A0A087WR27_MOUSE Loading...

Zinc finger protein 932

AlphaFold DB , UniProt , Accession A0A087WR27, Species MOUSE (Mus musculus, Mouse), Gene Zfp932, Length 526 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	L	30.2	Very low	41.5	Very low	225 Å²	225	107.4 Å²	107.4	100%	1.178	58%	0.584	S	S	*	*				0	109.3	0	-76.2	153.1	0	0	0	107.2
2	V	28.3	Very low	42.2	Very low	143 Å²	143	101.8 Å²	101.8	87%	0.867	56%	0.556	S	S	*	*			trans	-92.3	115.1	176.4	179.8	0	0	0	0	105.5	A4	V2-A4 PolarHBondContact O-N 3.37Å
3	D	36.5	Very low	42.6	Very low	125 Å²	125	103.2 Å²	103.2	67%	0.668	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-62	132.3	176.1	-69.2	-29.7	0	0	0	109.3
4	A	40.1	Very low	43.1	Very low	73 Å²	73	98.5 Å²	98.5	60%	0.603	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-70.4	131.3	-179.3	0	0	0	0	0	110.5	V2	V2-A4 PolarHBondContact O-N 3.37Å
5	L	41.4	Very low	43.8	Very low	97 Å²	97	96.5 Å²	96.5	51%	0.508	53%	0.527	S	S	.	.	P	Polyproline II helix	trans	-68.5	129.8	170.8	-90.3	145.1	0	0	0	109.3	D9 V10 Y46	L5-D9 HydrophobicContact CD2-CB 3.99Å; L5-V10 HydrophobicContact CD2-CG2 4.29Å; L5-Y46 PolarHBondContact N-OH 2.8Å
6	T	47	Very low	43.5	Very low	74 Å²	74	101.4 Å²	101.4	45%	0.454	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-96.7	161.1	178.2	66.8	0	0	0	0	111.6	D8 D9	T6-D8 PolarHBondContact O-N 3.39Å; T6-D9 PolarHBondContact N-OD2 3.19Å; T6-D9 WeakPolarHBondContact O-CB 3.19Å; T6-D9 PolarHBondContact O-N 3.02Å; T6-D9 VanDerWaalsContact OG1-CG 3.29Å; T6-D9 PolarHBondContact OG1-OD2 3.27Å
7	Y	41.3	Very low	43.5	Very low	94 Å²	94	103.6 Å²	103.6	37%	0.369	55%	0.551	S	S	.	*	G	3₁₀ helix	trans	-56.1	-38.9	177.8	174.9	-97.5	0	0	0	112.1	D9 V10 Y11 W48	Y7-D9 PolarHBondContact O-N 2.8Å; Y7-V10 PolarHBondContact O-N 3.05Å; Y7-Y11 HydrophobicContact CD1-CG 4.27Å; Y7-Y11 AromaticContact CE1-CD1 3.75Å; Y7-Y11 HydrophobicContact CE1-CD1 3.75Å; Y7-Y11 AromaticContact CE1-CD2 3.95Å; Y7-Y11 HydrophobicContact CE1-CD2 3.95Å; Y7-Y11 HydrophobicContact CE1-CE1 4.3Å; Y7-Y11 HydrophobicContact CE1-CE2 4.48Å; Y7-Y11 AromaticContact CE1-CG 3.54Å; Y7-Y11 HydrophobicContact CE1-CG 3.54Å; Y7-Y11 AromaticContact CE2-CD2 3.87Å; Y7-Y11 HydrophobicContact CE2-CD2 3.87Å; Y7-Y11 HydrophobicContact CE2-CE2 4.49Å; Y7-Y11 HydrophobicContact CE2-CG 4.19Å; Y7-Y11 AromaticContact CZ-CD2 3.39Å; Y7-Y11 AromaticContact CZ-CE2 3.8Å; Y7-Y11 AromaticContact CZ-CG 3.51Å; Y7-Y11 WeakPolarHBondContact O-CB 3.32Å; Y7-Y11 PolarHBondContact O-N 3.27Å; Y7-Y11 WeakPolarHBondContact OH-CD2 3.5Å; Y7-Y11 WeakPolarHBondContact OH-CE2 3.33Å; Y7-W48 VanDerWaalsContact CB-CZ3 3.42Å; Y7-W48 HydrophobicContact CD1-CH2 4.41Å; Y7-W48 HydrophobicContact CD2-CZ3 4.36Å; Y7-W48 HydrophobicContact CG-CH2 4.14Å; Y7-W48 AromaticContact CG-CZ3 3.95Å; Y7-W48 HydrophobicContact CG-CZ3 3.95Å
8	D	46.3	Very low	43.7	Very low	131 Å²	131	102 Å²	102	70%	0.701	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-69.4	-16.2	179.2	-61.5	-34.9	0	0	0	113.6	T6 V10	T6-D8 PolarHBondContact O-N 3.39Å; D8-V10 VanDerWaalsContact C-N 3.31Å
9	D	49.5	Very low	44.3	Very low	87 Å²	87	100.9 Å²	100.9	47%	0.465	53%	0.528	S	S	.	.	G	3₁₀ helix	trans	-77.4	-18.1	175.9	-67.1	-56.1	0	0	0	113	L5 T6 Y7	L5-D9 HydrophobicContact CD2-CB 3.99Å; T6-D9 PolarHBondContact N-OD2 3.19Å; T6-D9 WeakPolarHBondContact O-CB 3.19Å; T6-D9 PolarHBondContact O-N 3.02Å; T6-D9 VanDerWaalsContact OG1-CG 3.29Å; T6-D9 PolarHBondContact OG1-OD2 3.27Å; Y7-D9 PolarHBondContact O-N 2.8Å
10	V	45.9	Very low	44.6	Very low	46 Å²	46	99.6 Å²	99.6	28%	0.279	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.9	-17.9	-172	-145.5	0	0	0	0	113	L5 Y7 D8 T37 L41	L5-V10 HydrophobicContact CD2-CG2 4.29Å; Y7-V10 PolarHBondContact O-N 3.05Å; D8-V10 VanDerWaalsContact C-N 3.31Å; V10-T37 HydrophobicContact CB-CG2 4.41Å; V10-T37 HydrophobicContact CG1-CG2 3.47Å; V10-T37 VanDerWaalsContact CG1-CG2 3.47Å; V10-L41 HydrophobicContact CB-CD1 3.92Å; V10-L41 HydrophobicContact CG1-CD1 4.03Å; V10-L41 HydrophobicContact CG2-CD1 4.04Å; V10-L41 HydrophobicContact CG2-CD2 4.23Å
11	Y	50.5	Low	45.2	Very low	86 Å²	86	101.8 Å²	101.8	34%	0.337	54%	0.543	S	S	.	.			trans	-79	134.9	175.7	-169.4	-106.3	0	0	0	111.4	Y7 N13 M34	Y7-Y11 HydrophobicContact CD1-CG 4.27Å; Y7-Y11 AromaticContact CE1-CD1 3.75Å; Y7-Y11 HydrophobicContact CE1-CD1 3.75Å; Y7-Y11 AromaticContact CE1-CD2 3.95Å; Y7-Y11 HydrophobicContact CE1-CD2 3.95Å; Y7-Y11 HydrophobicContact CE1-CE1 4.3Å; Y7-Y11 HydrophobicContact CE1-CE2 4.48Å; Y7-Y11 AromaticContact CE1-CG 3.54Å; Y7-Y11 HydrophobicContact CE1-CG 3.54Å; Y7-Y11 AromaticContact CE2-CD2 3.87Å; Y7-Y11 HydrophobicContact CE2-CD2 3.87Å; Y7-Y11 HydrophobicContact CE2-CE2 4.49Å; Y7-Y11 HydrophobicContact CE2-CG 4.19Å; Y7-Y11 AromaticContact CZ-CD2 3.39Å; Y7-Y11 AromaticContact CZ-CE2 3.8Å; Y7-Y11 AromaticContact CZ-CG 3.51Å; Y7-Y11 WeakPolarHBondContact O-CB 3.32Å; Y7-Y11 PolarHBondContact O-N 3.27Å; Y7-Y11 WeakPolarHBondContact OH-CD2 3.5Å; Y7-Y11 WeakPolarHBondContact OH-CE2 3.33Å; Y11-N13 HydrophobicContact CD1-CB 4.1Å; Y11-N13 HydrophobicContact CE1-CB 3.83Å; Y11-M34 HydrophobicContact CD2-CE 3.53Å; Y11-M34 HydrophobicContact CE2-CE 4.03Å; Y11-M34 HydrophobicContact CG-CE 4.32Å
12	V	49.4	Very low	46.4	Very low	41 Å²	41	92.4 Å²	92.4	25%	0.248	49%	0.494	C	S	.	.			trans	-110.2	103.9	176.5	175	0	0	0	0	107.2	F14 Y30 M34	V12-F14 HydrophobicContact CG1-CE2 4.45Å; V12-F14 HydrophobicContact CG1-CZ 4.4Å; V12-Y30 HydrophobicContact CB-CE2 3.94Å; V12-Y30 HydrophobicContact CG1-CE2 3.98Å; V12-Y30 VanDerWaalsContact O-CE2 3.31Å; V12-Y30 WeakPolarHBondContact O-CE2 3.43Å; V12-Y30 PolarHBondContact O-OH 3.26Å; V12-M34 HydrophobicContact CB-SD 4.19Å; V12-M34 HydrophobicContact CG2-SD 4.43Å
13	N	47.3	Very low	47.7	Very low	120 Å²	120	89 Å²	89	64%	0.642	47%	0.471	S	S	*	.			trans	-87.5	144.2	177.4	-156.7	10	0	0	0	110.7	Y11	Y11-N13 HydrophobicContact CD1-CB 4.1Å; Y11-N13 HydrophobicContact CE1-CB 3.83Å
14	F	49.2	Very low	48.2	Very low	37 Å²	37	88.2 Å²	88.2	16%	0.162	47%	0.473	C	S	.	.			trans	-117.2	134.1	170.3	-72	-71.4	0	0	0	108.7	V12 E18 W19 L22 Y30	V12-F14 HydrophobicContact CG1-CE2 4.45Å; V12-F14 HydrophobicContact CG1-CZ 4.4Å; F14-E18 HydrophobicContact CB-CB 4.33Å; F14-E18 HydrophobicContact CD1-CB 3.98Å; F14-W19 HydrophobicContact CB-CB 4.18Å; F14-W19 HydrophobicContact CB-CE3 4.11Å; F14-W19 AromaticContact CD2-CE3 3.5Å; F14-W19 HydrophobicContact CD2-CE3 3.5Å; F14-W19 VanDerWaalsContact CD2-CE3 3.5Å; F14-W19 AromaticContact CD2-CZ3 3.71Å; F14-W19 HydrophobicContact CD2-CZ3 3.71Å; F14-W19 HydrophobicContact CE2-CE3 4.13Å; F14-W19 HydrophobicContact CE2-CZ3 4.02Å; F14-W19 HydrophobicContact CG-CE3 4.03Å; F14-L22 HydrophobicContact CD1-CD1 4.27Å; F14-L22 HydrophobicContact CD2-CD1 4.04Å; F14-L22 HydrophobicContact CE1-CD1 3.93Å; F14-L22 HydrophobicContact CE1-CD2 4.27Å; F14-L22 HydrophobicContact CE1-CG 4.49Å; F14-L22 HydrophobicContact CE2-CD1 3.62Å; F14-L22 HydrophobicContact CG-CD1 4.33Å; F14-L22 HydrophobicContact CZ-CD1 3.59Å; F14-L22 HydrophobicContact CZ-CD2 4.29Å; F14-L22 HydrophobicContact CZ-CG 4.49Å; F14-Y30 HydrophobicContact CD2-CD2 4.2Å; F14-Y30 HydrophobicContact CD2-CE1 4.29Å; F14-Y30 AromaticContact CD2-CE2 3.79Å; F14-Y30 HydrophobicContact CD2-CE2 3.79Å; F14-Y30 AromaticContact CD2-CZ 3.84Å; F14-Y30 HydrophobicContact CE2-CD1 4.23Å; F14-Y30 AromaticContact CE2-CD2 3.34Å; F14-Y30 HydrophobicContact CE2-CD2 3.34Å; F14-Y30 HydrophobicContact CE2-CE1 4.27Å; F14-Y30 AromaticContact CE2-CE2 3.34Å; F14-Y30 HydrophobicContact CE2-CE2 3.34Å; F14-Y30 AromaticContact CE2-CG 3.75Å; F14-Y30 HydrophobicContact CE2-CG 3.75Å; F14-Y30 AromaticContact CE2-CZ 3.84Å; F14-Y30 HydrophobicContact CZ-CD2 4.15Å; F14-Y30 HydrophobicContact CZ-CE2 4.34Å
15	T	53.8	Low	48.5	Very low	68 Å²	68	89.1 Å²	89.1	42%	0.417	47%	0.474	S	S	.	.			trans	-65.2	162	165	56.7	0	0	0	0	110.5	E17 E18 W19	T15-E17 PolarHBondContact O-N 3.18Å; T15-E18 WeakPolarHBondContact CB-OE2 3.28Å; T15-E18 WeakPolarHBondContact CG2-OE2 3.49Å; T15-E18 PolarHBondContact N-OE2 2.99Å; T15-E18 PolarHBondContact O-N 3.27Å; T15-E18 VanDerWaalsContact O-N 3.13Å; T15-E18 VanDerWaalsContact OG1-CB 3.3Å; T15-E18 WeakPolarHBondContact OG1-CB 3.27Å; T15-E18 WeakPolarHBondContact OG1-CG 3.24Å; T15-E18 PolarHBondContact OG1-N 2.93Å; T15-E18 PolarHBondContact OG1-OE2 3.4Å; T15-W19 PolarHBondContact O-N 3.43Å
16	Q	38.8	Very low	48.9	Very low	175 Å²	175	86.9 Å²	86.9	82%	0.818	46%	0.461	S	S	*	.	H	α-helix	trans	-61.4	-34.7	-180	-169.7	170.6	-3.8	0	0	111.4	A20	Q16-A20 PolarHBondContact O-N 3.37Å
17	E	44.4	Very low	49.2	Very low	139 Å²	139	85.9 Å²	85.9	65%	0.65	45%	0.451	S	S	*	.	H	α-helix	trans	-68.9	-42.9	172.5	-58.5	87.8	-178.8	0	0	112.2	T15 A20 L21	T15-E17 PolarHBondContact O-N 3.18Å; E17-A20 PolarHBondContact O-N 3.16Å; E17-L21 WeakPolarHBondContact O-CG 3.45Å; E17-L21 PolarHBondContact O-N 3.44Å
18	E	46.3	Very low	49.5	Very low	75 Å²	75	84.4 Å²	84.4	35%	0.35	45%	0.454	S	S	.	.	H	α-helix	trans	-68	-36.4	179.4	-72.4	167.7	141	0	0	112.8	F14 T15 A20 L21	F14-E18 HydrophobicContact CB-CB 4.33Å; F14-E18 HydrophobicContact CD1-CB 3.98Å; T15-E18 WeakPolarHBondContact CB-OE2 3.28Å; T15-E18 WeakPolarHBondContact CG2-OE2 3.49Å; T15-E18 PolarHBondContact N-OE2 2.99Å; T15-E18 PolarHBondContact O-N 3.27Å; T15-E18 VanDerWaalsContact O-N 3.13Å; T15-E18 VanDerWaalsContact OG1-CB 3.3Å; T15-E18 WeakPolarHBondContact OG1-CB 3.27Å; T15-E18 WeakPolarHBondContact OG1-CG 3.24Å; T15-E18 PolarHBondContact OG1-N 2.93Å; T15-E18 PolarHBondContact OG1-OE2 3.4Å; E18-A20 VanDerWaalsContact C-N 3.31Å; E18-A20 PolarHBondContact O-N 3.5Å; E18-L21 PolarHBondContact O-N 3.06Å
19	W	54.7	Low	49.8	Very low	81 Å²	81	81.4 Å²	81.4	31%	0.307	44%	0.437	S	S	.	.	H	α-helix	trans	-67	-33.7	176.3	-173.5	-104.1	0	0	0	112.1	F14 T15 L21 L22 K27 Y30	F14-W19 HydrophobicContact CB-CB 4.18Å; F14-W19 HydrophobicContact CB-CE3 4.11Å; F14-W19 AromaticContact CD2-CE3 3.5Å; F14-W19 HydrophobicContact CD2-CE3 3.5Å; F14-W19 VanDerWaalsContact CD2-CE3 3.5Å; F14-W19 AromaticContact CD2-CZ3 3.71Å; F14-W19 HydrophobicContact CD2-CZ3 3.71Å; F14-W19 HydrophobicContact CE2-CE3 4.13Å; F14-W19 HydrophobicContact CE2-CZ3 4.02Å; F14-W19 HydrophobicContact CG-CE3 4.03Å; T15-W19 PolarHBondContact O-N 3.43Å; W19-L21 VanDerWaalsContact C-N 3.26Å; W19-L21 PolarHBondContact O-N 3.33Å; W19-L22 HydrophobicContact CD2-CD1 4.43Å; W19-L22 HydrophobicContact CE3-CD1 3.7Å; W19-L22 HydrophobicContact CZ3-CD1 3.98Å; W19-L22 PolarHBondContact O-N 3.22Å; W19-K27 HydrophobicContact CH2-CB 4.41Å; W19-K27 HydrophobicContact CH2-CG 4.27Å; W19-K27 HydrophobicContact CZ2-CB 4.4Å; W19-K27 HydrophobicContact CZ2-CD 4.3Å; W19-K27 HydrophobicContact CZ2-CG 4.09Å; W19-K27 WeakPolarHBondContact O-CE 3.46Å; W19-K27 PolarHBondContact O-NZ 3.12Å; W19-Y30 AromaticContact CH2-CD1 3.64Å; W19-Y30 HydrophobicContact CH2-CD1 3.64Å; W19-Y30 AromaticContact CH2-CE1 3.92Å; W19-Y30 HydrophobicContact CH2-CE1 3.92Å; W19-Y30 AromaticContact CZ3-CD1 3.41Å; W19-Y30 HydrophobicContact CZ3-CD1 3.41Å; W19-Y30 VanDerWaalsContact CZ3-CD1 3.41Å; W19-Y30 AromaticContact CZ3-CE1 3.54Å; W19-Y30 HydrophobicContact CZ3-CE1 3.54Å; W19-Y30 HydrophobicContact CZ3-CG 4.16Å
20	A	51.3	Low	50.2	Low	74 Å²	74	79.1 Å²	79.1	61%	0.612	42%	0.423	S	S	*	.	H	α-helix	trans	-65	-31.4	175.9	0	0	0	0	0	112.3	Q16 E17 E18 L22	Q16-A20 PolarHBondContact O-N 3.37Å; E17-A20 PolarHBondContact O-N 3.16Å; E18-A20 VanDerWaalsContact C-N 3.31Å; E18-A20 PolarHBondContact O-N 3.5Å; A20-L22 VanDerWaalsContact C-N 3.34Å; A20-L22 PolarHBondContact O-N 3.19Å
21	L	56.9	Low	50.4	Low	147 Å²	147	83.1 Å²	83.1	77%	0.77	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-11.2	-178.9	-64.9	171.6	0	0	0	114.5	E17 E18 W19	E17-L21 WeakPolarHBondContact O-CG 3.45Å; E17-L21 PolarHBondContact O-N 3.44Å; E18-L21 PolarHBondContact O-N 3.06Å; W19-L21 VanDerWaalsContact C-N 3.26Å; W19-L21 PolarHBondContact O-N 3.33Å
22	L	56.4	Low	50.3	Low	27 Å²	27	82.8 Å²	82.8	14%	0.141	44%	0.441	C	S	.	.	S	Bend	trans	-80.4	132.5	178.5	-59.7	174.4	0	0	0	111.6	F14 W19 A20 Q26 K27	F14-L22 HydrophobicContact CD1-CD1 4.27Å; F14-L22 HydrophobicContact CD2-CD1 4.04Å; F14-L22 HydrophobicContact CE1-CD1 3.93Å; F14-L22 HydrophobicContact CE1-CD2 4.27Å; F14-L22 HydrophobicContact CE1-CG 4.49Å; F14-L22 HydrophobicContact CE2-CD1 3.62Å; F14-L22 HydrophobicContact CG-CD1 4.33Å; F14-L22 HydrophobicContact CZ-CD1 3.59Å; F14-L22 HydrophobicContact CZ-CD2 4.29Å; F14-L22 HydrophobicContact CZ-CG 4.49Å; W19-L22 HydrophobicContact CD2-CD1 4.43Å; W19-L22 HydrophobicContact CE3-CD1 3.7Å; W19-L22 HydrophobicContact CZ3-CD1 3.98Å; W19-L22 PolarHBondContact O-N 3.22Å; A20-L22 VanDerWaalsContact C-N 3.34Å; A20-L22 PolarHBondContact O-N 3.19Å; L22-Q26 HydrophobicContact CB-CB 4.23Å; L22-Q26 HydrophobicContact CD2-CB 4.27Å; L22-K27 HydrophobicContact CB-CD 4.35Å; L22-K27 HydrophobicContact CB-CG 3.68Å; L22-K27 HydrophobicContact CD1-CG 4.29Å; L22-K27 WeakPolarHBondContact O-CE 3.39Å; L22-K27 PolarHBondContact O-NZ 3.28Å
23	N	55.3	Low	50.4	Low	73 Å²	73	83.9 Å²	83.9	39%	0.39	45%	0.447	S	S	.	.			trans	-73.1	163.2	172.3	73	40.3	0	0	0	111.7	S25 Q26 K27	N23-S25 VanDerWaalsContact C-N 3.28Å; N23-S25 PolarHBondContact O-N 3.33Å; N23-S25 PolarHBondContact OD1-N 2.97Å; N23-Q26 VanDerWaalsContact CG-OE1 3.29Å; N23-Q26 PolarHBondContact ND2-OE1 2.95Å; N23-Q26 WeakPolarHBondContact O-CB 3.43Å; N23-Q26 PolarHBondContact O-N 2.81Å; N23-Q26 VanDerWaalsContact O-N 3.09Å; N23-Q26 WeakPolarHBondContact OD1-CB 3.37Å; N23-Q26 VanDerWaalsContact OD1-CG 3.27Å; N23-Q26 WeakPolarHBondContact OD1-CG 3.42Å; N23-Q26 PolarHBondContact OD1-N 3.3Å; N23-K27 PolarHBondContact O-N 3.17Å
24	P	46.7	Very low	51.1	Low	108 Å²	108	79.6 Å²	79.6	70%	0.701	42%	0.424	S	S	*	.	H	α-helix	trans	-56.2	-38	-175.8	-28	36.3	0	0	0	114.2	K27 S28	P24-K27 PolarHBondContact O-N 3.24Å; P24-S28 WeakPolarHBondContact O-CB 3.5Å; P24-S28 PolarHBondContact O-N 3.26Å
25	S	47	Very low	51.1	Low	92 Å²	92	81.7 Å²	81.7	64%	0.643	44%	0.436	S	S	*	.	H	α-helix	trans	-68.1	-37.6	178.2	-55.2	0	0	0	0	112.3	N23 S28 L29	N23-S25 VanDerWaalsContact C-N 3.28Å; N23-S25 PolarHBondContact O-N 3.33Å; N23-S25 PolarHBondContact OD1-N 2.97Å; S25-S28 PolarHBondContact O-N 3.44Å; S25-L29 WeakPolarHBondContact O-CB 3.2Å; S25-L29 PolarHBondContact O-N 2.9Å
26	Q	48.8	Very low	50.9	Low	49 Å²	49	82 Å²	82	23%	0.229	43%	0.432	C	S	.	.	H	α-helix	trans	-69	-40.7	174.8	-72.4	168.3	-28.8	0	0	111.7	L22 N23 S28 L29 Y30	L22-Q26 HydrophobicContact CB-CB 4.23Å; L22-Q26 HydrophobicContact CD2-CB 4.27Å; N23-Q26 VanDerWaalsContact CG-OE1 3.29Å; N23-Q26 PolarHBondContact ND2-OE1 2.95Å; N23-Q26 WeakPolarHBondContact O-CB 3.43Å; N23-Q26 PolarHBondContact O-N 2.81Å; N23-Q26 VanDerWaalsContact O-N 3.09Å; N23-Q26 WeakPolarHBondContact OD1-CB 3.37Å; N23-Q26 VanDerWaalsContact OD1-CG 3.27Å; N23-Q26 WeakPolarHBondContact OD1-CG 3.42Å; N23-Q26 PolarHBondContact OD1-N 3.3Å; Q26-S28 VanDerWaalsContact C-N 3.35Å; Q26-L29 PolarHBondContact O-N 2.75Å; Q26-Y30 WeakPolarHBondContact O-CB 3.39Å; Q26-Y30 PolarHBondContact O-N 3.22Å
27	K	54	Low	51.4	Low	54 Å²	54	75.2 Å²	75.2	24%	0.235	40%	0.403	C	S	.	.	H	α-helix	trans	-63	-41	174.3	-71.5	176.2	173.6	163.8	0	111.6	W19 L22 N23 P24 K31	W19-K27 HydrophobicContact CH2-CB 4.41Å; W19-K27 HydrophobicContact CH2-CG 4.27Å; W19-K27 HydrophobicContact CZ2-CB 4.4Å; W19-K27 HydrophobicContact CZ2-CD 4.3Å; W19-K27 HydrophobicContact CZ2-CG 4.09Å; W19-K27 WeakPolarHBondContact O-CE 3.46Å; W19-K27 PolarHBondContact O-NZ 3.12Å; L22-K27 HydrophobicContact CB-CD 4.35Å; L22-K27 HydrophobicContact CB-CG 3.68Å; L22-K27 HydrophobicContact CD1-CG 4.29Å; L22-K27 WeakPolarHBondContact O-CE 3.39Å; L22-K27 PolarHBondContact O-NZ 3.28Å; N23-K27 PolarHBondContact O-N 3.17Å; P24-K27 PolarHBondContact O-N 3.24Å; K27-K31 VanDerWaalsContact O-CG 3.32Å; K27-K31 WeakPolarHBondContact O-CG 3.38Å; K27-K31 PolarHBondContact O-N 3.24Å; K27-K31 VanDerWaalsContact O-N 3.09Å
28	S	47.6	Very low	51.8	Low	62 Å²	62	75 Å²	75	43%	0.434	40%	0.397	S	S	.	.	H	α-helix	trans	-64.8	-47.6	175.1	-167.1	0	0	0	0	111.6	P24 S25 Q26 Y30 K31 D32	P24-S28 WeakPolarHBondContact O-CB 3.5Å; P24-S28 PolarHBondContact O-N 3.26Å; S25-S28 PolarHBondContact O-N 3.44Å; Q26-S28 VanDerWaalsContact C-N 3.35Å; S28-Y30 VanDerWaalsContact C-N 3.33Å; S28-Y30 PolarHBondContact O-N 3.01Å; S28-K31 PolarHBondContact O-N 3.2Å; S28-D32 VanDerWaalsContact O-CG 3.3Å; S28-D32 PolarHBondContact O-N 3.27Å
29	L	52.7	Low	52	Low	68 Å²	68	78.9 Å²	78.9	36%	0.356	41%	0.409	S	S	.	.	H	α-helix	trans	-62.1	-41.4	178.9	-179.8	63.7	0	0	0	111.9	S25 Q26 D32 V33	S25-L29 WeakPolarHBondContact O-CB 3.2Å; S25-L29 PolarHBondContact O-N 2.9Å; Q26-L29 PolarHBondContact O-N 2.75Å; L29-D32 PolarHBondContact O-N 3.48Å; L29-V33 HydrophobicContact CD1-CG2 4Å; L29-V33 HydrophobicContact CG-CG2 4.28Å; L29-V33 WeakPolarHBondContact O-CB 3.43Å; L29-V33 WeakPolarHBondContact O-CG2 3.42Å; L29-V33 PolarHBondContact O-N 2.95Å
30	Y	56.4	Low	51.9	Low	40 Å²	40	78.7 Å²	78.7	16%	0.157	41%	0.414	C	S	.	.	H	α-helix	trans	-60.4	-46.8	175	170.4	-97.8	0	0	0	111.4	V12 F14 W19 Q26 S28 D32 V33 M34	V12-Y30 HydrophobicContact CB-CE2 3.94Å; V12-Y30 HydrophobicContact CG1-CE2 3.98Å; V12-Y30 VanDerWaalsContact O-CE2 3.31Å; V12-Y30 WeakPolarHBondContact O-CE2 3.43Å; V12-Y30 PolarHBondContact O-OH 3.26Å; F14-Y30 HydrophobicContact CD2-CD2 4.2Å; F14-Y30 HydrophobicContact CD2-CE1 4.29Å; F14-Y30 AromaticContact CD2-CE2 3.79Å; F14-Y30 HydrophobicContact CD2-CE2 3.79Å; F14-Y30 AromaticContact CD2-CZ 3.84Å; F14-Y30 HydrophobicContact CE2-CD1 4.23Å; F14-Y30 AromaticContact CE2-CD2 3.34Å; F14-Y30 HydrophobicContact CE2-CD2 3.34Å; F14-Y30 HydrophobicContact CE2-CE1 4.27Å; F14-Y30 AromaticContact CE2-CE2 3.34Å; F14-Y30 HydrophobicContact CE2-CE2 3.34Å; F14-Y30 AromaticContact CE2-CG 3.75Å; F14-Y30 HydrophobicContact CE2-CG 3.75Å; F14-Y30 AromaticContact CE2-CZ 3.84Å; F14-Y30 HydrophobicContact CZ-CD2 4.15Å; F14-Y30 HydrophobicContact CZ-CE2 4.34Å; W19-Y30 AromaticContact CH2-CD1 3.64Å; W19-Y30 HydrophobicContact CH2-CD1 3.64Å; W19-Y30 AromaticContact CH2-CE1 3.92Å; W19-Y30 HydrophobicContact CH2-CE1 3.92Å; W19-Y30 AromaticContact CZ3-CD1 3.41Å; W19-Y30 HydrophobicContact CZ3-CD1 3.41Å; W19-Y30 VanDerWaalsContact CZ3-CD1 3.41Å; W19-Y30 AromaticContact CZ3-CE1 3.54Å; W19-Y30 HydrophobicContact CZ3-CE1 3.54Å; W19-Y30 HydrophobicContact CZ3-CG 4.16Å; Q26-Y30 WeakPolarHBondContact O-CB 3.39Å; Q26-Y30 PolarHBondContact O-N 3.22Å; S28-Y30 VanDerWaalsContact C-N 3.33Å; S28-Y30 PolarHBondContact O-N 3.01Å; Y30-D32 VanDerWaalsContact C-N 3.33Å; Y30-D32 PolarHBondContact O-N 2.76Å; Y30-V33 PolarHBondContact O-N 3.21Å; Y30-M34 HydrophobicContact CD1-CG 4.25Å; Y30-M34 HydrophobicContact CD2-CG 3.73Å; Y30-M34 HydrophobicContact CD2-SD 4.43Å; Y30-M34 HydrophobicContact CE1-CG 3.95Å; Y30-M34 HydrophobicContact CE2-CG 3.43Å; Y30-M34 VanDerWaalsContact CE2-CG 3.43Å; Y30-M34 HydrophobicContact CE2-SD 3.96Å; Y30-M34 HydrophobicContact CG-CG 4.18Å; Y30-M34 WeakPolarHBondContact O-CB 3.42Å; Y30-M34 VanDerWaalsContact O-CG 3.25Å; Y30-M34 WeakPolarHBondContact O-CG 3.34Å; Y30-M34 PolarHBondContact O-N 3.09Å
31	K	50.8	Low	51.9	Low	129 Å²	129	77.7 Å²	77.7	56%	0.561	40%	0.398	S	S	*	.	H	α-helix	trans	-59.5	-43.9	176.6	-73.7	175.5	-179.9	-175.9	0	111.8	K27 S28 L35	K27-K31 VanDerWaalsContact O-CG 3.32Å; K27-K31 WeakPolarHBondContact O-CG 3.38Å; K27-K31 PolarHBondContact O-N 3.24Å; K27-K31 VanDerWaalsContact O-N 3.09Å; S28-K31 PolarHBondContact O-N 3.2Å; K31-L35 WeakPolarHBondContact O-CB 3.31Å; K31-L35 PolarHBondContact O-N 3.2Å
32	D	47.8	Very low	51.5	Low	80 Å²	80	73.2 Å²	73.2	43%	0.428	38%	0.375	S	S	.	.	H	α-helix	trans	-63.7	-46.7	178.7	-68.2	-21.1	0	0	0	111.7	S28 L29 Y30 L35 E36	S28-D32 VanDerWaalsContact O-CG 3.3Å; S28-D32 PolarHBondContact O-N 3.27Å; L29-D32 PolarHBondContact O-N 3.48Å; Y30-D32 VanDerWaalsContact C-N 3.33Å; Y30-D32 PolarHBondContact O-N 2.76Å; D32-L35 PolarHBondContact O-N 3.26Å; D32-E36 VanDerWaalsContact O-CB 3.29Å; D32-E36 WeakPolarHBondContact O-CB 3.46Å; D32-E36 PolarHBondContact O-N 3.31Å
33	V	51.1	Low	51.2	Low	64 Å²	64	72.3 Å²	72.3	39%	0.388	37%	0.371	S	S	.	.	H	α-helix	trans	-67.2	-42.6	-179.6	171.2	0	0	0	0	111.3	L29 Y30 E36 T37	L29-V33 HydrophobicContact CD1-CG2 4Å; L29-V33 HydrophobicContact CG-CG2 4.28Å; L29-V33 WeakPolarHBondContact O-CB 3.43Å; L29-V33 WeakPolarHBondContact O-CG2 3.42Å; L29-V33 PolarHBondContact O-N 2.95Å; Y30-V33 PolarHBondContact O-N 3.21Å; V33-E36 PolarHBondContact O-N 2.93Å; V33-T37 VanDerWaalsContact O-CB 3.23Å; V33-T37 WeakPolarHBondContact O-CB 3.34Å; V33-T37 PolarHBondContact O-N 3.41Å; V33-T37 PolarHBondContact O-OG1 2.99Å
34	M	63.8	Low	50.7	Low	30 Å²	30	73.2 Å²	73.2	15%	0.148	38%	0.379	C	S	.	.	H	α-helix	trans	-68.3	-38.8	178.7	-69.7	-47.5	-61.2	0	0	111.8	Y11 V12 Y30 T37 Y38	Y11-M34 HydrophobicContact CD2-CE 3.53Å; Y11-M34 HydrophobicContact CE2-CE 4.03Å; Y11-M34 HydrophobicContact CG-CE 4.32Å; V12-M34 HydrophobicContact CB-SD 4.19Å; V12-M34 HydrophobicContact CG2-SD 4.43Å; Y30-M34 HydrophobicContact CD1-CG 4.25Å; Y30-M34 HydrophobicContact CD2-CG 3.73Å; Y30-M34 HydrophobicContact CD2-SD 4.43Å; Y30-M34 HydrophobicContact CE1-CG 3.95Å; Y30-M34 HydrophobicContact CE2-CG 3.43Å; Y30-M34 VanDerWaalsContact CE2-CG 3.43Å; Y30-M34 HydrophobicContact CE2-SD 3.96Å; Y30-M34 HydrophobicContact CG-CG 4.18Å; Y30-M34 WeakPolarHBondContact O-CB 3.42Å; Y30-M34 VanDerWaalsContact O-CG 3.25Å; Y30-M34 WeakPolarHBondContact O-CG 3.34Å; Y30-M34 PolarHBondContact O-N 3.09Å; M34-T37 PolarHBondContact O-N 2.91Å; M34-Y38 VanDerWaalsContact O-CB 3.3Å; M34-Y38 WeakPolarHBondContact O-CB 3.41Å; M34-Y38 PolarHBondContact O-N 3.48Å
35	L	49.2	Very low	50.6	Low	81 Å²	81	70.3 Å²	70.3	42%	0.424	37%	0.369	S	S	.	.	H	α-helix	trans	-66.2	-40.3	175.4	-174.3	64.4	0	0	0	111.8	K31 D32 R39	K31-L35 WeakPolarHBondContact O-CB 3.31Å; K31-L35 PolarHBondContact O-N 3.2Å; D32-L35 PolarHBondContact O-N 3.26Å; L35-R39 WeakPolarHBondContact O-CB 3.43Å; L35-R39 WeakPolarHBondContact O-CD 3.43Å; L35-R39 WeakPolarHBondContact O-CG 3.45Å; L35-R39 PolarHBondContact O-N 3.41Å
36	E	49.9	Very low	50.3	Low	73 Å²	73	70.2 Å²	70.2	34%	0.341	36%	0.355	S	S	.	.	H	α-helix	trans	-70.4	-38.1	176	-168.1	167.5	-170.9	0	0	111.8	D32 V33 R39 N40	D32-E36 VanDerWaalsContact O-CB 3.29Å; D32-E36 WeakPolarHBondContact O-CB 3.46Å; D32-E36 PolarHBondContact O-N 3.31Å; V33-E36 PolarHBondContact O-N 2.93Å; E36-R39 PolarHBondContact O-N 3.24Å; E36-N40 WeakPolarHBondContact O-CB 3.45Å; E36-N40 PolarHBondContact O-N 2.79Å; E36-N40 PolarHBondContact O-ND2 3.37Å; E36-N40 VanDerWaalsContact O-ND2 3.14Å
37	T	48.3	Very low	50	Low	34 Å²	34	72.2 Å²	72.2	21%	0.209	37%	0.367	C	S	.	.	H	α-helix	trans	-63.1	-45.6	174.1	-59	0	0	0	0	111.1	V10 V33 M34 R39 N40 L41	V10-T37 HydrophobicContact CB-CG2 4.41Å; V10-T37 HydrophobicContact CG1-CG2 3.47Å; V10-T37 VanDerWaalsContact CG1-CG2 3.47Å; V33-T37 VanDerWaalsContact O-CB 3.23Å; V33-T37 WeakPolarHBondContact O-CB 3.34Å; V33-T37 PolarHBondContact O-N 3.41Å; V33-T37 PolarHBondContact O-OG1 2.99Å; M34-T37 PolarHBondContact O-N 2.91Å; T37-R39 PolarHBondContact O-N 3.4Å; T37-N40 PolarHBondContact O-N 2.98Å; T37-L41 HydrophobicContact CG2-CD1 3.99Å; T37-L41 HydrophobicContact CG2-CG 4.47Å; T37-L41 WeakPolarHBondContact O-CG 3.34Å; T37-L41 PolarHBondContact O-N 2.88Å
38	Y	51.9	Low	49.5	Very low	133 Å²	133	76.2 Å²	76.2	52%	0.522	38%	0.381	S	S	.	.	H	α-helix	trans	-59.4	-44.9	174.1	179.1	-99.7	0	0	0	111.7	M34 N40 L41 N42	M34-Y38 VanDerWaalsContact O-CB 3.3Å; M34-Y38 WeakPolarHBondContact O-CB 3.41Å; M34-Y38 PolarHBondContact O-N 3.48Å; Y38-N40 VanDerWaalsContact C-N 3.31Å; Y38-N40 PolarHBondContact O-N 2.78Å; Y38-L41 PolarHBondContact O-N 3.23Å; Y38-N42 PolarHBondContact O-N 2.85Å; Y38-N42 PolarHBondContact OH-ND2 3.25Å
39	R	51	Low	48.8	Very low	157 Å²	157	81.5 Å²	81.5	59%	0.592	40%	0.399	S	S	*	.	H	α-helix	trans	-62.5	-36.9	175.9	-74.1	167.4	179.9	174.8	0.6	112.6	L35 E36 T37 A43	L35-R39 WeakPolarHBondContact O-CB 3.43Å; L35-R39 WeakPolarHBondContact O-CD 3.43Å; L35-R39 WeakPolarHBondContact O-CG 3.45Å; L35-R39 PolarHBondContact O-N 3.41Å; E36-R39 PolarHBondContact O-N 3.24Å; T37-R39 PolarHBondContact O-N 3.4Å; R39-A43 WeakPolarHBondContact O-CB 3.22Å; R39-A43 PolarHBondContact O-N 3.41Å
40	N	53.1	Low	48.1	Very low	77 Å²	77	85.5 Å²	85.5	41%	0.412	42%	0.421	S	S	.	.	H	α-helix	trans	-73.7	-39.8	178.7	-72.6	-29.2	0	0	0	112.2	E36 T37 Y38 A43 V44	E36-N40 WeakPolarHBondContact O-CB 3.45Å; E36-N40 PolarHBondContact O-N 2.79Å; E36-N40 PolarHBondContact O-ND2 3.37Å; E36-N40 VanDerWaalsContact O-ND2 3.14Å; T37-N40 PolarHBondContact O-N 2.98Å; Y38-N40 VanDerWaalsContact C-N 3.31Å; Y38-N40 PolarHBondContact O-N 2.78Å; N40-A43 WeakPolarHBondContact O-CB 3.35Å; N40-A43 PolarHBondContact O-N 3.07Å; N40-V44 WeakPolarHBondContact O-CG2 3.44Å; N40-V44 PolarHBondContact O-N 3.39Å
41	L	51	Low	46.9	Very low	54 Å²	54	87.6 Å²	87.6	28%	0.283	44%	0.441	S	S	.	.	H	α-helix	trans	-68.6	-44.7	178.6	-70.7	170	0	0	0	112.2	V10 T37 Y38 A43 V44	V10-L41 HydrophobicContact CB-CD1 3.92Å; V10-L41 HydrophobicContact CG1-CD1 4.03Å; V10-L41 HydrophobicContact CG2-CD1 4.04Å; V10-L41 HydrophobicContact CG2-CD2 4.23Å; T37-L41 HydrophobicContact CG2-CD1 3.99Å; T37-L41 HydrophobicContact CG2-CG 4.47Å; T37-L41 WeakPolarHBondContact O-CG 3.34Å; T37-L41 PolarHBondContact O-N 2.88Å; Y38-L41 PolarHBondContact O-N 3.23Å; L41-A43 PolarHBondContact O-N 3.21Å; L41-V44 PolarHBondContact O-N 3.14Å; L41-V44 VanDerWaalsContact O-N 3.13Å
42	N	49.1	Very low	46.4	Very low	53 Å²	53	86.8 Å²	86.8	28%	0.283	44%	0.443	S	S	.	.	H	α-helix	trans	-60.1	-27.3	172.8	-86.4	13.7	0	0	0	112.3	Y38	Y38-N42 PolarHBondContact O-N 2.85Å; Y38-N42 PolarHBondContact OH-ND2 3.25Å
43	A	49.1	Very low	45.9	Very low	7 Å²	7	87.8 Å²	87.8	6%	0.058	45%	0.447	C	S	.	.	H	α-helix	trans	-77.9	-20.8	179.1	0	0	0	0	0	114.7	R39 N40 L41 G45 I118	R39-A43 WeakPolarHBondContact O-CB 3.22Å; R39-A43 PolarHBondContact O-N 3.41Å; N40-A43 WeakPolarHBondContact O-CB 3.35Å; N40-A43 PolarHBondContact O-N 3.07Å; L41-A43 PolarHBondContact O-N 3.21Å; A43-G45 VanDerWaalsContact C-N 3.35Å; A43-I118 HydrophobicContact CB-CD1 3.19Å
44	V	46.1	Very low	45.1	Very low	92 Å²	92	91.8 Å²	91.8	56%	0.558	46%	0.462	S	S	*	.	H	α-helix	trans	-88	-9.9	179.5	-174.1	0	0	0	0	111.6	N40 L41 Y46 K102	N40-V44 WeakPolarHBondContact O-CG2 3.44Å; N40-V44 PolarHBondContact O-N 3.39Å; L41-V44 PolarHBondContact O-N 3.14Å; L41-V44 VanDerWaalsContact O-N 3.13Å; V44-Y46 HydrophobicContact CG1-CE2 4.43Å; V44-K102 PolarHBondContact O-NZ 2.86Å
45	G	44.2	Very low	43.7	Very low	47 Å²	47	96.6 Å²	96.6	49%	0.485	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	102.6	27	171.5	0	0	0	0	0	114.6	A43	A43-G45 VanDerWaalsContact C-N 3.35Å
46	Y	40.5	Very low	42.9	Very low	90 Å²	90	99.8 Å²	99.8	35%	0.353	50%	0.496	S	S	.	.			trans	-88.4	119.4	169.2	-72.7	-89.9	0	0	0	109.1	L5 V44	L5-Y46 PolarHBondContact N-OH 2.8Å; V44-Y46 HydrophobicContact CG1-CE2 4.43Å
47	N	42.6	Very low	41.9	Very low	91 Å²	91	100.6 Å²	100.6	49%	0.487	51%	0.509	S	S	.	.			trans	-97.7	131.1	169	-81.8	-14	0	0	0	108.7
48	W	42.6	Very low	41	Very low	139 Å²	139	103.4 Å²	103.4	53%	0.527	52%	0.52	S	S	.	.			trans	-95.7	101.5	169.2	-176.8	-91.3	0	0	0	107.4	Y7	Y7-W48 VanDerWaalsContact CB-CZ3 3.42Å; Y7-W48 HydrophobicContact CD1-CH2 4.41Å; Y7-W48 HydrophobicContact CD2-CZ3 4.36Å; Y7-W48 HydrophobicContact CG-CH2 4.14Å; Y7-W48 AromaticContact CG-CZ3 3.95Å; Y7-W48 HydrophobicContact CG-CZ3 3.95Å
49	E	32.7	Very low	40	Very low	172 Å²	172	99.1 Å²	99.1	80%	0.804	51%	0.509	S	S	*	.			trans	-86.9	126.3	168.3	-74.4	-178.2	172.7	0	0	109
50	D	38.1	Very low	39.1	Very low	153 Å²	153	96.3 Å²	96.3	82%	0.818	51%	0.513	S	S	*	.			trans	33.3	98.9	167.9	-76.7	-27.3	0	0	0	119.3
51	S	31.7	Very low	38.3	Very low	84 Å²	84	103 Å²	103	59%	0.587	53%	0.533	S	S	*	.	S	Bend	trans	-152.4	89.6	136.2	-71.2	0	0	0	0	108.5	I53	S51-I53 PolarHBondContact O-N 2.89Å
52	N	40.7	Very low	37.4	Very low	111 Å²	111	109.4 Å²	109.4	59%	0.594	55%	0.554	S	S	*	*			trans	48.7	48.9	151	-99.1	1.2	0	0	0	119.8	E55	N52-E55 PolarHBondContact ND2-OE2 2.81Å; N52-E55 PolarHBondContact OD1-OE2 3.39Å
53	I	38.2	Very low	36.6	Very low	102 Å²	102	114.8 Å²	114.8	52%	0.523	58%	0.576	S	S	.	*	H	α-helix	trans	-83.9	-29.6	174.5	-66.1	171.1	0	0	0	112.6	S51 C57	S51-I53 PolarHBondContact O-N 2.89Å; I53-C57 WeakPolarHBondContact O-CB 3.27Å; I53-C57 PolarHBondContact O-N 3.36Å
