 3.28Å; E480-L484 WeakPolarHBondContact O-CB 3.37Å; E480-L484 WeakPolarHBondContact O-CG 3.46Å; E480-L484 PolarHBondContact O-N 3.14Å; V481-L484 PolarHBondContact O-N 3.4Å; L484-E488 PolarHBondContact O-N 3Å
485	S	97.3	Very high	95.1	Very high	84 Å²	84	53 Å²	53	59%	0.587	27%	0.267	S	S	*	.	H	α-helix	trans	-61.7	-44	173.1	-179.6	0	0	0	0	111.4	V481 F483	V481-S485 WeakPolarHBondContact O-CB 3.18Å; V481-S485 PolarHBondContact O-N 3.33Å; F483-S485 VanDerWaalsContact C-N 3.31Å; F483-S485 PolarHBondContact O-N 3.37Å
486	S	96.8	Very high	95.1	Very high	8 Å²	8	55.3 Å²	55.3	6%	0.056	28%	0.277	C	S	.	.	H	α-helix	trans	-66.6	-48.4	-179.6	-66	0	0	0	0	112.7	V253 N276 V278 T482 F483 E488	V253-S486 WeakPolarHBondContact CG1-O 3.41Å; N276-S486 WeakPolarHBondContact CB-OG 3.45Å; N276-S486 PolarHBondContact ND2-OG 2.99Å; V278-S486 WeakPolarHBondContact CG2-OG 3.3Å; T482-S486 WeakPolarHBondContact O-CB 3.41Å; T482-S486 PolarHBondContact O-N 3.38Å; T482-S486 PolarHBondContact O-OG 2.97Å; F483-S486 WeakPolarHBondContact O-CB 3.37Å; F483-S486 PolarHBondContact O-N 2.98Å; F483-S486 VanDerWaalsContact O-N 3.07Å; S486-E488 VanDerWaalsContact C-N 3.29Å; S486-E488 PolarHBondContact O-N 3.14Å
487	V	97	Very high	95.1	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-78.5	-10.1	-174.4	-60.3	0	0	0	0	113.8	L89 M255 F483 K489 L490 F491	L89-V487 HydrophobicContact CD2-CG2 4Å; M255-V487 HydrophobicContact CE-CG1 3.59Å; M255-V487 HydrophobicContact SD-CG1 3.5Å; M255-V487 VanDerWaalsContact SD-CG1 3.5Å; F483-V487 HydrophobicContact CD1-CG2 4.23Å; F483-V487 HydrophobicContact CD2-CG1 4.22Å; F483-V487 HydrophobicContact CE1-CG1 4.12Å; F483-V487 HydrophobicContact CE1-CG2 3.86Å; F483-V487 HydrophobicContact CE2-CG1 3.73Å; F483-V487 HydrophobicContact CZ-CG1 3.67Å; F483-V487 HydrophobicContact CZ-CG2 4.23Å; F483-V487 WeakPolarHBondContact O-CG2 3.5Å; F483-V487 PolarHBondContact O-N 3.35Å; V487-K489 PolarHBondContact O-N 3.19Å; V487-L490 HydrophobicContact CB-CD1 4.16Å; V487-L490 HydrophobicContact CG1-CD1 4.33Å; V487-L490 VanDerWaalsContact O-CB 3.29Å; V487-L490 WeakPolarHBondContact O-CB 3.39Å; V487-L490 PolarHBondContact O-N 3.42Å; V487-F491 HydrophobicContact CB-CE2 3.97Å; V487-F491 HydrophobicContact CG2-CE2 3.76Å; V487-F491 WeakPolarHBondContact O-CD2 3.42Å; V487-F491 VanDerWaalsContact O-CE2 3.29Å; V487-F491 WeakPolarHBondContact O-CE2 3.5Å
488	E	95.2	Very high	95.1	Very high	81 Å²	81	52.5 Å²	52.5	38%	0.379	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-52.5	-34.3	-178.6	-174	168.7	-104.2	0	0	113.2	K92 L484 S486 L490 F491	K92-E488 IonicContact NZ-OE1 2.9Å; K92-E488 PolarHBondContact NZ-OE1 3.05Å; L484-E488 PolarHBondContact O-N 3Å; S486-E488 VanDerWaalsContact C-N 3.29Å; S486-E488 PolarHBondContact O-N 3.14Å; E488-L490 PolarHBondContact O-N 3.18Å; E488-F491 PolarHBondContact O-N 3.44Å; E488-F491 VanDerWaalsContact O-N 3.1Å
489	K	92.1	Very high	94.9	Very high	102 Å²	102	50.6 Å²	50.6	44%	0.443	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-62.6	-24.4	177.3	-62.6	179.1	-176.2	174.9	0	113.6	V253 V487 F491	V253-K489 HydrophobicContact CG2-CB 3.81Å; V253-K489 HydrophobicContact CG2-CD 4.43Å; V487-K489 PolarHBondContact O-N 3.19Å; K489-F491 PolarHBondContact O-N 3.45Å