54	E	33	Very low	35.7	Very low	147 Å²	147	118 Å²	118	69%	0.687	61%	0.61	S	S	*	*	H	α-helix	trans	-75.3	-34.7	175.7	-95	176.2	172.2	0	0	112.5	H56 E58	E54-H56 PolarHBondContact O-N 3.11Å; E54-E58 WeakPolarHBondContact O-CB 3.35Å; E54-E58 WeakPolarHBondContact O-CG 3.39Å; E54-E58 PolarHBondContact O-N 3.23Å
55	E	34.5	Very low	35	Very low	131 Å²	131	124.3 Å²	124.3	61%	0.612	62%	0.624	S	S	*	*	H	α-helix	trans	-71.3	-29	178.8	-150.9	173	-161.6	0	0	112.5	N52 S59	N52-E55 PolarHBondContact ND2-OE2 2.81Å; N52-E55 PolarHBondContact OD1-OE2 3.39Å; E55-S59 PolarHBondContact O-N 3.01Å
56	H	32	Very low	34.5	Very low	149 Å²	149	130.9 Å²	130.9	69%	0.69	64%	0.642	S	S	*	*	H	α-helix	trans	-86.8	-26.8	178.6	-134.2	38.4	0	0	0	114	E54 S59	E54-H56 PolarHBondContact O-N 3.11Å; H56-S59 PolarHBondContact O-OG 3.43Å
57	C	30	Very low	33.8	Very low	90 Å²	90	135.6 Å²	135.6	61%	0.608	67%	0.667	S	S	*	*	H	α-helix	trans	-82.1	-26.2	174	-137.2	0	0	0	0	112.4	I53 S60	I53-C57 WeakPolarHBondContact O-CB 3.27Å; I53-C57 PolarHBondContact O-N 3.36Å; C57-S60 PolarHBondContact O-N 3.34Å
58	E	29.6	Very low	33.2	Very low	92 Å²	92	142.9 Å²	142.9	43%	0.43	69%	0.688	S	S	.	*	H	α-helix	trans	-74.5	-25.2	170	-75.8	-167.5	177.7	0	0	113.7	E54 S60 R61 R62	E54-E58 WeakPolarHBondContact O-CB 3.35Å; E54-E58 WeakPolarHBondContact O-CG 3.39Å; E54-E58 PolarHBondContact O-N 3.23Å; E58-S60 PolarHBondContact O-N 3.2Å; E58-R61 PolarHBondContact O-N 3.23Å; E58-R62 PolarHBondContact O-N 3.27Å; E58-R62 IonicContact OE2-NH2 2.99Å; E58-R62 PolarHBondContact OE2-NH2 3.25Å
59	S	30.8	Very low	32.5	Very low	43 Å²	43	143 Å²	143	30%	0.301	70%	0.699	S	S	.	*	H	α-helix	trans	-59.8	-29	171.1	81	0	0	0	0	112.1	E55 H56 R61 H63	E55-S59 PolarHBondContact O-N 3.01Å; H56-S59 PolarHBondContact O-OG 3.43Å; S59-R61 VanDerWaalsContact C-N 3.34Å; S59-R61 PolarHBondContact O-N 3.38Å; S59-H63 PolarHBondContact O-ND1 3.21Å
60	S	31.3	Very low	32.2	Very low	98 Å²	98	143.2 Å²	143.2	69%	0.685	70%	0.699	S	S	*	*	H	α-helix	trans	-80.8	-10.1	175.7	-64.5	0	0	0	0	114	C57 E58	C57-S60 PolarHBondContact O-N 3.34Å; E58-S60 PolarHBondContact O-N 3.2Å
61	R	36	Very low	31.6	Very low	217 Å²	217	142.5 Å²	142.5	82%	0.819	70%	0.701	S	S	*	*	H	α-helix	trans	-103	-19.9	179.5	-76.4	-177.9	176.3	163.9	-1.2	114.3	E58 S59	E58-R61 PolarHBondContact O-N 3.23Å; S59-R61 VanDerWaalsContact C-N 3.34Å; S59-R61 PolarHBondContact O-N 3.38Å
62	R	32.1	Very low	31.6	Very low	190 Å²	190	142 Å²	142	72%	0.717	71%	0.709	S	S	*	*	H	α-helix	trans	-90.6	-14.6	176.8	-67	-171.9	-156.5	-177.4	9.6	115.1	E58 G64	E58-R62 PolarHBondContact O-N 3.27Å; E58-R62 IonicContact OE2-NH2 2.99Å; E58-R62 PolarHBondContact OE2-NH2 3.25Å; R62-G64 VanDerWaalsContact C-N 3.31Å; R62-G64 PolarHBondContact O-N 3.05Å
63	H	32.9	Very low	30.9	Very low	165 Å²	165	146.3 Å²	146.3	76%	0.764	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	8.4	178	-66.5	99.3	0	0	0	114.6	S59	S59-H63 PolarHBondContact O-ND1 3.21Å
64	G	30.9	Very low	30.4	Very low	74 Å²	74	151 Å²	151	76%	0.763	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.1	17.6	178.8	0	0	0	0	0	115.1	R62	R62-G64 VanDerWaalsContact C-N 3.31Å; R62-G64 PolarHBondContact O-N 3.05Å
65	R	30.8	Very low	30	Very low	225 Å²	225	150.1 Å²	150.1	85%	0.849	75%	0.749	S	S	*	*	S	Bend	trans	-134.9	55.3	176.9	-159.4	-169.6	-128	-157.1	3	111.9
66	H	33.4	Very low	29.4	Very low	185 Å²	185	154.5 Å²	154.5	86%	0.856	76%	0.761	S	S	*	*	S	Bend	trans	-152.4	139.5	146.8	-107.5	-85.3	0	0	0	106.2
67	E	26.7	Very low	29.1	Very low	190 Å²	190	155.8 Å²	155.8	89%	0.888	77%	0.768	S	S	*	*			trans	81.9	67.1	-172.9	-53.8	-171.3	166.9	0	0	116.8
68	R	29.6	Very low	28.7	Very low	243 Å²	243	154.9 Å²	154.9	92%	0.917	77%	0.774	S	S	*	*				-109.4	110.6	129.3	-89	-170.4	-73.3	-165.2	-3.9	107.3
69	N	26.8	Very low	28.5	Very low	142 Å²	142	158 Å²	158	76%	0.759	79%	0.791	S	S	*	*			trans	-145.8	117.7	152.4	-90.9	-20.4	0	0	0	108.1
70	H	27.8	Very low	28.2	Very low	177 Å²	177	164.8 Å²	164.8	82%	0.819	82%	0.819	S	S	*	*	S	Bend	trans	66.2	120.3	171.3	-53.2	-67.9	0	0	0	115.2
71	T	25.6	Very low	27.7	Very low	138 Å²	138	171 Å²	171	85%	0.847	83%	0.828	S	S	*	*			cis	-143.7	147.6	38.5	42	0	0	0	0	110.7
72	G	30.6	Very low	27.2	Very low	73 Å²	73	164 Å²	164	75%	0.753	82%	0.824	S	S	*	*			trans	-77.6	152.7	-169.5	0	0	0	0	0	115.4
73	E	25.8	Very low	27.1	Very low	202 Å²	202	164.4 Å²	164.4	94%	0.944	83%	0.834	S	S	*	*			trans	-163.4	147.1	141.7	-105.5	169.8	-161.5	0	0	109
74	K	28.1	Very low	27	Very low	199 Å²	199	161 Å²	161	87%	0.865	83%	0.834	S	S	*	*			trans	-74	159.3	-162.2	-76.9	179.2	176.2	177.5	0	114.7
75	P	24.3	Very low	26.9	Very low	129 Å²	129	167.4 Å²	167.4	84%	0.838	84%	0.841	S	S	*	*			trans	-87.9	148.2	179.1	35	-31.7	0	0	0	113.2
76	Y	21.4	Very low	26.9	Very low	224 Å²	224	161.6 Å²	161.6	88%	0.878	83%	0.831	S	S	*	*			trans	-105.3	137.4	164.7	-175.6	-100.3	0	0	0	110.2
77	E	26.1	Very low	26.7	Very low	176 Å²	176	160.1 Å²	160.1	82%	0.822	82%	0.824	S	S	*	*			trans	-68	154.1	-170.9	-64.6	174.1	142.7	0	0	114.2
78	G	22	Very low	26.7	Very low	71 Å²	71	158.6 Å²	158.6	73%	0.732	82%	0.816	S	S	*	*			trans	-174.4	61.3	179.3	0	0	0	0	0	116.7
79	I	24.9	Very low	26.6	Very low	156 Å²	156	150.2 Å²	150.2	80%	0.8	80%	0.795	S	S	*	*			trans	72.8	102.9	145.7	-49.9	170.8	0	0	0	118.1	Y81	I79-Y81 HydrophobicContact CG2-CD2 3.88Å; I79-Y81 HydrophobicContact CG2-CE2 4.4Å
80	Q	24.2	Very low	27	Very low	187 Å²	187	145.9 Å²	145.9	87%	0.874	78%	0.776	S	S	*	*			trans	-66.6	129.5	154.2	-84.9	174.7	-49.1	0	0	110.7
81	Y	21.9	Very low	27.2	Very low	227 Å²	227	142.4 Å²	142.4	89%	0.89	76%	0.763	S	S	*	*			trans	-140.4	108.7	146.6	-101.1	-84.9	0	0	0	109.8	I79	I79-Y81 HydrophobicContact CG2-CD2 3.88Å; I79-Y81 HydrophobicContact CG2-CE2 4.4Å
82	G	25.2	Very low	27.5	Very low	71 Å²	71	142 Å²	142	73%	0.732	75%	0.751	S	S	*	*			trans	74.6	74.1	137.1	0	0	0	0	0	118.3
83	E	31	Very low	27.5	Very low	199 Å²	199	142.2 Å²	142.2	93%	0.93	73%	0.734	S	S	*	*			trans	-61	148.5	140.2	-72.6	176.6	149	0	0	109.3
84	A	30.9	Very low	28	Very low	92 Å²	92	140.7 Å²	140.7	76%	0.76	72%	0.719	S	S	*	*			trans	89.9	71	178.5	0	0	0	0	0	117.1
85	F	27.5	Very low	28.1	Very low	209 Å²	209	139.1 Å²	139.1	92%	0.917	71%	0.713	S	S	*	*	S	Bend	trans	-162.7	33.9	144.7	-115.5	-73.5	0	0	0	115.6
86	V	31.1	Very low	28.8	Very low	103 Å²	103	135.5 Å²	135.5	62%	0.624	69%	0.685	S	S	*	*			trans	-149.9	63.8	173	-160.1	0	0	0	0	112.6	S90	V86-S90 PolarHBondContact O-OG 2.82Å
87	H	29.7	Very low	29.5	Very low	155 Å²	155	129.1 Å²	129.1	72%	0.718	67%	0.666	S	S	*	*	S	Bend	trans	-119.1	-2.9	174.1	-140.8	-76.1	0	0	0	115.6
88	H	25.3	Very low	30	Very low	157 Å²	157	128.1 Å²	128.1	73%	0.727	66%	0.661	S	S	*	*	S	Bend	trans	-105.1	-35.5	176	-155.9	-81.8	0	0	0	113.4
89	S	29.5	Very low	31	Very low	67 Å²	67	128.8 Å²	128.8	47%	0.469	65%	0.651	S	S	.	*	H	α-helix	trans	-77.4	-25.8	-179.6	39.2	0	0	0	0	113.7	M93	S89-M93 WeakPolarHBondContact O-CB 3.45Å; S89-M93 WeakPolarHBondContact O-CG 3.14Å; S89-M93 PolarHBondContact O-N 3.48Å
90	S	34.8	Very low	32.2	Very low	51 Å²	51	123.7 Å²	123.7	36%	0.357	64%	0.636	S	S	.	*	H	α-helix	trans	-76.8	-35	179.8	24.8	0	0	0	0	113.1	V86 M93 R94	V86-S90 PolarHBondContact O-OG 2.82Å; S90-M93 PolarHBondContact O-N 3.46Å; S90-R94 PolarHBondContact O-N 3.45Å
91	L	32.1	Very low	33.3	Very low	104 Å²	104	119 Å²	119	55%	0.545	62%	0.615	S	S	.	*	H	α-helix	trans	-73.2	-37	175.4	-75.6	170	0	0	0	112.5	M93 R94 K95	L91-M93 VanDerWaalsContact C-N 3.29Å; L91-M93 PolarHBondContact O-N 3.26Å; L91-R94 PolarHBondContact O-N 3.4Å; L91-K95 PolarHBondContact O-N 2.75Å
92	Q	31.6	Very low	34.9	Very low	129 Å²	129	112.6 Å²	112.6	60%	0.603	59%	0.591	S	S	*	*	H	α-helix	trans	-68.3	-30.8	173.3	-155.4	167.6	5.5	0	0	111.7
93	M	30.8	Very low	36.6	Very low	78 Å²	78	116.5 Å²	116.5	38%	0.384	58%	0.584	S	S	.	*	H	α-helix	trans	-73.9	-33.8	174.3	-76.6	-79.7	-80.3	0	0	113.7	S89 S90 L91 I96 I97 R115	S89-M93 WeakPolarHBondContact O-CB 3.45Å; S89-M93 WeakPolarHBondContact O-CG 3.14Å; S89-M93 PolarHBondContact O-N 3.48Å; S90-M93 PolarHBondContact O-N 3.46Å; L91-M93 VanDerWaalsContact C-N 3.29Å; L91-M93 PolarHBondContact O-N 3.26Å; M93-I96 PolarHBondContact O-N 3.26Å; M93-I97 WeakPolarHBondContact O-CG1 3.39Å; M93-R115 VanDerWaalsContact CE-NH2 3.25Å
94	R	36.6	Very low	38.1	Very low	170 Å²	170	111.9 Å²	111.9	64%	0.642	56%	0.559	S	S	*	*	H	α-helix	trans	-67.8	-34.3	175.8	-127.4	178.5	-169.1	-175.8	0.8	112.1	S90 L91 I96 I97 H98	S90-R94 PolarHBondContact O-N 3.45Å; L91-R94 PolarHBondContact O-N 3.4Å; R94-I96 PolarHBondContact O-N 3.25Å; R94-I97 PolarHBondContact O-N 3.18Å; R94-H98 PolarHBondContact O-N 2.77Å
95	K	28.9	Very low	39.9	Very low	167 Å²	167	114.7 Å²	114.7	73%	0.726	55%	0.554	S	S	*	*	H	α-helix	trans	-67.3	-28.8	175.6	-92.4	-177	174.1	179.4	0	114.3	L91 T99	L91-K95 PolarHBondContact O-N 2.75Å; K95-T99 PolarHBondContact O-OG1 3.45Å
96	I	38.6	Very low	42	Very low	52 Å²	52	105.2 Å²	105.2	27%	0.267	51%	0.513	S	S	.	.	H	α-helix	trans	-79.5	-25.5	179.8	-63.9	167.8	0	0	0	111.8	M93 R94 T99	M93-I96 PolarHBondContact O-N 3.26Å; R94-I96 PolarHBondContact O-N 3.25Å; I96-T99 PolarHBondContact O-OG1 3.07Å
97	I	37.8	Very low	43.7	Very low	91 Å²	91	107.2 Å²	107.2	47%	0.467	52%	0.52	S	S	.	.	H	α-helix	trans	-78	-35.6	179.8	-62.6	168.9	0	0	0	110.8	M93 R94 T99	M93-I97 WeakPolarHBondContact O-CG1 3.39Å; R94-I97 PolarHBondContact O-N 3.18Å; I97-T99 VanDerWaalsContact C-N 3.34Å; I97-T99 PolarHBondContact O-N 3.2Å
98	H	36.7	Very low	45.5	Very low	154 Å²	154	106.1 Å²	106.1	71%	0.713	52%	0.516	S	S	*	.	H	α-helix	trans	-72.8	-19.1	179.1	-92.3	-58.8	0	0	0	115	R94	R94-H98 PolarHBondContact O-N 2.77Å
99	T	42.3	Very low	47.8	Very low	86 Å²	86	100.1 Å²	100.1	53%	0.528	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-2.9	-175.6	55.2	0	0	0	0	114.6	K95 I96 I97 E101	K95-T99 PolarHBondContact O-OG1 3.45Å; I96-T99 PolarHBondContact O-OG1 3.07Å; I97-T99 VanDerWaalsContact C-N 3.34Å; I97-T99 PolarHBondContact O-N 3.2Å; T99-E101 PolarHBondContact O-N 3.31Å
100	G	48.7	Very low	49.5	Very low	48 Å²	48	105.4 Å²	105.4	50%	0.495	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.8	12.2	-179.9	0	0	0	0	0	114.8	K102	G100-K102 PolarHBondContact O-N 2.82Å
101	E	48.3	Very low	50.9	Low	89 Å²	89	108.8 Å²	108.8	42%	0.416	52%	0.523	S	S	.	.			trans	-69.9	102.1	-174.6	-80.8	-170.1	155.7	0	0	112	T99 R103	T99-E101 PolarHBondContact O-N 3.31Å; E101-R103 VanDerWaalsContact C-N 3.27Å; E101-R103 HydrophobicContact CB-CG 4.16Å; E101-R103 PolarHBondContact O-N 2.93Å; E101-R103 IonicContact OE2-CZ 3.2Å; E101-R103 IonicContact OE2-NE 2.83Å; E101-R103 PolarHBondContact OE2-NE 3.39Å; E101-R103 IonicContact OE2-NH2 2.72Å; E101-R103 PolarHBondContact OE2-NH2 3.08Å
102	K	55	Low	52.1	Low	92 Å²	92	105 Å²	105	40%	0.4	51%	0.507	S	S	.	.			trans	-77.2	74.4	170.7	-68	173	172.1	178.7	0	110.6	V44 G100 Y104 A112 Y113	V44-K102 PolarHBondContact O-NZ 2.86Å; G100-K102 PolarHBondContact O-N 2.82Å; K102-Y104 VanDerWaalsContact C-N 3.34Å; K102-Y104 PolarHBondContact O-N 3.44Å; K102-A112 HydrophobicContact CB-CB 3.53Å; K102-A112 HydrophobicContact CD-CB 4.36Å; K102-A112 WeakPolarHBondContact CD-O 3.45Å; K102-A112 HydrophobicContact CG-CB 4.47Å; K102-Y113 CarbonylContact C-O 3.54Å
103	R	61.1	Low	53.8	Low	154 Å²	154	100.4 Å²	100.4	58%	0.581	48%	0.484	S	S	*	.			trans	-67.9	-26.3	-175.4	-69.9	-174.3	-179.5	-169.9	-3.1	114.6	E101 Y113	E101-R103 VanDerWaalsContact C-N 3.27Å; E101-R103 HydrophobicContact CB-CG 4.16Å; E101-R103 PolarHBondContact O-N 2.93Å; E101-R103 IonicContact OE2-CZ 3.2Å; E101-R103 IonicContact OE2-NE 2.83Å; E101-R103 PolarHBondContact OE2-NE 3.39Å; E101-R103 IonicContact OE2-NH2 2.72Å; E101-R103 PolarHBondContact OE2-NH2 3.08Å; R103-Y113 PolarHBondContact N-O 3.39Å
104	Y	63.7	Low	54.9	Low	101 Å²	101	98.4 Å²	98.4	40%	0.396	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	94.8	-172.5	-60.1	-78.4	0	0	0	111.3	K102 A112 Y113 H116	K102-Y104 VanDerWaalsContact C-N 3.34Å; K102-Y104 PolarHBondContact O-N 3.44Å; Y104-A112 CarbonylContact O-C 3.6Å; Y104-A112 WeakPolarHBondContact O-CA 3.27Å; Y104-Y113 WeakPolarHBondContact CB-O 3.24Å; Y104-Y113 PolarHBondContact N-O 3.26Å; Y104-Y113 PolarHBondContact O-N 3.41Å; Y104-H116 HydrophobicContact CD1-CB 4.1Å; Y104-H116 HydrophobicContact CE1-CB 3.97Å; Y104-H116 HydrophobicContact CE2-CB 4.43Å; Y104-H116 HydrophobicContact CG-CB 4.39Å
105	K	67.1	Low	56.1	Low	151 Å²	151	96.2 Å²	96.2	66%	0.657	47%	0.469	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.3	142.2	178.3	-60.1	-175.1	-179	179.3	0	111.2	N107 A112 L119	K105-N107 PolarHBondContact O-OD1 3.27Å; K105-A112 HydrophobicContact CG-CB 3.92Å; K105-L119 WeakPolarHBondContact O-CD2 3.41Å
106	C	71.4	Confident	57.4	Low	10 Å²	10	92.8 Å²	92.8	7%	0.068	46%	0.455	C	S	.	.			trans	-78.6	132.7	168.9	-174.7	0	0	0	0	109.3	Q108 C109 K111 Y113 L119 H126	C106-Q108 PolarHBondContact O-N 3.43Å; C106-Q108 PolarHBondContact SG-N 3.3Å; C106-C109 CarbonylContact C-O 3.5Å; C106-C109 WeakPolarHBondContact CB-O 3.46Å; C106-K111 WeakPolarHBondContact CB-O 3.37Å; C106-K111 PolarHBondContact N-O 3.18Å; C106-Y113 HydrophobicContact CB-CE2 4.46Å; C106-L119 HydrophobicContact CB-CD1 3.73Å; C106-H126 PolarHBondContact SG-NE2 3.41Å
107	N	68.3	Low	58.4	Low	145 Å²	145	93.3 Å²	93.3	78%	0.775	46%	0.464	S	S	*	.	S	Bend	trans	-83.4	-3	-179.6	-57.7	-3.4	0	0	0	112.3	K105	K105-N107 PolarHBondContact O-OD1 3.27Å
108	Q	66.2	Low	59.6	Low	132 Å²	132	90.7 Å²	90.7	62%	0.617	45%	0.45	S	S	*	.	S	Bend	trans	-116.1	-4	-177.4	-61.5	177.6	19.8	0	0	112.4	C106	C106-Q108 PolarHBondContact O-N 3.43Å; C106-Q108 PolarHBondContact SG-N 3.3Å
109	C	74.3	Confident	60.9	Low	31 Å²	31	83.7 Å²	83.7	21%	0.209	42%	0.418	C	S	.	.	S	Bend	trans	-162.1	163.8	170.6	71.5	0	0	0	0	110.8	C106 K111 H122 H126	C106-C109 CarbonylContact C-O 3.5Å; C106-C109 WeakPolarHBondContact CB-O 3.46Å; C109-K111 PolarHBondContact O-N 3.07Å; C109-H122 PolarHBondContact SG-NE2 2.9Å; C109-H126 PolarHBondContact SG-NE2 3.22Å; C109-H126 VanDerWaalsContact SG-NE2 3.39Å
110	D	65.8	Low	62	Low	179 Å²	179	83 Å²	83	96%	0.957	41%	0.409	S	S	*	.	S	Bend	trans	-73.7	19.9	-175.3	-56.9	-42.4	0	0	0	115.1
111	K	63.7	Low	62.8	Low	122 Å²	122	83.6 Å²	83.6	53%	0.53	40%	0.4	S	S	.	.			trans	-91.2	130.7	-178.4	-63.1	-177.1	-179.1	178.9	0	111.4	C106 C109 Y113	C106-K111 WeakPolarHBondContact CB-O 3.37Å; C106-K111 PolarHBondContact N-O 3.18Å; C109-K111 PolarHBondContact O-N 3.07Å; K111-Y113 HydrophobicContact CB-CE2 3.83Å; K111-Y113 VanDerWaalsContact CB-OH 3.3Å; K111-Y113 WeakPolarHBondContact CB-OH 3.43Å; K111-Y113 WeakPolarHBondContact CD-OH 3.37Å
112	A	56.5	Low	63.7	Low	25 Å²	25	80.2 Å²	80.2	21%	0.207	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	142.6	177.9	0	0	0	0	0	111	K102 Y104 K105	K102-A112 HydrophobicContact CB-CB 3.53Å; K102-A112 HydrophobicContact CD-CB 4.36Å; K102-A112 WeakPolarHBondContact CD-O 3.45Å; K102-A112 HydrophobicContact CG-CB 4.47Å; Y104-A112 CarbonylContact O-C 3.6Å; Y104-A112 WeakPolarHBondContact O-CA 3.27Å; K105-A112 HydrophobicContact CG-CB 3.92Å
113	Y	67.6	Low	64.3	Low	32 Å²	32	78.9 Å²	78.9	13%	0.125	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	148.3	-172.4	-58	-84.2	0	0	0	110.7	K102 R103 Y104 C106 K111 R115 I118 L119 H122	K102-Y113 CarbonylContact C-O 3.54Å; R103-Y113 PolarHBondContact N-O 3.39Å; Y104-Y113 WeakPolarHBondContact CB-O 3.24Å; Y104-Y113 PolarHBondContact N-O 3.26Å; Y104-Y113 PolarHBondContact O-N 3.41Å; C106-Y113 HydrophobicContact CB-CE2 4.46Å; K111-Y113 HydrophobicContact CB-CE2 3.83Å; K111-Y113 VanDerWaalsContact CB-OH 3.3Å; K111-Y113 WeakPolarHBondContact CB-OH 3.43Å; K111-Y113 WeakPolarHBondContact CD-OH 3.37Å; Y113-R115 VanDerWaalsContact C-N 3.29Å; Y113-I118 HydrophobicContact CD1-CB 4.39Å; Y113-I118 HydrophobicContact CD1-CG2 3.57Å; Y113-I118 HydrophobicContact CE1-CG2 4.18Å; Y113-I118 HydrophobicContact CG-CG2 4.26Å; Y113-L119 HydrophobicContact CD2-CB 3.87Å; Y113-L119 HydrophobicContact CD2-CD1 3.73Å; Y113-L119 HydrophobicContact CD2-CG 4.39Å; Y113-L119 HydrophobicContact CE2-CD1 3.95Å; Y113-L119 HydrophobicContact CG-CB 4.3Å; Y113-H122 HydrophobicContact CE1-CB 4.2Å; Y113-H122 HydrophobicContact CE2-CB 3.9Å; Y113-H122 AromaticContact CE2-CD2 3.27Å; Y113-H122 WeakPolarHBondContact CE2-CD2 3.49Å; Y113-H122 AromaticContact CE2-CG 3.64Å; Y113-H122 AromaticContact CE2-NE2 3.96Å; Y113-H122 AromaticContact CZ-CD2 3.47Å; Y113-H122 VanDerWaalsContact CZ-CD2 3.47Å; Y113-H122 AromaticContact CZ-CG 3.37Å; Y113-H122 AromaticContact CZ-ND1 3.92Å; Y113-H122 PolarHBondContact OH-CD2 3.31Å; Y113-H122 PolarHBondContact OH-CE1 2.79Å; Y113-H122 PolarHBondContact OH-ND1 3.06Å; Y113-H122 PolarHBondContact OH-NE2 3.22Å
114	S	55.5	Low	65	Low	35 Å²	35	74.4 Å²	74.4	25%	0.245	36%	0.361	C	S	.	.	S	Bend	trans	-72.4	-23	177	54.4	0	0	0	0	112.8
115	R	61.3	Low	65	Low	125 Å²	125	73.8 Å²	73.8	47%	0.472	37%	0.369	S	S	.	.	S	Bend	trans	-134.5	141.9	-178.1	-60.1	-179.9	80.7	152.2	-0.4	112.1	M93 Y113 S117 I118 L119	M93-R115 VanDerWaalsContact CE-NH2 3.25Å; Y113-R115 VanDerWaalsContact C-N 3.29Å; R115-S117 VanDerWaalsContact C-N 3.32Å; R115-S117 PolarHBondContact O-N 3.42Å; R115-I118 HydrophobicContact CB-CD1 4.24Å; R115-I118 HydrophobicContact CB-CG1 4.24Å; R115-I118 PolarHBondContact O-N 3.24Å; R115-L119 PolarHBondContact O-N 2.89Å
116	H	56.6	Low	65	Low	94 Å²	94	70.1 Å²	70.1	44%	0.435	35%	0.353	S	S	.	.	H	α-helix	trans	-58.7	-40.2	176.8	-177.8	-105.1	0	0	0	112.6	Y104 I118 L119 Q120	Y104-H116 HydrophobicContact CD1-CB 4.1Å; Y104-H116 HydrophobicContact CE1-CB 3.97Å; Y104-H116 HydrophobicContact CE2-CB 4.43Å; Y104-H116 HydrophobicContact CG-CB 4.39Å; H116-I118 PolarHBondContact O-N 2.87Å; H116-L119 WeakPolarHBondContact O-CB 3.35Å; H116-L119 PolarHBondContact O-N 3.12Å; H116-Q120 VanDerWaalsContact CE1-CG 3.48Å; H116-Q120 WeakPolarHBondContact CE1-CG 3.48Å; H116-Q120 PolarHBondContact CE1-NE2 3.28Å; H116-Q120 PolarHBondContact NE2-NE2 3.07Å; H116-Q120 VanDerWaalsContact O-CG 3.28Å; H116-Q120 WeakPolarHBondContact O-CG 3.39Å; H116-Q120 PolarHBondContact O-N 3.39Å
117	S	58.9	Low	64.9	Low	64 Å²	64	72.8 Å²	72.8	45%	0.448	37%	0.372	S	S	.	.	H	α-helix	trans	-57.5	-34.4	178	52.8	0	0	0	0	113.3	R115 Q120 I121	R115-S117 VanDerWaalsContact C-N 3.32Å; R115-S117 PolarHBondContact O-N 3.42Å; S117-Q120 PolarHBondContact O-N 2.82Å; S117-I121 WeakPolarHBondContact O-CG1 3.46Å; S117-I121 PolarHBondContact O-N 3.08Å
118	I	61.9	Low	64.8	Low	35 Å²	35	68.1 Å²	68.1	18%	0.179	36%	0.358	C	S	.	.	H	α-helix	trans	-79.8	-39	-179.5	-56.2	-179	0	0	0	110.3	A43 Y113 R115 H116 Q120 I121 H122	A43-I118 HydrophobicContact CB-CD1 3.19Å; Y113-I118 HydrophobicContact CD1-CB 4.39Å; Y113-I118 HydrophobicContact CD1-CG2 3.57Å; Y113-I118 HydrophobicContact CE1-CG2 4.18Å; Y113-I118 HydrophobicContact CG-CG2 4.26Å; R115-I118 HydrophobicContact CB-CD1 4.24Å; R115-I118 HydrophobicContact CB-CG1 4.24Å; R115-I118 PolarHBondContact O-N 3.24Å; H116-I118 PolarHBondContact O-N 2.87Å; I118-Q120 PolarHBondContact O-N 3.09Å; I118-I121 PolarHBondContact O-N 3.28Å; I118-H122 VanDerWaalsContact O-CB 3.3Å; I118-H122 WeakPolarHBondContact O-CB 3.36Å; I118-H122 PolarHBondContact O-N 3.41Å
119	L	65.9	Low	64.9	Low	8 Å²	8	67.2 Å²	67.2	4%	0.042	35%	0.354	C	S	.	.	H	α-helix	trans	-58.1	-39	167.9	173.7	61.9	0	0	0	111.1	K105 C106 Y113 R115 H116 H122 K123	K105-L119 WeakPolarHBondContact O-CD2 3.41Å; C106-L119 HydrophobicContact CB-CD1 3.73Å; Y113-L119 HydrophobicContact CD2-CB 3.87Å; Y113-L119 HydrophobicContact CD2-CD1 3.73Å; Y113-L119 HydrophobicContact CD2-CG 4.39Å; Y113-L119 HydrophobicContact CE2-CD1 3.95Å; Y113-L119 HydrophobicContact CG-CB 4.3Å; R115-L119 PolarHBondContact O-N 2.89Å; H116-L119 WeakPolarHBondContact O-CB 3.35Å; H116-L119 PolarHBondContact O-N 3.12Å; L119-H122 CarbonylContact O-C 3.35Å; L119-H122 PolarHBondContact O-N 3.38Å; L119-K123 HydrophobicContact CD1-CG 4.25Å; L119-K123 HydrophobicContact CG-CD 4.41Å; L119-K123 HydrophobicContact CG-CG 4.5Å; L119-K123 WeakPolarHBondContact O-CG 3.47Å; L119-K123 PolarHBondContact O-N 3.11Å
120	Q	65.3	Low	65	Low	71 Å²	71	71.4 Å²	71.4	33%	0.332	37%	0.369	S	S	.	.	H	α-helix	trans	-68.1	-42.4	178	-69.1	-60.5	-24.7	0	0	112.5	H116 S117 I118 H122 K123 R124	H116-Q120 VanDerWaalsContact CE1-CG 3.48Å; H116-Q120 WeakPolarHBondContact CE1-CG 3.48Å; H116-Q120 PolarHBondContact CE1-NE2 3.28Å; H116-Q120 PolarHBondContact NE2-NE2 3.07Å; H116-Q120 VanDerWaalsContact O-CG 3.28Å; H116-Q120 WeakPolarHBondContact O-CG 3.39Å; H116-Q120 PolarHBondContact O-N 3.39Å; S117-Q120 PolarHBondContact O-N 2.82Å; I118-Q120 PolarHBondContact O-N 3.09Å; Q120-H122 VanDerWaalsContact C-N 3.29Å; Q120-H122 PolarHBondContact O-N 3.41Å; Q120-K123 PolarHBondContact O-N 2.95Å; Q120-R124 PolarHBondContact O-N 3.4Å
121	I	64.7	Low	65.5	Low	61 Å²	61	66.2 Å²	66.2	31%	0.313	35%	0.345	S	S	.	.	H	α-helix	trans	-63	-38.9	171.7	-67.1	164	0	0	0	110.8	S117 I118 R124 Q143	S117-I121 WeakPolarHBondContact O-CG1 3.46Å; S117-I121 PolarHBondContact O-N 3.08Å; I118-I121 PolarHBondContact O-N 3.28Å; I121-R124 WeakPolarHBondContact O-CB 3.46Å; I121-R124 PolarHBondContact O-N 3.1Å; I121-Q143 HydrophobicContact CG2-CG 3.97Å; I121-Q143 VanDerWaalsContact CG2-NE2 3.32Å
122	H	68.2	Low	66	Low	18 Å²	18	64.2 Å²	64.2	8%	0.083	34%	0.335	C	S	.	.	H	α-helix	trans	-67.5	-38.9	176.5	169.7	62.2	0	0	0	112.7	C109 Y113 I118 L119 Q120 R124 T125 H126	C109-H122 PolarHBondContact SG-NE2 2.9Å; Y113-H122 HydrophobicContact CE1-CB 4.2Å; Y113-H122 HydrophobicContact CE2-CB 3.9Å; Y113-H122 AromaticContact CE2-CD2 3.27Å; Y113-H122 WeakPolarHBondContact CE2-CD2 3.49Å; Y113-H122 AromaticContact CE2-CG 3.64Å; Y113-H122 AromaticContact CE2-NE2 3.96Å; Y113-H122 AromaticContact CZ-CD2 3.47Å; Y113-H122 VanDerWaalsContact CZ-CD2 3.47Å; Y113-H122 AromaticContact CZ-CG 3.37Å; Y113-H122 AromaticContact CZ-ND1 3.92Å; Y113-H122 PolarHBondContact OH-CD2 3.31Å; Y113-H122 PolarHBondContact OH-CE1 2.79Å; Y113-H122 PolarHBondContact OH-ND1 3.06Å; Y113-H122 PolarHBondContact OH-NE2 3.22Å; I118-H122 VanDerWaalsContact O-CB 3.3Å; I118-H122 WeakPolarHBondContact O-CB 3.36Å; I118-H122 PolarHBondContact O-N 3.41Å; L119-H122 CarbonylContact O-C 3.35Å; L119-H122 PolarHBondContact O-N 3.38Å; Q120-H122 VanDerWaalsContact C-N 3.29Å; Q120-H122 PolarHBondContact O-N 3.41Å; H122-R124 PolarHBondContact O-N 3.42Å; H122-T125 PolarHBondContact ND1-OG1 2.89Å; H122-T125 VanDerWaalsContact O-CB 3.32Å; H122-T125 WeakPolarHBondContact O-CB 3.42Å; H122-T125 PolarHBondContact O-N 3.42Å; H122-T125 PolarHBondContact O-OG1 3.27Å; H122-H126 AromaticContact CD2-NE2 3.99Å; H122-H126 AromaticContact CE1-NE2 3.34Å; H122-H126 PolarHBondContact CE1-NE2 3.46Å; H122-H126 VanDerWaalsContact CE1-NE2 3.34Å; H122-H126 AromaticContact NE2-CD2 3.81Å; H122-H126 AromaticContact NE2-NE2 3.08Å; H122-H126 PolarHBondContact NE2-NE2 3.38Å
123	K	66.6	Low	66.4	Low	64 Å²	64	68.3 Å²	68.3	28%	0.278	35%	0.349	S	S	.	.	H	α-helix	trans	-56.7	-31.5	176.1	-80.4	176.8	175.3	-175.7	0	112.3	L119 Q120 T125 H126 S127	L119-K123 HydrophobicContact CD1-CG 4.25Å; L119-K123 HydrophobicContact CG-CD 4.41Å; L119-K123 HydrophobicContact CG-CG 4.5Å; L119-K123 WeakPolarHBondContact O-CG 3.47Å; L119-K123 PolarHBondContact O-N 3.11Å; Q120-K123 PolarHBondContact O-N 2.95Å; K123-T125 PolarHBondContact O-N 3.37Å; K123-H126 PolarHBondContact O-N 3.3Å; K123-S127 PolarHBondContact O-N 3.38Å; K123-S127 PolarHBondContact O-OG 3.19Å
124	R	75.6	Confident	66.6	Low	59 Å²	59	66.8 Å²	66.8	22%	0.223	34%	0.344	C	S	.	.	H	α-helix	trans	-61.5	-21.4	172.5	-60.3	177.4	-175.2	167.5	1.1	114	Q120 I121 H122 H126 S127 G128 E129 T142	Q120-R124 PolarHBondContact O-N 3.4Å; I121-R124 WeakPolarHBondContact O-CB 3.46Å; I121-R124 PolarHBondContact O-N 3.1Å; H122-R124 PolarHBondContact O-N 3.42Å; R124-H126 VanDerWaalsContact C-N 3.31Å; R124-S127 WeakPolarHBondContact CA-OG 3.37Å; R124-G128 WeakPolarHBondContact O-CA 3.4Å; R124-G128 PolarHBondContact O-N 3.16Å; R124-E129 HydrophobicContact CB-CB 4.36Å; R124-E129 HydrophobicContact CG-CB 4.2Å; R124-E129 PolarHBondContact O-N 2.75Å; R124-T142 HydrophobicContact CB-CG2 4.43Å; R124-T142 PolarHBondContact NH1-O 3.35Å
125	T	63.2	Low	67.3	Low	89 Å²	89	72.8 Å²	72.8	55%	0.546	37%	0.373	S	S	.	.	H	α-helix	trans	-74.5	-23.8	174.4	67.3	0	0	0	0	112.8	H122 K123	H122-T125 PolarHBondContact ND1-OG1 2.89Å; H122-T125 VanDerWaalsContact O-CB 3.32Å; H122-T125 WeakPolarHBondContact O-CB 3.42Å; H122-T125 PolarHBondContact O-N 3.42Å; H122-T125 PolarHBondContact O-OG1 3.27Å; K123-T125 PolarHBondContact O-N 3.37Å
126	H	67.6	Low	67.5	Low	73 Å²	73	72.7 Å²	72.7	34%	0.338	38%	0.378	S	S	.	.	H	α-helix	trans	-92.7	-40.5	175.4	-58	-63.1	0	0	0	112.2	C106 C109 H122 K123 R124 G128	C106-H126 PolarHBondContact SG-NE2 3.41Å; C109-H126 PolarHBondContact SG-NE2 3.22Å; C109-H126 VanDerWaalsContact SG-NE2 3.39Å; H122-H126 AromaticContact CD2-NE2 3.99Å; H122-H126 AromaticContact CE1-NE2 3.34Å; H122-H126 PolarHBondContact CE1-NE2 3.46Å; H122-H126 VanDerWaalsContact CE1-NE2 3.34Å; H122-H126 AromaticContact NE2-CD2 3.81Å; H122-H126 AromaticContact NE2-NE2 3.08Å; H122-H126 PolarHBondContact NE2-NE2 3.38Å; K123-H126 PolarHBondContact O-N 3.3Å; R124-H126 VanDerWaalsContact C-N 3.31Å; H126-G128 VanDerWaalsContact C-N 3.28Å; H126-G128 PolarHBondContact O-N 3.09Å
127	S	69.7	Low	68.1	Low	66 Å²	66	70.8 Å²	70.8	46%	0.462	37%	0.374	S	S	.	.	H	α-helix	trans	-76.5	-14.8	177.3	62.7	0	0	0	0	113.7	K123 R124 E129	K123-S127 PolarHBondContact O-N 3.38Å; K123-S127 PolarHBondContact O-OG 3.19Å; R124-S127 WeakPolarHBondContact CA-OG 3.37Å; S127-E129 PolarHBondContact O-N 3.35Å; S127-E129 WeakPolarHBondContact OG-CG 3.48Å
128	G	65.9	Low	68.6	Low	47 Å²	47	69.9 Å²	69.9	49%	0.485	38%	0.376	S	S	.	.			trans	71.2	4.4	-175.9	0	0	0	0	0	114.2	R124 H126 K130	R124-G128 WeakPolarHBondContact O-CA 3.4Å; R124-G128 PolarHBondContact O-N 3.16Å; H126-G128 VanDerWaalsContact C-N 3.28Å; H126-G128 PolarHBondContact O-N 3.09Å; G128-K130 PolarHBondContact O-N 2.72Å
129	E	69.4	Low	68.7	Low	114 Å²	114	74.1 Å²	74.1	53%	0.533	39%	0.393	S	S	.	.			trans	-59.3	124.9	179.5	-78.4	177.1	-170.8	0	0	111.5	R124 S127 P131	R124-E129 HydrophobicContact CB-CB 4.36Å; R124-E129 HydrophobicContact CG-CB 4.2Å; R124-E129 PolarHBondContact O-N 2.75Å; S127-E129 PolarHBondContact O-N 3.35Å; S127-E129 WeakPolarHBondContact OG-CG 3.48Å; E129-P131 WeakPolarHBondContact O-CD 3.49Å
130	K	75.4	Confident	69	Low	119 Å²	119	75.1 Å²	75.1	52%	0.517	40%	0.402	S	S	.	.			trans	-126.3	79.2	179.6	-74.1	162.5	169	-170	0	109.4	G128 Y132 A140 F141 T142	G128-K130 PolarHBondContact O-N 2.72Å; K130-Y132 PolarHBondContact O-N 3.09Å; K130-Y132 VanDerWaalsContact O-N 3.12Å; K130-A140 HydrophobicContact CB-CB 3.43Å; K130-A140 VanDerWaalsContact CB-CB 3.43Å; K130-A140 HydrophobicContact CD-CB 4.14Å; K130-A140 VanDerWaalsContact CD-O 3.28Å; K130-A140 WeakPolarHBondContact CD-O 3.5Å; K130-A140 HydrophobicContact CG-CB 4.37Å; K130-F141 CarbonylContact C-O 3.52Å; K130-F141 VanDerWaalsContact C-O 3.23Å; K130-F141 VanDerWaalsContact CA-O 3.29Å; K130-F141 WeakPolarHBondContact CA-O 3.45Å; K130-T142 HydrophobicContact CG-CG2 4Å
131	P	76.3	Confident	69.4	Low	70 Å²	70	73.9 Å²	73.9	46%	0.455	40%	0.396	S	S	.	.			trans	-67.6	-14.5	-170.4	-21.8	34.7	0	0	0	114.6	E129	E129-P131 WeakPolarHBondContact O-CD 3.49Å
132	Y	74	Confident	69.3	Low	80 Å²	80	72.5 Å²	72.5	31%	0.314	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	95	-174	-56.6	-76.1	0	0	0	109.6	K130 A140 F141 H144	K130-Y132 PolarHBondContact O-N 3.09Å; K130-Y132 VanDerWaalsContact O-N 3.12Å; Y132-A140 CarbonylContact O-C 3.58Å; Y132-A140 WeakPolarHBondContact O-CA 3.48Å; Y132-F141 PolarHBondContact N-O 3.43Å; Y132-F141 VanDerWaalsContact N-O 3.14Å; Y132-F141 PolarHBondContact O-N 3.49Å; Y132-H144 HydrophobicContact CD1-CB 3.85Å; Y132-H144 AromaticContact CD1-CD2 3.82Å; Y132-H144 HydrophobicContact CD2-CB 4.44Å; Y132-H144 HydrophobicContact CE1-CB 3.72Å; Y132-H144 HydrophobicContact CE2-CB 4.31Å; Y132-H144 HydrophobicContact CG-CB 4.2Å
133	E	64.9	Low	69.3	Low	110 Å²	110	73.7 Å²	73.7	51%	0.514	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	141.5	-179.6	-168.6	173.2	172.6	0	0	112.6	N135 G138 A140 L147	E133-N135 PolarHBondContact O-N 2.89Å; E133-G138 WeakPolarHBondContact OE1-CA 3.41Å; E133-A140 HydrophobicContact CB-CB 4.31Å; E133-A140 HydrophobicContact CG-CB 4.34Å; E133-L147 WeakPolarHBondContact O-CD2 3.4Å
134	C	72.1	Confident	69.1	Low	1 Å²	1	75.9 Å²	75.9	1%	0.007	41%	0.407	C	S	.	.			trans	-83.5	109.7	172	-180	0	0	0	0	110.4	Q136 C137 G138 K139 F141 L147 H150 H154	C134-Q136 PolarHBondContact O-N 2.79Å; C134-C137 PolarHBondContact O-N 2.79Å; C134-G138 WeakPolarHBondContact O-CA 3.42Å; C134-G138 PolarHBondContact O-N 3.49Å; C134-K139 HydrophobicContact CB-CB 4.41Å; C134-K139 VanDerWaalsContact CB-O 3.22Å; C134-K139 WeakPolarHBondContact CB-O 3.47Å; C134-K139 PolarHBondContact N-O 3.15Å; C134-F141 HydrophobicContact CB-CE2 4.45Å; C134-L147 HydrophobicContact CB-CD1 3.65Å; C134-H150 VanDerWaalsContact SG-CD2 3.58Å; C134-H150 PolarHBondContact SG-NE2 2.73Å; C134-H150 VanDerWaalsContact SG-NE2 3.36Å; C134-H154 VanDerWaalsContact SG-CD2 3.6Å; C134-H154 PolarHBondContact SG-NE2 2.66Å
135	N	70.5	Confident	68.4	Low	161 Å²	161	74.4 Å²	74.4	86%	0.861	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-11.5	179.8	-60.5	-16.6	0	0	0	114.2	E133	E133-N135 PolarHBondContact O-N 2.89Å
136	Q	66	Low	68.3	Low	123 Å²	123	74 Å²	74	58%	0.575	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	-23	-179	-65.3	-177.6	3.8	0	0	114.1	C134 M151 H154	C134-Q136 PolarHBondContact O-N 2.79Å; Q136-M151 HydrophobicContact CG-CE 4.34Å; Q136-H154 VanDerWaalsContact OE1-CG 3.3Å
137	C	69.3	Low	68.3	Low	53 Å²	53	71.6 Å²	71.6	36%	0.358	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.2	11.4	-179.6	78.3	0	0	0	0	114.8	C134 K139 H150 H154	C134-C137 PolarHBondContact O-N 2.79Å; C137-K139 PolarHBondContact O-N 3.25Å; C137-K139 VanDerWaalsContact O-N 3.08Å; C137-K139 VanDerWaalsContact SG-CG 3.52Å; C137-H150 PolarHBondContact SG-NE2 2.95Å; C137-H154 VanDerWaalsContact CB-CE1 3.46Å; C137-H154 WeakPolarHBondContact CB-CE1 3.17Å; C137-H154 PolarHBondContact SG-CE1 2.98Å; C137-H154 PolarHBondContact SG-NE2 3.48Å
138	G	68.1	Low	68.1	Low	46 Å²	46	74.1 Å²	74.1	47%	0.474	39%	0.389	S	S	.	.			trans	64.1	12.8	178.6	0	0	0	0	0	114.7	E133 C134 A140	E133-G138 WeakPolarHBondContact OE1-CA 3.41Å; C134-G138 WeakPolarHBondContact O-CA 3.42Å; C134-G138 PolarHBondContact O-N 3.49Å; G138-A140 PolarHBondContact O-N 3.15Å
139	K	64.9	Low	67.8	Low	123 Å²	123	75.3 Å²	75.3	54%	0.535	38%	0.384	S	S	.	.			trans	-80.3	122.2	179.4	-76.8	-178.1	-174.2	175.3	0	109.6	C134 C137 F141	C134-K139 HydrophobicContact CB-CB 4.41Å; C134-K139 VanDerWaalsContact CB-O 3.22Å; C134-K139 WeakPolarHBondContact CB-O 3.47Å; C134-K139 PolarHBondContact N-O 3.15Å; C137-K139 PolarHBondContact O-N 3.25Å; C137-K139 VanDerWaalsContact O-N 3.08Å; C137-K139 VanDerWaalsContact SG-CG 3.52Å; K139-F141 HydrophobicContact CB-CE2 3.93Å; K139-F141 HydrophobicContact CB-CZ 4.06Å; K139-F141 WeakPolarHBondContact O-CD2 3.44Å; K139-F141 VanDerWaalsContact O-CE2 3.22Å; K139-F141 WeakPolarHBondContact O-CE2 3.24Å
140	A	71.8	Confident	67.6	Low	30 Å²	30	70.6 Å²	70.6	25%	0.248	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	142.6	-179.4	0	0	0	0	0	112.8	K130 Y132 E133 G138	K130-A140 HydrophobicContact CB-CB 3.43Å; K130-A140 VanDerWaalsContact CB-CB 3.43Å; K130-A140 HydrophobicContact CD-CB 4.14Å; K130-A140 VanDerWaalsContact CD-O 3.28Å; K130-A140 WeakPolarHBondContact CD-O 3.5Å; K130-A140 HydrophobicContact CG-CB 4.37Å; Y132-A140 CarbonylContact O-C 3.58Å; Y132-A140 WeakPolarHBondContact O-CA 3.48Å; E133-A140 HydrophobicContact CB-CB 4.31Å; E133-A140 HydrophobicContact CG-CB 4.34Å; G138-A140 PolarHBondContact O-N 3.15Å
141	F	73.1	Confident	67	Low	45 Å²	45	67.8 Å²	67.8	20%	0.197	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	149.9	-176.1	-58.7	-89.7	0	0	0	111.4	K130 Y132 C134 K139 Q143 H146 L147 H150	K130-F141 CarbonylContact C-O 3.52Å; K130-F141 VanDerWaalsContact C-O 3.23Å; K130-F141 VanDerWaalsContact CA-O 3.29Å; K130-F141 WeakPolarHBondContact CA-O 3.45Å; Y132-F141 PolarHBondContact N-O 3.43Å; Y132-F141 VanDerWaalsContact N-O 3.14Å; Y132-F141 PolarHBondContact O-N 3.49Å; C134-F141 HydrophobicContact CB-CE2 4.45Å; K139-F141 HydrophobicContact CB-CE2 3.93Å; K139-F141 HydrophobicContact CB-CZ 4.06Å; K139-F141 WeakPolarHBondContact O-CD2 3.44Å; K139-F141 VanDerWaalsContact O-CE2 3.22Å; K139-F141 WeakPolarHBondContact O-CE2 3.24Å; F141-Q143 VanDerWaalsContact C-N 3.28Å; F141-Q143 PolarHBondContact O-N 3.18Å; F141-H146 HydrophobicContact CB-CB 4.16Å; F141-H146 HydrophobicContact CD1-CB 3.91Å; F141-H146 HydrophobicContact CG-CB 4.27Å; F141-L147 HydrophobicContact CB-CB 4.36Å; F141-L147 HydrophobicContact CD2-CB 3.89Å; F141-L147 HydrophobicContact CD2-CD1 3.74Å; F141-L147 HydrophobicContact CD2-CG 4.42Å; F141-L147 HydrophobicContact CE2-CD1 3.92Å; F141-L147 HydrophobicContact CG-CB 4.32Å; F141-H150 HydrophobicContact CE1-CB 3.93Å; F141-H150 HydrophobicContact CE2-CB 3.67Å; F141-H150 AromaticContact CE2-CD2 3.31Å; F141-H150 WeakPolarHBondContact CE2-CD2 3.44Å; F141-H150 AromaticContact CE2-CG 3.49Å; F141-H150 VanDerWaalsContact CE2-CG 3.49Å; F141-H150 HydrophobicContact CZ-CB 3.31Å; F141-H150 AromaticContact CZ-CD2 3.48Å; F141-H150 VanDerWaalsContact CZ-CD2 3.48Å; F141-H150 WeakPolarHBondContact CZ-CD2 3.42Å; F141-H150 AromaticContact CZ-CG 3.17Å; F141-H150 AromaticContact CZ-ND1 3.75Å
142	T	63.5	Low	66.5	Low	32 Å²	32	66.3 Å²	66.3	20%	0.196	34%	0.341	C	S	.	.	S	Bend	trans	-75.9	-18.3	179	54.9	0	0	0	0	113	R124 K130	R124-T142 HydrophobicContact CB-CG2 4.43Å; R124-T142 PolarHBondContact NH1-O 3.35Å; K130-T142 HydrophobicContact CG-CG2 4Å
143	Q	68.3	Low	65.7	Low	43 Å²	43	66.4 Å²	66.4	20%	0.201	35%	0.35	C	S	.	.	S	Bend	trans	-139	146.6	-176.9	-60	180	18.8	0	0	111.2	I121 F141 H146 L147	I121-Q143 HydrophobicContact CG2-CG 3.97Å; I121-Q143 VanDerWaalsContact CG2-NE2 3.32Å; F141-Q143 VanDerWaalsContact C-N 3.28Å; F141-Q143 PolarHBondContact O-N 3.18Å; Q143-H146 PolarHBondContact O-N 3.4Å; Q143-L147 PolarHBondContact O-N 3.05Å
144	H	62.2	Low	65.6	Low	110 Å²	110	64.4 Å²	64.4	51%	0.509	34%	0.34	S	S	.	.	H	α-helix	trans	-67.8	-36.9	-178.9	-175.6	-91.6	0	0	0	113	Y132 H146 L147 K148	Y132-H144 HydrophobicContact CD1-CB 3.85Å; Y132-H144 AromaticContact CD1-CD2 3.82Å; Y132-H144 HydrophobicContact CD2-CB 4.44Å; Y132-H144 HydrophobicContact CE1-CB 3.72Å; Y132-H144 HydrophobicContact CE2-CB 4.31Å; Y132-H144 HydrophobicContact CG-CB 4.2Å; H144-H146 VanDerWaalsContact C-N 3.3Å; H144-H146 PolarHBondContact O-N 3.37Å; H144-L147 PolarHBondContact O-N 3.19Å; H144-L147 VanDerWaalsContact O-N 3.15Å; H144-K148 PolarHBondContact O-N 3.29Å
145	S	60	Low	65.1	Low	27 Å²	27	68.2 Å²	68.2	19%	0.189	36%	0.364	C	S	.	.	H	α-helix	trans	-58.9	-40.4	175.6	49.3	0	0	0	0	111.9	K148 I149	S145-K148 PolarHBondContact O-N 3.22Å; S145-I149 WeakPolarHBondContact O-CB 3.25Å; S145-I149 WeakPolarHBondContact O-CD1 3.21Å; S145-I149 VanDerWaalsContact O-CG1 3.29Å; S145-I149 WeakPolarHBondContact O-CG1 3.48Å; S145-I149 PolarHBondContact O-N 3.21Å
146	H	62.5	Low	64.6	Low	81 Å²	81	63 Å²	63	38%	0.375	35%	0.348	S	S	.	.	H	α-helix	trans	-67.2	-36.9	174.3	-62.8	157.9	0	0	0	113.3	F141 Q143 H144 H150	F141-H146 HydrophobicContact CB-CB 4.16Å; F141-H146 HydrophobicContact CD1-CB 3.91Å; F141-H146 HydrophobicContact CG-CB 4.27Å; Q143-H146 PolarHBondContact O-N 3.4Å; H144-H146 VanDerWaalsContact C-N 3.3Å; H144-H146 PolarHBondContact O-N 3.37Å; H146-H150 WeakPolarHBondContact O-CB 3.42Å; H146-H150 PolarHBondContact O-N 2.84Å
147	L	67.4	Low	64.3	Low	22 Å²	22	63.2 Å²	63.2	12%	0.115	35%	0.349	C	S	.	.	H	α-helix	trans	-64.9	-48	172.3	174.1	62.4	0	0	0	110.7	E133 C134 F141 Q143 H144 I149 H150 M151	E133-L147 WeakPolarHBondContact O-CD2 3.4Å; C134-L147 HydrophobicContact CB-CD1 3.65Å; F141-L147 HydrophobicContact CB-CB 4.36Å; F141-L147 HydrophobicContact CD2-CB 3.89Å; F141-L147 HydrophobicContact CD2-CD1 3.74Å; F141-L147 HydrophobicContact CD2-CG 4.42Å; F141-L147 HydrophobicContact CE2-CD1 3.92Å; F141-L147 HydrophobicContact CG-CB 4.32Å; Q143-L147 PolarHBondContact O-N 3.05Å; H144-L147 PolarHBondContact O-N 3.19Å; H144-L147 VanDerWaalsContact O-N 3.15Å; L147-I149 VanDerWaalsContact C-N 3.27Å; L147-I149 PolarHBondContact O-N 3.41Å; L147-H150 CarbonylContact O-C 3.58Å; L147-H150 WeakPolarHBondContact O-CA 3.46Å; L147-H150 WeakPolarHBondContact O-CB 3.47Å; L147-H150 PolarHBondContact O-N 3.45Å; L147-M151 HydrophobicContact CD1-SD 4.28Å; L147-M151 WeakPolarHBondContact O-CG 3.46Å; L147-M151 PolarHBondContact O-N 2.89Å
148	K	64.4	Low	64.2	Low	120 Å²	120	66.2 Å²	66.2	52%	0.522	36%	0.356	S	S	.	.	H	α-helix	trans	-57.6	-40.2	178.2	-169.7	175.4	-177.9	-179.5	0	112	H144 S145 M151	H144-K148 PolarHBondContact O-N 3.29Å; S145-K148 PolarHBondContact O-N 3.22Å; K148-M151 PolarHBondContact O-N 3.27Å
149	I	60.2	Low	64	Low	71 Å²	71	66.7 Å²	66.7	36%	0.364	35%	0.351	S	S	.	.	H	α-helix	trans	-64	-45.4	171.6	-78.3	167.5	0	0	0	111.8	S145 L147 M151 V152 F171	S145-I149 WeakPolarHBondContact O-CB 3.25Å; S145-I149 WeakPolarHBondContact O-CD1 3.21Å; S145-I149 VanDerWaalsContact O-CG1 3.29Å; S145-I149 WeakPolarHBondContact O-CG1 3.48Å; S145-I149 PolarHBondContact O-N 3.21Å; L147-I149 VanDerWaalsContact C-N 3.27Å; L147-I149 PolarHBondContact O-N 3.41Å; I149-M151 VanDerWaalsContact C-N 3.25Å; I149-M151 PolarHBondContact O-N 3.45Å; I149-V152 VanDerWaalsContact O-CB 3.28Å; I149-V152 WeakPolarHBondContact O-CB 3.41Å; I149-V152 WeakPolarHBondContact O-CG2 3.5Å; I149-V152 PolarHBondContact O-N 2.85Å; I149-F171 HydrophobicContact CG2-CE1 3.32Å; I149-F171 HydrophobicContact CG2-CZ 3.66Å
150	H	65	Low	64.1	Low	16 Å²	16	63.8 Å²	63.8	7%	0.074	34%	0.337	C	S	.	.	H	α-helix	trans	-63.2	-32.4	179.5	168.1	62.5	0	0	0	112.5	C134 C137 F141 H146 L147 V152 T153 H154	C134-H150 VanDerWaalsContact SG-CD2 3.58Å; C134-H150 PolarHBondContact SG-NE2 2.73Å; C134-H150 VanDerWaalsContact SG-NE2 3.36Å; C137-H150 PolarHBondContact SG-NE2 2.95Å; F141-H150 HydrophobicContact CE1-CB 3.93Å; F141-H150 HydrophobicContact CE2-CB 3.67Å; F141-H150 AromaticContact CE2-CD2 3.31Å; F141-H150 WeakPolarHBondContact CE2-CD2 3.44Å; F141-H150 AromaticContact CE2-CG 3.49Å; F141-H150 VanDerWaalsContact CE2-CG 3.49Å; F141-H150 HydrophobicContact CZ-CB 3.31Å; F141-H150 AromaticContact CZ-CD2 3.48Å; F141-H150 VanDerWaalsContact CZ-CD2 3.48Å; F141-H150 WeakPolarHBondContact CZ-CD2 3.42Å; F141-H150 AromaticContact CZ-CG 3.17Å; F141-H150 AromaticContact CZ-ND1 3.75Å; H146-H150 WeakPolarHBondContact O-CB 3.42Å; H146-H150 PolarHBondContact O-N 2.84Å; L147-H150 CarbonylContact O-C 3.58Å; L147-H150 WeakPolarHBondContact O-CA 3.46Å; L147-H150 WeakPolarHBondContact O-CB 3.47Å; L147-H150 PolarHBondContact O-N 3.45Å; H150-V152 PolarHBondContact O-N 3.19Å; H150-V152 VanDerWaalsContact O-N 3.16Å; H150-T153 PolarHBondContact CE1-OG1 3.11Å; H150-T153 PolarHBondContact ND1-OG1 2.93Å; H150-T153 WeakPolarHBondContact O-CB 3.34Å; H150-T153 PolarHBondContact O-N 3.04Å; H150-T153 PolarHBondContact O-OG1 3.44Å; H150-H154 AromaticContact CD2-NE2 3.93Å; H150-H154 AromaticContact CE1-NE2 3.35Å; H150-H154 PolarHBondContact CE1-NE2 3.08Å; H150-H154 VanDerWaalsContact CE1-NE2 3.35Å; H150-H154 AromaticContact NE2-CD2 3.76Å; H150-H154 AromaticContact NE2-CE1 3.96Å; H150-H154 AromaticContact NE2-NE2 2.99Å; H150-H154 PolarHBondContact NE2-NE2 2.79Å
151	M	63.7	Low	63.7	Low	59 Å²	59	69 Å²	69	29%	0.291	35%	0.354	S	S	.	.	H	α-helix	trans	-58.5	-28	176.1	-65.9	-54.6	-67.3	0	0	112.9	Q136 L147 K148 I149 T153 H154 T155	Q136-M151 HydrophobicContact CG-CE 4.34Å; L147-M151 HydrophobicContact CD1-SD 4.28Å; L147-M151 WeakPolarHBondContact O-CG 3.46Å; L147-M151 PolarHBondContact O-N 2.89Å; K148-M151 PolarHBondContact O-N 3.27Å; I149-M151 VanDerWaalsContact C-N 3.25Å; I149-M151 PolarHBondContact O-N 3.45Å; M151-T153 PolarHBondContact O-N 3.23Å; M151-H154 PolarHBondContact O-N 3.21Å; M151-H154 VanDerWaalsContact O-N 3.08Å; M151-T155 PolarHBondContact O-N 2.89Å
152	V	64.4	Low	63.5	Low	40 Å²	40	67 Å²	67	24%	0.242	35%	0.345	C	S	.	.	H	α-helix	trans	-62.2	-24.6	174.2	-175.8	0	0	0	0	112.2	I149 H150 H154 T155 G156 E157	I149-V152 VanDerWaalsContact O-CB 3.28Å; I149-V152 WeakPolarHBondContact O-CB 3.41Å; I149-V152 WeakPolarHBondContact O-CG2 3.5Å; I149-V152 PolarHBondContact O-N 2.85Å; H150-V152 PolarHBondContact O-N 3.19Å; H150-V152 VanDerWaalsContact O-N 3.16Å; V152-H154 VanDerWaalsContact C-N 3.32Å; V152-T155 PolarHBondContact O-OG1 3.4Å; V152-G156 PolarHBondContact O-N 2.8Å; V152-E157 WeakPolarHBondContact CG1-O 3.38Å
153	T	58.5	Low	63.9	Low	81 Å²	81	72.1 Å²	72.1	50%	0.497	37%	0.372	S	S	.	.	H	α-helix	trans	-74.4	-22.1	176.6	66.6	0	0	0	0	113.6	H150 M151	H150-T153 PolarHBondContact CE1-OG1 3.11Å; H150-T153 PolarHBondContact ND1-OG1 2.93Å; H150-T153 WeakPolarHBondContact O-CB 3.34Å; H150-T153 PolarHBondContact O-N 3.04Å; H150-T153 PolarHBondContact O-OG1 3.44Å; M151-T153 PolarHBondContact O-N 3.23Å
154	H	61.1	Low	63.9	Low	68 Å²	68	76.2 Å²	76.2	32%	0.315	39%	0.391	S	S	.	.	H	α-helix	trans	-91	-35.5	177.3	-63.8	-57	0	0	0	112.6	C134 Q136 C137 H150 M151 V152 G156	C134-H154 VanDerWaalsContact SG-CD2 3.6Å; C134-H154 PolarHBondContact SG-NE2 2.66Å; Q136-H154 VanDerWaalsContact OE1-CG 3.3Å; C137-H154 VanDerWaalsContact CB-CE1 3.46Å; C137-H154 WeakPolarHBondContact CB-CE1 3.17Å; C137-H154 PolarHBondContact SG-CE1 2.98Å; C137-H154 PolarHBondContact SG-NE2 3.48Å; H150-H154 AromaticContact CD2-NE2 3.93Å; H150-H154 AromaticContact CE1-NE2 3.35Å; H150-H154 PolarHBondContact CE1-NE2 3.08Å; H150-H154 VanDerWaalsContact CE1-NE2 3.35Å; H150-H154 AromaticContact NE2-CD2 3.76Å; H150-H154 AromaticContact NE2-CE1 3.96Å; H150-H154 AromaticContact NE2-NE2 2.99Å; H150-H154 PolarHBondContact NE2-NE2 2.79Å; M151-H154 PolarHBondContact O-N 3.21Å; M151-H154 VanDerWaalsContact O-N 3.08Å; V152-H154 VanDerWaalsContact C-N 3.32Å; H154-G156 PolarHBondContact O-N 2.85Å
155	T	62.9	Low	64.2	Low	82 Å²	82	73.3 Å²	73.3	50%	0.503	38%	0.383	S	S	.	.	H	α-helix	trans	-71.1	-16.4	175.5	61.8	0	0	0	0	112.3	M151 V152 E157	M151-T155 PolarHBondContact O-N 2.89Å; V152-T155 PolarHBondContact O-OG1 3.4Å; T155-E157 PolarHBondContact O-N 3.37Å
156	G	58.6	Low	64.2	Low	52 Å²	52	74.8 Å²	74.8	54%	0.536	40%	0.402	S	S	.	.			trans	67.9	0.8	-177.5	0	0	0	0	0	113.5	V152 H154 K158	V152-G156 PolarHBondContact O-N 2.8Å; H154-G156 PolarHBondContact O-N 2.85Å; G156-K158 PolarHBondContact O-N 3.25Å
157	E	60.6	Low	64.2	Low	127 Å²	127	77 Å²	77	59%	0.593	41%	0.41	S	S	*	.			trans	-64.2	123.9	175.6	-67.6	-173.7	162.5	0	0	108.4	V152 T155 P159	V152-E157 WeakPolarHBondContact CG1-O 3.38Å; T155-E157 PolarHBondContact O-N 3.37Å; E157-P159 WeakPolarHBondContact O-CD 3.46Å
158	K	66.2	Low	64	Low	116 Å²	116	77.2 Å²	77.2	50%	0.504	42%	0.416	S	S	.	.			trans	-117.4	82.2	174	-65.5	-169	-164.4	171.8	0	106.8	G156 Y160 A168 F169	G156-K158 PolarHBondContact O-N 3.25Å; K158-Y160 PolarHBondContact O-N 3.33Å; K158-Y160 VanDerWaalsContact O-N 3.1Å; K158-A168 HydrophobicContact CB-CB 3.34Å; K158-A168 HydrophobicContact CD-CB 3.97Å; K158-A168 WeakPolarHBondContact CD-O 3.35Å; K158-A168 HydrophobicContact CG-CB 4.29Å; K158-F169 CarbonylContact C-O 3.26Å; K158-F169 WeakPolarHBondContact CA-O 3.32Å
159	P	65.9	Low	64.1	Low	56 Å²	56	73.5 Å²	73.5	36%	0.364	40%	0.4	S	S	.	.			trans	-64	-22.1	-167.1	-22.5	34.9	0	0	0	112.9	E157	E157-P159 WeakPolarHBondContact O-CD 3.46Å
160	Y	66	Low	64.1	Low	61 Å²	61	71.7 Å²	71.7	24%	0.239	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	95.4	-174	-56	-75.9	0	0	0	109.8	K158 A168 F169 H172	K158-Y160 PolarHBondContact O-N 3.33Å; K158-Y160 VanDerWaalsContact O-N 3.1Å; Y160-A168 CarbonylContact O-C 3.57Å; Y160-A168 WeakPolarHBondContact O-CA 2.87Å; Y160-F169 PolarHBondContact N-O 3.14Å; Y160-F169 PolarHBondContact O-N 3.13Å; Y160-H172 HydrophobicContact CD1-CB 3.82Å; Y160-H172 HydrophobicContact CE1-CB 3.73Å; Y160-H172 HydrophobicContact CE2-CB 4.46Å; Y160-H172 HydrophobicContact CG-CB 4.22Å
161	K	62.6	Low	64	Low	140 Å²	140	75 Å²	75	61%	0.609	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.8	144.3	178.4	-63.8	-176.9	-178.7	175.4	0	111.1	A168 L175	K161-A168 HydrophobicContact CG-CB 3.81Å; K161-L175 WeakPolarHBondContact O-CD2 3.26Å
162	C	70.1	Confident	64	Low	2 Å²	2	74 Å²	74	1%	0.014	40%	0.404	C	S	.	.			trans	-90.2	115.1	172.6	-175.6	0	0	0	0	109.5	Q164 C165 G166 K167 F169 L175 H178 H182	C162-Q164 PolarHBondContact O-N 2.88Å; C162-C165 PolarHBondContact O-N 3.36Å; C162-G166 VanDerWaalsContact O-CA 3.29Å; C162-G166 WeakPolarHBondContact O-CA 3.43Å; C162-G166 PolarHBondContact O-N 3.41Å; C162-K167 VanDerWaalsContact CB-O 3.32Å; C162-K167 WeakPolarHBondContact CB-O 3.48Å; C162-K167 PolarHBondContact N-O 3.48Å; C162-F169 HydrophobicContact CB-CE2 4.24Å; C162-L175 HydrophobicContact CB-CD1 3.52Å; C162-H178 VanDerWaalsContact SG-CD2 3.58Å; C162-H182 PolarHBondContact SG-NE2 3.34Å; C162-H182 VanDerWaalsContact SG-NE2 3.43Å
163	D	70.5	Confident	63.9	Low	140 Å²	140	75.8 Å²	75.8	75%	0.749	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-23.7	-175.2	-48.7	-52.3	0	0	0	112.6
164	Q	69.9	Low	64.2	Low	129 Å²	129	74.6 Å²	74.6	60%	0.603	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-21.9	-178.5	-66.3	178.4	-3.3	0	0	114.3	C162 H182	C162-Q164 PolarHBondContact O-N 2.88Å; Q164-H182 PolarHBondContact OE1-CD2 3.42Å; Q164-H182 VanDerWaalsContact OE1-CD2 3.24Å
165	C	67.2	Low	64.6	Low	50 Å²	50	71.8 Å²	71.8	34%	0.338	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.4	5.3	-176.8	76	0	0	0	0	114.9	C162 K167 H178 H182	C162-C165 PolarHBondContact O-N 3.36Å; C165-K167 PolarHBondContact O-N 2.91Å; C165-K167 VanDerWaalsContact SG-CB 3.6Å; C165-K167 VanDerWaalsContact SG-CG 3.58Å; C165-H178 PolarHBondContact SG-NE2 2.87Å; C165-H182 PolarHBondContact SG-NE2 2.86Å; C165-H182 VanDerWaalsContact SG-NE2 3.43Å
166	G	61.3	Low	64.9	Low	58 Å²	58	71 Å²	71	60%	0.598	39%	0.389	S	S	*	.			trans	67.7	-1	179.9	0	0	0	0	0	115.1	C162 A168	C162-G166 VanDerWaalsContact O-CA 3.29Å; C162-G166 WeakPolarHBondContact O-CA 3.43Å; C162-G166 PolarHBondContact O-N 3.41Å; G166-A168 PolarHBondContact O-N 3.4Å
167	K	61.3	Low	65.4	Low	126 Å²	126	70.1 Å²	70.1	55%	0.548	37%	0.373	S	S	.	.			trans	-69.1	127.5	-179.6	-71.3	-179.5	-177.5	174.3	0	110.2	C162 C165 F169	C162-K167 VanDerWaalsContact CB-O 3.32Å; C162-K167 WeakPolarHBondContact CB-O 3.48Å; C162-K167 PolarHBondContact N-O 3.48Å; C165-K167 PolarHBondContact O-N 2.91Å; C165-K167 VanDerWaalsContact SG-CB 3.6Å; C165-K167 VanDerWaalsContact SG-CG 3.58Å; K167-F169 HydrophobicContact CB-CE2 3.79Å; K167-F169 HydrophobicContact CB-CZ 3.9Å; K167-F169 WeakPolarHBondContact O-CD2 3.44Å; K167-F169 VanDerWaalsContact O-CE2 3.25Å; K167-F169 WeakPolarHBondContact O-CE2 3.44Å
168	A	62.8	Low	65.9	Low	28 Å²	28	65.2 Å²	65.2	23%	0.231	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	143.4	179.3	0	0	0	0	0	110.9	K158 Y160 K161 G166	K158-A168 HydrophobicContact CB-CB 3.34Å; K158-A168 HydrophobicContact CD-CB 3.97Å; K158-A168 WeakPolarHBondContact CD-O 3.35Å; K158-A168 HydrophobicContact CG-CB 4.29Å; Y160-A168 CarbonylContact O-C 3.57Å; Y160-A168 WeakPolarHBondContact O-CA 2.87Å; K161-A168 HydrophobicContact CG-CB 3.81Å; G166-A168 PolarHBondContact O-N 3.4Å
169	F	66.6	Low	66.2	Low	42 Å²	42	62.3 Å²	62.3	18%	0.184	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	149.6	-176.8	-60	-90	0	0	0	111	K158 Y160 C162 K167 F171 T174 L175 H178	K158-F169 CarbonylContact C-O 3.26Å; K158-F169 WeakPolarHBondContact CA-O 3.32Å; Y160-F169 PolarHBondContact N-O 3.14Å; Y160-F169 PolarHBondContact O-N 3.13Å; C162-F169 HydrophobicContact CB-CE2 4.24Å; K167-F169 HydrophobicContact CB-CE2 3.79Å; K167-F169 HydrophobicContact CB-CZ 3.9Å; K167-F169 WeakPolarHBondContact O-CD2 3.44Å; K167-F169 VanDerWaalsContact O-CE2 3.25Å; K167-F169 WeakPolarHBondContact O-CE2 3.44Å; F169-F171 VanDerWaalsContact C-N 3.27Å; F169-T174 WeakPolarHBondContact CB-OG1 3.37Å; F169-L175 HydrophobicContact CB-CB 4.22Å; F169-L175 HydrophobicContact CD2-CB 3.88Å; F169-L175 HydrophobicContact CD2-CD1 3.63Å; F169-L175 HydrophobicContact CD2-CG 4.36Å; F169-L175 HydrophobicContact CE2-CD1 3.84Å; F169-L175 HydrophobicContact CG-CB 4.21Å; F169-H178 HydrophobicContact CE1-CB 3.91Å; F169-H178 HydrophobicContact CE2-CB 3.9Å; F169-H178 AromaticContact CE2-CD2 3.27Å; F169-H178 WeakPolarHBondContact CE2-CD2 3.42Å; F169-H178 AromaticContact CE2-CG 3.58Å; F169-H178 AromaticContact CE2-NE2 4Å; F169-H178 HydrophobicContact CZ-CB 3.47Å; F169-H178 VanDerWaalsContact CZ-CB 3.47Å; F169-H178 AromaticContact CZ-CD2 3.31Å; F169-H178 WeakPolarHBondContact CZ-CD2 3.45Å; F169-H178 AromaticContact CZ-CG 3.14Å; F169-H178 AromaticContact CZ-ND1 3.68Å; F169-H178 AromaticContact CZ-NE2 3.9Å
170	A	60.5	Low	66.8	Low	32 Å²	32	62.3 Å²	62.3	26%	0.264	33%	0.33	S	S	.	.	S	Bend	trans	-73.1	-22.1	175.6	0	0	0	0	0	112.2
171	F	64.2	Low	67	Low	87 Å²	87	63.7 Å²	63.7	38%	0.382	35%	0.345	S	S	.	.			trans	-130.3	140.4	-176.5	-51.2	-80.7	0	0	0	112.3	I149 F169 S173 T174 L175	I149-F171 HydrophobicContact CG2-CE1 3.32Å; I149-F171 HydrophobicContact CG2-CZ 3.66Å; F169-F171 VanDerWaalsContact C-N 3.27Å; F171-S173 VanDerWaalsContact C-N 3.35Å; F171-S173 PolarHBondContact O-N 3.14Å; F171-T174 HydrophobicContact CB-CG2 4.06Å; F171-T174 WeakPolarHBondContact CB-OG1 3.21Å; F171-T174 HydrophobicContact CD2-CG2 4.02Å; F171-T174 HydrophobicContact CG-CG2 4.46Å; F171-T174 PolarHBondContact O-N 3.46Å; F171-T174 PolarHBondContact O-OG1 2.89Å; F171-L175 PolarHBondContact O-N 3.04Å
172	H	62.2	Low	67.5	Low	37 Å²	37	60.7 Å²	60.7	17%	0.171	33%	0.333	C	S	.	.	H	α-helix	trans	-58.7	-44.5	171.2	-176.9	-105.7	0	0	0	112	Y160 T174 L175 Q176	Y160-H172 HydrophobicContact CD1-CB 3.82Å; Y160-H172 HydrophobicContact CE1-CB 3.73Å; Y160-H172 HydrophobicContact CE2-CB 4.46Å; Y160-H172 HydrophobicContact CG-CB 4.22Å; H172-T174 VanDerWaalsContact C-N 3.27Å; H172-T174 PolarHBondContact O-N 3.11Å; H172-L175 CarbonylContact O-C 3.59Å; H172-L175 WeakPolarHBondContact O-CA 3.44Å; H172-L175 WeakPolarHBondContact O-CB 3.31Å; H172-L175 PolarHBondContact O-N 3.42Å; H172-Q176 WeakPolarHBondContact CE1-CG 3.45Å; H172-Q176 PolarHBondContact CE1-NE2 3.38Å; H172-Q176 VanDerWaalsContact CE1-NE2 3.26Å; H172-Q176 PolarHBondContact NE2-NE2 3.03Å; H172-Q176 WeakPolarHBondContact O-CG 3.29Å; H172-Q176 PolarHBondContact O-N 2.84Å
173	S	63.2	Low	67.7	Low	77 Å²	77	64.1 Å²	64.1	54%	0.538	35%	0.354	S	S	.	.	H	α-helix	trans	-57.9	-38.6	177.3	57	0	0	0	0	112.6	F171 Q176 V177	F171-S173 VanDerWaalsContact C-N 3.35Å; F171-S173 PolarHBondContact O-N 3.14Å; S173-Q176 PolarHBondContact O-N 3.01Å; S173-V177 WeakPolarHBondContact O-CG2 3.43Å; S173-V177 PolarHBondContact O-N 3.2Å
174	T	64.3	Low	67.8	Low	57 Å²	57	59.7 Å²	59.7	35%	0.35	34%	0.341	S	S	.	.	H	α-helix	trans	-72.4	-34.7	175.3	57.9	0	0	0	0	113	F169 F171 H172 H178	F169-T174 WeakPolarHBondContact CB-OG1 3.37Å; F171-T174 HydrophobicContact CB-CG2 4.06Å; F171-T174 WeakPolarHBondContact CB-OG1 3.21Å; F171-T174 HydrophobicContact CD2-CG2 4.02Å; F171-T174 HydrophobicContact CG-CG2 4.46Å; F171-T174 PolarHBondContact O-N 3.46Å; F171-T174 PolarHBondContact O-OG1 2.89Å; H172-T174 VanDerWaalsContact C-N 3.27Å; H172-T174 PolarHBondContact O-N 3.11Å; T174-H178 VanDerWaalsContact O-CB 3.25Å; T174-H178 WeakPolarHBondContact O-CB 3.47Å; T174-H178 PolarHBondContact O-N 3.49Å
175	L	70.3	Confident	67.9	Low	9 Å²	9	58.9 Å²	58.9	5%	0.047	34%	0.338	C	S	.	.	H	α-helix	trans	-64	-44.2	171.3	171.1	63.5	0	0	0	110.7	K161 C162 F169 F171 H172 H178 K179	K161-L175 WeakPolarHBondContact O-CD2 3.26Å; C162-L175 HydrophobicContact CB-CD1 3.52Å; F169-L175 HydrophobicContact CB-CB 4.22Å; F169-L175 HydrophobicContact CD2-CB 3.88Å; F169-L175 HydrophobicContact CD2-CD1 3.63Å; F169-L175 HydrophobicContact CD2-CG 4.36Å; F169-L175 HydrophobicContact CE2-CD1 3.84Å; F169-L175 HydrophobicContact CG-CB 4.21Å; F171-L175 PolarHBondContact O-N 3.04Å; H172-L175 CarbonylContact O-C 3.59Å; H172-L175 WeakPolarHBondContact O-CA 3.44Å; H172-L175 WeakPolarHBondContact O-CB 3.31Å; H172-L175 PolarHBondContact O-N 3.42Å; L175-H178 CarbonylContact O-C 3.55Å; L175-H178 WeakPolarHBondContact O-CA 3.23Å; L175-H178 WeakPolarHBondContact O-CB 3.46Å; L175-H178 PolarHBondContact O-N 3.08Å; L175-H178 VanDerWaalsContact O-N 3.09Å; L175-K179 HydrophobicContact CD1-CG 4.32Å; L175-K179 WeakPolarHBondContact O-CG 3.36Å; L175-K179 PolarHBondContact O-N 3.04Å
176	Q	69.1	Low	68.3	Low	66 Å²	66	62.2 Å²	62.2	31%	0.308	35%	0.346	S	S	.	.	H	α-helix	trans	-62.7	-45.4	179.8	-73	-60.9	-18.3	0	0	112.1	H172 S173 H178 K179 R180	H172-Q176 WeakPolarHBondContact CE1-CG 3.45Å; H172-Q176 PolarHBondContact CE1-NE2 3.38Å; H172-Q176 VanDerWaalsContact CE1-NE2 3.26Å; H172-Q176 PolarHBondContact NE2-NE2 3.03Å; H172-Q176 WeakPolarHBondContact O-CG 3.29Å; H172-Q176 PolarHBondContact O-N 2.84Å; S173-Q176 PolarHBondContact O-N 3.01Å; Q176-H178 VanDerWaalsContact C-N 3.25Å; Q176-H178 PolarHBondContact O-N 3.41Å; Q176-K179 PolarHBondContact O-N 3.23Å; Q176-R180 PolarHBondContact O-N 2.99Å
177	V	67.9	Low	69.1	Low	32 Å²	32	62.8 Å²	62.8	19%	0.194	34%	0.34	C	S	.	.	H	α-helix	trans	-67.8	-30.1	174.3	-175.3	0	0	0	0	111.8	S173 R180 H199	S173-V177 WeakPolarHBondContact O-CG2 3.43Å; S173-V177 PolarHBondContact O-N 3.2Å; V177-R180 WeakPolarHBondContact O-CB 3.47Å; V177-R180 PolarHBondContact O-N 3.09Å; V177-H199 WeakPolarHBondContact CG1-CE1 3.36Å; V177-H199 WeakPolarHBondContact CG1-ND1 3.25Å; V177-H199 VanDerWaalsContact CG1-NE2 3.33Å; V177-H199 WeakPolarHBondContact CG1-NE2 3.4Å
178	H	72.2	Confident	69.8	Low	24 Å²	24	59.7 Å²	59.7	11%	0.111	33%	0.325	C	S	.	.	H	α-helix	trans	-67.8	-38.4	171.4	170.8	65.4	0	0	0	112.8	C162 C165 F169 T174 L175 Q176 R180 T181 H182	C162-H178 VanDerWaalsContact SG-CD2 3.58Å; C165-H178 PolarHBondContact SG-NE2 2.87Å; F169-H178 HydrophobicContact CE1-CB 3.91Å; F169-H178 HydrophobicContact CE2-CB 3.9Å; F169-H178 AromaticContact CE2-CD2 3.27Å; F169-H178 WeakPolarHBondContact CE2-CD2 3.42Å; F169-H178 AromaticContact CE2-CG 3.58Å; F169-H178 AromaticContact CE2-NE2 4Å; F169-H178 HydrophobicContact CZ-CB 3.47Å; F169-H178 VanDerWaalsContact CZ-CB 3.47Å; F169-H178 AromaticContact CZ-CD2 3.31Å; F169-H178 WeakPolarHBondContact CZ-CD2 3.45Å; F169-H178 AromaticContact CZ-CG 3.14Å; F169-H178 AromaticContact CZ-ND1 3.68Å; F169-H178 AromaticContact CZ-NE2 3.9Å; T174-H178 VanDerWaalsContact O-CB 3.25Å; T174-H178 WeakPolarHBondContact O-CB 3.47Å; T174-H178 PolarHBondContact O-N 3.49Å; L175-H178 CarbonylContact O-C 3.55Å; L175-H178 WeakPolarHBondContact O-CA 3.23Å; L175-H178 WeakPolarHBondContact O-CB 3.46Å; L175-H178 PolarHBondContact O-N 3.08Å; L175-H178 VanDerWaalsContact O-N 3.09Å; Q176-H178 VanDerWaalsContact C-N 3.25Å; Q176-H178 PolarHBondContact O-N 3.41Å; H178-R180 PolarHBondContact O-N 3.26Å; H178-T181 PolarHBondContact CE1-OG1 3.47Å; H178-T181 PolarHBondContact ND1-OG1 3.19Å; H178-T181 WeakPolarHBondContact O-CB 3.3Å; H178-T181 PolarHBondContact O-N 3.16Å; H178-T181 PolarHBondContact O-OG1 2.99Å; H178-H182 AromaticContact CE1-CE1 3.99Å; H178-H182 AromaticContact CE1-NE2 3.55Å; H178-H182 AromaticContact NE2-CD2 4Å; H178-H182 AromaticContact NE2-CE1 3.92Å; H178-H182 AromaticContact NE2-NE2 3.12Å; H178-H182 PolarHBondContact NE2-NE2 2.99Å; H178-H182 VanDerWaalsContact NE2-NE2 3.12Å
179	K	72	Confident	70.4	Confident	55 Å²	55	64.7 Å²	64.7	24%	0.239	34%	0.344	C	S	.	.	H	α-helix	trans	-56.8	-33.1	176.3	-73.2	-172.3	177.4	-169.6	0	111.6	L175 Q176 T181 H182 T183	L175-K179 HydrophobicContact CD1-CG 4.32Å; L175-K179 WeakPolarHBondContact O-CG 3.36Å; L175-K179 PolarHBondContact O-N 3.04Å; Q176-K179 PolarHBondContact O-N 3.23Å; K179-T181 PolarHBondContact O-N 2.78Å; K179-T181 VanDerWaalsContact O-N 3.1Å; K179-H182 PolarHBondContact O-N 3.12Å; K179-T183 PolarHBondContact O-N 3.41Å
180	R	79	Confident	71	Confident	57 Å²	57	63.1 Å²	63.1	22%	0.215	34%	0.337	C	S	.	.	H	α-helix	trans	-59	-21.4	172.8	-58.9	178.1	-175.1	169.4	-1.3	114.3	Q176 V177 H178 H182 T183 G184 E185 A198	Q176-R180 PolarHBondContact O-N 2.99Å; V177-R180 WeakPolarHBondContact O-CB 3.47Å; V177-R180 PolarHBondContact O-N 3.09Å; H178-R180 PolarHBondContact O-N 3.26Å; R180-H182 VanDerWaalsContact C-N 3.28Å; R180-T183 WeakPolarHBondContact CA-OG1 3.36Å; R180-G184 WeakPolarHBondContact O-CA 3.46Å; R180-G184 PolarHBondContact O-N 3.25Å; R180-E185 HydrophobicContact CB-CB 4.41Å; R180-E185 HydrophobicContact CG-CB 4.28Å; R180-A198 HydrophobicContact CB-CB 4.45Å; R180-A198 PolarHBondContact NH1-O 3.18Å
181	T	70.1	Confident	71.7	Confident	90 Å²	90	68.8 Å²	68.8	55%	0.552	36%	0.364	S	S	*	.	H	α-helix	trans	-73.6	-21.1	175.9	66.5	0	0	0	0	113.3	H178 K179	H178-T181 PolarHBondContact CE1-OG1 3.47Å; H178-T181 PolarHBondContact ND1-OG1 3.19Å; H178-T181 WeakPolarHBondContact O-CB 3.3Å; H178-T181 PolarHBondContact O-N 3.16Å; H178-T181 PolarHBondContact O-OG1 2.99Å; K179-T181 PolarHBondContact O-N 2.78Å; K179-T181 VanDerWaalsContact O-N 3.1Å