490	L	95.4	Very high	94.7	Very high	3 Å²	3	54.2 Å²	54.2	2%	0.016	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-73.4	-15.6	177.6	-58.6	177.4	0	0	0	112.8	V171 I173 Q192 D252 V253 V487 E488	V171-L490 HydrophobicContact CG1-CB 3.89Å; V171-L490 HydrophobicContact CG1-CD1 3.86Å; V171-L490 HydrophobicContact CG1-CG 4.44Å; V171-L490 HydrophobicContact CG2-CB 4.35Å; V171-L490 WeakPolarHBondContact CG2-O 3Å; I173-L490 HydrophobicContact CD1-CD1 4.36Å; I173-L490 HydrophobicContact CG1-CD1 4.27Å; Q192-L490 HydrophobicContact CB-CB 4.38Å; Q192-L490 HydrophobicContact CB-CD2 4.19Å; D252-L490 HydrophobicContact CB-CD2 3.72Å; V253-L490 HydrophobicContact CB-CD1 4.41Å; V253-L490 HydrophobicContact CB-CD2 3.99Å; V253-L490 HydrophobicContact CB-CG 4.14Å; V253-L490 HydrophobicContact CG2-CD2 3.72Å; V253-L490 HydrophobicContact CG2-CG 3.79Å; V487-L490 HydrophobicContact CB-CD1 4.16Å; V487-L490 HydrophobicContact CG1-CD1 4.33Å; V487-L490 VanDerWaalsContact O-CB 3.29Å; V487-L490 WeakPolarHBondContact O-CB 3.39Å; V487-L490 PolarHBondContact O-N 3.42Å; E488-L490 PolarHBondContact O-N 3.18Å
491	F	92.3	Very high	94.4	Very high	29 Å²	29	55.4 Å²	55.4	13%	0.127	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-107.7	5.7	-173.6	-57.4	-75.5	0	0	0	113.1	M63 I65 L89 Y93 V171 V487 E488 K489	M63-F491 HydrophobicContact CE-CD1 4.31Å; M63-F491 HydrophobicContact SD-CD1 3.49Å; M63-F491 WeakPolarHBondContact SD-CD1 3.42Å; M63-F491 HydrophobicContact SD-CE1 3.93Å; I65-F491 HydrophobicContact CD1-CE1 3.48Å; I65-F491 VanDerWaalsContact CD1-CE1 3.48Å; I65-F491 HydrophobicContact CD1-CZ 4.01Å; I65-F491 HydrophobicContact CG1-CE1 3.9Å; L89-F491 HydrophobicContact CD2-CE2 3.92Å; L89-F491 HydrophobicContact CD2-CZ 3.71Å; Y93-F491 HydrophobicContact CD2-CD1 4.47Å; Y93-F491 HydrophobicContact CD2-CE1 4.26Å; Y93-F491 HydrophobicContact CD2-CZ 4.3Å; Y93-F491 HydrophobicContact CE2-CD1 4.01Å; Y93-F491 AromaticContact CE2-CD2 3.69Å; Y93-F491 HydrophobicContact CE2-CD2 3.69Å; Y93-F491 HydrophobicContact CE2-CE1 4.02Å; Y93-F491 AromaticContact CE2-CE2 3.71Å; Y93-F491 HydrophobicContact CE2-CE2 3.71Å; Y93-F491 AromaticContact CE2-CG 3.85Å; Y93-F491 HydrophobicContact CE2-CG 3.85Å; Y93-F491 AromaticContact CE2-CZ 3.88Å; Y93-F491 HydrophobicContact CE2-CZ 3.88Å; Y93-F491 AromaticContact CZ-CD2 3.81Å; Y93-F491 AromaticContact CZ-CG 3.74Å; Y93-F491 WeakPolarHBondContact OH-CD2 3.46Å; V171-F491 HydrophobicContact CB-CE1 4.28Å; V171-F491 HydrophobicContact CG1-CE1 4.34Å; V171-F491 HydrophobicContact CG1-CZ 4.31Å; V171-F491 HydrophobicContact CG2-CD1 3.96Å; V171-F491 HydrophobicContact CG2-CE1 3.75Å; V171-F491 HydrophobicContact CG2-CZ 4.47Å; V487-F491 HydrophobicContact CB-CE2 3.97Å; V487-F491 HydrophobicContact CG2-CE2 3.76Å; V487-F491 WeakPolarHBondContact O-CD2 3.42Å; V487-F491 VanDerWaalsContact O-CE2 3.29Å; V487-F491 WeakPolarHBondContact O-CE2 3.5Å; E488-F491 PolarHBondContact O-N 3.44Å; E488-F491 VanDerWaalsContact O-N 3.1Å; K489-F491 PolarHBondContact O-N 3.45Å
492	K	74.8	Confident	94.1	Very high	201 Å²	201	52 Å²	52	87%	0.874	26%	0.259	S	S	*	.			trans	-87.6	0	-179.3	-68.7	-174.2	-178.3	-176.9	0	113.2

Retrieved 492 of 492 residues in 99.7 ms (Link to these results)

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