182	H	73.3	Confident	72.1	Confident	76 Å²	76	70.9 Å²	70.9	35%	0.352	37%	0.374	S	S	.	.	H	α-helix	trans	-96	-40.3	176.9	-55.6	-57	0	0	0	112	C162 Q164 C165 H178 K179 R180 G184	C162-H182 PolarHBondContact SG-NE2 3.34Å; C162-H182 VanDerWaalsContact SG-NE2 3.43Å; Q164-H182 PolarHBondContact OE1-CD2 3.42Å; Q164-H182 VanDerWaalsContact OE1-CD2 3.24Å; C165-H182 PolarHBondContact SG-NE2 2.86Å; C165-H182 VanDerWaalsContact SG-NE2 3.43Å; H178-H182 AromaticContact CE1-CE1 3.99Å; H178-H182 AromaticContact CE1-NE2 3.55Å; H178-H182 AromaticContact NE2-CD2 4Å; H178-H182 AromaticContact NE2-CE1 3.92Å; H178-H182 AromaticContact NE2-NE2 3.12Å; H178-H182 PolarHBondContact NE2-NE2 2.99Å; H178-H182 VanDerWaalsContact NE2-NE2 3.12Å; K179-H182 PolarHBondContact O-N 3.12Å; R180-H182 VanDerWaalsContact C-N 3.28Å; H182-G184 VanDerWaalsContact C-N 3.3Å
183	T	73.1	Confident	72.8	Confident	75 Å²	75	71 Å²	71	46%	0.46	38%	0.379	S	S	.	.	H	α-helix	trans	-76.5	-19	177.6	62.5	0	0	0	0	112.8	K179 R180 E185	K179-T183 PolarHBondContact O-N 3.41Å; R180-T183 WeakPolarHBondContact CA-OG1 3.36Å; T183-E185 PolarHBondContact O-N 3.25Å; T183-E185 WeakPolarHBondContact OG1-CG 3.3Å; T183-E185 PolarHBondContact OG1-N 3.39Å
184	G	72.5	Confident	73.3	Confident	47 Å²	47	73.9 Å²	73.9	49%	0.485	40%	0.399	S	S	.	.			trans	75.3	3.3	-176.5	0	0	0	0	0	114.1	R180 H182 K186	R180-G184 WeakPolarHBondContact O-CA 3.46Å; R180-G184 PolarHBondContact O-N 3.25Å; H182-G184 VanDerWaalsContact C-N 3.3Å; G184-K186 PolarHBondContact O-N 2.95Å
185	E	72.2	Confident	73.5	Confident	112 Å²	112	77.2 Å²	77.2	52%	0.523	41%	0.409	S	S	.	.			trans	-57.7	128.6	178.6	-76.2	175	-172.6	0	0	111.7	R180 T183	R180-E185 HydrophobicContact CB-CB 4.41Å; R180-E185 HydrophobicContact CG-CB 4.28Å; T183-E185 PolarHBondContact O-N 3.25Å; T183-E185 WeakPolarHBondContact OG1-CG 3.3Å; T183-E185 PolarHBondContact OG1-N 3.39Å
186	K	76.8	Confident	73.8	Confident	119 Å²	119	77.9 Å²	77.9	52%	0.517	42%	0.416	S	S	.	.			trans	-130	75.9	179.2	-72.9	164.3	176.8	-178.8	0	109.6	G184 Y188 A196 F197	G184-K186 PolarHBondContact O-N 2.95Å; K186-Y188 PolarHBondContact O-N 2.85Å; K186-A196 HydrophobicContact CB-CB 3.45Å; K186-A196 VanDerWaalsContact CB-CB 3.45Å; K186-A196 HydrophobicContact CD-CB 4.12Å; K186-A196 WeakPolarHBondContact CD-O 3.36Å; K186-A196 HydrophobicContact CG-CB 4.39Å; K186-A196 WeakPolarHBondContact O-CB 3.34Å; K186-F197 CarbonylContact C-O 3.57Å; K186-F197 WeakPolarHBondContact CA-O 3.22Å
187	P	77	Confident	74.1	Confident	71 Å²	71	77 Å²	77	46%	0.461	41%	0.411	S	S	.	.			trans	-63.8	-18.2	-171.4	-23.3	35	0	0	0	114.4
188	Y	77.6	Confident	74.2	Confident	61 Å²	61	76.5 Å²	76.5	24%	0.239	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	92.8	-174.5	-53.7	-71.5	0	0	0	110.6	K186 A196 F197 A198 H200	K186-Y188 PolarHBondContact O-N 2.85Å; Y188-A196 CarbonylContact O-C 3.59Å; Y188-A196 WeakPolarHBondContact O-CA 3.28Å; Y188-F197 WeakPolarHBondContact CB-O 3.46Å; Y188-F197 WeakPolarHBondContact CD2-O 3.47Å; Y188-F197 PolarHBondContact N-O 3.33Å; Y188-F197 VanDerWaalsContact N-O 3.15Å; Y188-F197 PolarHBondContact O-N 3.2Å; Y188-A198 WeakPolarHBondContact CE2-O 3.4Å; Y188-H200 HydrophobicContact CD1-CB 3.92Å; Y188-H200 HydrophobicContact CD2-CB 4.33Å; Y188-H200 HydrophobicContact CE1-CB 3.81Å; Y188-H200 HydrophobicContact CE2-CB 4.19Å; Y188-H200 HydrophobicContact CG-CB 4.18Å
189	E	75.1	Confident	74.1	Confident	133 Å²	133	79 Å²	79	62%	0.621	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.5	150.3	180	-55.5	-159.9	152.6	0	0	113	A196 L203	E189-A196 HydrophobicContact CG-CB 3.86Å; E189-L203 VanDerWaalsContact O-CD2 3.31Å; E189-L203 WeakPolarHBondContact O-CD2 3.47Å
190	C	78.1	Confident	74.1	Confident	8 Å²	8	80.7 Å²	80.7	5%	0.054	43%	0.43	C	S	.	.			trans	-92.3	117.2	174.4	-175.6	0	0	0	0	110.7	Q192 C193 K195 L203 H210	C190-Q192 PolarHBondContact O-N 3.35Å; C190-C193 CarbonylContact C-O 3.55Å; C190-C193 WeakPolarHBondContact CB-O 3.43Å; C190-C193 CarbonylContact O-C 3.4Å; C190-C193 PolarHBondContact O-N 3.43Å; C190-K195 WeakPolarHBondContact CB-O 2.81Å; C190-K195 PolarHBondContact N-O 3.2Å; C190-L203 HydrophobicContact CB-CD1 3.74Å; C190-H210 PolarHBondContact SG-NE2 3.32Å
191	N	75.4	Confident	73.4	Confident	152 Å²	152	80.6 Å²	80.6	81%	0.813	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-7.4	179.3	-56.1	-7.5	0	0	0	114.2
192	Q	72.4	Confident	73.5	Confident	131 Å²	131	81 Å²	81	61%	0.612	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	-9.6	-179.4	-65.6	176.6	7	0	0	113.3	C190 H210	C190-Q192 PolarHBondContact O-N 3.35Å; Q192-H210 PolarHBondContact OE1-CD2 3.13Å; Q192-H210 VanDerWaalsContact OE1-CG 3.24Å
193	C	76.6	Confident	73.6	Confident	39 Å²	39	77.8 Å²	77.8	26%	0.264	42%	0.419	S	S	.	.	S	Bend	trans	-158.3	155.3	169.7	71.6	0	0	0	0	110.6	C190 K195 H206 H210	C190-C193 CarbonylContact C-O 3.55Å; C190-C193 WeakPolarHBondContact CB-O 3.43Å; C190-C193 CarbonylContact O-C 3.4Å; C190-C193 PolarHBondContact O-N 3.43Å; C193-K195 PolarHBondContact O-N 3.4Å; C193-H206 PolarHBondContact SG-NE2 3.01Å; C193-H210 PolarHBondContact SG-NE2 3.31Å
194	S	73.9	Confident	73.7	Confident	137 Å²	137	81.4 Å²	81.4	96%	0.958	42%	0.424	S	S	*	.	S	Bend	trans	-68.7	25.1	-176.9	-41.5	0	0	0	0	115.4
195	K	68.3	Low	73.5	Confident	127 Å²	127	82 Å²	82	55%	0.552	42%	0.418	S	S	*	.			trans	-92.7	126.2	176.4	-69.5	-174.9	-179.9	177.3	0	110.9	C190 C193 F197	C190-K195 WeakPolarHBondContact CB-O 2.81Å; C190-K195 PolarHBondContact N-O 3.2Å; C193-K195 PolarHBondContact O-N 3.4Å; K195-F197 HydrophobicContact CB-CE2 4.08Å; K195-F197 HydrophobicContact CB-CZ 4.17Å
196	A	76.8	Confident	73.7	Confident	24 Å²	24	77.4 Å²	77.4	20%	0.198	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	149.9	176.4	0	0	0	0	0	111.8	K186 Y188 E189	K186-A196 HydrophobicContact CB-CB 3.45Å; K186-A196 VanDerWaalsContact CB-CB 3.45Å; K186-A196 HydrophobicContact CD-CB 4.12Å; K186-A196 WeakPolarHBondContact CD-O 3.36Å; K186-A196 HydrophobicContact CG-CB 4.39Å; K186-A196 WeakPolarHBondContact O-CB 3.34Å; Y188-A196 CarbonylContact O-C 3.59Å; Y188-A196 WeakPolarHBondContact O-CA 3.28Å; E189-A196 HydrophobicContact CG-CB 3.86Å
197	F	75.3	Confident	73.7	Confident	46 Å²	46	75.5 Å²	75.5	20%	0.202	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	146.3	-176.3	-58.6	-90.7	0	0	0	111.8	K186 Y188 K195 H199 H202 L203 H206	K186-F197 CarbonylContact C-O 3.57Å; K186-F197 WeakPolarHBondContact CA-O 3.22Å; Y188-F197 WeakPolarHBondContact CB-O 3.46Å; Y188-F197 WeakPolarHBondContact CD2-O 3.47Å; Y188-F197 PolarHBondContact N-O 3.33Å; Y188-F197 VanDerWaalsContact N-O 3.15Å; Y188-F197 PolarHBondContact O-N 3.2Å; K195-F197 HydrophobicContact CB-CE2 4.08Å; K195-F197 HydrophobicContact CB-CZ 4.17Å; F197-H199 VanDerWaalsContact C-N 3.3Å; F197-H202 HydrophobicContact CB-CB 4.32Å; F197-H202 HydrophobicContact CD1-CB 3.91Å; F197-H202 HydrophobicContact CG-CB 4.33Å; F197-L203 HydrophobicContact CB-CB 4.37Å; F197-L203 HydrophobicContact CD2-CB 3.89Å; F197-L203 HydrophobicContact CD2-CD1 3.8Å; F197-L203 HydrophobicContact CD2-CG 4.45Å; F197-L203 HydrophobicContact CE2-CD1 3.98Å; F197-L203 HydrophobicContact CG-CB 4.32Å; F197-H206 HydrophobicContact CE1-CB 4.05Å; F197-H206 HydrophobicContact CE2-CB 3.73Å; F197-H206 AromaticContact CE2-CD2 3.41Å; F197-H206 VanDerWaalsContact CE2-CD2 3.41Å; F197-H206 WeakPolarHBondContact CE2-CD2 3.41Å; F197-H206 AromaticContact CE2-CG 3.49Å; F197-H206 VanDerWaalsContact CE2-CG 3.49Å; F197-H206 HydrophobicContact CZ-CB 3.4Å; F197-H206 VanDerWaalsContact CZ-CB 3.4Å; F197-H206 AromaticContact CZ-CD2 3.6Å; F197-H206 AromaticContact CZ-CG 3.2Å; F197-H206 AromaticContact CZ-ND1 3.59Å
198	A	70.6	Confident	73.8	Confident	23 Å²	23	74.5 Å²	74.5	19%	0.19	38%	0.376	C	S	.	.	S	Bend	trans	-75.6	-18.4	175.3	0	0	0	0	0	113.4	R180 Y188	R180-A198 HydrophobicContact CB-CB 4.45Å; R180-A198 PolarHBondContact NH1-O 3.18Å; Y188-A198 WeakPolarHBondContact CE2-O 3.4Å
199	H	70.8	Confident	73.5	Confident	75 Å²	75	76.7 Å²	76.7	35%	0.347	39%	0.39	S	S	.	.	S	Bend	trans	-128.4	136.7	179.9	-62.3	-106.6	0	0	0	111.8	V177 F197 C201 H202 L203	V177-H199 WeakPolarHBondContact CG1-CE1 3.36Å; V177-H199 WeakPolarHBondContact CG1-ND1 3.25Å; V177-H199 VanDerWaalsContact CG1-NE2 3.33Å; V177-H199 WeakPolarHBondContact CG1-NE2 3.4Å; F197-H199 VanDerWaalsContact C-N 3.3Å; H199-C201 VanDerWaalsContact C-N 3.32Å; H199-C201 PolarHBondContact O-N 3.5Å; H199-H202 HydrophobicContact CB-CB 4.44Å; H199-H202 AromaticContact CD2-CE1 3.83Å; H199-H202 AromaticContact CD2-ND1 3.74Å; H199-H202 AromaticContact CG-ND1 4Å; H199-H202 PolarHBondContact O-N 3.09Å; H199-L203 PolarHBondContact O-N 2.94Å
200	H	70.5	Confident	73.4	Confident	91 Å²	91	73.8 Å²	73.8	42%	0.421	38%	0.377	S	S	.	.	H	α-helix	trans	-60.5	-37.9	176.2	-179.1	-110.5	0	0	0	113	Y188 H202 L203 R204	Y188-H200 HydrophobicContact CD1-CB 3.92Å; Y188-H200 HydrophobicContact CD2-CB 4.33Å; Y188-H200 HydrophobicContact CE1-CB 3.81Å; Y188-H200 HydrophobicContact CE2-CB 4.19Å; Y188-H200 HydrophobicContact CG-CB 4.18Å; H200-H202 VanDerWaalsContact C-N 3.26Å; H200-H202 PolarHBondContact O-N 3.3Å; H200-L203 PolarHBondContact O-N 3.11Å; H200-R204 PolarHBondContact O-N 3.03Å
201	C	65.1	Low	73.3	Confident	55 Å²	55	77.2 Å²	77.2	37%	0.372	40%	0.397	S	S	.	.	H	α-helix	trans	-62.1	-33.2	178.1	62.1	0	0	0	0	112.7	H199 R204 V205	H199-C201 VanDerWaalsContact C-N 3.32Å; H199-C201 PolarHBondContact O-N 3.5Å; C201-R204 PolarHBondContact O-N 2.77Å; C201-V205 WeakPolarHBondContact O-CG2 2.95Å; C201-V205 PolarHBondContact O-N 3.19Å; C201-V205 VanDerWaalsContact O-N 3.12Å
202	H	72.1	Confident	73.2	Confident	99 Å²	99	72.3 Å²	72.3	46%	0.458	38%	0.382	S	S	.	.	H	α-helix	trans	-73.7	-39.3	176.3	-64.1	159.8	0	0	0	111.7	F197 H199 H200 R204 V205 H206	F197-H202 HydrophobicContact CB-CB 4.32Å; F197-H202 HydrophobicContact CD1-CB 3.91Å; F197-H202 HydrophobicContact CG-CB 4.33Å; H199-H202 HydrophobicContact CB-CB 4.44Å; H199-H202 AromaticContact CD2-CE1 3.83Å; H199-H202 AromaticContact CD2-ND1 3.74Å; H199-H202 AromaticContact CG-ND1 4Å; H199-H202 PolarHBondContact O-N 3.09Å; H200-H202 VanDerWaalsContact C-N 3.26Å; H200-H202 PolarHBondContact O-N 3.3Å; H202-R204 VanDerWaalsContact C-N 3.3Å; H202-R204 PolarHBondContact O-N 3.08Å; H202-V205 PolarHBondContact O-N 3.26Å; H202-H206 VanDerWaalsContact O-CB 3.28Å; H202-H206 WeakPolarHBondContact O-CB 3.5Å; H202-H206 PolarHBondContact O-N 2.98Å
203	L	75.7	Confident	73.4	Confident	9 Å²	9	71.4 Å²	71.4	5%	0.047	38%	0.378	C	S	.	.	H	α-helix	trans	-59.2	-43.1	170.8	174.8	63	0	0	0	111	E189 C190 F197 H199 H200 V205 H206 K207	E189-L203 VanDerWaalsContact O-CD2 3.31Å; E189-L203 WeakPolarHBondContact O-CD2 3.47Å; C190-L203 HydrophobicContact CB-CD1 3.74Å; F197-L203 HydrophobicContact CB-CB 4.37Å; F197-L203 HydrophobicContact CD2-CB 3.89Å; F197-L203 HydrophobicContact CD2-CD1 3.8Å; F197-L203 HydrophobicContact CD2-CG 4.45Å; F197-L203 HydrophobicContact CE2-CD1 3.98Å; F197-L203 HydrophobicContact CG-CB 4.32Å; H199-L203 PolarHBondContact O-N 2.94Å; H200-L203 PolarHBondContact O-N 3.11Å; L203-V205 PolarHBondContact O-N 2.83Å; L203-H206 WeakPolarHBondContact O-CB 3.41Å; L203-H206 PolarHBondContact O-N 2.86Å; L203-H206 VanDerWaalsContact O-N 3.15Å; L203-K207 HydrophobicContact CD1-CG 4.32Å; L203-K207 WeakPolarHBondContact O-CG 3.42Å; L203-K207 PolarHBondContact O-N 3.13Å
204	R	74.1	Confident	73.6	Confident	150 Å²	150	75 Å²	75	57%	0.566	39%	0.389	S	S	*	.	H	α-helix	trans	-61.1	-43.1	177.8	-174.4	173.8	65.5	-171.7	0.4	112.7	H200 C201 H202 H206	H200-R204 PolarHBondContact O-N 3.03Å; C201-R204 PolarHBondContact O-N 2.77Å; H202-R204 VanDerWaalsContact C-N 3.3Å; H202-R204 PolarHBondContact O-N 3.08Å; R204-H206 VanDerWaalsContact C-N 3.34Å
205	V	69.6	Low	74.1	Confident	61 Å²	61	71.8 Å²	71.8	37%	0.37	37%	0.365	S	S	.	.	H	α-helix	trans	-68.4	-36.4	174.5	175.8	0	0	0	0	110.9	C201 H202 L203 R208 V226	C201-V205 WeakPolarHBondContact O-CG2 2.95Å; C201-V205 PolarHBondContact O-N 3.19Å; C201-V205 VanDerWaalsContact O-N 3.12Å; H202-V205 PolarHBondContact O-N 3.26Å; L203-V205 PolarHBondContact O-N 2.83Å; V205-R208 WeakPolarHBondContact O-CB 3.48Å; V205-R208 PolarHBondContact O-N 3.48Å; V205-V226 HydrophobicContact CG1-CG1 4.14Å
206	H	76.8	Confident	74.8	Confident	15 Å²	15	69.2 Å²	69.2	7%	0.069	35%	0.352	C	S	.	.	H	α-helix	trans	-65	-40.4	177.5	171.9	68.9	0	0	0	113.1	C193 F197 H202 L203 R204 R208 I209 H210	C193-H206 PolarHBondContact SG-NE2 3.01Å; F197-H206 HydrophobicContact CE1-CB 4.05Å; F197-H206 HydrophobicContact CE2-CB 3.73Å; F197-H206 AromaticContact CE2-CD2 3.41Å; F197-H206 VanDerWaalsContact CE2-CD2 3.41Å; F197-H206 WeakPolarHBondContact CE2-CD2 3.41Å; F197-H206 AromaticContact CE2-CG 3.49Å; F197-H206 VanDerWaalsContact CE2-CG 3.49Å; F197-H206 HydrophobicContact CZ-CB 3.4Å; F197-H206 VanDerWaalsContact CZ-CB 3.4Å; F197-H206 AromaticContact CZ-CD2 3.6Å; F197-H206 AromaticContact CZ-CG 3.2Å; F197-H206 AromaticContact CZ-ND1 3.59Å; H202-H206 VanDerWaalsContact O-CB 3.28Å; H202-H206 WeakPolarHBondContact O-CB 3.5Å; H202-H206 PolarHBondContact O-N 2.98Å; L203-H206 WeakPolarHBondContact O-CB 3.41Å; L203-H206 PolarHBondContact O-N 2.86Å; L203-H206 VanDerWaalsContact O-N 3.15Å; R204-H206 VanDerWaalsContact C-N 3.34Å; H206-R208 PolarHBondContact O-N 3.04Å; H206-I209 VanDerWaalsContact O-CB 3.28Å; H206-I209 WeakPolarHBondContact O-CB 3.46Å; H206-I209 WeakPolarHBondContact O-CG1 3.41Å; H206-I209 PolarHBondContact O-N 3.41Å; H206-H210 AromaticContact CE1-NE2 3.84Å; H206-H210 AromaticContact NE2-NE2 3.25Å; H206-H210 PolarHBondContact NE2-NE2 3.32Å
207	K	75.9	Confident	75.1	Confident	78 Å²	78	74.7 Å²	74.7	34%	0.339	37%	0.372	S	S	.	.	H	α-helix	trans	-55.2	-27.5	177.3	-76.5	-178.7	176.9	-178.4	0	112.6	L203 I209 H210 T211	L203-K207 HydrophobicContact CD1-CG 4.32Å; L203-K207 WeakPolarHBondContact O-CG 3.42Å; L203-K207 PolarHBondContact O-N 3.13Å; K207-I209 PolarHBondContact O-N 3.41Å; K207-H210 PolarHBondContact O-N 3.11Å; K207-H210 VanDerWaalsContact O-N 3.16Å; K207-T211 PolarHBondContact O-N 3.03Å
208	R	78.6	Confident	75.7	Confident	51 Å²	51	72.6 Å²	72.6	19%	0.192	36%	0.363	C	S	.	.	H	α-helix	trans	-65.4	-19.5	175.2	-62.4	178.3	-178.7	169.8	-1.6	114.4	V205 H206 H210 T211 G212 E213 V226	V205-R208 WeakPolarHBondContact O-CB 3.48Å; V205-R208 PolarHBondContact O-N 3.48Å; H206-R208 PolarHBondContact O-N 3.04Å; R208-H210 VanDerWaalsContact C-N 3.3Å; R208-T211 WeakPolarHBondContact CA-OG1 3.32Å; R208-G212 WeakPolarHBondContact O-CA 3.17Å; R208-G212 PolarHBondContact O-N 3.43Å; R208-E213 HydrophobicContact CB-CB 4.36Å; R208-E213 HydrophobicContact CG-CB 4.38Å; R208-E213 PolarHBondContact O-N 3.15Å; R208-V226 HydrophobicContact CB-CG1 3.58Å; R208-V226 HydrophobicContact CG-CG1 4.42Å; R208-V226 PolarHBondContact NH1-O 3.36Å; R208-V226 VanDerWaalsContact NH1-O 3.1Å
209	I	71.1	Confident	76.4	Confident	107 Å²	107	78.9 Å²	78.9	55%	0.549	39%	0.393	S	S	.	.	H	α-helix	trans	-67.7	-37	175	-61.2	178.4	0	0	0	110.1	H206 K207	H206-I209 VanDerWaalsContact O-CB 3.28Å; H206-I209 WeakPolarHBondContact O-CB 3.46Å; H206-I209 WeakPolarHBondContact O-CG1 3.41Å; H206-I209 PolarHBondContact O-N 3.41Å; K207-I209 PolarHBondContact O-N 3.41Å
210	H	73.9	Confident	76.9	Confident	72 Å²	72	81.7 Å²	81.7	33%	0.333	41%	0.406	S	S	.	.	H	α-helix	trans	-80.8	-37.4	-179.1	-54.8	-55.8	0	0	0	112.2	C190 Q192 C193 H206 K207 R208 G212	C190-H210 PolarHBondContact SG-NE2 3.32Å; Q192-H210 PolarHBondContact OE1-CD2 3.13Å; Q192-H210 VanDerWaalsContact OE1-CG 3.24Å; C193-H210 PolarHBondContact SG-NE2 3.31Å; H206-H210 AromaticContact CE1-NE2 3.84Å; H206-H210 AromaticContact NE2-NE2 3.25Å; H206-H210 PolarHBondContact NE2-NE2 3.32Å; K207-H210 PolarHBondContact O-N 3.11Å; K207-H210 VanDerWaalsContact O-N 3.16Å; R208-H210 VanDerWaalsContact C-N 3.3Å; H210-G212 PolarHBondContact O-N 3.41Å
211	T	75.4	Confident	77.5	Confident	80 Å²	80	79.9 Å²	79.9	49%	0.491	40%	0.404	S	S	.	.	H	α-helix	trans	-77.3	-12.2	176.1	63.3	0	0	0	0	113	K207 R208 E213	K207-T211 PolarHBondContact O-N 3.03Å; R208-T211 WeakPolarHBondContact CA-OG1 3.32Å; T211-E213 PolarHBondContact O-N 3.14Å; T211-E213 WeakPolarHBondContact OG1-CG 3.44Å
212	G	73.7	Confident	78.2	Confident	48 Å²	48	80 Å²	80	50%	0.495	41%	0.414	S	S	.	.			trans	70.8	4	-176.1	0	0	0	0	0	114.2	R208 H210 K214	R208-G212 WeakPolarHBondContact O-CA 3.17Å; R208-G212 PolarHBondContact O-N 3.43Å; H210-G212 PolarHBondContact O-N 3.41Å; G212-K214 PolarHBondContact O-N 3.05Å
213	E	76.9	Confident	78.6	Confident	113 Å²	113	81.3 Å²	81.3	53%	0.528	42%	0.418	S	S	.	.			trans	-62.5	123.2	-179.7	-75.4	-179.5	-176.3	0	0	111.4	R208 T211 P215	R208-E213 HydrophobicContact CB-CB 4.36Å; R208-E213 HydrophobicContact CG-CB 4.38Å; R208-E213 PolarHBondContact O-N 3.15Å; T211-E213 PolarHBondContact O-N 3.14Å; T211-E213 WeakPolarHBondContact OG1-CG 3.44Å; E213-P215 WeakPolarHBondContact O-CD 3.47Å
214	K	81.3	Confident	79.1	Confident	115 Å²	115	82.3 Å²	82.3	50%	0.5	43%	0.428	S	S	.	.			trans	-125.2	80	177	-70.6	167.5	175.6	-176.8	0	109.8	G212 Y216 A224 F225 V226	G212-K214 PolarHBondContact O-N 3.05Å; K214-Y216 PolarHBondContact O-N 2.78Å; K214-A224 HydrophobicContact CB-CB 3.44Å; K214-A224 VanDerWaalsContact CB-CB 3.44Å; K214-A224 HydrophobicContact CD-CB 4.07Å; K214-A224 WeakPolarHBondContact CD-O 3.49Å; K214-A224 HydrophobicContact CG-CB 4.36Å; K214-F225 CarbonylContact C-O 3.55Å; K214-F225 VanDerWaalsContact C-O 3.3Å; K214-F225 VanDerWaalsContact CA-O 3.32Å; K214-F225 WeakPolarHBondContact CA-O 3.24Å; K214-V226 HydrophobicContact CG-CG2 4.02Å
215	P	82.9	Confident	79.5	Confident	69 Å²	69	77.2 Å²	77.2	45%	0.448	41%	0.41	S	S	.	.			trans	-66.5	-22.2	-171.8	-22.3	34.8	0	0	0	114.1	E213	E213-P215 WeakPolarHBondContact O-CD 3.47Å
216	Y	83.6	Confident	79.9	Confident	72 Å²	72	75.8 Å²	75.8	28%	0.282	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	103.5	-172.2	-55.3	-78.9	0	0	0	110.1	K214 A224 F225 V226 Q228	K214-Y216 PolarHBondContact O-N 2.78Å; Y216-A224 CarbonylContact O-C 3.55Å; Y216-A224 WeakPolarHBondContact O-CA 3.25Å; Y216-F225 PolarHBondContact N-O 3.29Å; Y216-F225 PolarHBondContact O-N 3.27Å; Y216-V226 WeakPolarHBondContact CE2-O 3.37Å; Y216-Q228 HydrophobicContact CD1-CB 3.94Å; Y216-Q228 HydrophobicContact CD1-CG 4.21Å; Y216-Q228 HydrophobicContact CE1-CB 3.71Å; Y216-Q228 HydrophobicContact CE1-CG 4.15Å; Y216-Q228 HydrophobicContact CE2-CB 4.44Å; Y216-Q228 HydrophobicContact CG-CB 4.4Å
217	K	82.3	Confident	80	Confident	140 Å²	140	75.7 Å²	75.7	61%	0.609	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.3	143.6	179.9	-64.1	-179	-178.3	177	0	110.8	K223 A224 L231	K217-K223 CarbonylContact C-O 3.55Å; K217-A224 HydrophobicContact CG-CB 3.97Å; K217-L231 WeakPolarHBondContact O-CD2 3.43Å
218	C	88.9	Confident	80.1	Confident	2 Å²	2	76.9 Å²	76.9	1%	0.014	41%	0.411	C	S	.	.			trans	-87.6	121.3	171.6	179.6	0	0	0	0	109.6	Q220 C221 G222 K223 F225 L231	C218-Q220 PolarHBondContact O-N 2.82Å; C218-C221 PolarHBondContact O-N 3.24Å; C218-G222 VanDerWaalsContact O-CA 3.23Å; C218-G222 WeakPolarHBondContact O-CA 3.44Å; C218-G222 PolarHBondContact O-N 3.34Å; C218-K223 WeakPolarHBondContact CB-O 3.5Å; C218-K223 PolarHBondContact N-O 3.18Å; C218-F225 HydrophobicContact CB-CE2 4.3Å; C218-L231 HydrophobicContact CB-CD1 3.58Å
219	D	84.4	Confident	80.2	Confident	155 Å²	155	80.5 Å²	80.5	83%	0.829	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-24.6	-176.7	-59.1	-31.3	0	0	0	112.7
220	Q	82.3	Confident	80.7	Confident	133 Å²	133	78.2 Å²	78.2	62%	0.621	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-24.9	-176.6	-59.1	-170	21.2	0	0	114.3	C218 H238	C218-Q220 PolarHBondContact O-N 2.82Å; Q220-H238 VanDerWaalsContact OE1-CG 3.22Å
221	C	82	Confident	81.2	Confident	54 Å²	54	75.7 Å²	75.7	37%	0.365	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.1	5.5	-178.2	71.8	0	0	0	0	115.1	C218 K223 H234 H238	C218-C221 PolarHBondContact O-N 3.24Å; C221-K223 PolarHBondContact O-N 2.9Å; C221-K223 VanDerWaalsContact O-N 3.08Å; C221-H234 PolarHBondContact SG-NE2 3.43Å; C221-H238 PolarHBondContact SG-NE2 2.88Å; C221-H238 VanDerWaalsContact SG-NE2 3.41Å
222	G	81.1	Confident	81.6	Confident	57 Å²	57	77.3 Å²	77.3	59%	0.588	41%	0.412	S	S	*	.			trans	69.5	-0.1	179	0	0	0	0	0	115.1	C218 A224	C218-G222 VanDerWaalsContact O-CA 3.23Å; C218-G222 WeakPolarHBondContact O-CA 3.44Å; C218-G222 PolarHBondContact O-N 3.34Å; G222-A224 PolarHBondContact O-N 3.26Å
223	K	81.1	Confident	82.1	Confident	126 Å²	126	80.6 Å²	80.6	55%	0.548	41%	0.41	S	S	.	.			trans	-68	133.4	-179	-74.3	-179.7	-178	173	0	111	K217 C218 C221 F225	K217-K223 CarbonylContact C-O 3.55Å; C218-K223 WeakPolarHBondContact CB-O 3.5Å; C218-K223 PolarHBondContact N-O 3.18Å; C221-K223 PolarHBondContact O-N 2.9Å; C221-K223 VanDerWaalsContact O-N 3.08Å; K223-F225 HydrophobicContact CB-CE2 3.88Å; K223-F225 HydrophobicContact CB-CZ 4Å; K223-F225 VanDerWaalsContact O-CE2 3.32Å; K223-F225 WeakPolarHBondContact O-CE2 3.4Å
224	A	85.5	Confident	82.6	Confident	31 Å²	31	76.5 Å²	76.5	26%	0.256	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	144	-177.4	0	0	0	0	0	112.1	K214 Y216 K217 G222	K214-A224 HydrophobicContact CB-CB 3.44Å; K214-A224 VanDerWaalsContact CB-CB 3.44Å; K214-A224 HydrophobicContact CD-CB 4.07Å; K214-A224 WeakPolarHBondContact CD-O 3.49Å; K214-A224 HydrophobicContact CG-CB 4.36Å; Y216-A224 CarbonylContact O-C 3.55Å; Y216-A224 WeakPolarHBondContact O-CA 3.25Å; K217-A224 HydrophobicContact CG-CB 3.97Å; G222-A224 PolarHBondContact O-N 3.26Å
225	F	82.4	Confident	82.7	Confident	42 Å²	42	74.4 Å²	74.4	18%	0.184	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	151.4	-174.8	-59.4	-87.9	0	0	0	111.5	K214 Y216 C218 K223 D230 L231 H234	K214-F225 CarbonylContact C-O 3.55Å; K214-F225 VanDerWaalsContact C-O 3.3Å; K214-F225 VanDerWaalsContact CA-O 3.32Å; K214-F225 WeakPolarHBondContact CA-O 3.24Å; Y216-F225 PolarHBondContact N-O 3.29Å; Y216-F225 PolarHBondContact O-N 3.27Å; C218-F225 HydrophobicContact CB-CE2 4.3Å; K223-F225 HydrophobicContact CB-CE2 3.88Å; K223-F225 HydrophobicContact CB-CZ 4Å; K223-F225 VanDerWaalsContact O-CE2 3.32Å; K223-F225 WeakPolarHBondContact O-CE2 3.4Å; F225-D230 HydrophobicContact CB-CB 4.03Å; F225-D230 HydrophobicContact CD1-CB 3.92Å; F225-D230 HydrophobicContact CG-CB 4.25Å; F225-L231 HydrophobicContact CB-CB 4.34Å; F225-L231 HydrophobicContact CD2-CB 3.96Å; F225-L231 HydrophobicContact CD2-CD1 3.76Å; F225-L231 HydrophobicContact CD2-CG 4.48Å; F225-L231 HydrophobicContact CE2-CD1 3.95Å; F225-L231 HydrophobicContact CG-CB 4.31Å; F225-H234 HydrophobicContact CE1-CB 3.81Å; F225-H234 AromaticContact CE1-CG 4Å; F225-H234 HydrophobicContact CE2-CB 3.84Å; F225-H234 AromaticContact CE2-CD2 3.34Å; F225-H234 WeakPolarHBondContact CE2-CD2 3.48Å; F225-H234 AromaticContact CE2-CG 3.64Å; F225-H234 HydrophobicContact CZ-CB 3.37Å; F225-H234 AromaticContact CZ-CD2 3.29Å; F225-H234 WeakPolarHBondContact CZ-CD2 3.36Å; F225-H234 AromaticContact CZ-CG 3.14Å; F225-H234 AromaticContact CZ-ND1 3.72Å; F225-H234 AromaticContact CZ-NE2 3.88Å
226	V	78.3	Confident	82.9	Confident	32 Å²	32	74 Å²	74	19%	0.194	37%	0.372	C	S	.	.	S	Bend	trans	-77.3	-30.1	-178.2	-180	0	0	0	0	111.9	V205 R208 K214 Y216	V205-V226 HydrophobicContact CG1-CG1 4.14Å; R208-V226 HydrophobicContact CB-CG1 3.58Å; R208-V226 HydrophobicContact CG-CG1 4.42Å; R208-V226 PolarHBondContact NH1-O 3.36Å; R208-V226 VanDerWaalsContact NH1-O 3.1Å; K214-V226 HydrophobicContact CG-CG2 4.02Å; Y216-V226 WeakPolarHBondContact CE2-O 3.37Å
227	G	78.7	Confident	82.9	Confident	12 Å²	12	75.1 Å²	75.1	12%	0.124	39%	0.386	C	S	.	.	S	Bend	trans	-128.6	151.6	179.7	0	0	0	0	0	113.2	N229 D230 L231	G227-N229 VanDerWaalsContact C-N 3.34Å; G227-N229 PolarHBondContact O-N 3.06Å; G227-D230 WeakPolarHBondContact O-CB 3.39Å; G227-D230 PolarHBondContact O-N 2.56Å; G227-L231 PolarHBondContact O-N 2.9Å
228	Q	78	Confident	83	Confident	104 Å²	104	71.8 Å²	71.8	49%	0.486	37%	0.372	S	S	.	.	H	α-helix	trans	-64.9	-35.7	179.5	-167.7	177.8	7.7	0	0	112.7	Y216 D230 L231 K232	Y216-Q228 HydrophobicContact CD1-CB 3.94Å; Y216-Q228 HydrophobicContact CD1-CG 4.21Å; Y216-Q228 HydrophobicContact CE1-CB 3.71Å; Y216-Q228 HydrophobicContact CE1-CG 4.15Å; Y216-Q228 HydrophobicContact CE2-CB 4.44Å; Y216-Q228 HydrophobicContact CG-CB 4.4Å; Q228-D230 VanDerWaalsContact C-N 3.26Å; Q228-D230 PolarHBondContact O-N 3.26Å; Q228-L231 PolarHBondContact O-N 3.2Å; Q228-K232 PolarHBondContact O-N 3Å
229	N	79.5	Confident	82.7	Confident	126 Å²	126	76 Å²	76	67%	0.674	40%	0.399	S	S	*	.	H	α-helix	trans	-66.1	-29.7	176.8	-72.2	-19.6	0	0	0	112.4	G227 R233	G227-N229 VanDerWaalsContact C-N 3.34Å; G227-N229 PolarHBondContact O-N 3.06Å; N229-R233 WeakPolarHBondContact O-CB 3.47Å; N229-R233 PolarHBondContact O-N 3.46Å
230	D	81.7	Confident	82.6	Confident	60 Å²	60	70.9 Å²	70.9	32%	0.321	38%	0.382	S	S	.	.	H	α-helix	trans	-71.5	-41.4	175.9	-65.2	-51.5	0	0	0	111.2	F225 G227 Q228 R233 H234	F225-D230 HydrophobicContact CB-CB 4.03Å; F225-D230 HydrophobicContact CD1-CB 3.92Å; F225-D230 HydrophobicContact CG-CB 4.25Å; G227-D230 WeakPolarHBondContact O-CB 3.39Å; G227-D230 PolarHBondContact O-N 2.56Å; Q228-D230 VanDerWaalsContact C-N 3.26Å; Q228-D230 PolarHBondContact O-N 3.26Å; D230-R233 PolarHBondContact O-N 3.01Å; D230-R233 IonicContact OD1-CZ 3.9Å; D230-R233 IonicContact OD1-NH2 3.09Å; D230-R233 PolarHBondContact OD1-NH2 3.11Å; D230-H234 WeakPolarHBondContact O-CB 3.48Å; D230-H234 PolarHBondContact O-N 3.47Å
231	L	85.9	Confident	82.7	Confident	18 Å²	18	69.4 Å²	69.4	9%	0.094	38%	0.375	C	S	.	.	H	α-helix	trans	-60.1	-52.3	172	174.7	61.2	0	0	0	111	K217 C218 F225 G227 Q228 R233 H234 E235	K217-L231 WeakPolarHBondContact O-CD2 3.43Å; C218-L231 HydrophobicContact CB-CD1 3.58Å; F225-L231 HydrophobicContact CB-CB 4.34Å; F225-L231 HydrophobicContact CD2-CB 3.96Å; F225-L231 HydrophobicContact CD2-CD1 3.76Å; F225-L231 HydrophobicContact CD2-CG 4.48Å; F225-L231 HydrophobicContact CE2-CD1 3.95Å; F225-L231 HydrophobicContact CG-CB 4.31Å; G227-L231 PolarHBondContact O-N 2.9Å; Q228-L231 PolarHBondContact O-N 3.2Å; L231-R233 VanDerWaalsContact C-N 3.25Å; L231-R233 PolarHBondContact O-N 3.09Å; L231-H234 CarbonylContact O-C 3.23Å; L231-H234 WeakPolarHBondContact O-CA 3.22Å; L231-H234 WeakPolarHBondContact O-CB 3.35Å; L231-H234 PolarHBondContact O-N 3.18Å; L231-E235 HydrophobicContact CD1-CG 4.16Å; L231-E235 HydrophobicContact CG-CG 4.42Å; L231-E235 WeakPolarHBondContact O-CG 3.25Å; L231-E235 PolarHBondContact O-N 2.83Å
232	K	83.7	Confident	83	Confident	115 Å²	115	72 Å²	72	50%	0.5	38%	0.381	S	S	.	.	H	α-helix	trans	-55.9	-39.7	177.7	-75.3	-173.4	176.7	-174.7	0	112.9	Q228 H234 E235	Q228-K232 PolarHBondContact O-N 3Å; K232-H234 VanDerWaalsContact C-N 3.34Å; K232-E235 WeakPolarHBondContact CA-OE2 3.47Å
233	R	84.6	Confident	83.3	Confident	117 Å²	117	72.1 Å²	72.1	44%	0.442	37%	0.37	S	S	.	.	H	α-helix	trans	-68.5	-35.4	175.5	178	172.4	58.3	-175	-1.4	111.9	N229 D230 L231 R236 V254	N229-R233 WeakPolarHBondContact O-CB 3.47Å; N229-R233 PolarHBondContact O-N 3.46Å; D230-R233 PolarHBondContact O-N 3.01Å; D230-R233 IonicContact OD1-CZ 3.9Å; D230-R233 IonicContact OD1-NH2 3.09Å; D230-R233 PolarHBondContact OD1-NH2 3.11Å; L231-R233 VanDerWaalsContact C-N 3.25Å; L231-R233 PolarHBondContact O-N 3.09Å; R233-R236 WeakPolarHBondContact O-CB 3.32Å; R233-V254 HydrophobicContact CG-CG1 4.28Å
234	H	85.7	Confident	83.6	Confident	26 Å²	26	70 Å²	70	12%	0.12	36%	0.36	C	S	.	.	H	α-helix	trans	-70.9	-38.5	177.1	172.3	64.3	0	0	0	112.5	C221 F225 D230 L231 K232 R236 V237 H238	C221-H234 PolarHBondContact SG-NE2 3.43Å; F225-H234 HydrophobicContact CE1-CB 3.81Å; F225-H234 AromaticContact CE1-CG 4Å; F225-H234 HydrophobicContact CE2-CB 3.84Å; F225-H234 AromaticContact CE2-CD2 3.34Å; F225-H234 WeakPolarHBondContact CE2-CD2 3.48Å; F225-H234 AromaticContact CE2-CG 3.64Å; F225-H234 HydrophobicContact CZ-CB 3.37Å; F225-H234 AromaticContact CZ-CD2 3.29Å; F225-H234 WeakPolarHBondContact CZ-CD2 3.36Å; F225-H234 AromaticContact CZ-CG 3.14Å; F225-H234 AromaticContact CZ-ND1 3.72Å; F225-H234 AromaticContact CZ-NE2 3.88Å; D230-H234 WeakPolarHBondContact O-CB 3.48Å; D230-H234 PolarHBondContact O-N 3.47Å; L231-H234 CarbonylContact O-C 3.23Å; L231-H234 WeakPolarHBondContact O-CA 3.22Å; L231-H234 WeakPolarHBondContact O-CB 3.35Å; L231-H234 PolarHBondContact O-N 3.18Å; K232-H234 VanDerWaalsContact C-N 3.34Å; H234-R236 PolarHBondContact O-N 3.23Å; H234-R236 VanDerWaalsContact O-N 3.12Å; H234-V237 WeakPolarHBondContact O-CB 3.36Å; H234-V237 VanDerWaalsContact O-CG2 3.3Å; H234-V237 WeakPolarHBondContact O-CG2 3.34Å; H234-V237 PolarHBondContact O-N 3.25Å; H234-H238 AromaticContact CE1-NE2 3.86Å; H234-H238 AromaticContact NE2-NE2 3.39Å; H234-H238 PolarHBondContact NE2-NE2 2.9Å
235	E	85.3	Confident	83.5	Confident	72 Å²	72	75.2 Å²	75.2	34%	0.336	38%	0.377	S	S	.	.	H	α-helix	trans	-55.7	-31	177.2	-73.4	169.3	162.4	0	0	112.4	L231 K232 V237 H238 T239	L231-E235 HydrophobicContact CD1-CG 4.16Å; L231-E235 HydrophobicContact CG-CG 4.42Å; L231-E235 WeakPolarHBondContact O-CG 3.25Å; L231-E235 PolarHBondContact O-N 2.83Å; K232-E235 WeakPolarHBondContact CA-OE2 3.47Å; E235-V237 PolarHBondContact O-N 3.25Å; E235-V237 VanDerWaalsContact O-N 3.14Å; E235-H238 WeakPolarHBondContact O-CB 3.34Å; E235-H238 PolarHBondContact O-N 3.21Å; E235-T239 PolarHBondContact O-N 3.28Å; E235-T239 VanDerWaalsContact O-N 3.16Å
236	R	87.1	Confident	83.8	Confident	61 Å²	61	73.3 Å²	73.3	23%	0.23	37%	0.368	C	S	.	.	H	α-helix	trans	-60.3	-21.5	172.9	-64.3	-178.6	-179.4	164	2.6	114.6	R233 H234 H238 T239 G240 E241 V254	R233-R236 WeakPolarHBondContact O-CB 3.32Å; H234-R236 PolarHBondContact O-N 3.23Å; H234-R236 VanDerWaalsContact O-N 3.12Å; R236-H238 VanDerWaalsContact C-N 3.27Å; R236-T239 WeakPolarHBondContact CA-OG1 3.32Å; R236-G240 CarbonylContact O-C 3.34Å; R236-G240 WeakPolarHBondContact O-CA 3.5Å; R236-G240 PolarHBondContact O-N 3.05Å; R236-E241 HydrophobicContact CB-CB 4.41Å; R236-E241 HydrophobicContact CG-CB 4.29Å; R236-E241 PolarHBondContact O-N 2.77Å; R236-V254 HydrophobicContact CB-CG1 3.68Å; R236-V254 HydrophobicContact CG-CG1 4.44Å; R236-V254 PolarHBondContact NH1-O 3.41Å
237	V	83.3	Confident	84.1	Confident	95 Å²	95	78.9 Å²	78.9	58%	0.576	40%	0.397	S	S	*	.	H	α-helix	trans	-67.6	-34.9	173.5	179.4	0	0	0	0	110.4	H234 E235	H234-V237 WeakPolarHBondContact O-CB 3.36Å; H234-V237 VanDerWaalsContact O-CG2 3.3Å; H234-V237 WeakPolarHBondContact O-CG2 3.34Å; H234-V237 PolarHBondContact O-N 3.25Å; E235-V237 PolarHBondContact O-N 3.25Å; E235-V237 VanDerWaalsContact O-N 3.14Å
238	H	83.4	Confident	84.4	Confident	69 Å²	69	83.9 Å²	83.9	32%	0.319	42%	0.417	S	S	.	.	H	α-helix	trans	-81	-42.2	179.7	-62.2	-66.7	0	0	0	112.5	Q220 C221 H234 E235 R236 G240	Q220-H238 VanDerWaalsContact OE1-CG 3.22Å; C221-H238 PolarHBondContact SG-NE2 2.88Å; C221-H238 VanDerWaalsContact SG-NE2 3.41Å; H234-H238 AromaticContact CE1-NE2 3.86Å; H234-H238 AromaticContact NE2-NE2 3.39Å; H234-H238 PolarHBondContact NE2-NE2 2.9Å; E235-H238 WeakPolarHBondContact O-CB 3.34Å; E235-H238 PolarHBondContact O-N 3.21Å; R236-H238 VanDerWaalsContact C-N 3.27Å; H238-G240 PolarHBondContact O-N 3.42Å
239	T	83.4	Confident	84.7	Confident	92 Å²	92	81.5 Å²	81.5	56%	0.564	41%	0.412	S	S	*	.	H	α-helix	trans	-75.5	-14.9	177.8	63.9	0	0	0	0	112.8	E235 R236 E241	E235-T239 PolarHBondContact O-N 3.28Å; E235-T239 VanDerWaalsContact O-N 3.16Å; R236-T239 WeakPolarHBondContact CA-OG1 3.32Å; T239-E241 PolarHBondContact O-N 2.84Å; T239-E241 WeakPolarHBondContact OG1-CB 2.97Å; T239-E241 PolarHBondContact OG1-N 3.41Å
240	G	82.6	Confident	84.8	Confident	47 Å²	47	78.2 Å²	78.2	49%	0.485	41%	0.407	S	S	.	.			trans	71.4	5.7	-173.9	0	0	0	0	0	113.9	R236 H238 K242	R236-G240 CarbonylContact O-C 3.34Å; R236-G240 WeakPolarHBondContact O-CA 3.5Å; R236-G240 PolarHBondContact O-N 3.05Å; H238-G240 PolarHBondContact O-N 3.42Å; G240-K242 PolarHBondContact O-N 2.89Å
241	E	84.4	Confident	84.9	Confident	101 Å²	101	81.5 Å²	81.5	47%	0.472	42%	0.418	S	S	.	.			trans	-63.1	122	-177.4	-166	-163.4	161.8	0	0	110.8	R236 T239 P243	R236-E241 HydrophobicContact CB-CB 4.41Å; R236-E241 HydrophobicContact CG-CB 4.29Å; R236-E241 PolarHBondContact O-N 2.77Å; T239-E241 PolarHBondContact O-N 2.84Å; T239-E241 WeakPolarHBondContact OG1-CB 2.97Å; T239-E241 PolarHBondContact OG1-N 3.41Å; E241-P243 HydrophobicContact CG-CG 4.06Å; E241-P243 WeakPolarHBondContact OE1-CG 3.28Å
242	K	86.8	Confident	85	Confident	110 Å²	110	82.1 Å²	82.1	48%	0.478	43%	0.426	S	S	.	.			trans	-126.1	80.3	179.3	-71.7	166.7	178.2	-179.6	0	109.7	G240 Y244 A252 F253 V254	G240-K242 PolarHBondContact O-N 2.89Å; K242-Y244 PolarHBondContact O-N 3.09Å; K242-A252 HydrophobicContact CB-CB 3.47Å; K242-A252 VanDerWaalsContact CB-CB 3.47Å; K242-A252 HydrophobicContact CD-CB 4.14Å; K242-A252 WeakPolarHBondContact CD-O 3.33Å; K242-A252 HydrophobicContact CG-CB 4.41Å; K242-F253 CarbonylContact C-O 3.53Å; K242-F253 WeakPolarHBondContact CA-O 3.21Å; K242-V254 HydrophobicContact CG-CG2 4.01Å
243	P	87.2	Confident	85.1	Confident	58 Å²	58	78.7 Å²	78.7	38%	0.377	41%	0.412	S	S	.	.			trans	-64.6	-24.1	-172.1	-23.8	35.1	0	0	0	114	E241 K245	E241-P243 HydrophobicContact CG-CG 4.06Å; E241-P243 WeakPolarHBondContact OE1-CG 3.28Å; P243-K245 PolarHBondContact O-N 3.32Å
244	Y	87.6	Confident	85.1	Confident	83 Å²	83	75 Å²	75	33%	0.325	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	95.7	-171	-56.5	-80.8	0	0	0	110.2	K242 A252 F253 V254 C255 N256	K242-Y244 PolarHBondContact O-N 3.09Å; Y244-A252 CarbonylContact O-C 3.33Å; Y244-A252 WeakPolarHBondContact O-CA 3.38Å; Y244-F253 PolarHBondContact N-O 3.33Å; Y244-F253 VanDerWaalsContact N-O 3.16Å; Y244-F253 PolarHBondContact O-N 3.17Å; Y244-V254 WeakPolarHBondContact CE2-O 3.47Å; Y244-C255 VanDerWaalsContact CD2-CA 3.42Å; Y244-N256 HydrophobicContact CD1-CB 3.84Å; Y244-N256 HydrophobicContact CE1-CB 3.73Å; Y244-N256 HydrophobicContact CG-CB 4.36Å
245	K	83.9	Confident	85	Confident	140 Å²	140	74.9 Å²	74.9	61%	0.609	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.2	141.3	179.2	-63.9	-179.7	-179.3	177.8	0	111.6	P243 A252	P243-K245 PolarHBondContact O-N 3.32Å; K245-A252 HydrophobicContact CG-CB 3.89Å
246	C	88.5	Confident	84.9	Confident	1 Å²	1	74.9 Å²	74.9	1%	0.007	41%	0.406	C	S	.	.			trans	-84.5	123.1	170.6	-172.5	0	0	0	0	109.3	E248 G250 K251 F253 L259	C246-E248 VanDerWaalsContact C-N 3.25Å; C246-E248 PolarHBondContact O-N 3.15Å; C246-G250 WeakPolarHBondContact O-CA 3.46Å; C246-G250 PolarHBondContact O-N 3.09Å; C246-K251 VanDerWaalsContact CB-O 3.31Å; C246-K251 WeakPolarHBondContact CB-O 3.29Å; C246-K251 PolarHBondContact N-O 3.26Å; C246-F253 HydrophobicContact CB-CE2 4.4Å; C246-L259 HydrophobicContact CB-CD1 3.65Å
247	N	85.4	Confident	84.5	Confident	149 Å²	149	75.1 Å²	75.1	80%	0.797	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-21	-177.9	-62.4	-8	0	0	0	112.7
248	E	83.4	Confident	84.6	Confident	117 Å²	117	73.2 Å²	73.2	55%	0.547	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-28.8	-175.2	-68.6	164.9	-155.9	0	0	113.5	C246 H266	C246-E248 VanDerWaalsContact C-N 3.25Å; C246-E248 PolarHBondContact O-N 3.15Å; E248-H266 WeakPolarHBondContact OE2-CB 3.36Å; E248-H266 IonicContact OE2-CD2 3.11Å; E248-H266 PolarHBondContact OE2-CD2 3.26Å; E248-H266 IonicContact OE2-CG 3.01Å; E248-H266 IonicContact OE2-ND1 3.94Å
249	C	84.4	Confident	84.7	Confident	55 Å²	55	70.5 Å²	70.5	37%	0.372	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.4	7.4	-179.9	70.6	0	0	0	0	114.7	K251 H262 H266	C249-K251 PolarHBondContact O-N 2.96Å; C249-H262 PolarHBondContact SG-NE2 3.33Å; C249-H266 VanDerWaalsContact SG-CE1 3.54Å; C249-H266 PolarHBondContact SG-NE2 3.45Å
250	G	83.1	Confident	84.7	Confident	56 Å²	56	74.8 Å²	74.8	58%	0.577	41%	0.405	S	S	*	.			trans	69.8	-5.1	179.7	0	0	0	0	0	115.5	C246 A252	C246-G250 WeakPolarHBondContact O-CA 3.46Å; C246-G250 PolarHBondContact O-N 3.09Å; G250-A252 PolarHBondContact O-N 2.78Å
251	K	83.8	Confident	84.7	Confident	129 Å²	129	75.1 Å²	75.1	56%	0.561	40%	0.398	S	S	*	.			trans	-63.7	131	-178.8	-74.1	-178.2	-177.8	174.5	0	111.4	C246 C249 F253	C246-K251 VanDerWaalsContact CB-O 3.31Å; C246-K251 WeakPolarHBondContact CB-O 3.29Å; C246-K251 PolarHBondContact N-O 3.26Å; C249-K251 PolarHBondContact O-N 2.96Å; K251-F253 HydrophobicContact CB-CE2 3.92Å; K251-F253 HydrophobicContact CB-CZ 4.11Å; K251-F253 WeakPolarHBondContact O-CE2 3.48Å
252	A	87.8	Confident	84.7	Confident	31 Å²	31	71.4 Å²	71.4	26%	0.256	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	144.5	-177.8	0	0	0	0	0	112.3	K242 Y244 K245 G250	K242-A252 HydrophobicContact CB-CB 3.47Å; K242-A252 VanDerWaalsContact CB-CB 3.47Å; K242-A252 HydrophobicContact CD-CB 4.14Å; K242-A252 WeakPolarHBondContact CD-O 3.33Å; K242-A252 HydrophobicContact CG-CB 4.41Å; Y244-A252 CarbonylContact O-C 3.33Å; Y244-A252 WeakPolarHBondContact O-CA 3.38Å; K245-A252 HydrophobicContact CG-CB 3.89Å; G250-A252 PolarHBondContact O-N 2.78Å
253	F	86.1	Confident	84.5	Confident	44 Å²	44	70.2 Å²	70.2	19%	0.193	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	150.4	-176	-60	-91	0	0	0	111.6	K242 Y244 C246 K251 C255 L259 H262	K242-F253 CarbonylContact C-O 3.53Å; K242-F253 WeakPolarHBondContact CA-O 3.21Å; Y244-F253 PolarHBondContact N-O 3.33Å; Y244-F253 VanDerWaalsContact N-O 3.16Å; Y244-F253 PolarHBondContact O-N 3.17Å; C246-F253 HydrophobicContact CB-CE2 4.4Å; K251-F253 HydrophobicContact CB-CE2 3.92Å; K251-F253 HydrophobicContact CB-CZ 4.11Å; K251-F253 WeakPolarHBondContact O-CE2 3.48Å; F253-C255 VanDerWaalsContact C-N 3.33Å; F253-L259 HydrophobicContact CB-CB 4.31Å; F253-L259 HydrophobicContact CD2-CB 3.94Å; F253-L259 HydrophobicContact CD2-CD1 3.74Å; F253-L259 HydrophobicContact CD2-CG 4.44Å; F253-L259 HydrophobicContact CE2-CD1 3.91Å; F253-L259 HydrophobicContact CG-CB 4.25Å; F253-H262 HydrophobicContact CE1-CB 3.86Å; F253-H262 HydrophobicContact CE2-CB 3.92Å; F253-H262 AromaticContact CE2-CD2 3.21Å; F253-H262 WeakPolarHBondContact CE2-CD2 3.44Å; F253-H262 AromaticContact CE2-CG 3.69Å; F253-H262 AromaticContact CE2-NE2 3.95Å; F253-H262 HydrophobicContact CZ-CB 3.39Å; F253-H262 AromaticContact CZ-CD2 3.23Å; F253-H262 WeakPolarHBondContact CZ-CD2 3.21Å; F253-H262 AromaticContact CZ-CG 3.22Å; F253-H262 AromaticContact CZ-ND1 3.95Å; F253-H262 AromaticContact CZ-NE2 3.89Å
254	V	84.5	Confident	84.2	Confident	39 Å²	39	68.4 Å²	68.4	24%	0.236	36%	0.364	C	S	.	.	S	Bend	trans	-72.4	-27.7	179.9	179.4	0	0	0	0	112.1	R233 R236 K242 Y244	R233-V254 HydrophobicContact CG-CG1 4.28Å; R236-V254 HydrophobicContact CB-CG1 3.68Å; R236-V254 HydrophobicContact CG-CG1 4.44Å; R236-V254 PolarHBondContact NH1-O 3.41Å; K242-V254 HydrophobicContact CG-CG2 4.01Å; Y244-V254 WeakPolarHBondContact CE2-O 3.47Å
255	C	83.1	Confident	83.9	Confident	24 Å²	24	68.9 Å²	68.9	16%	0.162	38%	0.375	C	S	.	.	S	Bend	trans	-139.9	153.4	178.9	71.7	0	0	0	0	112.9	Y244 F253 A257 S258 L259	Y244-C255 VanDerWaalsContact CD2-CA 3.42Å; F253-C255 VanDerWaalsContact C-N 3.33Å; C255-A257 VanDerWaalsContact C-N 3.32Å; C255-A257 PolarHBondContact O-N 3.24Å; C255-S258 PolarHBondContact O-N 3.49Å; C255-S258 PolarHBondContact SG-OG 3.27Å; C255-L259 PolarHBondContact O-N 3.1Å
256	N	82.5	Confident	83.6	Confident	71 Å²	71	65.9 Å²	65.9	38%	0.38	36%	0.363	S	S	.	.	H	α-helix	trans	-62.9	-34	-178.9	-170.6	39.9	0	0	0	113.3	Y244 S258 L259 R260	Y244-N256 HydrophobicContact CD1-CB 3.84Å; Y244-N256 HydrophobicContact CE1-CB 3.73Å; Y244-N256 HydrophobicContact CG-CB 4.36Å; N256-S258 VanDerWaalsContact C-N 3.32Å; N256-S258 PolarHBondContact O-N 3.45Å; N256-L259 PolarHBondContact O-N 3.39Å; N256-R260 PolarHBondContact O-N 3.33Å
257	A	80.1	Confident	83.1	Confident	66 Å²	66	70 Å²	70	55%	0.545	39%	0.388	S	S	.	.	H	α-helix	trans	-62.3	-39.3	178.3	0	0	0	0	0	112.2	C255 R260 T261	C255-A257 VanDerWaalsContact C-N 3.32Å; C255-A257 PolarHBondContact O-N 3.24Å; A257-R260 PolarHBondContact O-N 3.17Å; A257-T261 PolarHBondContact O-N 3.17Å; A257-T261 PolarHBondContact O-OG1 2.85Å
258	S	83.9	Confident	82.7	Confident	55 Å²	55	65.4 Å²	65.4	39%	0.385	38%	0.377	S	S	.	.	H	α-helix	trans	-67.3	-40.4	174.7	-62.3	0	0	0	0	111.8	C255 N256 T261 H262	C255-S258 PolarHBondContact O-N 3.49Å; C255-S258 PolarHBondContact SG-OG 3.27Å; N256-S258 VanDerWaalsContact C-N 3.32Å; N256-S258 PolarHBondContact O-N 3.45Å; S258-T261 PolarHBondContact O-N 3.18Å; S258-H262 WeakPolarHBondContact O-CB 3.34Å; S258-H262 PolarHBondContact O-N 3.43Å
259	L	86.1	Confident	82.3	Confident	13 Å²	13	64 Å²	64	7%	0.068	38%	0.376	C	S	.	.	H	α-helix	trans	-61.9	-45.2	173.9	174.7	61.7	0	0	0	111.5	C246 F253 C255 N256 T261 H262 K263	C246-L259 HydrophobicContact CB-CD1 3.65Å; F253-L259 HydrophobicContact CB-CB 4.31Å; F253-L259 HydrophobicContact CD2-CB 3.94Å; F253-L259 HydrophobicContact CD2-CD1 3.74Å; F253-L259 HydrophobicContact CD2-CG 4.44Å; F253-L259 HydrophobicContact CE2-CD1 3.91Å; F253-L259 HydrophobicContact CG-CB 4.25Å; C255-L259 PolarHBondContact O-N 3.1Å; N256-L259 PolarHBondContact O-N 3.39Å; L259-T261 VanDerWaalsContact C-N 3.35Å; L259-T261 PolarHBondContact O-N 2.84Å; L259-H262 WeakPolarHBondContact O-CB 3.35Å; L259-H262 PolarHBondContact O-N 3.23Å; L259-H262 VanDerWaalsContact O-N 3.14Å; L259-K263 HydrophobicContact CD1-CG 4.37Å; L259-K263 WeakPolarHBondContact O-CG 3.32Å; L259-K263 PolarHBondContact O-N 2.97Å
260	R	82.6	Confident	82.3	Confident	181 Å²	181	67 Å²	67	68%	0.683	38%	0.383	S	S	*	.	H	α-helix	trans	-58.1	-46.2	175.8	-81.1	-169.8	167.5	-174.5	-3.4	112.1	N256 A257 H262 K263	N256-R260 PolarHBondContact O-N 3.33Å; A257-R260 PolarHBondContact O-N 3.17Å; R260-H262 VanDerWaalsContact C-N 3.3Å; R260-H262 PolarHBondContact O-N 2.89Å; R260-K263 PolarHBondContact O-N 3.05Å
261	T	82.7	Confident	82.2	Confident	54 Å²	54	68.2 Å²	68.2	33%	0.331	38%	0.38	S	S	.	.	H	α-helix	trans	-63.2	-39.2	176.4	-51.4	0	0	0	0	110.7	A257 S258 L259 T264 A282	A257-T261 PolarHBondContact O-N 3.17Å; A257-T261 PolarHBondContact O-OG1 2.85Å; S258-T261 PolarHBondContact O-N 3.18Å; L259-T261 VanDerWaalsContact C-N 3.35Å; L259-T261 PolarHBondContact O-N 2.84Å; T261-T264 WeakPolarHBondContact O-CB 3.32Å; T261-T264 PolarHBondContact O-N 3.13Å; T261-T264 PolarHBondContact O-OG1 3.01Å; T261-A282 HydrophobicContact CG2-CB 4.26Å
262	H	84.3	Confident	82.2	Confident	23 Å²	23	66.7 Å²	66.7	11%	0.106	37%	0.372	C	S	.	.	H	α-helix	trans	-66.4	-38.5	176.8	168.9	55.6	0	0	0	113.3	C249 F253 S258 L259 R260 T264 T265 H266	C249-H262 PolarHBondContact SG-NE2 3.33Å; F253-H262 HydrophobicContact CE1-CB 3.86Å; F253-H262 HydrophobicContact CE2-CB 3.92Å; F253-H262 AromaticContact CE2-CD2 3.21Å; F253-H262 WeakPolarHBondContact CE2-CD2 3.44Å; F253-H262 AromaticContact CE2-CG 3.69Å; F253-H262 AromaticContact CE2-NE2 3.95Å; F253-H262 HydrophobicContact CZ-CB 3.39Å; F253-H262 AromaticContact CZ-CD2 3.23Å; F253-H262 WeakPolarHBondContact CZ-CD2 3.21Å; F253-H262 AromaticContact CZ-CG 3.22Å; F253-H262 AromaticContact CZ-ND1 3.95Å; F253-H262 AromaticContact CZ-NE2 3.89Å; S258-H262 WeakPolarHBondContact O-CB 3.34Å; S258-H262 PolarHBondContact O-N 3.43Å; L259-H262 WeakPolarHBondContact O-CB 3.35Å; L259-H262 PolarHBondContact O-N 3.23Å; L259-H262 VanDerWaalsContact O-N 3.14Å; R260-H262 VanDerWaalsContact C-N 3.3Å; R260-H262 PolarHBondContact O-N 2.89Å; H262-T264 PolarHBondContact O-N 3.3Å; H262-T265 PolarHBondContact ND1-OG1 3.16Å; H262-T265 WeakPolarHBondContact O-CB 3.4Å; H262-T265 PolarHBondContact O-N 3.48Å; H262-T265 PolarHBondContact O-OG1 2.95Å; H262-H266 AromaticContact CE1-NE2 3.32Å; H262-H266 PolarHBondContact CE1-NE2 2.79Å; H262-H266 VanDerWaalsContact CE1-NE2 3.32Å; H262-H266 AromaticContact NE2-CD2 3.99Å; H262-H266 AromaticContact NE2-NE2 3.17Å; H262-H266 PolarHBondContact NE2-NE2 2.92Å; H262-H266 VanDerWaalsContact NE2-NE2 3.17Å
263	K	82.5	Confident	82	Confident	86 Å²	86	71.2 Å²	71.2	37%	0.374	39%	0.388	S	S	.	.	H	α-helix	trans	-57	-25.3	177.2	-74.7	-172.6	173.1	-163.5	0	113.4	L259 R260 T265 H266 T267	L259-K263 HydrophobicContact CD1-CG 4.37Å; L259-K263 WeakPolarHBondContact O-CG 3.32Å; L259-K263 PolarHBondContact O-N 2.97Å; R260-K263 PolarHBondContact O-N 3.05Å; K263-T265 PolarHBondContact O-N 3.23Å; K263-H266 PolarHBondContact O-N 3.4Å; K263-T267 PolarHBondContact O-N 3.36Å; K263-T267 PolarHBondContact O-OG1 3.03Å
264	T	81.8	Confident	82.1	Confident	20 Å²	20	69.3 Å²	69.3	12%	0.123	38%	0.38	C	S	.	.	H	α-helix	trans	-62.6	-23.3	172.5	72.4	0	0	0	0	113.3	T261 H262 H266 T267 G268 V269 P271 A282	T261-T264 WeakPolarHBondContact O-CB 3.32Å; T261-T264 PolarHBondContact O-N 3.13Å; T261-T264 PolarHBondContact O-OG1 3.01Å; H262-T264 PolarHBondContact O-N 3.3Å; T264-H266 VanDerWaalsContact C-N 3.33Å; T264-T267 WeakPolarHBondContact CA-OG1 3.42Å; T264-G268 WeakPolarHBondContact O-CA 3.3Å; T264-G268 PolarHBondContact O-N 3.39Å; T264-V269 VanDerWaalsContact CB-O 3.28Å; T264-V269 WeakPolarHBondContact CB-O 3.41Å; T264-P271 HydrophobicContact CG2-CG 4.42Å; T264-A282 WeakPolarHBondContact OG1-CB 3.37Å
265	T	80.4	Confident	82.1	Confident	93 Å²	93	77.2 Å²	77.2	57%	0.571	41%	0.411	S	S	*	.	H	α-helix	trans	-75	-24.2	178.4	66.7	0	0	0	0	113.1	H262 K263	H262-T265 PolarHBondContact ND1-OG1 3.16Å; H262-T265 WeakPolarHBondContact O-CB 3.4Å; H262-T265 PolarHBondContact O-N 3.48Å; H262-T265 PolarHBondContact O-OG1 2.95Å; K263-T265 PolarHBondContact O-N 3.23Å
266	H	79.6	Confident	82.1	Confident	76 Å²	76	81.6 Å²	81.6	35%	0.352	43%	0.429	S	S	.	.	H	α-helix	trans	-86.6	-43.7	178.2	-64	-60.3	0	0	0	111.8	E248 C249 H262 K263 T264 G268	E248-H266 WeakPolarHBondContact OE2-CB 3.36Å; E248-H266 IonicContact OE2-CD2 3.11Å; E248-H266 PolarHBondContact OE2-CD2 3.26Å; E248-H266 IonicContact OE2-CG 3.01Å; E248-H266 IonicContact OE2-ND1 3.94Å; C249-H266 VanDerWaalsContact SG-CE1 3.54Å; C249-H266 PolarHBondContact SG-NE2 3.45Å; H262-H266 AromaticContact CE1-NE2 3.32Å; H262-H266 PolarHBondContact CE1-NE2 2.79Å; H262-H266 VanDerWaalsContact CE1-NE2 3.32Å; H262-H266 AromaticContact NE2-CD2 3.99Å; H262-H266 AromaticContact NE2-NE2 3.17Å; H262-H266 PolarHBondContact NE2-NE2 2.92Å; H262-H266 VanDerWaalsContact NE2-NE2 3.17Å; K263-H266 PolarHBondContact O-N 3.4Å; T264-H266 VanDerWaalsContact C-N 3.33Å; H266-G268 PolarHBondContact O-N 3.44Å
267	T	78	Confident	82.3	Confident	87 Å²	87	80 Å²	80	53%	0.534	42%	0.423	S	S	.	.	H	α-helix	trans	-73.5	-18.1	177.6	53.1	0	0	0	0	112.8	K263 T264 V269	K263-T267 PolarHBondContact O-N 3.36Å; K263-T267 PolarHBondContact O-OG1 3.03Å; T264-T267 WeakPolarHBondContact CA-OG1 3.42Å; T267-V269 PolarHBondContact O-N 3.32Å
268	G	75.1	Confident	82.4	Confident	54 Å²	54	83.3 Å²	83.3	56%	0.557	44%	0.436	S	S	*	.			trans	68.6	-7.5	-173.6	0	0	0	0	0	113.9	T264 H266 K270	T264-G268 WeakPolarHBondContact O-CA 3.3Å; T264-G268 PolarHBondContact O-N 3.39Å; H266-G268 PolarHBondContact O-N 3.44Å; G268-K270 PolarHBondContact O-N 2.89Å
269	V	77	Confident	82.3	Confident	88 Å²	88	86.4 Å²	86.4	53%	0.533	44%	0.443	S	S	.	.			trans	-68.9	117.4	177.9	179.1	0	0	0	0	108.2	T264 T267 P271	T264-V269 VanDerWaalsContact CB-O 3.28Å; T264-V269 WeakPolarHBondContact CB-O 3.41Å; T267-V269 PolarHBondContact O-N 3.32Å; V269-P271 HydrophobicContact CG1-CG 4.4Å; V269-P271 WeakPolarHBondContact O-CD 3.02Å
270	K	82.6	Confident	82.2	Confident	118 Å²	118	87.4 Å²	87.4	51%	0.513	45%	0.451	S	S	.	.			trans	-109	95.1	176.2	-69.3	-173	-163.6	168	0	108.1	G268 Y272 S280 F281	G268-K270 PolarHBondContact O-N 2.89Å; K270-Y272 PolarHBondContact O-N 3.06Å; K270-Y272 VanDerWaalsContact O-N 3.08Å; K270-S280 WeakPolarHBondContact CD-O 3.46Å; K270-S280 WeakPolarHBondContact O-CB 3.5Å; K270-F281 CarbonylContact C-O 3.52Å; K270-F281 VanDerWaalsContact C-O 3.31Å; K270-F281 WeakPolarHBondContact CA-O 3.22Å; K270-F281 WeakPolarHBondContact CB-O 3.11Å
271	P	81.8	Confident	82.3	Confident	81 Å²	81	80.7 Å²	80.7	53%	0.526	43%	0.427	S	S	.	.			trans	-67.6	-15.1	-166.1	-20.1	32.7	0	0	0	114.5	T264 V269	T264-P271 HydrophobicContact CG2-CG 4.42Å; V269-P271 HydrophobicContact CG1-CG 4.4Å; V269-P271 WeakPolarHBondContact O-CD 3.02Å
272	Y	84.4	Confident	82.3	Confident	96 Å²	96	79 Å²	79	38%	0.376	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	91.8	-172.8	-58.2	-85.6	0	0	0	109.6	K270 S280 F281 S283 H284	K270-Y272 PolarHBondContact O-N 3.06Å; K270-Y272 VanDerWaalsContact O-N 3.08Å; Y272-S280 CarbonylContact O-C 3.58Å; Y272-S280 WeakPolarHBondContact O-CA 3.49Å; Y272-F281 WeakPolarHBondContact CD2-O 3.2Å; Y272-F281 PolarHBondContact N-O 3.28Å; Y272-F281 PolarHBondContact O-N 3.45Å; Y272-S283 VanDerWaalsContact CD2-C 3.48Å; Y272-S283 VanDerWaalsContact CD2-CA 3.46Å; Y272-H284 HydrophobicContact CD1-CB 3.91Å; Y272-H284 HydrophobicContact CE1-CB 3.7Å
273	E	83.9	Confident	82.2	Confident	127 Å²	127	79.1 Å²	79.1	59%	0.593	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.1	140.5	178.4	-174.3	169.4	-171.4	0	0	112.1
274	C	87.4	Confident	82.1	Confident	4 Å²	4	79.9 Å²	79.9	3%	0.027	43%	0.426	C	S	.	.			trans	-77.8	128.2	172.1	-175.2	0	0	0	0	110.1	Q276 K279 F281 L287	C274-Q276 PolarHBondContact O-N 2.92Å; C274-K279 VanDerWaalsContact CB-O 3.24Å; C274-K279 WeakPolarHBondContact CB-O 3.36Å; C274-K279 PolarHBondContact N-O 2.9Å; C274-F281 HydrophobicContact CB-CE2 4.46Å; C274-L287 HydrophobicContact CB-CD1 3.78Å
275	K	84.9	Confident	82.1	Confident	205 Å²	205	81 Å²	81	89%	0.891	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-16.8	177.7	-63.4	-175.9	178.4	-176.9	0	113.6
276	Q	82.6	Confident	82.2	Confident	116 Å²	116	80.8 Å²	80.8	54%	0.542	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	-7.8	-174	-59.2	-174.6	46.6	0	0	113.4	C274	C274-Q276 PolarHBondContact O-N 2.92Å
277	C	86.7	Confident	82.5	Confident	37 Å²	37	77.9 Å²	77.9	25%	0.25	42%	0.421	C	S	.	.	S	Bend	trans	-158	166.3	170.7	70	0	0	0	0	111.5	K279 H290 H294	C277-K279 PolarHBondContact O-N 3.07Å; C277-H290 PolarHBondContact SG-NE2 3.33Å; C277-H294 PolarHBondContact SG-NE2 3.23Å; C277-H294 VanDerWaalsContact SG-NE2 3.39Å
278	T	82.3	Confident	82.7	Confident	135 Å²	135	77.6 Å²	77.6	83%	0.828	41%	0.414	S	S	*	.	S	Bend	trans	-69.3	12.5	-178.1	57.4	0	0	0	0	115.1
279	K	80.8	Confident	83.1	Confident	121 Å²	121	80.7 Å²	80.7	53%	0.526	41%	0.412	S	S	.	.			trans	-90	128	-177.5	-68.2	-179.6	179.9	171.6	0	111	C274 C277 F281	C274-K279 VanDerWaalsContact CB-O 3.24Å; C274-K279 WeakPolarHBondContact CB-O 3.36Å; C274-K279 PolarHBondContact N-O 2.9Å; C277-K279 PolarHBondContact O-N 3.07Å; K279-F281 HydrophobicContact CB-CE2 3.98Å; K279-F281 HydrophobicContact CB-CZ 4Å; K279-F281 WeakPolarHBondContact O-CE2 3.46Å
280	S	84.9	Confident	83.5	Confident	33 Å²	33	77.2 Å²	77.2	23%	0.231	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	154.8	173.3	-46.5	0	0	0	0	111.9	K270 Y272	K270-S280 WeakPolarHBondContact CD-O 3.46Å; K270-S280 WeakPolarHBondContact O-CB 3.5Å; Y272-S280 CarbonylContact O-C 3.58Å; Y272-S280 WeakPolarHBondContact O-CA 3.49Å
281	F	83.8	Confident	83.6	Confident	40 Å²	40	73.7 Å²	73.7	18%	0.175	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	154.7	-174.3	-59.3	-87.5	0	0	0	112.7	K270 Y272 C274 K279 S283 Q286 L287 H290	K270-F281 CarbonylContact C-O 3.52Å; K270-F281 VanDerWaalsContact C-O 3.31Å; K270-F281 WeakPolarHBondContact CA-O 3.22Å; K270-F281 WeakPolarHBondContact CB-O 3.11Å; Y272-F281 WeakPolarHBondContact CD2-O 3.2Å; Y272-F281 PolarHBondContact N-O 3.28Å; Y272-F281 PolarHBondContact O-N 3.45Å; C274-F281 HydrophobicContact CB-CE2 4.46Å; K279-F281 HydrophobicContact CB-CE2 3.98Å; K279-F281 HydrophobicContact CB-CZ 4Å; K279-F281 WeakPolarHBondContact O-CE2 3.46Å; F281-S283 VanDerWaalsContact C-N 3.3Å; F281-Q286 HydrophobicContact CB-CB 3.99Å; F281-Q286 HydrophobicContact CD1-CB 3.95Å; F281-Q286 HydrophobicContact CG-CB 4.23Å; F281-L287 HydrophobicContact CB-CB 4.28Å; F281-L287 HydrophobicContact CD2-CB 3.93Å; F281-L287 HydrophobicContact CD2-CD1 3.75Å; F281-L287 HydrophobicContact CD2-CG 4.46Å; F281-L287 HydrophobicContact CE2-CD1 4Å; F281-L287 HydrophobicContact CG-CB 4.29Å; F281-H290 HydrophobicContact CE1-CB 3.84Å; F281-H290 HydrophobicContact CE2-CB 3.76Å; F281-H290 AromaticContact CE2-CD2 3.25Å; F281-H290 WeakPolarHBondContact CE2-CD2 2.81Å; F281-H290 AromaticContact CE2-CG 3.51Å; F281-H290 AromaticContact CE2-NE2 3.96Å; F281-H290 HydrophobicContact CZ-CB 3.35Å; F281-H290 AromaticContact CZ-CD2 3.35Å; F281-H290 WeakPolarHBondContact CZ-CD2 3.48Å; F281-H290 AromaticContact CZ-CG 3.12Å; F281-H290 AromaticContact CZ-ND1 3.65Å; F281-H290 AromaticContact CZ-NE2 3.94Å
282	A	82.9	Confident	83.8	Confident	18 Å²	18	72.6 Å²	72.6	15%	0.149	36%	0.361	C	S	.	.	S	Bend	trans	-76.5	-17.9	-180	0	0	0	0	0	113.2	T261 T264	T261-A282 HydrophobicContact CG2-CB 4.26Å; T264-A282 WeakPolarHBondContact OG1-CB 3.37Å
283	S	82.6	Confident	83.7	Confident	26 Å²	26	73.6 Å²	73.6	18%	0.182	37%	0.371	C	S	.	.	S	Bend	trans	-148.5	149.3	-178.3	61.1	0	0	0	0	111.8	Y272 F281 G285 Q286 L287	Y272-S283 VanDerWaalsContact CD2-C 3.48Å; Y272-S283 VanDerWaalsContact CD2-CA 3.46Å; F281-S283 VanDerWaalsContact C-N 3.3Å; S283-G285 VanDerWaalsContact C-N 3.27Å; S283-G285 PolarHBondContact O-N 3.45Å; S283-Q286 WeakPolarHBondContact O-CB 3.41Å; S283-Q286 PolarHBondContact O-N 3.47Å; S283-Q286 VanDerWaalsContact OG-CD 3.23Å; S283-Q286 WeakPolarHBondContact OG-CG 3.49Å; S283-Q286 PolarHBondContact OG-OE1 3.15Å; S283-L287 PolarHBondContact O-N 3.44Å
284	H	80.2	Confident	83.6	Confident	102 Å²	102	70.9 Å²	70.9	47%	0.472	36%	0.358	S	S	.	.	H	α-helix	trans	-55.2	-41.1	176	-177	-98.7	0	0	0	112.6	Y272 Q286 L287 Q288	Y272-H284 HydrophobicContact CD1-CB 3.91Å; Y272-H284 HydrophobicContact CE1-CB 3.7Å; H284-Q286 PolarHBondContact O-N 3.14Å; H284-L287 PolarHBondContact O-N 2.88Å; H284-Q288 WeakPolarHBondContact CE1-CG 3.5Å; H284-Q288 PolarHBondContact CE1-NE2 3.16Å; H284-Q288 PolarHBondContact NE2-NE2 3.38Å; H284-Q288 WeakPolarHBondContact O-CG 3.31Å; H284-Q288 PolarHBondContact O-N 3.35Å
285	G	81.3	Confident	83.4	Confident	43 Å²	43	74.3 Å²	74.3	44%	0.443	38%	0.38	S	S	.	.	H	α-helix	trans	-64.3	-26.1	178.8	0	0	0	0	0	114.1	S283 K289	S283-G285 VanDerWaalsContact C-N 3.27Å; S283-G285 PolarHBondContact O-N 3.45Å; G285-K289 WeakPolarHBondContact O-CG 3.4Å; G285-K289 PolarHBondContact O-N 2.88Å
286	Q	83.6	Confident	83.3	Confident	90 Å²	90	66.8 Å²	66.8	42%	0.421	36%	0.36	S	S	.	.	H	α-helix	trans	-77.7	-41.7	173	-72.3	169.6	-5.7	0	0	111.5	F281 S283 H284 K289 H290	F281-Q286 HydrophobicContact CB-CB 3.99Å; F281-Q286 HydrophobicContact CD1-CB 3.95Å; F281-Q286 HydrophobicContact CG-CB 4.23Å; S283-Q286 WeakPolarHBondContact O-CB 3.41Å; S283-Q286 PolarHBondContact O-N 3.47Å; S283-Q286 VanDerWaalsContact OG-CD 3.23Å; S283-Q286 WeakPolarHBondContact OG-CG 3.49Å; S283-Q286 PolarHBondContact OG-OE1 3.15Å; H284-Q286 PolarHBondContact O-N 3.14Å; Q286-K289 PolarHBondContact O-N 3.02Å; Q286-H290 WeakPolarHBondContact O-CB 3.46Å; Q286-H290 PolarHBondContact O-N 3.04Å
287	L	85.8	Confident	83.3	Confident	14 Å²	14	66.7 Å²	66.7	7%	0.073	36%	0.36	C	S	.	.	H	α-helix	trans	-58	-49.2	173.5	173	61.5	0	0	0	110.8	C274 F281 S283 H284 K289 H290 E291	C274-L287 HydrophobicContact CB-CD1 3.78Å; F281-L287 HydrophobicContact CB-CB 4.28Å; F281-L287 HydrophobicContact CD2-CB 3.93Å; F281-L287 HydrophobicContact CD2-CD1 3.75Å; F281-L287 HydrophobicContact CD2-CG 4.46Å; F281-L287 HydrophobicContact CE2-CD1 4Å; F281-L287 HydrophobicContact CG-CB 4.29Å; S283-L287 PolarHBondContact O-N 3.44Å; H284-L287 PolarHBondContact O-N 2.88Å; L287-K289 VanDerWaalsContact C-N 3.3Å; L287-K289 PolarHBondContact O-N 3.32Å; L287-H290 CarbonylContact O-C 3.36Å; L287-H290 WeakPolarHBondContact O-CA 3.41Å; L287-H290 WeakPolarHBondContact O-CB 3.37Å; L287-H290 PolarHBondContact O-N 3.41Å; L287-E291 HydrophobicContact CD1-CG 4Å; L287-E291 HydrophobicContact CG-CG 4.31Å; L287-E291 WeakPolarHBondContact O-CG 3.32Å; L287-E291 PolarHBondContact O-N 3Å
288	Q	82.9	Confident	83.3	Confident	82 Å²	82	70.5 Å²	70.5	38%	0.383	37%	0.372	S	S	.	.	H	α-helix	trans	-57.4	-39.3	177.2	-75	-68	-34.3	0	0	113.2	H284 H290 E291	H284-Q288 WeakPolarHBondContact CE1-CG 3.5Å; H284-Q288 PolarHBondContact CE1-NE2 3.16Å; H284-Q288 PolarHBondContact NE2-NE2 3.38Å; H284-Q288 WeakPolarHBondContact O-CG 3.31Å; H284-Q288 PolarHBondContact O-N 3.35Å; Q288-H290 VanDerWaalsContact C-N 3.31Å; Q288-E291 PolarHBondContact NE2-OE2 3.45Å
289	K	83	Confident	83.5	Confident	118 Å²	118	67.5 Å²	67.5	51%	0.513	36%	0.355	S	S	.	.	H	α-helix	trans	-68.4	-32.4	174.2	-74.9	177.8	-177.3	-175.2	0	112.1	G285 Q286 L287	G285-K289 WeakPolarHBondContact O-CG 3.4Å; G285-K289 PolarHBondContact O-N 2.88Å; Q286-K289 PolarHBondContact O-N 3.02Å; L287-K289 VanDerWaalsContact C-N 3.3Å; L287-K289 PolarHBondContact O-N 3.32Å
290	H	85.2	Confident	83.9	Confident	15 Å²	15	65.1 Å²	65.1	7%	0.069	34%	0.343	C	S	.	.	H	α-helix	trans	-75	-39.5	178	168.2	67.4	0	0	0	112.5	C277 F281 Q286 L287 Q288 R292 I293 H294	C277-H290 PolarHBondContact SG-NE2 3.33Å; F281-H290 HydrophobicContact CE1-CB 3.84Å; F281-H290 HydrophobicContact CE2-CB 3.76Å; F281-H290 AromaticContact CE2-CD2 3.25Å; F281-H290 WeakPolarHBondContact CE2-CD2 2.81Å; F281-H290 AromaticContact CE2-CG 3.51Å; F281-H290 AromaticContact CE2-NE2 3.96Å; F281-H290 HydrophobicContact CZ-CB 3.35Å; F281-H290 AromaticContact CZ-CD2 3.35Å; F281-H290 WeakPolarHBondContact CZ-CD2 3.48Å; F281-H290 AromaticContact CZ-CG 3.12Å; F281-H290 AromaticContact CZ-ND1 3.65Å; F281-H290 AromaticContact CZ-NE2 3.94Å; Q286-H290 WeakPolarHBondContact O-CB 3.46Å; Q286-H290 PolarHBondContact O-N 3.04Å; L287-H290 CarbonylContact O-C 3.36Å; L287-H290 WeakPolarHBondContact O-CA 3.41Å; L287-H290 WeakPolarHBondContact O-CB 3.37Å; L287-H290 PolarHBondContact O-N 3.41Å; Q288-H290 VanDerWaalsContact C-N 3.31Å; H290-R292 PolarHBondContact O-N 3.33Å; H290-R292 VanDerWaalsContact O-N 3.13Å; H290-I293 WeakPolarHBondContact O-CB 3.41Å; H290-I293 WeakPolarHBondContact O-CG1 3.3Å; H290-I293 PolarHBondContact O-N 3.31Å; H290-H294 AromaticContact CE1-NE2 3.63Å; H290-H294 AromaticContact NE2-CD2 3.85Å; H290-H294 AromaticContact NE2-NE2 3.25Å; H290-H294 PolarHBondContact NE2-NE2 3.21Å
291	E	84.9	Confident	83.9	Confident	44 Å²	44	70.5 Å²	70.5	21%	0.206	36%	0.362	C	S	.	.	H	α-helix	trans	-57.1	-29.7	178.3	-73.9	176.3	142.6	0	0	112.3	L287 Q288 I293 H294 T295	L287-E291 HydrophobicContact CD1-CG 4Å; L287-E291 HydrophobicContact CG-CG 4.31Å; L287-E291 WeakPolarHBondContact O-CG 3.32Å; L287-E291 PolarHBondContact O-N 3Å; Q288-E291 PolarHBondContact NE2-OE2 3.45Å; E291-I293 PolarHBondContact O-N 3.21Å; E291-I293 VanDerWaalsContact O-N 3.11Å; E291-H294 WeakPolarHBondContact O-CB 3.17Å; E291-H294 PolarHBondContact O-N 3.27Å; E291-T295 PolarHBondContact O-N 3.24Å; E291-T295 VanDerWaalsContact O-N 3.09Å; E291-T295 PolarHBondContact O-OG1 3.28Å
292	R	86	Confident	84.2	Confident	58 Å²	58	68.8 Å²	68.8	22%	0.219	36%	0.355	C	S	.	.	H	α-helix	trans	-58.8	-21.1	171.9	-63.6	175.8	-171.7	-171.8	-4.8	114.5	H290 H294 T295 G296 E297 A310	H290-R292 PolarHBondContact O-N 3.33Å; H290-R292 VanDerWaalsContact O-N 3.13Å; R292-H294 VanDerWaalsContact C-N 3.35Å; R292-T295 WeakPolarHBondContact CA-OG1 3.32Å; R292-G296 CarbonylContact O-C 3.34Å; R292-G296 WeakPolarHBondContact O-CA 3.36Å; R292-G296 PolarHBondContact O-N 3.26Å; R292-E297 HydrophobicContact CG-CB 4.4Å; R292-E297 PolarHBondContact O-N 3.03Å; R292-A310 HydrophobicContact CB-CB 4.3Å; R292-A310 WeakPolarHBondContact CD-O 3.31Å; R292-A310 PolarHBondContact NH1-O 3.39Å
293	I	82.1	Confident	84.3	Confident	118 Å²	118	75.5 Å²	75.5	61%	0.605	39%	0.388	S	S	*	.	H	α-helix	trans	-71.1	-37.7	174.5	-59.3	177.2	0	0	0	110	H290 E291	H290-I293 WeakPolarHBondContact O-CB 3.41Å; H290-I293 WeakPolarHBondContact O-CG1 3.3Å; H290-I293 PolarHBondContact O-N 3.31Å; E291-I293 PolarHBondContact O-N 3.21Å; E291-I293 VanDerWaalsContact O-N 3.11Å
294	H	82.6	Confident	84.3	Confident	69 Å²	69	80.4 Å²	80.4	32%	0.319	41%	0.409	S	S	.	.	H	α-helix	trans	-77.6	-43.5	-179.9	-64.4	-72.7	0	0	0	112	C277 H290 E291 R292 G296	C277-H294 PolarHBondContact SG-NE2 3.23Å; C277-H294 VanDerWaalsContact SG-NE2 3.39Å; H290-H294 AromaticContact CE1-NE2 3.63Å; H290-H294 AromaticContact NE2-CD2 3.85Å; H290-H294 AromaticContact NE2-NE2 3.25Å; H290-H294 PolarHBondContact NE2-NE2 3.21Å; E291-H294 WeakPolarHBondContact O-CB 3.17Å; E291-H294 PolarHBondContact O-N 3.27Å; R292-H294 VanDerWaalsContact C-N 3.35Å; H294-G296 PolarHBondContact O-N 3.06Å
295	T	82.8	Confident	84.5	Confident	77 Å²	77	78.1 Å²	78.1	47%	0.472	40%	0.403	S	S	.	.	H	α-helix	trans	-75.5	-15.2	177.9	62.7	0	0	0	0	112.8	E291 R292 E297	E291-T295 PolarHBondContact O-N 3.24Å; E291-T295 VanDerWaalsContact O-N 3.09Å; E291-T295 PolarHBondContact O-OG1 3.28Å; R292-T295 WeakPolarHBondContact CA-OG1 3.32Å; T295-E297 PolarHBondContact O-N 3.32Å; T295-E297 WeakPolarHBondContact OG1-CB 3.4Å; T295-E297 WeakPolarHBondContact OG1-CG 3.4Å; T295-E297 PolarHBondContact OG1-N 3.12Å
296	G	81.8	Confident	84.6	Confident	47 Å²	47	79 Å²	79	49%	0.485	41%	0.413	S	S	.	.			trans	69.7	5.7	-174.2	0	0	0	0	0	113.8	R292 H294 K298	R292-G296 CarbonylContact O-C 3.34Å; R292-G296 WeakPolarHBondContact O-CA 3.36Å; R292-G296 PolarHBondContact O-N 3.26Å; H294-G296 PolarHBondContact O-N 3.06Å; G296-K298 PolarHBondContact O-N 2.79Å
297	E	83.4	Confident	84.7	Confident	114 Å²	114	80.7 Å²	80.7	53%	0.533	42%	0.419	S	S	.	.			trans	-60	125.6	-178.7	-78.7	-177	179.3	0	0	111.6	R292 T295 P299	R292-E297 HydrophobicContact CG-CB 4.4Å; R292-E297 PolarHBondContact O-N 3.03Å; T295-E297 PolarHBondContact O-N 3.32Å; T295-E297 WeakPolarHBondContact OG1-CB 3.4Å; T295-E297 WeakPolarHBondContact OG1-CG 3.4Å; T295-E297 PolarHBondContact OG1-N 3.12Å; E297-P299 WeakPolarHBondContact O-CD 3.26Å
298	K	86.4	Confident	84.8	Confident	117 Å²	117	81.5 Å²	81.5	51%	0.509	43%	0.427	S	S	.	.			trans	-125.4	79.3	177.2	-70.1	168.3	-178.7	179	0	109.7	G296 Y300 A308 F309	G296-K298 PolarHBondContact O-N 2.79Å; K298-Y300 PolarHBondContact O-N 3.14Å; K298-Y300 VanDerWaalsContact O-N 3.15Å; K298-A308 HydrophobicContact CB-CB 3.51Å; K298-A308 HydrophobicContact CD-CB 4Å; K298-A308 WeakPolarHBondContact CD-O 3.48Å; K298-A308 HydrophobicContact CG-CB 4.36Å; K298-F309 CarbonylContact C-O 3.56Å; K298-F309 WeakPolarHBondContact CA-O 3.46Å
299	P	87.1	Confident	85	Confident	71 Å²	71	79.8 Å²	79.8	46%	0.461	42%	0.419	S	S	.	.			trans	-64.4	-21.4	-172.5	-23.3	34.8	0	0	0	114	E297	E297-P299 WeakPolarHBondContact O-CD 3.26Å
300	Y	88.1	Confident	85	Confident	72 Å²	72	75.8 Å²	75.8	28%	0.282	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	98.8	-174.5	-50.8	-79	0	0	0	109.7	K298 A308 F309 S311 H312 F315	K298-Y300 PolarHBondContact O-N 3.14Å; K298-Y300 VanDerWaalsContact O-N 3.15Å; Y300-A308 CarbonylContact O-C 3.57Å; Y300-A308 WeakPolarHBondContact O-CA 3.47Å; Y300-F309 WeakPolarHBondContact CD2-O 3.4Å; Y300-F309 PolarHBondContact N-O 3.28Å; Y300-F309 PolarHBondContact O-N 2.77Å; Y300-S311 VanDerWaalsContact CD2-C 3.44Å; Y300-H312 HydrophobicContact CD1-CB 4.24Å; Y300-H312 HydrophobicContact CE1-CB 3.79Å; Y300-H312 AromaticContact CE1-CD2 3.9Å; Y300-H312 HydrophobicContact CE2-CB 4.11Å; Y300-F315 HydrophobicContact CG-CB 4.38Å
301	K	85.5	Confident	84.9	Confident	145 Å²	145	76.5 Å²	76.5	63%	0.63	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.7	140.8	177.5	-63.1	-176.1	-178.6	177.5	0	110.3	A308 F315	K301-A308 HydrophobicContact CG-CB 3.89Å; K301-F315 VanDerWaalsContact O-CE2 3.31Å; K301-F315 WeakPolarHBondContact O-CE2 3.49Å
302	C	89.1	Confident	84.8	Confident	4 Å²	4	78.5 Å²	78.5	3%	0.027	42%	0.423	C	S	.	.			trans	-93.4	116.4	172.9	179.4	0	0	0	0	110	Q304 C305 G306 K307 F315 H318 H322	C302-Q304 PolarHBondContact O-N 3.18Å; C302-C305 PolarHBondContact O-N 3.42Å; C302-C305 VanDerWaalsContact SG-SG 3.69Å; C302-G306 WeakPolarHBondContact O-CA 3.48Å; C302-G306 PolarHBondContact O-N 3.32Å; C302-K307 WeakPolarHBondContact CB-O 3.38Å; C302-K307 PolarHBondContact N-O 3.48Å; C302-F315 HydrophobicContact CB-CD2 4.39Å; C302-F315 HydrophobicContact CB-CE2 3.81Å; C302-H318 PolarHBondContact SG-NE2 3.44Å; C302-H318 VanDerWaalsContact SG-NE2 3.45Å; C302-H322 PolarHBondContact SG-NE2 3.37Å
303	D	84.9	Confident	84.7	Confident	159 Å²	159	80.4 Å²	80.4	85%	0.85	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-26.8	-176.9	-56.5	-32.5	0	0	0	112.3
304	Q	82.9	Confident	84.8	Confident	130 Å²	130	81 Å²	81	61%	0.607	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-22	-178.3	-58.1	-170.1	21.2	0	0	114.4	C302	C302-Q304 PolarHBondContact O-N 3.18Å
305	C	85.5	Confident	85	Confident	53 Å²	53	79 Å²	79	36%	0.358	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.7	7.2	-177.6	72.9	0	0	0	0	114.9	C302 K307 H318 H322	C302-C305 PolarHBondContact O-N 3.42Å; C302-C305 VanDerWaalsContact SG-SG 3.69Å; C305-K307 PolarHBondContact O-N 3.46Å; C305-H318 VanDerWaalsContact SG-CE1 3.53Å; C305-H318 PolarHBondContact SG-NE2 2.88Å; C305-H322 PolarHBondContact SG-NE2 3.23Å
306	G	83.1	Confident	85	Confident	62 Å²	62	78.6 Å²	78.6	64%	0.639	42%	0.419	S	S	*	.			trans	68.4	-3.3	-179	0	0	0	0	0	115.5	C302 A308	C302-G306 WeakPolarHBondContact O-CA 3.48Å; C302-G306 PolarHBondContact O-N 3.32Å; G306-A308 PolarHBondContact O-N 2.78Å
307	K	85.4	Confident	85.1	Confident	126 Å²	126	80.6 Å²	80.6	55%	0.548	42%	0.415	S	S	.	.			trans	-69.2	130	-177	-72.6	179.5	-178.2	169.7	0	111.3	C302 C305 F309	C302-K307 WeakPolarHBondContact CB-O 3.38Å; C302-K307 PolarHBondContact N-O 3.48Å; C305-K307 PolarHBondContact O-N 3.46Å; K307-F309 HydrophobicContact CB-CE2 3.87Å; K307-F309 HydrophobicContact CB-CZ 3.98Å; K307-F309 WeakPolarHBondContact O-CE2 3.5Å
308	A	88.7	Confident	85.2	Confident	31 Å²	31	76 Å²	76	26%	0.256	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	145.6	179	0	0	0	0	0	112.2	K298 Y300 K301 G306	K298-A308 HydrophobicContact CB-CB 3.51Å; K298-A308 HydrophobicContact CD-CB 4Å; K298-A308 WeakPolarHBondContact CD-O 3.48Å; K298-A308 HydrophobicContact CG-CB 4.36Å; Y300-A308 CarbonylContact O-C 3.57Å; Y300-A308 WeakPolarHBondContact O-CA 3.47Å; K301-A308 HydrophobicContact CG-CB 3.89Å; G306-A308 PolarHBondContact O-N 2.78Å
309	F	85.3	Confident	85	Confident	46 Å²	46	73.1 Å²	73.1	20%	0.202	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	145.1	-177.1	-56.5	-92.8	0	0	0	111.2	K298 Y300 K307 S311 K314 F315 H318	K298-F309 CarbonylContact C-O 3.56Å; K298-F309 WeakPolarHBondContact CA-O 3.46Å; Y300-F309 WeakPolarHBondContact CD2-O 3.4Å; Y300-F309 PolarHBondContact N-O 3.28Å; Y300-F309 PolarHBondContact O-N 2.77Å; K307-F309 HydrophobicContact CB-CE2 3.87Å; K307-F309 HydrophobicContact CB-CZ 3.98Å; K307-F309 WeakPolarHBondContact O-CE2 3.5Å; F309-S311 VanDerWaalsContact C-N 3.33Å; F309-K314 HydrophobicContact CD1-CB 4.16Å; F309-F315 HydrophobicContact CB-CB 4.08Å; F309-F315 HydrophobicContact CD2-CB 3.98Å; F309-F315 AromaticContact CD2-CD2 3.79Å; F309-F315 HydrophobicContact CD2-CD2 3.79Å; F309-F315 HydrophobicContact CD2-CG 4.39Å; F309-F315 HydrophobicContact CE2-CD2 4.18Å; F309-F315 HydrophobicContact CG-CB 4.17Å; F309-H318 HydrophobicContact CE1-CB 3.96Å; F309-H318 HydrophobicContact CE2-CB 3.92Å; F309-H318 AromaticContact CE2-CD2 3.3Å; F309-H318 WeakPolarHBondContact CE2-CD2 3.34Å; F309-H318 AromaticContact CE2-CG 3.61Å; F309-H318 AromaticContact CE2-NE2 3.98Å; F309-H318 HydrophobicContact CZ-CB 3.45Å; F309-H318 VanDerWaalsContact CZ-CB 3.45Å; F309-H318 AromaticContact CZ-CD2 3.41Å; F309-H318 VanDerWaalsContact CZ-CD2 3.41Å; F309-H318 WeakPolarHBondContact CZ-CD2 3.27Å; F309-H318 AromaticContact CZ-CG 3.21Å; F309-H318 AromaticContact CZ-ND1 3.76Å; F309-H318 AromaticContact CZ-NE2 4Å
310	A	84.4	Confident	84.8	Confident	34 Å²	34	72.8 Å²	72.8	28%	0.281	37%	0.371	S	S	.	.	S	Bend	trans	-77.1	-17.9	178.4	0	0	0	0	0	113.5	R292	R292-A310 HydrophobicContact CB-CB 4.3Å; R292-A310 WeakPolarHBondContact CD-O 3.31Å; R292-A310 PolarHBondContact NH1-O 3.39Å
311	S	83.4	Confident	84.5	Confident	30 Å²	30	74.8 Å²	74.8	21%	0.21	39%	0.385	C	S	.	.	S	Bend	trans	-135.5	137.9	-176.1	66.4	0	0	0	0	112.3	Y300 F309 D313 K314 F315	Y300-S311 VanDerWaalsContact CD2-C 3.44Å; F309-S311 VanDerWaalsContact C-N 3.33Å; S311-D313 VanDerWaalsContact C-N 3.34Å; S311-D313 PolarHBondContact O-N 2.7Å; S311-K314 PolarHBondContact O-N 3.48Å; S311-K314 VanDerWaalsContact O-N 3.17Å; S311-K314 WeakPolarHBondContact OG-CB 3.49Å; S311-K314 WeakPolarHBondContact OG-CG 3.48Å; S311-F315 PolarHBondContact O-N 3.05Å
312	H	82.9	Confident	84.2	Confident	85 Å²	85	70.9 Å²	70.9	39%	0.394	37%	0.369	S	S	.	.	H	α-helix	trans	-55.2	-43.5	178.9	-176.9	-100.8	0	0	0	113.1	Y300 K314 F315 Q316	Y300-H312 HydrophobicContact CD1-CB 4.24Å; Y300-H312 HydrophobicContact CE1-CB 3.79Å; Y300-H312 AromaticContact CE1-CD2 3.9Å; Y300-H312 HydrophobicContact CE2-CB 4.11Å; H312-K314 VanDerWaalsContact C-N 3.25Å; H312-K314 PolarHBondContact O-N 3.49Å; H312-F315 WeakPolarHBondContact O-CB 3.29Å; H312-F315 PolarHBondContact O-N 2.88Å; H312-F315 VanDerWaalsContact O-N 3.13Å; H312-Q316 WeakPolarHBondContact CE1-CG 3.31Å; H312-Q316 WeakPolarHBondContact O-CB 3.38Å; H312-Q316 WeakPolarHBondContact O-CG 3.3Å; H312-Q316 PolarHBondContact O-N 3.2Å
313	D	82.8	Confident	83.7	Confident	99 Å²	99	75.3 Å²	75.3	53%	0.529	39%	0.392	S	S	.	.	H	α-helix	trans	-62.7	-32.1	-178	-56.1	-46.6	0	0	0	113.1	S311 K317	S311-D313 VanDerWaalsContact C-N 3.34Å; S311-D313 PolarHBondContact O-N 2.7Å; D313-K317 WeakPolarHBondContact O-CB 3.18Å; D313-K317 VanDerWaalsContact O-CG 3.26Å; D313-K317 WeakPolarHBondContact O-CG 3.41Å; D313-K317 PolarHBondContact O-N 3.39Å; D313-K317 VanDerWaalsContact O-N 3.16Å
314	K	84	Confident	83.4	Confident	130 Å²	130	69.9 Å²	69.9	57%	0.565	37%	0.373	S	S	*	.	H	α-helix	trans	-76.7	-39	177.1	-64.2	-72	-177.8	173.8	0	110.9	F309 S311 H312 K317 H318	F309-K314 HydrophobicContact CD1-CB 4.16Å; S311-K314 PolarHBondContact O-N 3.48Å; S311-K314 VanDerWaalsContact O-N 3.17Å; S311-K314 WeakPolarHBondContact OG-CB 3.49Å; S311-K314 WeakPolarHBondContact OG-CG 3.48Å; H312-K314 VanDerWaalsContact C-N 3.25Å; H312-K314 PolarHBondContact O-N 3.49Å; K314-K317 PolarHBondContact O-N 3.16Å; K314-H318 WeakPolarHBondContact O-CB 3.5Å; K314-H318 PolarHBondContact O-N 3.1Å
315	F	86.8	Confident	83.2	Confident	27 Å²	27	68.5 Å²	68.5	12%	0.118	37%	0.367	C	S	.	.	H	α-helix	trans	-60.6	-51.3	173	170.7	-111.9	0	0	0	111.3	Y300 K301 C302 F309 S311 H312 K317 H318 E319	Y300-F315 HydrophobicContact CG-CB 4.38Å; K301-F315 VanDerWaalsContact O-CE2 3.31Å; K301-F315 WeakPolarHBondContact O-CE2 3.49Å; C302-F315 HydrophobicContact CB-CD2 4.39Å; C302-F315 HydrophobicContact CB-CE2 3.81Å; F309-F315 HydrophobicContact CB-CB 4.08Å; F309-F315 HydrophobicContact CD2-CB 3.98Å; F309-F315 AromaticContact CD2-CD2 3.79Å; F309-F315 HydrophobicContact CD2-CD2 3.79Å; F309-F315 HydrophobicContact CD2-CG 4.39Å; F309-F315 HydrophobicContact CE2-CD2 4.18Å; F309-F315 HydrophobicContact CG-CB 4.17Å; S311-F315 PolarHBondContact O-N 3.05Å; H312-F315 WeakPolarHBondContact O-CB 3.29Å; H312-F315 PolarHBondContact O-N 2.88Å; H312-F315 VanDerWaalsContact O-N 3.13Å; F315-K317 VanDerWaalsContact C-N 3.34Å; F315-K317 PolarHBondContact O-N 3.43Å; F315-H318 CarbonylContact O-C 3.3Å; F315-H318 WeakPolarHBondContact O-CA 3.44Å; F315-H318 WeakPolarHBondContact O-CB 3.33Å; F315-H318 PolarHBondContact O-N 3.47Å; F315-E319 PolarHBondContact O-N 2.79Å
316	Q	83.3	Confident	83.1	Confident	68 Å²	68	71.9 Å²	71.9	32%	0.318	38%	0.375	S	S	.	.	H	α-helix	trans	-57.2	-43	176.1	-77.7	-65.5	-41.5	0	0	113	H312 H318 E319 R320	H312-Q316 WeakPolarHBondContact CE1-CG 3.31Å; H312-Q316 WeakPolarHBondContact O-CB 3.38Å; H312-Q316 WeakPolarHBondContact O-CG 3.3Å; H312-Q316 PolarHBondContact O-N 3.2Å; Q316-H318 VanDerWaalsContact C-N 3.27Å; Q316-H318 PolarHBondContact O-N 3.43Å; Q316-E319 PolarHBondContact NE2-OE2 2.99Å; Q316-E319 PolarHBondContact O-N 2.62Å; Q316-R320 WeakPolarHBondContact O-CG 3.49Å; Q316-R320 PolarHBondContact O-N 3.49Å
317	K	83.2	Confident	83.2	Confident	90 Å²	90	72.2 Å²	72.2	39%	0.391	37%	0.367	S	S	.	.	H	α-helix	trans	-65.1	-31.6	174.7	-76.2	176.9	-177.9	-174.7	0	112.8	D313 K314 F315	D313-K317 WeakPolarHBondContact O-CB 3.18Å; D313-K317 VanDerWaalsContact O-CG 3.26Å; D313-K317 WeakPolarHBondContact O-CG 3.41Å; D313-K317 PolarHBondContact O-N 3.39Å; D313-K317 VanDerWaalsContact O-N 3.16Å; K314-K317 PolarHBondContact O-N 3.16Å; F315-K317 VanDerWaalsContact C-N 3.34Å; F315-K317 PolarHBondContact O-N 3.43Å
318	H	85.6	Confident	83.3	Confident	18 Å²	18	69.9 Å²	69.9	8%	0.083	36%	0.355	C	S	.	.	H	α-helix	trans	-74.6	-41.6	176.9	164.3	69.7	0	0	0	111.7	C302 C305 F309 K314 F315 Q316 R320 I321 H322	C302-H318 PolarHBondContact SG-NE2 3.44Å; C302-H318 VanDerWaalsContact SG-NE2 3.45Å; C305-H318 VanDerWaalsContact SG-CE1 3.53Å; C305-H318 PolarHBondContact SG-NE2 2.88Å; F309-H318 HydrophobicContact CE1-CB 3.96Å; F309-H318 HydrophobicContact CE2-CB 3.92Å; F309-H318 AromaticContact CE2-CD2 3.3Å; F309-H318 WeakPolarHBondContact CE2-CD2 3.34Å; F309-H318 AromaticContact CE2-CG 3.61Å; F309-H318 AromaticContact CE2-NE2 3.98Å; F309-H318 HydrophobicContact CZ-CB 3.45Å; F309-H318 VanDerWaalsContact CZ-CB 3.45Å; F309-H318 AromaticContact CZ-CD2 3.41Å; F309-H318 VanDerWaalsContact CZ-CD2 3.41Å; F309-H318 WeakPolarHBondContact CZ-CD2 3.27Å; F309-H318 AromaticContact CZ-CG 3.21Å; F309-H318 AromaticContact CZ-ND1 3.76Å; F309-H318 AromaticContact CZ-NE2 4Å; K314-H318 WeakPolarHBondContact O-CB 3.5Å; K314-H318 PolarHBondContact O-N 3.1Å; F315-H318 CarbonylContact O-C 3.3Å; F315-H318 WeakPolarHBondContact O-CA 3.44Å; F315-H318 WeakPolarHBondContact O-CB 3.33Å; F315-H318 PolarHBondContact O-N 3.47Å; Q316-H318 VanDerWaalsContact C-N 3.27Å; Q316-H318 PolarHBondContact O-N 3.43Å; H318-R320 PolarHBondContact O-N 3.12Å; H318-I321 WeakPolarHBondContact O-CB 3.41Å; H318-I321 VanDerWaalsContact O-CG1 3.3Å; H318-I321 WeakPolarHBondContact O-CG1 3.47Å; H318-I321 PolarHBondContact O-N 3.43Å; H318-H322 AromaticContact CE1-CE1 3.88Å; H318-H322 AromaticContact CE1-NE2 3.39Å; H318-H322 PolarHBondContact CE1-NE2 3.09Å; H318-H322 AromaticContact NE2-CD2 3.98Å; H318-H322 AromaticContact NE2-CE1 3.96Å; H318-H322 AromaticContact NE2-NE2 3.1Å; H318-H322 PolarHBondContact NE2-NE2 3.36Å
319	E	82.5	Confident	83.1	Confident	56 Å²	56	75.9 Å²	75.9	26%	0.262	38%	0.375	S	S	.	.	H	α-helix	trans	-56.3	-36.8	179.6	-169.3	173.5	-161.4	0	0	112.3	F315 Q316 I321 H322 I323	F315-E319 PolarHBondContact O-N 2.79Å; Q316-E319 PolarHBondContact NE2-OE2 2.99Å; Q316-E319 PolarHBondContact O-N 2.62Å; E319-I321 PolarHBondContact O-N 3.39Å; E319-H322 PolarHBondContact O-N 2.81Å; E319-I323 HydrophobicContact CG-CD1 4.21Å; E319-I323 PolarHBondContact O-N 3.07Å
320	R	84.1	Confident	83.4	Confident	63 Å²	63	74.1 Å²	74.1	24%	0.238	37%	0.369	C	S	.	.	H	α-helix	trans	-57.6	-20.9	172.9	-66.1	175.9	-170.3	-172.5	-3.9	114.7	Q316 H318 H322 G324 E325 A338	Q316-R320 WeakPolarHBondContact O-CG 3.49Å; Q316-R320 PolarHBondContact O-N 3.49Å; H318-R320 PolarHBondContact O-N 3.12Å; R320-H322 VanDerWaalsContact C-N 3.31Å; R320-G324 WeakPolarHBondContact O-CA 3.41Å; R320-G324 PolarHBondContact O-N 3.19Å; R320-E325 PolarHBondContact O-N 3.19Å; R320-A338 HydrophobicContact CB-CB 4.5Å; R320-A338 PolarHBondContact NH1-O 3.15Å
321	I	80.6	Confident	83.4	Confident	114 Å²	114	82.1 Å²	82.1	59%	0.585	40%	0.397	S	S	*	.	H	α-helix	trans	-67.6	-38.7	175.9	-60.7	173.5	0	0	0	109.9	H318 E319	H318-I321 WeakPolarHBondContact O-CB 3.41Å; H318-I321 VanDerWaalsContact O-CG1 3.3Å; H318-I321 WeakPolarHBondContact O-CG1 3.47Å; H318-I321 PolarHBondContact O-N 3.43Å; E319-I321 PolarHBondContact O-N 3.39Å
322	H	79.2	Confident	83.4	Confident	64 Å²	64	86.2 Å²	86.2	30%	0.296	41%	0.413	S	S	.	.	H	α-helix	trans	-79.8	-39.2	-177.1	-53	-60.2	0	0	0	112.5	C302 C305 H318 E319 R320 G324	C302-H322 PolarHBondContact SG-NE2 3.37Å; C305-H322 PolarHBondContact SG-NE2 3.23Å; H318-H322 AromaticContact CE1-CE1 3.88Å; H318-H322 AromaticContact CE1-NE2 3.39Å; H318-H322 PolarHBondContact CE1-NE2 3.09Å; H318-H322 AromaticContact NE2-CD2 3.98Å; H318-H322 AromaticContact NE2-CE1 3.96Å; H318-H322 AromaticContact NE2-NE2 3.1Å; H318-H322 PolarHBondContact NE2-NE2 3.36Å; E319-H322 PolarHBondContact O-N 2.81Å; R320-H322 VanDerWaalsContact C-N 3.31Å; H322-G324 PolarHBondContact O-N 2.96Å
323	I	79.6	Confident	83.7	Confident	96 Å²	96	84 Å²	84	49%	0.492	41%	0.407	S	S	.	.	H	α-helix	trans	-71.4	-17	174.8	-47.6	173.9	0	0	0	110.5	E319 E325	E319-I323 HydrophobicContact CG-CD1 4.21Å; E319-I323 PolarHBondContact O-N 3.07Å; I323-E325 HydrophobicContact CB-CG 4.2Å; I323-E325 HydrophobicContact CG2-CG 3.72Å; I323-E325 PolarHBondContact O-N 3.16Å
324	G	77.9	Confident	83.8	Confident	45 Å²	45	86.3 Å²	86.3	46%	0.464	42%	0.424	S	S	.	.			trans	72	5.9	-176.9	0	0	0	0	0	113.8	R320 H322 K326	R320-G324 WeakPolarHBondContact O-CA 3.41Å; R320-G324 PolarHBondContact O-N 3.19Å; H322-G324 PolarHBondContact O-N 2.96Å; G324-K326 PolarHBondContact O-N 3.29Å
325	E	78.8	Confident	83.8	Confident	101 Å²	101	86.1 Å²	86.1	47%	0.472	42%	0.423	S	S	.	.			trans	-60.5	123.6	179.5	-76.5	-170.9	170.5	0	0	111.5	R320 I323 P327	R320-E325 PolarHBondContact O-N 3.19Å; I323-E325 HydrophobicContact CB-CG 4.2Å; I323-E325 HydrophobicContact CG2-CG 3.72Å; I323-E325 PolarHBondContact O-N 3.16Å; E325-P327 WeakPolarHBondContact O-CD 3.23Å
326	K	82.9	Confident	83.8	Confident	124 Å²	124	86.6 Å²	86.6	54%	0.539	43%	0.43	S	S	.	.			trans	-124.1	75.4	175.7	-71.9	166.3	178.3	179.2	0	109.6	G324 Y328 S336 F337	G324-K326 PolarHBondContact O-N 3.29Å; K326-Y328 PolarHBondContact O-N 3.01Å; K326-Y328 VanDerWaalsContact O-N 3.14Å; K326-S336 WeakPolarHBondContact CD-O 3.43Å; K326-F337 CarbonylContact C-O 3.52Å; K326-F337 VanDerWaalsContact C-O 3.3Å; K326-F337 WeakPolarHBondContact CA-O 3.43Å
327	P	85.6	Confident	83.9	Confident	70 Å²	70	85.3 Å²	85.3	46%	0.455	42%	0.423	S	S	.	.			trans	-64.3	-22.6	-173.1	-21.9	34	0	0	0	113.5	E325 K329	E325-P327 WeakPolarHBondContact O-CD 3.23Å; P327-K329 PolarHBondContact O-N 3.32Å
328	Y	87.1	Confident	83.9	Confident	77 Å²	77	82.4 Å²	82.4	30%	0.302	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	95.4	-172.7	-54.9	-82.8	0	0	0	110.2	K326 S336 F337 S339 H340	K326-Y328 PolarHBondContact O-N 3.01Å; K326-Y328 VanDerWaalsContact O-N 3.14Å; Y328-S336 CarbonylContact O-C 3.49Å; Y328-S336 WeakPolarHBondContact O-CA 3.33Å; Y328-F337 WeakPolarHBondContact CB-O 3.4Å; Y328-F337 WeakPolarHBondContact CD2-O 3.5Å; Y328-F337 PolarHBondContact N-O 2.91Å; Y328-F337 VanDerWaalsContact N-O 3.12Å; Y328-F337 PolarHBondContact O-N 3.25Å; Y328-S339 VanDerWaalsContact CD2-C 3.43Å; Y328-S339 VanDerWaalsContact CD2-CA 3.46Å; Y328-S339 VanDerWaalsContact CE2-CA 3.5Å; Y328-H340 HydrophobicContact CD1-CB 4.03Å; Y328-H340 HydrophobicContact CE1-CB 3.84Å
329	K	85.9	Confident	83.8	Confident	156 Å²	156	82.5 Å²	82.5	68%	0.678	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.1	137.4	178.6	-53.8	-169.8	176.8	176.5	0	110.9	P327 S336	P327-K329 PolarHBondContact O-N 3.32Å; K329-S336 WeakPolarHBondContact CG-OG 3.45Å
330	C	89.9	Confident	83.9	Confident	10 Å²	10	84 Å²	84	7%	0.068	43%	0.426	C	S	.	.			trans	-73.2	138	169.9	-175.2	0	0	0	0	109.9	Q332 K335 F337 L343 H350	C330-Q332 PolarHBondContact SG-N 3.31Å; C330-Q332 VanDerWaalsContact SG-N 3.44Å; C330-K335 VanDerWaalsContact CB-O 3.27Å; C330-K335 WeakPolarHBondContact CB-O 3.21Å; C330-K335 PolarHBondContact N-O 2.74Å; C330-F337 HydrophobicContact CB-CE2 4.4Å; C330-L343 HydrophobicContact CB-CD1 3.74Å; C330-H350 PolarHBondContact SG-NE2 2.88Å; C330-H350 VanDerWaalsContact SG-NE2 3.41Å
331	K	85.9	Confident	83.9	Confident	202 Å²	202	85.5 Å²	85.5	88%	0.878	44%	0.438	S	S	*	.	S	Bend	trans	-77.4	-23.3	176.5	-63.7	-175.6	179.4	-177.4	0	113.1
332	Q	83.3	Confident	84.1	Confident	116 Å²	116	86.1 Å²	86.1	54%	0.542	44%	0.437	S	S	.	.	S	Bend	trans	-100	-8.4	-173.2	-60.3	-176.9	53.8	0	0	113.2	C330 H350	C330-Q332 PolarHBondContact SG-N 3.31Å; C330-Q332 VanDerWaalsContact SG-N 3.44Å; Q332-H350 HydrophobicContact CB-CB 4.41Å
333	C	88	Confident	84.5	Confident	39 Å²	39	83.7 Å²	83.7	26%	0.264	43%	0.426	S	S	.	.	S	Bend	trans	-155.9	170	173.4	73.4	0	0	0	0	111.3	K335 H346	C333-K335 PolarHBondContact O-N 3.13Å; C333-K335 VanDerWaalsContact O-N 3.07Å; C333-H346 PolarHBondContact SG-NE2 3.05Å
334	T	85.1	Confident	84.8	Confident	146 Å²	146	83.2 Å²	83.2	90%	0.896	42%	0.422	S	S	*	.	S	Bend	trans	-70.1	-3.3	-178.6	57.2	0	0	0	0	114.6
335	K	84.1	Confident	85.1	Confident	127 Å²	127	87 Å²	87	55%	0.552	43%	0.426	S	S	*	.			trans	-73.9	135.1	-176	-65.2	-179.4	178.9	173.4	0	111.6	C330 C333 F337	C330-K335 VanDerWaalsContact CB-O 3.27Å; C330-K335 WeakPolarHBondContact CB-O 3.21Å; C330-K335 PolarHBondContact N-O 2.74Å; C333-K335 PolarHBondContact O-N 3.13Å; C333-K335 VanDerWaalsContact O-N 3.07Å; K335-F337 HydrophobicContact CB-CE2 3.95Å; K335-F337 HydrophobicContact CB-CZ 3.9Å
336	S	87.6	Confident	85.4	Confident	36 Å²	36	83 Å²	83	25%	0.252	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	151.1	176.5	-55.2	0	0	0	0	110.9	K326 Y328 K329	K326-S336 WeakPolarHBondContact CD-O 3.43Å; Y328-S336 CarbonylContact O-C 3.49Å; Y328-S336 WeakPolarHBondContact O-CA 3.33Å; K329-S336 WeakPolarHBondContact CG-OG 3.45Å
337	F	84.7	Confident	85.6	Confident	41 Å²	41	79.1 Å²	79.1	18%	0.18	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	149.7	-172.8	-57.1	-88.6	0	0	0	111.8	K326 Y328 C330 K335 S339 K342 L343 H346	K326-F337 CarbonylContact C-O 3.52Å; K326-F337 VanDerWaalsContact C-O 3.3Å; K326-F337 WeakPolarHBondContact CA-O 3.43Å; Y328-F337 WeakPolarHBondContact CB-O 3.4Å; Y328-F337 WeakPolarHBondContact CD2-O 3.5Å; Y328-F337 PolarHBondContact N-O 2.91Å; Y328-F337 VanDerWaalsContact N-O 3.12Å; Y328-F337 PolarHBondContact O-N 3.25Å; C330-F337 HydrophobicContact CB-CE2 4.4Å; K335-F337 HydrophobicContact CB-CE2 3.95Å; K335-F337 HydrophobicContact CB-CZ 3.9Å; F337-S339 VanDerWaalsContact C-N 3.29Å; F337-S339 PolarHBondContact O-N 2.81Å; F337-K342 HydrophobicContact CB-CB 4.21Å; F337-K342 HydrophobicContact CD1-CB 4.08Å; F337-K342 HydrophobicContact CG-CB 4.4Å; F337-L343 HydrophobicContact CB-CB 4.32Å; F337-L343 HydrophobicContact CD2-CB 3.9Å; F337-L343 HydrophobicContact CD2-CD1 3.72Å; F337-L343 HydrophobicContact CD2-CG 4.42Å; F337-L343 HydrophobicContact CE2-CD1 3.9Å; F337-L343 HydrophobicContact CG-CB 4.29Å; F337-H346 HydrophobicContact CE1-CB 3.89Å; F337-H346 HydrophobicContact CE2-CB 3.83Å; F337-H346 AromaticContact CE2-CD2 3.34Å; F337-H346 WeakPolarHBondContact CE2-CD2 3.44Å; F337-H346 AromaticContact CE2-CG 3.58Å; F337-H346 HydrophobicContact CZ-CB 3.38Å; F337-H346 AromaticContact CZ-CD2 3.4Å; F337-H346 WeakPolarHBondContact CZ-CD2 3.39Å; F337-H346 AromaticContact CZ-CG 3.16Å; F337-H346 AromaticContact CZ-ND1 3.7Å
338	A	83.3	Confident	85.6	Confident	29 Å²	29	78.6 Å²	78.6	24%	0.24	38%	0.379	C	S	.	.	S	Bend	trans	-76.2	-14.3	179.1	0	0	0	0	0	113.8	R320	R320-A338 HydrophobicContact CB-CB 4.5Å; R320-A338 PolarHBondContact NH1-O 3.15Å
339	S	83.8	Confident	85.4	Confident	20 Å²	20	80.8 Å²	80.8	14%	0.14	40%	0.395	C	S	.	.	S	Bend	trans	-146.6	144.2	-178.6	66.8	0	0	0	0	112.5	Y328 F337 D341 K342 L343	Y328-S339 VanDerWaalsContact CD2-C 3.43Å; Y328-S339 VanDerWaalsContact CD2-CA 3.46Å; Y328-S339 VanDerWaalsContact CE2-CA 3.5Å; F337-S339 VanDerWaalsContact C-N 3.29Å; F337-S339 PolarHBondContact O-N 2.81Å; S339-D341 VanDerWaalsContact C-N 3.34Å; S339-D341 PolarHBondContact O-N 3.07Å; S339-K342 WeakPolarHBondContact O-CB 3.39Å; S339-K342 PolarHBondContact O-N 3.48Å; S339-K342 VanDerWaalsContact O-N 3.09Å; S339-K342 WeakPolarHBondContact OG-CG 3.31Å; S339-L343 PolarHBondContact O-N 2.93Å
340	H	84.7	Confident	85.2	Confident	88 Å²	88	76.6 Å²	76.6	41%	0.407	38%	0.378	S	S	.	.	H	α-helix	trans	-53.6	-44.1	176.8	-176.3	-98.3	0	0	0	113.5	Y328 K342 L343 Q344	Y328-H340 HydrophobicContact CD1-CB 4.03Å; Y328-H340 HydrophobicContact CE1-CB 3.84Å; H340-K342 PolarHBondContact O-N 3.34Å; H340-K342 VanDerWaalsContact O-N 3.11Å; H340-L343 WeakPolarHBondContact O-CB 3.48Å; H340-L343 PolarHBondContact O-N 3.25Å; H340-Q344 WeakPolarHBondContact CE1-CG 3.29Å; H340-Q344 PolarHBondContact CE1-NE2 3.38Å; H340-Q344 PolarHBondContact NE2-NE2 3.19Å; H340-Q344 WeakPolarHBondContact O-CG 3.46Å; H340-Q344 PolarHBondContact O-N 2.9Å
341	D	84.3	Confident	84.8	Confident	94 Å²	94	79.8 Å²	79.8	50%	0.503	40%	0.397	S	S	.	.	H	α-helix	trans	-59.2	-29.4	-179.9	-55.5	-37.4	0	0	0	113.4	S339 K345	S339-D341 VanDerWaalsContact C-N 3.34Å; S339-D341 PolarHBondContact O-N 3.07Å; D341-K345 VanDerWaalsContact O-CG 3.29Å; D341-K345 WeakPolarHBondContact O-CG 3.32Å; D341-K345 PolarHBondContact O-N 3.16Å
342	K	84.7	Confident	84.6	Confident	127 Å²	127	72.4 Å²	72.4	55%	0.552	38%	0.378	S	S	*	.	H	α-helix	trans	-80.4	-38.1	178.4	-66.7	-73.5	-175.1	171.1	0	111.1	F337 S339 H340 K345 H346	F337-K342 HydrophobicContact CB-CB 4.21Å; F337-K342 HydrophobicContact CD1-CB 4.08Å; F337-K342 HydrophobicContact CG-CB 4.4Å; S339-K342 WeakPolarHBondContact O-CB 3.39Å; S339-K342 PolarHBondContact O-N 3.48Å; S339-K342 VanDerWaalsContact O-N 3.09Å; S339-K342 WeakPolarHBondContact OG-CG 3.31Å; H340-K342 PolarHBondContact O-N 3.34Å; H340-K342 VanDerWaalsContact O-N 3.11Å; K342-K345 PolarHBondContact O-N 3.27Å; K342-H346 WeakPolarHBondContact O-CB 3.46Å; K342-H346 PolarHBondContact O-N 3.41Å
343	L	87.8	Confident	84.5	Confident	13 Å²	13	72.3 Å²	72.3	7%	0.068	38%	0.378	C	S	.	.	H	α-helix	trans	-61	-50.1	171.6	172.6	61.4	0	0	0	110.4	C330 F337 S339 H340 K345 H346 E347	C330-L343 HydrophobicContact CB-CD1 3.74Å; F337-L343 HydrophobicContact CB-CB 4.32Å; F337-L343 HydrophobicContact CD2-CB 3.9Å; F337-L343 HydrophobicContact CD2-CD1 3.72Å; F337-L343 HydrophobicContact CD2-CG 4.42Å; F337-L343 HydrophobicContact CE2-CD1 3.9Å; F337-L343 HydrophobicContact CG-CB 4.29Å; S339-L343 PolarHBondContact O-N 2.93Å; H340-L343 WeakPolarHBondContact O-CB 3.48Å; H340-L343 PolarHBondContact O-N 3.25Å; L343-K345 VanDerWaalsContact C-N 3.31Å; L343-K345 PolarHBondContact O-N 2.81Å; L343-H346 CarbonylContact O-C 3.36Å; L343-H346 WeakPolarHBondContact O-CA 3.27Å; L343-H346 VanDerWaalsContact O-CB 3.31Å; L343-H346 WeakPolarHBondContact O-CB 3.25Å; L343-H346 PolarHBondContact O-N 3.46Å; L343-E347 HydrophobicContact CD1-CG 3.98Å; L343-E347 HydrophobicContact CG-CG 4.34Å; L343-E347 WeakPolarHBondContact O-CG 3.33Å; L343-E347 PolarHBondContact O-N 3.26Å
344	Q	84.6	Confident	84.5	Confident	86 Å²	86	76.3 Å²	76.3	40%	0.402	39%	0.391	S	S	.	.	H	α-helix	trans	-55.3	-43.9	177.3	-75.9	-68.4	-32.9	0	0	112.7	H340 H346 E347	H340-Q344 WeakPolarHBondContact CE1-CG 3.29Å; H340-Q344 PolarHBondContact CE1-NE2 3.38Å; H340-Q344 PolarHBondContact NE2-NE2 3.19Å; H340-Q344 WeakPolarHBondContact O-CG 3.46Å; H340-Q344 PolarHBondContact O-N 2.9Å; Q344-H346 VanDerWaalsContact C-N 3.28Å; Q344-H346 PolarHBondContact O-N 3.09Å; Q344-E347 PolarHBondContact NE2-OE2 3.47Å; Q344-E347 PolarHBondContact O-N 3.04Å
345	K	84.6	Confident	84.6	Confident	126 Å²	126	72.5 Å²	72.5	55%	0.548	37%	0.369	S	S	.	.	H	α-helix	trans	-66.8	-30.2	175	-74.5	175.6	-175.5	-178.5	0	113.1	D341 K342 L343	D341-K345 VanDerWaalsContact O-CG 3.29Å; D341-K345 WeakPolarHBondContact O-CG 3.32Å; D341-K345 PolarHBondContact O-N 3.16Å; K342-K345 PolarHBondContact O-N 3.27Å; L343-K345 VanDerWaalsContact C-N 3.31Å; L343-K345 PolarHBondContact O-N 2.81Å
346	H	86.3	Confident	84.8	Confident	15 Å²	15	70.1 Å²	70.1	7%	0.069	36%	0.357	C	S	.	.	H	α-helix	trans	-75.1	-38.3	176.3	167.2	68.1	0	0	0	111.8	C333 F337 K342 L343 Q344 R348 I349 H350	C333-H346 PolarHBondContact SG-NE2 3.05Å; F337-H346 HydrophobicContact CE1-CB 3.89Å; F337-H346 HydrophobicContact CE2-CB 3.83Å; F337-H346 AromaticContact CE2-CD2 3.34Å; F337-H346 WeakPolarHBondContact CE2-CD2 3.44Å; F337-H346 AromaticContact CE2-CG 3.58Å; F337-H346 HydrophobicContact CZ-CB 3.38Å; F337-H346 AromaticContact CZ-CD2 3.4Å; F337-H346 WeakPolarHBondContact CZ-CD2 3.39Å; F337-H346 AromaticContact CZ-CG 3.16Å; F337-H346 AromaticContact CZ-ND1 3.7Å; K342-H346 WeakPolarHBondContact O-CB 3.46Å; K342-H346 PolarHBondContact O-N 3.41Å; L343-H346 CarbonylContact O-C 3.36Å; L343-H346 WeakPolarHBondContact O-CA 3.27Å; L343-H346 VanDerWaalsContact O-CB 3.31Å; L343-H346 WeakPolarHBondContact O-CB 3.25Å; L343-H346 PolarHBondContact O-N 3.46Å; Q344-H346 VanDerWaalsContact C-N 3.28Å; Q344-H346 PolarHBondContact O-N 3.09Å; H346-R348 PolarHBondContact O-N 2.96Å; H346-I349 WeakPolarHBondContact O-CB 3.46Å; H346-I349 WeakPolarHBondContact O-CG1 3.47Å; H346-I349 PolarHBondContact O-N 2.78Å; H346-H350 AromaticContact CD2-NE2 3.9Å; H346-H350 AromaticContact CE1-NE2 3.53Å; H346-H350 AromaticContact NE2-CD2 3.88Å; H346-H350 AromaticContact NE2-CE1 3.93Å; H346-H350 AromaticContact NE2-NE2 3.04Å; H346-H350 PolarHBondContact NE2-NE2 3.01Å
347	E	85.5	Confident	84.8	Confident	44 Å²	44	75 Å²	75	21%	0.206	38%	0.375	C	S	.	.	H	α-helix	trans	-59.7	-30.1	179.3	-73.7	175.2	147.3	0	0	112.5	L343 Q344 I349 H350 T351	L343-E347 HydrophobicContact CD1-CG 3.98Å; L343-E347 HydrophobicContact CG-CG 4.34Å; L343-E347 WeakPolarHBondContact O-CG 3.33Å; L343-E347 PolarHBondContact O-N 3.26Å; Q344-E347 PolarHBondContact NE2-OE2 3.47Å; Q344-E347 PolarHBondContact O-N 3.04Å; E347-I349 PolarHBondContact O-N 2.67Å; E347-I349 VanDerWaalsContact O-N 3.09Å; E347-H350 PolarHBondContact O-N 2.91Å; E347-T351 PolarHBondContact O-N 2.84Å; E347-T351 VanDerWaalsContact O-N 3.15Å
348	R	85.6	Confident	85	Confident	59 Å²	59	73.5 Å²	73.5	22%	0.223	37%	0.37	C	S	.	.	H	α-helix	trans	-57.8	-20.4	170.6	-64	178.4	-174	-171.2	-5.6	114.7	H346 T351 G352 E353 A366	H346-R348 PolarHBondContact O-N 2.96Å; R348-T351 WeakPolarHBondContact CA-OG1 3.39Å; R348-G352 PolarHBondContact O-N 3.12Å; R348-G352 VanDerWaalsContact O-N 3.14Å; R348-E353 PolarHBondContact O-N 2.99Å; R348-A366 PolarHBondContact NH1-O 3.07Å
349	I	82.9	Confident	85.2	Confident	122 Å²	122	82 Å²	82	63%	0.626	40%	0.402	S	S	*	.	H	α-helix	trans	-72.2	-37.6	175.4	-59.2	176.6	0	0	0	109.9	H346 E347	H346-I349 WeakPolarHBondContact O-CB 3.46Å; H346-I349 WeakPolarHBondContact O-CG1 3.47Å; H346-I349 PolarHBondContact O-N 2.78Å; E347-I349 PolarHBondContact O-N 2.67Å; E347-I349 VanDerWaalsContact O-N 3.09Å
350	H	82.4	Confident	85.3	Confident	69 Å²	69	86.6 Å²	86.6	32%	0.319	42%	0.421	S	S	.	.	H	α-helix	trans	-78.9	-39.6	-179.3	-55.7	-64.1	0	0	0	111.7	C330 Q332 H346 E347 G352	C330-H350 PolarHBondContact SG-NE2 2.88Å; C330-H350 VanDerWaalsContact SG-NE2 3.41Å; Q332-H350 HydrophobicContact CB-CB 4.41Å; H346-H350 AromaticContact CD2-NE2 3.9Å; H346-H350 AromaticContact CE1-NE2 3.53Å; H346-H350 AromaticContact NE2-CD2 3.88Å; H346-H350 AromaticContact NE2-CE1 3.93Å; H346-H350 AromaticContact NE2-NE2 3.04Å; H346-H350 PolarHBondContact NE2-NE2 3.01Å; E347-H350 PolarHBondContact O-N 2.91Å; H350-G352 VanDerWaalsContact C-N 3.26Å; H350-G352 PolarHBondContact O-N 3.14Å
351	T	82.1	Confident	85.5	Confident	76 Å²	76	84.1 Å²	84.1	47%	0.466	41%	0.414	S	S	.	.	H	α-helix	trans	-77.1	-14	178	63.3	0	0	0	0	113.1	E347 R348 E353	E347-T351 PolarHBondContact O-N 2.84Å; E347-T351 VanDerWaalsContact O-N 3.15Å; R348-T351 WeakPolarHBondContact CA-OG1 3.39Å; T351-E353 PolarHBondContact O-N 3.29Å; T351-E353 VanDerWaalsContact O-N 3.11Å; T351-E353 WeakPolarHBondContact OG1-CB 3.36Å; T351-E353 WeakPolarHBondContact OG1-CG 3.31Å; T351-E353 PolarHBondContact OG1-N 3.28Å
352	G	80.5	Confident	85.5	Confident	48 Å²	48	86.7 Å²	86.7	50%	0.495	43%	0.433	S	S	.	.			trans	69.4	-1	-173.5	0	0	0	0	0	114.4	R348 H350 K354	R348-G352 PolarHBondContact O-N 3.12Å; R348-G352 VanDerWaalsContact O-N 3.14Å; H350-G352 VanDerWaalsContact C-N 3.26Å; H350-G352 PolarHBondContact O-N 3.14Å; G352-K354 PolarHBondContact O-N 3.26Å
353	E	82.5	Confident	85.5	Confident	113 Å²	113	86.5 Å²	86.5	53%	0.528	43%	0.432	S	S	.	.			trans	-55.1	126.6	-178.5	-76.8	-176.6	-179.6	0	0	112.1	R348 T351 P355	R348-E353 PolarHBondContact O-N 2.99Å; T351-E353 PolarHBondContact O-N 3.29Å; T351-E353 VanDerWaalsContact O-N 3.11Å; T351-E353 WeakPolarHBondContact OG1-CB 3.36Å; T351-E353 WeakPolarHBondContact OG1-CG 3.31Å; T351-E353 PolarHBondContact OG1-N 3.28Å; E353-P355 WeakPolarHBondContact O-CD 3.07Å
354	K	86.6	Confident	85.5	Confident	123 Å²	123	87.3 Å²	87.3	54%	0.535	44%	0.439	S	S	.	.			trans	-125.1	77.2	177.5	-76.5	161.4	171.6	-176.7	0	109.6	G352 Y356 S364 F365	G352-K354 PolarHBondContact O-N 3.26Å; K354-Y356 PolarHBondContact O-N 3.38Å; K354-S364 WeakPolarHBondContact CD-O 3.39Å; K354-S364 WeakPolarHBondContact O-CB 3.41Å; K354-F365 CarbonylContact C-O 3.43Å; K354-F365 VanDerWaalsContact C-O 3.26Å; K354-F365 WeakPolarHBondContact CA-O 3.28Å
355	P	87.6	Confident	85.6	Confident	67 Å²	67	85.1 Å²	85.1	44%	0.435	43%	0.428	S	S	.	.			trans	-67.8	-9.3	-169.9	-21.2	33.8	0	0	0	115	E353	E353-P355 WeakPolarHBondContact O-CD 3.07Å
356	Y	88.3	Confident	85.6	Confident	76 Å²	76	80.8 Å²	80.8	30%	0.298	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	97	-174.4	-55.4	-80.3	0	0	0	109.6	K354 S364 F365 S367 H368	K354-Y356 PolarHBondContact O-N 3.38Å; Y356-S364 CarbonylContact O-C 3.48Å; Y356-S364 WeakPolarHBondContact O-CA 3.46Å; Y356-F365 WeakPolarHBondContact CB-O 3.3Å; Y356-F365 WeakPolarHBondContact CD2-O 3.47Å; Y356-F365 PolarHBondContact N-O 3.15Å; Y356-F365 VanDerWaalsContact N-O 3.13Å; Y356-F365 PolarHBondContact O-N 3.3Å; Y356-S367 VanDerWaalsContact CD2-CA 3.41Å; Y356-S367 VanDerWaalsContact CE2-CA 3.46Å; Y356-H368 HydrophobicContact CD1-CB 4.03Å; Y356-H368 HydrophobicContact CE1-CB 3.86Å; Y356-H368 HydrophobicContact CG-CB 4.5Å
357	E	87.4	Confident	85.4	Confident	138 Å²	138	81.8 Å²	81.8	65%	0.645	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.8	138.9	-178.5	-48.4	-160.9	138.8	0	0	111.1	S364	E357-S364 WeakPolarHBondContact CG-OG 3.47Å; E357-S364 PolarHBondContact OE1-OG 3.34Å
358	C	90.4	Very high	85.4	Confident	11 Å²	11	84.5 Å²	84.5	7%	0.074	44%	0.437	C	S	.	.			trans	-77.6	130.1	172.7	-176.4	0	0	0	0	109.7	Q360 C361 K363 F365 L371 H378	C358-Q360 VanDerWaalsContact C-N 3.26Å; C358-Q360 PolarHBondContact O-N 3.46Å; C358-C361 VanDerWaalsContact SG-SG 3.62Å; C358-K363 WeakPolarHBondContact CB-O 3.41Å; C358-K363 PolarHBondContact N-O 3.25Å; C358-F365 HydrophobicContact CB-CE2 4.47Å; C358-L371 HydrophobicContact CB-CD1 3.69Å; C358-H378 PolarHBondContact SG-NE2 3.29Å; C358-H378 VanDerWaalsContact SG-NE2 3.42Å
359	K	87.4	Confident	85.4	Confident	206 Å²	206	86.8 Å²	86.8	90%	0.896	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-20.1	177.6	-62.7	-173.5	179.1	-175.7	0	113.3
360	Q	84.5	Confident	85.6	Confident	117 Å²	117	87.1 Å²	87.1	55%	0.547	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-6.9	-174.1	-60.4	-177	54.6	0	0	113.1	C358 H378	C358-Q360 VanDerWaalsContact C-N 3.26Å; C358-Q360 PolarHBondContact O-N 3.46Å; Q360-H378 HydrophobicContact CB-CB 4.45Å
361	C	88.9	Confident	85.9	Confident	37 Å²	37	84.6 Å²	84.6	25%	0.25	44%	0.439	C	S	.	.	S	Bend	trans	-160.2	165.2	174.9	72.2	0	0	0	0	110.8	C358 K363 H374	C358-C361 VanDerWaalsContact SG-SG 3.62Å; C361-K363 PolarHBondContact O-N 2.88Å; C361-H374 PolarHBondContact SG-NE2 2.93Å
362	T	84.4	Confident	86.1	Confident	147 Å²	147	85.5 Å²	85.5	90%	0.902	44%	0.438	S	S	*	.	S	Bend	trans	-69.2	9.1	-178.4	57.3	0	0	0	0	115.5
363	K	85.2	Confident	86.4	Confident	123 Å²	123	87.7 Å²	87.7	54%	0.535	43%	0.434	S	S	.	.			trans	-86.6	126	-176.6	-66.5	-179.8	179.4	172.2	0	111.6	C358 C361 F365	C358-K363 WeakPolarHBondContact CB-O 3.41Å; C358-K363 PolarHBondContact N-O 3.25Å; C361-K363 PolarHBondContact O-N 2.88Å; K363-F365 HydrophobicContact CB-CE2 3.93Å; K363-F365 HydrophobicContact CB-CZ 4Å; K363-F365 WeakPolarHBondContact O-CE2 3.4Å
364	S	88.6	Confident	86.7	Confident	31 Å²	31	82.9 Å²	82.9	22%	0.217	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	150.1	172.9	-45.6	0	0	0	0	112	K354 Y356 E357	K354-S364 WeakPolarHBondContact CD-O 3.39Å; K354-S364 WeakPolarHBondContact O-CB 3.41Å; Y356-S364 CarbonylContact O-C 3.48Å; Y356-S364 WeakPolarHBondContact O-CA 3.46Å; E357-S364 WeakPolarHBondContact CG-OG 3.47Å; E357-S364 PolarHBondContact OE1-OG 3.34Å
365	F	85.8	Confident	86.7	Confident	40 Å²	40	80 Å²	80	18%	0.175	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	148.2	-174.6	-59.5	-89.9	0	0	0	111.9	K354 Y356 C358 K363 S367 K370 L371 H374	K354-F365 CarbonylContact C-O 3.43Å; K354-F365 VanDerWaalsContact C-O 3.26Å; K354-F365 WeakPolarHBondContact CA-O 3.28Å; Y356-F365 WeakPolarHBondContact CB-O 3.3Å; Y356-F365 WeakPolarHBondContact CD2-O 3.47Å; Y356-F365 PolarHBondContact N-O 3.15Å; Y356-F365 VanDerWaalsContact N-O 3.13Å; Y356-F365 PolarHBondContact O-N 3.3Å; C358-F365 HydrophobicContact CB-CE2 4.47Å; K363-F365 HydrophobicContact CB-CE2 3.93Å; K363-F365 HydrophobicContact CB-CZ 4Å; K363-F365 WeakPolarHBondContact O-CE2 3.4Å; F365-S367 PolarHBondContact O-N 3.44Å; F365-K370 HydrophobicContact CB-CB 4.21Å; F365-K370 HydrophobicContact CD1-CB 3.97Å; F365-K370 HydrophobicContact CG-CB 4.35Å; F365-L371 HydrophobicContact CB-CB 4.31Å; F365-L371 HydrophobicContact CD2-CB 3.93Å; F365-L371 HydrophobicContact CD2-CD1 3.77Å; F365-L371 HydrophobicContact CD2-CG 4.46Å; F365-L371 HydrophobicContact CE2-CD1 3.97Å; F365-L371 HydrophobicContact CG-CB 4.3Å; F365-H374 HydrophobicContact CE1-CB 3.93Å; F365-H374 HydrophobicContact CE2-CB 3.82Å; F365-H374 AromaticContact CE2-CD2 3.36Å; F365-H374 WeakPolarHBondContact CE2-CD2 3.07Å; F365-H374 AromaticContact CE2-CG 3.56Å; F365-H374 HydrophobicContact CZ-CB 3.39Å; F365-H374 AromaticContact CZ-CD2 3.47Å; F365-H374 VanDerWaalsContact CZ-CD2 3.47Å; F365-H374 WeakPolarHBondContact CZ-CD2 3.45Å; F365-H374 AromaticContact CZ-CG 3.18Å; F365-H374 AromaticContact CZ-ND1 3.69Å
366	A	84.1	Confident	86.8	Confident	34 Å²	34	79.1 Å²	79.1	28%	0.281	39%	0.388	S	S	.	.	S	Bend	trans	-74.5	-12	178	0	0	0	0	0	113.9	R348	R348-A366 PolarHBondContact NH1-O 3.07Å
367	S	83.2	Confident	86.6	Confident	37 Å²	37	80 Å²	80	26%	0.259	40%	0.396	S	S	.	.	S	Bend	trans	-148.1	140.6	-177.5	66.1	0	0	0	0	112.8	Y356 F365 N369 K370 L371	Y356-S367 VanDerWaalsContact CD2-CA 3.41Å; Y356-S367 VanDerWaalsContact CE2-CA 3.46Å; F365-S367 PolarHBondContact O-N 3.44Å; S367-N369 PolarHBondContact O-N 3.23Å; S367-K370 WeakPolarHBondContact O-CB 3.37Å; S367-K370 PolarHBondContact O-N 3.05Å; S367-K370 WeakPolarHBondContact OG-CB 3.34Å; S367-K370 VanDerWaalsContact OG-CG 3.25Å; S367-K370 WeakPolarHBondContact OG-CG 3.42Å; S367-L371 PolarHBondContact O-N 3.41Å
368	H	85.6	Confident	86.5	Confident	100 Å²	100	76.6 Å²	76.6	46%	0.463	38%	0.38	S	S	.	.	H	α-helix	trans	-51.8	-47.3	176.8	-176.6	-87.3	0	0	0	113.8	Y356 K370 L371 Q372	Y356-H368 HydrophobicContact CD1-CB 4.03Å; Y356-H368 HydrophobicContact CE1-CB 3.86Å; Y356-H368 HydrophobicContact CG-CB 4.5Å; H368-K370 PolarHBondContact O-N 3.03Å; H368-K370 VanDerWaalsContact O-N 3.12Å; H368-L371 WeakPolarHBondContact O-CB 3.28Å; H368-L371 PolarHBondContact O-N 3.21Å; H368-Q372 PolarHBondContact O-N 3.43Å
369	N	85.6	Confident	86.2	Confident	107 Å²	107	79.7 Å²	79.7	57%	0.572	40%	0.399	S	S	*	.	H	α-helix	trans	-59.2	-28.2	178.3	-93.5	31.9	0	0	0	114.1	S367 K373	S367-N369 PolarHBondContact O-N 3.23Å; N369-K373 WeakPolarHBondContact O-CB 3.49Å; N369-K373 VanDerWaalsContact O-CG 3.28Å; N369-K373 WeakPolarHBondContact O-CG 3.25Å; N369-K373 PolarHBondContact O-N 3.21Å
370	K	85.6	Confident	86.1	Confident	130 Å²	130	72 Å²	72	57%	0.565	38%	0.379	S	S	*	.	H	α-helix	trans	-77	-39.5	176.1	-74.6	-175.4	-179.1	-173.1	0	110.9	F365 S367 H368 K373 H374	F365-K370 HydrophobicContact CB-CB 4.21Å; F365-K370 HydrophobicContact CD1-CB 3.97Å; F365-K370 HydrophobicContact CG-CB 4.35Å; S367-K370 WeakPolarHBondContact O-CB 3.37Å; S367-K370 PolarHBondContact O-N 3.05Å; S367-K370 WeakPolarHBondContact OG-CB 3.34Å; S367-K370 VanDerWaalsContact OG-CG 3.25Å; S367-K370 WeakPolarHBondContact OG-CG 3.42Å; H368-K370 PolarHBondContact O-N 3.03Å; H368-K370 VanDerWaalsContact O-N 3.12Å; K370-K373 PolarHBondContact O-N 3.28Å; K370-H374 WeakPolarHBondContact O-CB 3.42Å; K370-H374 PolarHBondContact O-N 3.17Å
371	L	89.4	Confident	86.2	Confident	15 Å²	15	71.7 Å²	71.7	8%	0.079	38%	0.377	C	S	.	.	H	α-helix	trans	-59.8	-52.4	171.9	172.9	61.6	0	0	0	110.6	C358 F365 S367 H368 K373 H374 E375	C358-L371 HydrophobicContact CB-CD1 3.69Å; F365-L371 HydrophobicContact CB-CB 4.31Å; F365-L371 HydrophobicContact CD2-CB 3.93Å; F365-L371 HydrophobicContact CD2-CD1 3.77Å; F365-L371 HydrophobicContact CD2-CG 4.46Å; F365-L371 HydrophobicContact CE2-CD1 3.97Å; F365-L371 HydrophobicContact CG-CB 4.3Å; S367-L371 PolarHBondContact O-N 3.41Å; H368-L371 WeakPolarHBondContact O-CB 3.28Å; H368-L371 PolarHBondContact O-N 3.21Å; L371-K373 VanDerWaalsContact C-N 3.26Å; L371-K373 PolarHBondContact O-N 3.29Å; L371-H374 CarbonylContact O-C 3.47Å; L371-H374 WeakPolarHBondContact O-CA 3.5Å; L371-H374 VanDerWaalsContact O-CB 3.3Å; L371-H374 WeakPolarHBondContact O-CB 3.33Å; L371-H374 PolarHBondContact O-N 3.37Å; L371-E375 HydrophobicContact CD1-CG 4.07Å; L371-E375 HydrophobicContact CG-CG 4.38Å; L371-E375 WeakPolarHBondContact O-CG 3.48Å; L371-E375 PolarHBondContact O-N 3.35Å
372	Q	86.8	Confident	86.2	Confident	95 Å²	95	75.3 Å²	75.3	44%	0.444	39%	0.389	S	S	.	.	H	α-helix	trans	-57.6	-38.4	179.7	-168.6	-175.4	20.1	0	0	112.8	H368	H368-Q372 PolarHBondContact O-N 3.43Å
373	K	86.6	Confident	86.4	Confident	95 Å²	95	71.5 Å²	71.5	41%	0.413	37%	0.367	S	S	.	.	H	α-helix	trans	-69	-35.2	173.9	-79.4	-178.1	-177.6	-170.1	0	112.7	N369 K370 L371 R376 Y395	N369-K373 WeakPolarHBondContact O-CB 3.49Å; N369-K373 VanDerWaalsContact O-CG 3.28Å; N369-K373 WeakPolarHBondContact O-CG 3.25Å; N369-K373 PolarHBondContact O-N 3.21Å; K370-K373 PolarHBondContact O-N 3.28Å; L371-K373 VanDerWaalsContact C-N 3.26Å; L371-K373 PolarHBondContact O-N 3.29Å; K373-R376 WeakPolarHBondContact O-CB 3.46Å; K373-Y395 HydrophobicContact CB-CE1 4.05Å; K373-Y395 HydrophobicContact CD-CE1 4.29Å; K373-Y395 HydrophobicContact CG-CE1 4.49Å
374	H	88.1	Confident	86.7	Confident	11 Å²	11	68.9 Å²	68.9	5%	0.051	35%	0.354	C	S	.	.	H	α-helix	trans	-69.1	-38.8	176	165.3	69	0	0	0	111.9	C361 F365 K370 L371 R376 I377 H378	C361-H374 PolarHBondContact SG-NE2 2.93Å; F365-H374 HydrophobicContact CE1-CB 3.93Å; F365-H374 HydrophobicContact CE2-CB 3.82Å; F365-H374 AromaticContact CE2-CD2 3.36Å; F365-H374 WeakPolarHBondContact CE2-CD2 3.07Å; F365-H374 AromaticContact CE2-CG 3.56Å; F365-H374 HydrophobicContact CZ-CB 3.39Å; F365-H374 AromaticContact CZ-CD2 3.47Å; F365-H374 VanDerWaalsContact CZ-CD2 3.47Å; F365-H374 WeakPolarHBondContact CZ-CD2 3.45Å; F365-H374 AromaticContact CZ-CG 3.18Å; F365-H374 AromaticContact CZ-ND1 3.69Å; K370-H374 WeakPolarHBondContact O-CB 3.42Å; K370-H374 PolarHBondContact O-N 3.17Å; L371-H374 CarbonylContact O-C 3.47Å; L371-H374 WeakPolarHBondContact O-CA 3.5Å; L371-H374 VanDerWaalsContact O-CB 3.3Å; L371-H374 WeakPolarHBondContact O-CB 3.33Å; L371-H374 PolarHBondContact O-N 3.37Å; H374-R376 PolarHBondContact O-N 3.12Å; H374-R376 VanDerWaalsContact O-N 3.11Å; H374-I377 VanDerWaalsContact O-CB 3.25Å; H374-I377 WeakPolarHBondContact O-CB 3.08Å; H374-I377 WeakPolarHBondContact O-CG1 3.33Å; H374-I377 PolarHBondContact O-N 3.46Å; H374-H378 AromaticContact CD2-NE2 3.93Å; H374-H378 AromaticContact CE1-NE2 3.54Å; H374-H378 AromaticContact NE2-CD2 3.84Å; H374-H378 AromaticContact NE2-CE1 3.98Å; H374-H378 AromaticContact NE2-NE2 3.04Å; H374-H378 PolarHBondContact NE2-NE2 2.85Å
375	E	87.5	Confident	86.8	Confident	62 Å²	62	74 Å²	74	29%	0.29	37%	0.372	S	S	.	.	H	α-helix	trans	-57.5	-27.5	179.1	-73.6	174	149.6	0	0	112.8	L371 I377 H378 T379	L371-E375 HydrophobicContact CD1-CG 4.07Å; L371-E375 HydrophobicContact CG-CG 4.38Å; L371-E375 WeakPolarHBondContact O-CG 3.48Å; L371-E375 PolarHBondContact O-N 3.35Å; E375-I377 PolarHBondContact O-N 3.48Å; E375-I377 VanDerWaalsContact O-N 3.12Å; E375-H378 PolarHBondContact O-N 3.29Å; E375-T379 PolarHBondContact O-N 3.27Å; E375-T379 VanDerWaalsContact O-N 3.08Å
376	R	88.7	Confident	87.1	Confident	49 Å²	49	72.2 Å²	72.2	19%	0.185	36%	0.364	C	S	.	.	H	α-helix	trans	-58.9	-22.5	172.5	-60.3	178.1	-178.3	-165.6	-8.4	114.3	K373 H374 H378 T379 G380 E381 V394	K373-R376 WeakPolarHBondContact O-CB 3.46Å; H374-R376 PolarHBondContact O-N 3.12Å; H374-R376 VanDerWaalsContact O-N 3.11Å; R376-H378 VanDerWaalsContact C-N 3.33Å; R376-T379 WeakPolarHBondContact CA-OG1 3.39Å; R376-G380 WeakPolarHBondContact O-CA 3.47Å; R376-G380 PolarHBondContact O-N 3.47Å; R376-G380 VanDerWaalsContact O-N 3.07Å; R376-E381 HydrophobicContact CB-CB 4.44Å; R376-E381 HydrophobicContact CG-CB 4.49Å; R376-E381 PolarHBondContact O-N 3.1Å; R376-V394 HydrophobicContact CB-CG1 3.67Å; R376-V394 PolarHBondContact NH1-O 2.79Å
377	I	84.3	Confident	87.3	Confident	94 Å²	94	76.6 Å²	76.6	48%	0.482	38%	0.383	S	S	.	.	H	α-helix	trans	-70.1	-36.9	175.5	-62.2	171.6	0	0	0	110	H374 E375	H374-I377 VanDerWaalsContact O-CB 3.25Å; H374-I377 WeakPolarHBondContact O-CB 3.08Å; H374-I377 WeakPolarHBondContact O-CG1 3.33Å; H374-I377 PolarHBondContact O-N 3.46Å; E375-I377 PolarHBondContact O-N 3.48Å; E375-I377 VanDerWaalsContact O-N 3.12Å
378	H	85.5	Confident	87.5	Confident	67 Å²	67	81 Å²	81	31%	0.31	40%	0.4	S	S	.	.	H	α-helix	trans	-80.3	-40	-179.7	-56.1	-59.3	0	0	0	111.9	C358 Q360 H374 E375 R376 G380	C358-H378 PolarHBondContact SG-NE2 3.29Å; C358-H378 VanDerWaalsContact SG-NE2 3.42Å; Q360-H378 HydrophobicContact CB-CB 4.45Å; H374-H378 AromaticContact CD2-NE2 3.93Å; H374-H378 AromaticContact CE1-NE2 3.54Å; H374-H378 AromaticContact NE2-CD2 3.84Å; H374-H378 AromaticContact NE2-CE1 3.98Å; H374-H378 AromaticContact NE2-NE2 3.04Å; H374-H378 PolarHBondContact NE2-NE2 2.85Å; E375-H378 PolarHBondContact O-N 3.29Å; R376-H378 VanDerWaalsContact C-N 3.33Å; H378-G380 PolarHBondContact O-N 2.71Å
379	T	85.2	Confident	87.7	Confident	77 Å²	77	78.5 Å²	78.5	47%	0.472	39%	0.393	S	S	.	.	H	α-helix	trans	-75.7	-13.1	177	64	0	0	0	0	113.2	E375 R376 E381	E375-T379 PolarHBondContact O-N 3.27Å; E375-T379 VanDerWaalsContact O-N 3.08Å; R376-T379 WeakPolarHBondContact CA-OG1 3.39Å; T379-E381 PolarHBondContact O-N 3.23Å; T379-E381 WeakPolarHBondContact OG1-CG 3.3Å; T379-E381 PolarHBondContact OG1-N 3.2Å
380	G	83.9	Confident	87.6	Confident	45 Å²	45	79.7 Å²	79.7	46%	0.464	40%	0.399	S	S	.	.			trans	69.9	5.8	-175.1	0	0	0	0	0	114.1	R376 H378 K382	R376-G380 WeakPolarHBondContact O-CA 3.47Å; R376-G380 PolarHBondContact O-N 3.47Å; R376-G380 VanDerWaalsContact O-N 3.07Å; H378-G380 PolarHBondContact O-N 2.71Å; G380-K382 PolarHBondContact O-N 2.74Å
381	E	86.8	Confident	87.7	Confident	109 Å²	109	79.6 Å²	79.6	51%	0.509	40%	0.398	S	S	.	.			trans	-60.4	123.2	-179.8	-79.2	-177.4	-174.7	0	0	111.5	R376 T379 P383	R376-E381 HydrophobicContact CB-CB 4.44Å; R376-E381 HydrophobicContact CG-CB 4.49Å; R376-E381 PolarHBondContact O-N 3.1Å; T379-E381 PolarHBondContact O-N 3.23Å; T379-E381 WeakPolarHBondContact OG1-CG 3.3Å; T379-E381 PolarHBondContact OG1-N 3.2Å; E381-P383 WeakPolarHBondContact O-CD 3.41Å
382	K	89.2	Confident	87.8	Confident	114 Å²	114	80.4 Å²	80.4	50%	0.496	41%	0.407	S	S	.	.			trans	-123.2	79.9	176.9	-69.7	168.5	-179	-179.2	0	110	G380 Y384 A392 F393 V394	G380-K382 PolarHBondContact O-N 2.74Å; K382-Y384 PolarHBondContact O-N 3.47Å; K382-A392 HydrophobicContact CB-CB 3.52Å; K382-A392 HydrophobicContact CD-CB 4.14Å; K382-A392 WeakPolarHBondContact CD-O 2.86Å; K382-A392 HydrophobicContact CG-CB 4.44Å; K382-F393 CarbonylContact C-O 3.55Å; K382-F393 WeakPolarHBondContact CA-O 3.18Å; K382-V394 HydrophobicContact CG-CG2 3.83Å
383	P	89.7	Confident	87.9	Confident	67 Å²	67	77.9 Å²	77.9	44%	0.435	40%	0.395	S	S	.	.			trans	-66.1	-20.7	-172.7	-23.2	35.6	0	0	0	114.1	E381	E381-P383 WeakPolarHBondContact O-CD 3.41Å
384	Y	91.8	Very high	87.9	Confident	67 Å²	67	74.5 Å²	74.5	26%	0.263	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	99.4	-169.9	-52.7	-73.9	0	0	0	110	K382 A392 F393 V394 E396	K382-Y384 PolarHBondContact O-N 3.47Å; Y384-A392 CarbonylContact O-C 3.56Å; Y384-A392 WeakPolarHBondContact O-CA 3.42Å; Y384-F393 WeakPolarHBondContact CD2-O 3.39Å; Y384-F393 PolarHBondContact N-O 3.31Å; Y384-F393 PolarHBondContact O-N 2.92Å; Y384-V394 WeakPolarHBondContact CD2-O 3.44Å; Y384-V394 VanDerWaalsContact CE2-O 3.32Å; Y384-V394 WeakPolarHBondContact CE2-O 3.5Å; Y384-E396 HydrophobicContact CD1-CB 3.95Å; Y384-E396 WeakPolarHBondContact CD1-OE2 3.39Å; Y384-E396 HydrophobicContact CD2-CB 4.45Å; Y384-E396 VanDerWaalsContact CD2-N 3.26Å; Y384-E396 HydrophobicContact CE1-CB 3.75Å; Y384-E396 HydrophobicContact CE1-CG 4.44Å; Y384-E396 WeakPolarHBondContact CE1-OE2 3.35Å; Y384-E396 HydrophobicContact CE2-CB 4.27Å; Y384-E396 VanDerWaalsContact CE2-N 3.31Å; Y384-E396 HydrophobicContact CG-CB 4.27Å
385	K	89.4	Confident	87.8	Confident	140 Å²	140	76.8 Å²	76.8	61%	0.609	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.5	143.9	-178.9	-62.6	-177.4	-178.7	179.3	0	111.2	A392 L399	K385-A392 HydrophobicContact CG-CB 4Å; K385-L399 WeakPolarHBondContact O-CD2 3.46Å
386	C	92.1	Very high	87.9	Confident	1 Å²	1	77.2 Å²	77.2	1%	0.007	39%	0.393	C	S	.	.			trans	-88.9	121	172.2	-178.4	0	0	0	0	110.2	Q388 N390 K391 F393 L399	C386-Q388 PolarHBondContact O-N 3.39Å; C386-N390 WeakPolarHBondContact O-CA 3.4Å; C386-N390 PolarHBondContact O-N 3.3Å; C386-K391 WeakPolarHBondContact CB-O 3.42Å; C386-K391 PolarHBondContact N-O 3.1Å; C386-F393 HydrophobicContact CB-CE2 4.45Å; C386-L399 HydrophobicContact CB-CD1 3.59Å
387	D	88.9	Confident	87.8	Confident	126 Å²	126	78.1 Å²	78.1	67%	0.674	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-20.2	-177.2	-44.3	-55.2	0	0	0	113.1	K403	D387-K403 IonicContact OD2-NZ 3.32Å; D387-K403 PolarHBondContact OD2-NZ 3.34Å
388	Q	87.5	Confident	88.1	Confident	131 Å²	131	80 Å²	80	61%	0.612	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-24	-175.6	-64.5	-178.6	4	0	0	114.3	C386 H406	C386-Q388 PolarHBondContact O-N 3.39Å; Q388-H406 PolarHBondContact OE1-CD2 3.21Å
389	C	89.1	Confident	88.3	Confident	47 Å²	47	77.2 Å²	77.2	32%	0.318	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.1	11.2	-180	70.6	0	0	0	0	114.2	K391 H402 H406	C389-K391 PolarHBondContact O-N 3.44Å; C389-H402 PolarHBondContact SG-NE2 2.96Å; C389-H406 PolarHBondContact SG-NE2 3.31Å; C389-H406 VanDerWaalsContact SG-NE2 3.39Å
390	N	84.4	Confident	88.4	Confident	131 Å²	131	77.8 Å²	77.8	70%	0.701	39%	0.394	S	S	*	.			trans	55.1	8.5	-178.6	-69.8	-43.4	0	0	0	115.8	C386 A392	C386-N390 WeakPolarHBondContact O-CA 3.4Å; C386-N390 PolarHBondContact O-N 3.3Å; N390-A392 PolarHBondContact O-N 3.4Å
391	K	87.9	Confident	88.5	Confident	128 Å²	128	77.5 Å²	77.5	56%	0.557	38%	0.382	S	S	*	.			trans	-65.1	129.6	174.3	-74.7	-176.3	-178.3	177	0	110.2	C386 C389 F393	C386-K391 WeakPolarHBondContact CB-O 3.42Å; C386-K391 PolarHBondContact N-O 3.1Å; C389-K391 PolarHBondContact O-N 3.44Å; K391-F393 HydrophobicContact CB-CE2 3.89Å; K391-F393 HydrophobicContact CB-CZ 4.01Å; K391-F393 WeakPolarHBondContact O-CE2 3.5Å
392	A	90.5	Very high	88.6	Confident	32 Å²	32	73.2 Å²	73.2	26%	0.264	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	144.8	-179.4	0	0	0	0	0	111.7	K382 Y384 K385 N390	K382-A392 HydrophobicContact CB-CB 3.52Å; K382-A392 HydrophobicContact CD-CB 4.14Å; K382-A392 WeakPolarHBondContact CD-O 2.86Å; K382-A392 HydrophobicContact CG-CB 4.44Å; Y384-A392 CarbonylContact O-C 3.56Å; Y384-A392 WeakPolarHBondContact O-CA 3.42Å; K385-A392 HydrophobicContact CG-CB 4Å; N390-A392 PolarHBondContact O-N 3.4Å
393	F	88.9	Confident	88.5	Confident	42 Å²	42	71 Å²	71	18%	0.184	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	148.2	-177.1	-59	-89.3	0	0	0	111.2	K382 Y384 C386 K391 Y395 L399 H402	K382-F393 CarbonylContact C-O 3.55Å; K382-F393 WeakPolarHBondContact CA-O 3.18Å; Y384-F393 WeakPolarHBondContact CD2-O 3.39Å; Y384-F393 PolarHBondContact N-O 3.31Å; Y384-F393 PolarHBondContact O-N 2.92Å; C386-F393 HydrophobicContact CB-CE2 4.45Å; K391-F393 HydrophobicContact CB-CE2 3.89Å; K391-F393 HydrophobicContact CB-CZ 4.01Å; K391-F393 WeakPolarHBondContact O-CE2 3.5Å; F393-Y395 VanDerWaalsContact C-N 3.3Å; F393-L399 HydrophobicContact CB-CB 4.44Å; F393-L399 HydrophobicContact CD2-CB 3.95Å; F393-L399 HydrophobicContact CD2-CD1 3.91Å; F393-L399 HydrophobicContact CE2-CD1 4.06Å; F393-L399 HydrophobicContact CG-CB 4.38Å; F393-H402 HydrophobicContact CE1-CB 4.07Å; F393-H402 HydrophobicContact CE2-CB 3.96Å; F393-H402 AromaticContact CE2-CD2 3.24Å; F393-H402 WeakPolarHBondContact CE2-CD2 3.27Å; F393-H402 AromaticContact CE2-CG 3.73Å; F393-H402 AromaticContact CE2-NE2 3.97Å; F393-H402 HydrophobicContact CZ-CB 3.52Å; F393-H402 AromaticContact CZ-CD2 3.27Å; F393-H402 WeakPolarHBondContact CZ-CD2 3.41Å; F393-H402 AromaticContact CZ-CG 3.3Å; F393-H402 AromaticContact CZ-NE2 3.87Å
394	V	87.3	Confident	88.4	Confident	25 Å²	25	70 Å²	70	15%	0.152	34%	0.342	C	S	.	.	S	Bend	trans	-71.8	-28	177.1	-178.8	0	0	0	0	111.6	R376 K382 Y384	R376-V394 HydrophobicContact CB-CG1 3.67Å; R376-V394 PolarHBondContact NH1-O 2.79Å; K382-V394 HydrophobicContact CG-CG2 3.83Å; Y384-V394 WeakPolarHBondContact CD2-O 3.44Å; Y384-V394 VanDerWaalsContact CE2-O 3.32Å; Y384-V394 WeakPolarHBondContact CE2-O 3.5Å
395	Y	86.3	Confident	88.1	Confident	58 Å²	58	71.1 Å²	71.1	23%	0.227	36%	0.355	C	S	.	.	S	Bend	trans	-127.7	139.5	-176.5	-58	-76.6	0	0	0	112	K373 F393 S397 Y398 L399	K373-Y395 HydrophobicContact CB-CE1 4.05Å; K373-Y395 HydrophobicContact CD-CE1 4.29Å; K373-Y395 HydrophobicContact CG-CE1 4.49Å; F393-Y395 VanDerWaalsContact C-N 3.3Å; Y395-S397 VanDerWaalsContact C-N 3.29Å; Y395-S397 PolarHBondContact O-N 3.14Å; Y395-Y398 AromaticContact CD2-CD2 3.71Å; Y395-Y398 HydrophobicContact CD2-CD2 3.71Å; Y395-Y398 AromaticContact CD2-CE2 3.39Å; Y395-Y398 HydrophobicContact CD2-CE2 3.39Å; Y395-Y398 HydrophobicContact CD2-CG 4.43Å; Y395-Y398 AromaticContact CD2-CZ 3.87Å; Y395-Y398 HydrophobicContact CE2-CE2 4.01Å; Y395-Y398 HydrophobicContact CG-CD2 4.43Å; Y395-Y398 HydrophobicContact CG-CE2 4.39Å; Y395-Y398 WeakPolarHBondContact O-CB 3.33Å; Y395-Y398 PolarHBondContact O-N 3.08Å; Y395-L399 PolarHBondContact O-N 3.28Å
396	E	88.8	Confident	87.8	Confident	72 Å²	72	67.9 Å²	67.9	34%	0.336	34%	0.343	S	S	.	.	H	α-helix	trans	-58.2	-40.6	175.8	-179.1	55.4	-154.9	0	0	112.3	Y384 Y398 L399 Q400	Y384-E396 HydrophobicContact CD1-CB 3.95Å; Y384-E396 WeakPolarHBondContact CD1-OE2 3.39Å; Y384-E396 HydrophobicContact CD2-CB 4.45Å; Y384-E396 VanDerWaalsContact CD2-N 3.26Å; Y384-E396 HydrophobicContact CE1-CB 3.75Å; Y384-E396 HydrophobicContact CE1-CG 4.44Å; Y384-E396 WeakPolarHBondContact CE1-OE2 3.35Å; Y384-E396 HydrophobicContact CE2-CB 4.27Å; Y384-E396 VanDerWaalsContact CE2-N 3.31Å; Y384-E396 HydrophobicContact CG-CB 4.27Å; E396-Y398 PolarHBondContact O-N 3.41Å; E396-L399 WeakPolarHBondContact O-CB 3.49Å; E396-L399 PolarHBondContact O-N 3.04Å; E396-L399 VanDerWaalsContact O-N 3.09Å; E396-Q400 HydrophobicContact CG-CG 4.39Å; E396-Q400 WeakPolarHBondContact O-CG 3.11Å; E396-Q400 PolarHBondContact O-N 3.39Å; E396-Q400 PolarHBondContact OE1-NE2 3.32Å
397	S	87.4	Confident	87.4	Confident	68 Å²	68	71.6 Å²	71.6	48%	0.476	37%	0.365	S	S	.	.	H	α-helix	trans	-60	-30.3	177.5	54.5	0	0	0	0	112.9	Y395 V401	Y395-S397 VanDerWaalsContact C-N 3.29Å; Y395-S397 PolarHBondContact O-N 3.14Å; S397-V401 WeakPolarHBondContact O-CB 3.43Å; S397-V401 WeakPolarHBondContact O-CG2 3.35Å; S397-V401 PolarHBondContact O-N 3.35Å; S397-V401 VanDerWaalsContact O-N 3.09Å
398	Y	89.2	Confident	87	Confident	134 Å²	134	67.9 Å²	67.9	53%	0.525	36%	0.357	S	S	.	.	H	α-helix	trans	-76.1	-38.7	176.9	-66.1	-5.9	0	0	0	111.3	Y395 E396 V401 H402	Y395-Y398 AromaticContact CD2-CD2 3.71Å; Y395-Y398 HydrophobicContact CD2-CD2 3.71Å; Y395-Y398 AromaticContact CD2-CE2 3.39Å; Y395-Y398 HydrophobicContact CD2-CE2 3.39Å; Y395-Y398 HydrophobicContact CD2-CG 4.43Å; Y395-Y398 AromaticContact CD2-CZ 3.87Å; Y395-Y398 HydrophobicContact CE2-CE2 4.01Å; Y395-Y398 HydrophobicContact CG-CD2 4.43Å; Y395-Y398 HydrophobicContact CG-CE2 4.39Å; Y395-Y398 WeakPolarHBondContact O-CB 3.33Å; Y395-Y398 PolarHBondContact O-N 3.08Å; E396-Y398 PolarHBondContact O-N 3.41Å; Y398-V401 PolarHBondContact O-N 3.36Å; Y398-H402 VanDerWaalsContact O-CB 3.24Å; Y398-H402 WeakPolarHBondContact O-CB 3.36Å; Y398-H402 PolarHBondContact O-N 3.16Å
399	L	90.6	Very high	86.8	Confident	8 Å²	8	66.8 Å²	66.8	4%	0.042	35%	0.352	C	S	.	.	H	α-helix	trans	-59.6	-47.7	170.8	174.3	61	0	0	0	110.8	K385 C386 F393 Y395 E396 V401 H402 K403	K385-L399 WeakPolarHBondContact O-CD2 3.46Å; C386-L399 HydrophobicContact CB-CD1 3.59Å; F393-L399 HydrophobicContact CB-CB 4.44Å; F393-L399 HydrophobicContact CD2-CB 3.95Å; F393-L399 HydrophobicContact CD2-CD1 3.91Å; F393-L399 HydrophobicContact CE2-CD1 4.06Å; F393-L399 HydrophobicContact CG-CB 4.38Å; Y395-L399 PolarHBondContact O-N 3.28Å; E396-L399 WeakPolarHBondContact O-CB 3.49Å; E396-L399 PolarHBondContact O-N 3.04Å; E396-L399 VanDerWaalsContact O-N 3.09Å; L399-V401 VanDerWaalsContact C-N 3.34Å; L399-V401 PolarHBondContact O-N 2.86Å; L399-H402 CarbonylContact O-C 3.3Å; L399-H402 WeakPolarHBondContact O-CA 3.41Å; L399-H402 WeakPolarHBondContact O-CB 3.42Å; L399-H402 PolarHBondContact O-N 3.22Å; L399-K403 HydrophobicContact CD1-CG 4.22Å; L399-K403 WeakPolarHBondContact O-CG 3.44Å; L399-K403 PolarHBondContact O-N 3.4Å
400	Q	87.8	Confident	86.7	Confident	89 Å²	89	70.3 Å²	70.3	42%	0.416	36%	0.362	S	S	.	.	H	α-helix	trans	-60.4	-42.6	179.1	-68.3	-59.6	-30.6	0	0	112.6	E396 H402 K403	E396-Q400 HydrophobicContact CG-CG 4.39Å; E396-Q400 WeakPolarHBondContact O-CG 3.11Å; E396-Q400 PolarHBondContact O-N 3.39Å; E396-Q400 PolarHBondContact OE1-NE2 3.32Å; Q400-H402 VanDerWaalsContact C-N 3.3Å; Q400-H402 PolarHBondContact O-N 3.04Å; Q400-K403 PolarHBondContact O-N 2.94Å
401	V	86	Confident	86.8	Confident	38 Å²	38	67.6 Å²	67.6	23%	0.23	35%	0.351	C	S	.	.	H	α-helix	trans	-68.8	-32	175.5	170.9	0	0	0	0	111.9	S397 Y398 L399 R423	S397-V401 WeakPolarHBondContact O-CB 3.43Å; S397-V401 WeakPolarHBondContact O-CG2 3.35Å; S397-V401 PolarHBondContact O-N 3.35Å; S397-V401 VanDerWaalsContact O-N 3.09Å; Y398-V401 PolarHBondContact O-N 3.36Å; L399-V401 VanDerWaalsContact C-N 3.34Å; L399-V401 PolarHBondContact O-N 2.86Å; V401-R423 HydrophobicContact CG1-CG 3.76Å
402	H	88.3	Confident	86.9	Confident	20 Å²	20	65.3 Å²	65.3	9%	0.093	34%	0.339	C	S	.	.	H	α-helix	trans	-72.1	-38	174.4	171	56.6	0	0	0	112.4	C389 F393 Y398 L399 Q400 K404 T405 H406	C389-H402 PolarHBondContact SG-NE2 2.96Å; F393-H402 HydrophobicContact CE1-CB 4.07Å; F393-H402 HydrophobicContact CE2-CB 3.96Å; F393-H402 AromaticContact CE2-CD2 3.24Å; F393-H402 WeakPolarHBondContact CE2-CD2 3.27Å; F393-H402 AromaticContact CE2-CG 3.73Å; F393-H402 AromaticContact CE2-NE2 3.97Å; F393-H402 HydrophobicContact CZ-CB 3.52Å; F393-H402 AromaticContact CZ-CD2 3.27Å; F393-H402 WeakPolarHBondContact CZ-CD2 3.41Å; F393-H402 AromaticContact CZ-CG 3.3Å; F393-H402 AromaticContact CZ-NE2 3.87Å; Y398-H402 VanDerWaalsContact O-CB 3.24Å; Y398-H402 WeakPolarHBondContact O-CB 3.36Å; Y398-H402 PolarHBondContact O-N 3.16Å; L399-H402 CarbonylContact O-C 3.3Å; L399-H402 WeakPolarHBondContact O-CA 3.41Å; L399-H402 WeakPolarHBondContact O-CB 3.42Å; L399-H402 PolarHBondContact O-N 3.22Å; Q400-H402 VanDerWaalsContact C-N 3.3Å; Q400-H402 PolarHBondContact O-N 3.04Å; H402-K404 PolarHBondContact O-N 3.42Å; H402-K404 VanDerWaalsContact O-N 3.08Å; H402-T405 PolarHBondContact ND1-OG1 3.44Å; H402-T405 WeakPolarHBondContact O-CB 3.37Å; H402-T405 PolarHBondContact O-N 2.7Å; H402-T405 PolarHBondContact O-OG1 3.5Å; H402-H406 AromaticContact CE1-NE2 3.4Å; H402-H406 PolarHBondContact CE1-NE2 2.86Å; H402-H406 AromaticContact NE2-NE2 3.26Å; H402-H406 PolarHBondContact NE2-NE2 3.19Å
403	K	87.1	Confident	86.7	Confident	67 Å²	67	70.6 Å²	70.6	29%	0.291	36%	0.356	S	S	.	.	H	α-helix	trans	-54.3	-32.9	175.6	-75.6	-174.1	172.5	-167.8	0	112	D387 L399 Q400 T405 H406 T407	D387-K403 IonicContact OD2-NZ 3.32Å; D387-K403 PolarHBondContact OD2-NZ 3.34Å; L399-K403 HydrophobicContact CD1-CG 4.22Å; L399-K403 WeakPolarHBondContact O-CG 3.44Å; L399-K403 PolarHBondContact O-N 3.4Å; Q400-K403 PolarHBondContact O-N 2.94Å; K403-T405 PolarHBondContact O-N 2.77Å; K403-H406 PolarHBondContact O-N 2.72Å; K403-T407 PolarHBondContact O-N 3.25Å
404	K	87.1	Confident	86.8	Confident	47 Å²	47	68.7 Å²	68.7	20%	0.204	35%	0.348	C	S	.	.	H	α-helix	trans	-62.3	-22.4	173.7	-60.1	-178.2	-180	-173.2	0	114.7	H402 H406 T407 G408 E409	H402-K404 PolarHBondContact O-N 3.42Å; H402-K404 VanDerWaalsContact O-N 3.08Å; K404-H406 VanDerWaalsContact C-N 3.28Å; K404-T407 WeakPolarHBondContact CA-OG1 3.29Å; K404-G408 PolarHBondContact O-N 2.84Å; K404-E409 PolarHBondContact O-N 2.6Å
405	T	84.7	Confident	86.8	Confident	89 Å²	89	74.6 Å²	74.6	55%	0.546	38%	0.379	S	S	.	.	H	α-helix	trans	-74	-24.3	175.7	65.2	0	0	0	0	112.2	H402 K403	H402-T405 PolarHBondContact ND1-OG1 3.44Å; H402-T405 WeakPolarHBondContact O-CB 3.37Å; H402-T405 PolarHBondContact O-N 2.7Å; H402-T405 PolarHBondContact O-OG1 3.5Å; K403-T405 PolarHBondContact O-N 2.77Å
406	H	84.5	Confident	86.8	Confident	73 Å²	73	77.3 Å²	77.3	34%	0.338	39%	0.394	S	S	.	.	H	α-helix	trans	-84	-40.6	175.6	-61.8	-67.6	0	0	0	112.1	Q388 C389 H402 K403 K404 G408	Q388-H406 PolarHBondContact OE1-CD2 3.21Å; C389-H406 PolarHBondContact SG-NE2 3.31Å; C389-H406 VanDerWaalsContact SG-NE2 3.39Å; H402-H406 AromaticContact CE1-NE2 3.4Å; H402-H406 PolarHBondContact CE1-NE2 2.86Å; H402-H406 AromaticContact NE2-NE2 3.26Å; H402-H406 PolarHBondContact NE2-NE2 3.19Å; K403-H406 PolarHBondContact O-N 2.72Å; K404-H406 VanDerWaalsContact C-N 3.28Å; H406-G408 VanDerWaalsContact C-N 3.27Å; H406-G408 PolarHBondContact O-N 3.31Å
407	T	83.3	Confident	86.8	Confident	79 Å²	79	76.5 Å²	76.5	49%	0.485	40%	0.395	S	S	.	.	H	α-helix	trans	-77.5	-14	178.5	61.6	0	0	0	0	113.1	K403 K404 E409	K403-T407 PolarHBondContact O-N 3.25Å; K404-T407 WeakPolarHBondContact CA-OG1 3.29Å; T407-E409 PolarHBondContact O-N 2.95Å; T407-E409 WeakPolarHBondContact OG1-CB 3.32Å; T407-E409 WeakPolarHBondContact OG1-CG 3.34Å; T407-E409 PolarHBondContact OG1-N 2.69Å
408	G	81.4	Confident	86.7	Confident	48 Å²	48	75.9 Å²	75.9	50%	0.495	40%	0.399	S	S	.	.			trans	69	5.8	-173.9	0	0	0	0	0	113.8	K404 H406 K410	K404-G408 PolarHBondContact O-N 2.84Å; H406-G408 VanDerWaalsContact C-N 3.27Å; H406-G408 PolarHBondContact O-N 3.31Å; G408-K410 PolarHBondContact O-N 3.07Å
409	E	83.1	Confident	86.5	Confident	108 Å²	108	75.6 Å²	75.6	51%	0.505	40%	0.401	S	S	.	.			trans	-60.5	124	-177.7	-79.5	179.4	-165.5	0	0	111.6	K404 T407 P411	K404-E409 PolarHBondContact O-N 2.6Å; T407-E409 PolarHBondContact O-N 2.95Å; T407-E409 WeakPolarHBondContact OG1-CB 3.32Å; T407-E409 WeakPolarHBondContact OG1-CG 3.34Å; T407-E409 PolarHBondContact OG1-N 2.69Å; E409-P411 WeakPolarHBondContact O-CD 3.06Å
410	K	86.6	Confident	86.5	Confident	121 Å²	121	76.7 Å²	76.7	53%	0.526	41%	0.411	S	S	.	.			trans	-123.2	76.5	176.3	-69.9	167.8	178.5	-176.3	0	110.1	G408 Y412 A420 F421	G408-K410 PolarHBondContact O-N 3.07Å; K410-Y412 PolarHBondContact O-N 3.5Å; K410-A420 HydrophobicContact CB-CB 3.5Å; K410-A420 HydrophobicContact CD-CB 4.17Å; K410-A420 WeakPolarHBondContact CD-O 3.38Å; K410-A420 HydrophobicContact CG-CB 4.43Å; K410-F421 CarbonylContact C-O 3.53Å; K410-F421 WeakPolarHBondContact CA-O 3.43Å
411	P	86.7	Confident	86.4	Confident	73 Å²	73	74.4 Å²	74.4	47%	0.474	40%	0.4	S	S	.	.			trans	-66.5	-21	-172.9	-21.2	33.9	0	0	0	113.8	E409 K413	E409-P411 WeakPolarHBondContact O-CD 3.06Å; P411-K413 PolarHBondContact O-N 3.41Å
412	Y	89.1	Confident	86.4	Confident	81 Å²	81	73.9 Å²	73.9	32%	0.318	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	94.4	-172.6	-55.2	-75.3	0	0	0	109.9	K410 A420 F421 H424	K410-Y412 PolarHBondContact O-N 3.5Å; Y412-A420 CarbonylContact O-C 3.57Å; Y412-A420 WeakPolarHBondContact O-CA 3.37Å; Y412-F421 WeakPolarHBondContact CB-O 3.43Å; Y412-F421 WeakPolarHBondContact CD2-O 3.05Å; Y412-F421 PolarHBondContact N-O 3.49Å; Y412-F421 VanDerWaalsContact N-O 3.15Å; Y412-F421 PolarHBondContact O-N 3.21Å; Y412-H424 HydrophobicContact CD1-CB 3.93Å; Y412-H424 HydrophobicContact CD2-CB 4.47Å; Y412-H424 VanDerWaalsContact CD2-N 3.33Å; Y412-H424 HydrophobicContact CE1-CB 3.73Å; Y412-H424 HydrophobicContact CE2-CB 4.28Å; Y412-H424 HydrophobicContact CG-CB 4.29Å
413	K	86.9	Confident	86.3	Confident	142 Å²	142	78.2 Å²	78.2	62%	0.617	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.7	140	178	-63.7	-175.3	179.3	-179.7	0	111.3	P411 A420	P411-K413 PolarHBondContact O-N 3.41Å; K413-A420 HydrophobicContact CG-CB 3.92Å
414	C	90.9	Very high	86.3	Confident	2 Å²	2	80 Å²	80	1%	0.014	42%	0.424	C	S	.	.			trans	-82	123.2	168.2	-171.9	0	0	0	0	109	E416 G418 K419 L427 H434	C414-E416 VanDerWaalsContact C-N 3.25Å; C414-E416 PolarHBondContact O-N 2.96Å; C414-G418 WeakPolarHBondContact O-CA 3.43Å; C414-G418 PolarHBondContact O-N 3.09Å; C414-K419 WeakPolarHBondContact CB-O 3.35Å; C414-K419 PolarHBondContact N-O 2.87Å; C414-L427 HydrophobicContact CB-CD1 3.69Å; C414-H434 PolarHBondContact SG-NE2 3.22Å
415	N	87.8	Confident	86.2	Confident	149 Å²	149	81 Å²	81	80%	0.797	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-21.7	-179.8	-63.7	-6.4	0	0	0	112.3
416	E	86.4	Confident	86.3	Confident	116 Å²	116	81.2 Å²	81.2	54%	0.542	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-28.9	-175.2	-68.6	161.7	-148.4	0	0	113.3	C414 H434	C414-E416 VanDerWaalsContact C-N 3.25Å; C414-E416 PolarHBondContact O-N 2.96Å; E416-H434 WeakPolarHBondContact OE2-CB 3.43Å; E416-H434 IonicContact OE2-CD2 2.79Å; E416-H434 PolarHBondContact OE2-CD2 3.09Å; E416-H434 IonicContact OE2-CG 3.48Å; E416-H434 IonicContact OE2-ND1 3.81Å
417	C	87.6	Confident	86.4	Confident	54 Å²	54	78.4 Å²	78.4	37%	0.365	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.7	8.8	179.1	70.9	0	0	0	0	114.9	K419 H430 H434	C417-K419 PolarHBondContact O-N 3.23Å; C417-H430 PolarHBondContact SG-NE2 2.88Å; C417-H434 VanDerWaalsContact SG-CE1 3.52Å; C417-H434 PolarHBondContact SG-NE2 3.42Å
418	G	84.8	Confident	86.5	Confident	55 Å²	55	81.6 Å²	81.6	57%	0.567	43%	0.426	S	S	*	.			trans	70	-7.6	179.4	0	0	0	0	0	115.6	C414 A420	C414-G418 WeakPolarHBondContact O-CA 3.43Å; C414-G418 PolarHBondContact O-N 3.09Å; G418-A420 PolarHBondContact O-N 3.4Å
419	K	86.5	Confident	86.6	Confident	129 Å²	129	82.1 Å²	82.1	56%	0.561	42%	0.42	S	S	*	.			trans	-62.3	129.7	-178.3	-73.5	-178	-177.4	174.5	0	111.4	C414 C417 F421	C414-K419 WeakPolarHBondContact CB-O 3.35Å; C414-K419 PolarHBondContact N-O 2.87Å; C417-K419 PolarHBondContact O-N 3.23Å; K419-F421 HydrophobicContact CB-CE2 3.92Å; K419-F421 HydrophobicContact CB-CZ 4.08Å; K419-F421 WeakPolarHBondContact O-CE2 3.48Å
420	A	89.2	Confident	86.7	Confident	30 Å²	30	78 Å²	78	25%	0.248	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	143.4	-178	0	0	0	0	0	111.9	K410 Y412 K413 G418	K410-A420 HydrophobicContact CB-CB 3.5Å; K410-A420 HydrophobicContact CD-CB 4.17Å; K410-A420 WeakPolarHBondContact CD-O 3.38Å; K410-A420 HydrophobicContact CG-CB 4.43Å; Y412-A420 CarbonylContact O-C 3.57Å; Y412-A420 WeakPolarHBondContact O-CA 3.37Å; K413-A420 HydrophobicContact CG-CB 3.92Å; G418-A420 PolarHBondContact O-N 3.4Å
421	F	86.6	Confident	86.7	Confident	42 Å²	42	76.3 Å²	76.3	18%	0.184	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	146.2	-178.1	-58.2	-91.5	0	0	0	111.3	K410 Y412 K419 R423 H426 L427 H430	K410-F421 CarbonylContact C-O 3.53Å; K410-F421 WeakPolarHBondContact CA-O 3.43Å; Y412-F421 WeakPolarHBondContact CB-O 3.43Å; Y412-F421 WeakPolarHBondContact CD2-O 3.05Å; Y412-F421 PolarHBondContact N-O 3.49Å; Y412-F421 VanDerWaalsContact N-O 3.15Å; Y412-F421 PolarHBondContact O-N 3.21Å; K419-F421 HydrophobicContact CB-CE2 3.92Å; K419-F421 HydrophobicContact CB-CZ 4.08Å; K419-F421 WeakPolarHBondContact O-CE2 3.48Å; F421-R423 VanDerWaalsContact C-N 3.29Å; F421-R423 PolarHBondContact O-N 3.29Å; F421-H426 HydrophobicContact CB-CB 4.26Å; F421-H426 HydrophobicContact CD1-CB 3.87Å; F421-H426 HydrophobicContact CG-CB 4.3Å; F421-L427 HydrophobicContact CB-CB 4.42Å; F421-L427 HydrophobicContact CD2-CB 3.95Å; F421-L427 HydrophobicContact CD2-CD1 3.88Å; F421-L427 HydrophobicContact CE2-CD1 4.02Å; F421-L427 HydrophobicContact CG-CB 4.35Å; F421-H430 HydrophobicContact CE1-CB 4.05Å; F421-H430 HydrophobicContact CE2-CB 3.95Å; F421-H430 AromaticContact CE2-CD2 3.23Å; F421-H430 WeakPolarHBondContact CE2-CD2 3.32Å; F421-H430 AromaticContact CE2-CG 3.69Å; F421-H430 AromaticContact CE2-NE2 3.94Å; F421-H430 HydrophobicContact CZ-CB 3.5Å; F421-H430 AromaticContact CZ-CD2 3.31Å; F421-H430 WeakPolarHBondContact CZ-CD2 3.49Å; F421-H430 AromaticContact CZ-CG 3.28Å; F421-H430 AromaticContact CZ-ND1 3.94Å; F421-H430 AromaticContact CZ-NE2 3.9Å
422	A	85.9	Confident	86.6	Confident	26 Å²	26	73.9 Å²	73.9	22%	0.215	38%	0.376	C	S	.	.	S	Bend	trans	-74.7	-18.5	175.6	0	0	0	0	0	113.1
423	R	85.9	Confident	86.3	Confident	111 Å²	111	73.5 Å²	73.5	42%	0.419	38%	0.382	S	S	.	.	S	Bend	trans	-131.2	137.7	-177.2	-61.1	179.9	-173.8	-175.4	-9.2	111.4	V401 F421 S425 H426 L427	V401-R423 HydrophobicContact CG1-CG 3.76Å; F421-R423 VanDerWaalsContact C-N 3.29Å; F421-R423 PolarHBondContact O-N 3.29Å; R423-S425 VanDerWaalsContact C-N 3.31Å; R423-S425 PolarHBondContact O-N 2.8Å; R423-H426 PolarHBondContact O-N 3.18Å; R423-L427 PolarHBondContact O-N 3.16Å
424	H	86.8	Confident	86	Confident	106 Å²	106	70.3 Å²	70.3	49%	0.491	37%	0.369	S	S	.	.	H	α-helix	trans	-60.6	-37.4	176.1	-178.6	-96.7	0	0	0	113	Y412 H426 L427 K428	Y412-H424 HydrophobicContact CD1-CB 3.93Å; Y412-H424 HydrophobicContact CD2-CB 4.47Å; Y412-H424 VanDerWaalsContact CD2-N 3.33Å; Y412-H424 HydrophobicContact CE1-CB 3.73Å; Y412-H424 HydrophobicContact CE2-CB 4.28Å; Y412-H424 HydrophobicContact CG-CB 4.29Å; H424-H426 VanDerWaalsContact C-N 3.28Å; H424-H426 PolarHBondContact O-N 3.36Å; H424-L427 PolarHBondContact O-N 2.63Å; H424-K428 PolarHBondContact O-N 3.26Å
425	S	85.6	Confident	85.6	Confident	68 Å²	68	73.8 Å²	73.8	48%	0.476	39%	0.39	S	S	.	.	H	α-helix	trans	-60.5	-37.6	177.4	52.9	0	0	0	0	112.4	R423 K428 V429	R423-S425 VanDerWaalsContact C-N 3.31Å; R423-S425 PolarHBondContact O-N 2.8Å; S425-K428 PolarHBondContact O-N 3.32Å; S425-V429 VanDerWaalsContact O-CG2 3.29Å; S425-V429 WeakPolarHBondContact O-CG2 3.35Å; S425-V429 PolarHBondContact O-N 3.26Å
426	H	86.4	Confident	85.1	Confident	93 Å²	93	69.2 Å²	69.2	43%	0.431	38%	0.379	S	S	.	.	H	α-helix	trans	-70.1	-39.7	177.3	-64.1	-177.5	0	0	0	111.3	F421 R423 H424 V429 H430	F421-H426 HydrophobicContact CB-CB 4.26Å; F421-H426 HydrophobicContact CD1-CB 3.87Å; F421-H426 HydrophobicContact CG-CB 4.3Å; R423-H426 PolarHBondContact O-N 3.18Å; H424-H426 VanDerWaalsContact C-N 3.28Å; H424-H426 PolarHBondContact O-N 3.36Å; H426-V429 PolarHBondContact O-N 3.08Å; H426-H430 VanDerWaalsContact O-CB 3.26Å; H426-H430 WeakPolarHBondContact O-CB 3.31Å; H426-H430 PolarHBondContact O-N 3.21Å
427	L	87.9	Confident	84.7	Confident	13 Å²	13	69.4 Å²	69.4	7%	0.068	38%	0.379	C	S	.	.	H	α-helix	trans	-60.4	-45.8	172	174.2	62.4	0	0	0	111.2	C414 F421 R423 H424 V429 H430 K431	C414-L427 HydrophobicContact CB-CD1 3.69Å; F421-L427 HydrophobicContact CB-CB 4.42Å; F421-L427 HydrophobicContact CD2-CB 3.95Å; F421-L427 HydrophobicContact CD2-CD1 3.88Å; F421-L427 HydrophobicContact CE2-CD1 4.02Å; F421-L427 HydrophobicContact CG-CB 4.35Å; R423-L427 PolarHBondContact O-N 3.16Å; H424-L427 PolarHBondContact O-N 2.63Å; L427-V429 VanDerWaalsContact C-N 3.33Å; L427-V429 PolarHBondContact O-N 3.43Å; L427-H430 WeakPolarHBondContact O-CB 3.35Å; L427-H430 PolarHBondContact O-N 3.25Å; L427-H430 VanDerWaalsContact O-N 3.14Å; L427-K431 HydrophobicContact CD1-CG 4.36Å; L427-K431 WeakPolarHBondContact O-CG 3.17Å; L427-K431 PolarHBondContact O-N 2.91Å
428	K	85.5	Confident	84.5	Confident	147 Å²	147	72.7 Å²	72.7	64%	0.639	39%	0.388	S	S	*	.	H	α-helix	trans	-59.2	-44.4	178.7	-173.3	176.6	-178.8	178.7	0	111.9	H424 S425 H430 K431	H424-K428 PolarHBondContact O-N 3.26Å; S425-K428 PolarHBondContact O-N 3.32Å; K428-H430 VanDerWaalsContact C-N 3.33Å; K428-K431 PolarHBondContact O-N 3.41Å
429	V	83.3	Confident	84.5	Confident	59 Å²	59	73.6 Å²	73.6	36%	0.358	38%	0.383	S	S	.	.	H	α-helix	trans	-68.3	-34.7	176.9	172.4	0	0	0	0	111.6	S425 H426 L427 I432 Y451	S425-V429 VanDerWaalsContact O-CG2 3.29Å; S425-V429 WeakPolarHBondContact O-CG2 3.35Å; S425-V429 PolarHBondContact O-N 3.26Å; H426-V429 PolarHBondContact O-N 3.08Å; L427-V429 VanDerWaalsContact C-N 3.33Å; L427-V429 PolarHBondContact O-N 3.43Å; V429-I432 WeakPolarHBondContact O-CB 3.18Å; V429-I432 PolarHBondContact O-N 3.39Å; V429-Y451 HydrophobicContact CG1-CD1 3.49Å; V429-Y451 VanDerWaalsContact CG1-CD1 3.49Å; V429-Y451 HydrophobicContact CG1-CE1 3.26Å
430	H	85.6	Confident	84.5	Confident	21 Å²	21	71.3 Å²	71.3	10%	0.097	37%	0.372	C	S	.	.	H	α-helix	trans	-67.6	-38	174.6	169.4	56.4	0	0	0	112.6	C417 F421 H426 L427 K428 I432 T433 H434	C417-H430 PolarHBondContact SG-NE2 2.88Å; F421-H430 HydrophobicContact CE1-CB 4.05Å; F421-H430 HydrophobicContact CE2-CB 3.95Å; F421-H430 AromaticContact CE2-CD2 3.23Å; F421-H430 WeakPolarHBondContact CE2-CD2 3.32Å; F421-H430 AromaticContact CE2-CG 3.69Å; F421-H430 AromaticContact CE2-NE2 3.94Å; F421-H430 HydrophobicContact CZ-CB 3.5Å; F421-H430 AromaticContact CZ-CD2 3.31Å; F421-H430 WeakPolarHBondContact CZ-CD2 3.49Å; F421-H430 AromaticContact CZ-CG 3.28Å; F421-H430 AromaticContact CZ-ND1 3.94Å; F421-H430 AromaticContact CZ-NE2 3.9Å; H426-H430 VanDerWaalsContact O-CB 3.26Å; H426-H430 WeakPolarHBondContact O-CB 3.31Å; H426-H430 PolarHBondContact O-N 3.21Å; L427-H430 WeakPolarHBondContact O-CB 3.35Å; L427-H430 PolarHBondContact O-N 3.25Å; L427-H430 VanDerWaalsContact O-N 3.14Å; K428-H430 VanDerWaalsContact C-N 3.33Å; H430-I432 PolarHBondContact O-N 3.43Å; H430-I432 VanDerWaalsContact O-N 3.08Å; H430-T433 PolarHBondContact ND1-OG1 3.23Å; H430-T433 WeakPolarHBondContact O-CB 3.47Å; H430-T433 PolarHBondContact O-N 2.98Å; H430-T433 PolarHBondContact O-OG1 3.47Å; H430-H434 AromaticContact CE1-NE2 3.4Å; H430-H434 PolarHBondContact CE1-NE2 3.06Å; H430-H434 AromaticContact NE2-NE2 3.21Å; H430-H434 PolarHBondContact NE2-NE2 3.29Å
431	K	84.8	Confident	84.4	Confident	86 Å²	86	76.9 Å²	76.9	37%	0.374	39%	0.39	S	S	.	.	H	α-helix	trans	-56.6	-29.1	177.3	-74.2	-172.2	173.1	-161.5	0	113.4	L427 K428 T433 H434 T435	L427-K431 HydrophobicContact CD1-CG 4.36Å; L427-K431 WeakPolarHBondContact O-CG 3.17Å; L427-K431 PolarHBondContact O-N 2.91Å; K428-K431 PolarHBondContact O-N 3.41Å; K431-T433 PolarHBondContact O-N 3.44Å; K431-H434 PolarHBondContact O-N 2.96Å; K431-T435 PolarHBondContact O-N 3.42Å
432	I	85.1	Confident	84.6	Confident	22 Å²	22	75 Å²	75	11%	0.113	38%	0.382	C	S	.	.	H	α-helix	trans	-58.8	-29.4	174	-54.8	175.1	0	0	0	111.6	V429 H430 H434 T435 G436 E437 P439 A450	V429-I432 WeakPolarHBondContact O-CB 3.18Å; V429-I432 PolarHBondContact O-N 3.39Å; H430-I432 PolarHBondContact O-N 3.43Å; H430-I432 VanDerWaalsContact O-N 3.08Å; I432-H434 PolarHBondContact O-N 3.21Å; I432-T435 PolarHBondContact O-OG1 3.21Å; I432-G436 PolarHBondContact O-N 2.84Å; I432-E437 HydrophobicContact CG2-CB 4.41Å; I432-E437 WeakPolarHBondContact CG2-O 3.48Å; I432-P439 HydrophobicContact CD1-CG 4.32Å; I432-A450 HydrophobicContact CG2-CB 4.2Å
433	T	82.7	Confident	84.6	Confident	73 Å²	73	81.3 Å²	81.3	45%	0.448	41%	0.412	S	S	.	.	H	α-helix	trans	-71	-21.3	178	67.3	0	0	0	0	113.3	H430 K431 Y451	H430-T433 PolarHBondContact ND1-OG1 3.23Å; H430-T433 WeakPolarHBondContact O-CB 3.47Å; H430-T433 PolarHBondContact O-N 2.98Å; H430-T433 PolarHBondContact O-OG1 3.47Å; K431-T433 PolarHBondContact O-N 3.44Å; T433-Y451 VanDerWaalsContact CG2-OH 3.25Å; T433-Y451 WeakPolarHBondContact CG2-OH 3.23Å
434	H	81.9	Confident	84.6	Confident	74 Å²	74	82.2 Å²	82.2	34%	0.343	42%	0.421	S	S	.	.	H	α-helix	trans	-89	-41.9	176.5	-64.2	-58.7	0	0	0	111.8	C414 E416 C417 H430 K431 I432 G436	C414-H434 PolarHBondContact SG-NE2 3.22Å; E416-H434 WeakPolarHBondContact OE2-CB 3.43Å; E416-H434 IonicContact OE2-CD2 2.79Å; E416-H434 PolarHBondContact OE2-CD2 3.09Å; E416-H434 IonicContact OE2-CG 3.48Å; E416-H434 IonicContact OE2-ND1 3.81Å; C417-H434 VanDerWaalsContact SG-CE1 3.52Å; C417-H434 PolarHBondContact SG-NE2 3.42Å; H430-H434 AromaticContact CE1-NE2 3.4Å; H430-H434 PolarHBondContact CE1-NE2 3.06Å; H430-H434 AromaticContact NE2-NE2 3.21Å; H430-H434 PolarHBondContact NE2-NE2 3.29Å; K431-H434 PolarHBondContact O-N 2.96Å; I432-H434 PolarHBondContact O-N 3.21Å; H434-G436 PolarHBondContact O-N 3.48Å
435	T	81.1	Confident	84.7	Confident	76 Å²	76	80.2 Å²	80.2	47%	0.466	42%	0.419	S	S	.	.	H	α-helix	trans	-74.3	-18.5	179.1	62.4	0	0	0	0	112.7	K431 I432 E437	K431-T435 PolarHBondContact O-N 3.42Å; I432-T435 PolarHBondContact O-OG1 3.21Å; T435-E437 PolarHBondContact O-N 3.42Å; T435-E437 VanDerWaalsContact O-N 3.09Å; T435-E437 WeakPolarHBondContact OG1-CB 3.23Å; T435-E437 WeakPolarHBondContact OG1-CG 3.45Å; T435-E437 PolarHBondContact OG1-N 3.35Å
436	G	77.1	Confident	84.6	Confident	53 Å²	53	79.5 Å²	79.5	55%	0.546	42%	0.422	S	S	.	.			trans	66.9	5.6	-174.5	0	0	0	0	0	113.3	I432 H434	I432-G436 PolarHBondContact O-N 2.84Å; H434-G436 PolarHBondContact O-N 3.48Å
437	E	79.4	Confident	84.5	Confident	119 Å²	119	80.8 Å²	80.8	56%	0.556	43%	0.426	S	S	*	.			trans	-59	141.7	179.4	-74.8	178.8	-177.3	0	0	110.1	I432 T435 P439	I432-E437 HydrophobicContact CG2-CB 4.41Å; I432-E437 WeakPolarHBondContact CG2-O 3.48Å; T435-E437 PolarHBondContact O-N 3.42Å; T435-E437 VanDerWaalsContact O-N 3.09Å; T435-E437 WeakPolarHBondContact OG1-CB 3.23Å; T435-E437 WeakPolarHBondContact OG1-CG 3.45Å; T435-E437 PolarHBondContact OG1-N 3.35Å; E437-P439 HydrophobicContact CB-CG 4.47Å; E437-P439 WeakPolarHBondContact O-CD 3.28Å
438	K	83.3	Confident	84.4	Confident	124 Å²	124	81.6 Å²	81.6	54%	0.539	44%	0.435	S	S	.	.			trans	-121.9	78.1	175.4	-66.4	-177.3	-170.1	172.4	0	108.5	Y440 A448 L449	K438-Y440 PolarHBondContact O-N 2.82Å; K438-Y440 VanDerWaalsContact O-N 3.16Å; K438-A448 HydrophobicContact CB-CB 3.49Å; K438-A448 VanDerWaalsContact CB-CB 3.49Å; K438-A448 HydrophobicContact CD-CB 4.23Å; K438-A448 VanDerWaalsContact CD-O 3.3Å; K438-A448 WeakPolarHBondContact CD-O 3.48Å; K438-L449 CarbonylContact C-O 3.53Å; K438-L449 WeakPolarHBondContact CA-O 3.32Å
439	P	84.5	Confident	84.4	Confident	73 Å²	73	76.1 Å²	76.1	47%	0.474	41%	0.412	S	S	.	.			trans	-66.7	-20.9	-169	-20.4	33.4	0	0	0	113.3	I432 E437	I432-P439 HydrophobicContact CD1-CG 4.32Å; E437-P439 HydrophobicContact CB-CG 4.47Å; E437-P439 WeakPolarHBondContact O-CD 3.28Å
440	Y	86.7	Confident	84.4	Confident	82 Å²	82	74.6 Å²	74.6	32%	0.322	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	96.2	-172.5	-57.2	-79.9	0	0	0	109.7	K438 A448 L449 A450 H452	K438-Y440 PolarHBondContact O-N 2.82Å; K438-Y440 VanDerWaalsContact O-N 3.16Å; Y440-A448 CarbonylContact O-C 3.58Å; Y440-A448 WeakPolarHBondContact O-CA 3.38Å; Y440-L449 WeakPolarHBondContact CB-O 3.14Å; Y440-L449 PolarHBondContact N-O 3.31Å; Y440-L449 PolarHBondContact O-N 2.94Å; Y440-A450 WeakPolarHBondContact CD2-O 3.25Å; Y440-A450 WeakPolarHBondContact CE2-O 3.33Å; Y440-H452 HydrophobicContact CD1-CB 3.99Å; Y440-H452 HydrophobicContact CE1-CB 3.7Å; Y440-H452 HydrophobicContact CE2-CB 4.49Å; Y440-H452 HydrophobicContact CG-CB 4.49Å
441	K	86.3	Confident	84.3	Confident	146 Å²	146	77.5 Å²	77.5	64%	0.635	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.7	135.8	177.1	-65.6	-175.6	179.5	-177.4	0	111.2	A448	K441-A448 HydrophobicContact CG-CB 4.03Å
442	C	90.3	Very high	84.2	Confident	2 Å²	2	77.9 Å²	77.9	1%	0.014	42%	0.42	C	S	.	.			trans	-77.6	122.5	169.9	-175	0	0	0	0	109.9	Q444 C445 G446 K447 L455 H462	C442-Q444 PolarHBondContact O-N 3.42Å; C442-C445 VanDerWaalsContact SG-SG 3.69Å; C442-G446 WeakPolarHBondContact O-CA 3.39Å; C442-G446 PolarHBondContact O-N 2.65Å; C442-K447 HydrophobicContact CB-CB 4.48Å; C442-K447 WeakPolarHBondContact CB-O 3.39Å; C442-K447 PolarHBondContact N-O 2.94Å; C442-L455 HydrophobicContact CB-CD1 3.76Å; C442-H462 PolarHBondContact SG-NE2 3.15Å; C442-H462 VanDerWaalsContact SG-NE2 3.37Å
443	N	87.3	Confident	84.2	Confident	159 Å²	159	80.6 Å²	80.6	85%	0.85	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-19.8	-180	-63.6	-13	0	0	0	113.3
444	Q	86.1	Confident	84.3	Confident	130 Å²	130	79.9 Å²	79.9	61%	0.607	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-34.3	-176.6	-68.8	174.7	-3.8	0	0	113.3	C442 H462	C442-Q444 PolarHBondContact O-N 3.42Å; Q444-H462 PolarHBondContact OE1-CD2 2.88Å
445	C	87.3	Confident	84.6	Confident	65 Å²	65	77 Å²	77	44%	0.439	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.9	6.3	-178	69.8	0	0	0	0	114.2	C442 K447 H458 H462	C442-C445 VanDerWaalsContact SG-SG 3.69Å; C445-K447 PolarHBondContact O-N 3.35Å; C445-K447 VanDerWaalsContact SG-CB 3.51Å; C445-H458 PolarHBondContact SG-NE2 3.4Å; C445-H462 VanDerWaalsContact SG-CE1 3.51Å; C445-H462 PolarHBondContact SG-NE2 3.39Å
446	G	83.6	Confident	84.9	Confident	53 Å²	53	78 Å²	78	55%	0.546	42%	0.422	S	S	.	.			trans	70.6	-7.8	-179.5	0	0	0	0	0	115.4	C442 A448	C442-G446 WeakPolarHBondContact O-CA 3.39Å; C442-G446 PolarHBondContact O-N 2.65Å; G446-A448 PolarHBondContact O-N 2.9Å
447	K	85.2	Confident	85.3	Confident	119 Å²	119	77.5 Å²	77.5	52%	0.517	41%	0.409	S	S	.	.			trans	-60.8	121	-176.2	-168.5	171.9	-172.9	170.1	0	111.1	C442 C445	C442-K447 HydrophobicContact CB-CB 4.48Å; C442-K447 WeakPolarHBondContact CB-O 3.39Å; C442-K447 PolarHBondContact N-O 2.94Å; C445-K447 PolarHBondContact O-N 3.35Å; C445-K447 VanDerWaalsContact SG-CB 3.51Å
448	A	86.4	Confident	85.7	Confident	30 Å²	30	73.1 Å²	73.1	25%	0.248	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	138.8	176.7	0	0	0	0	0	110.7	K438 Y440 K441 G446	K438-A448 HydrophobicContact CB-CB 3.49Å; K438-A448 VanDerWaalsContact CB-CB 3.49Å; K438-A448 HydrophobicContact CD-CB 4.23Å; K438-A448 VanDerWaalsContact CD-O 3.3Å; K438-A448 WeakPolarHBondContact CD-O 3.48Å; Y440-A448 CarbonylContact O-C 3.58Å; Y440-A448 WeakPolarHBondContact O-CA 3.38Å; K441-A448 HydrophobicContact CG-CB 4.03Å; G446-A448 PolarHBondContact O-N 2.9Å
449	L	84.8	Confident	85.9	Confident	32 Å²	32	70.7 Å²	70.7	17%	0.168	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	150.5	-179	-67.5	163.4	0	0	0	110.8	K438 Y440 L455 H458	K438-L449 CarbonylContact C-O 3.53Å; K438-L449 WeakPolarHBondContact CA-O 3.32Å; Y440-L449 WeakPolarHBondContact CB-O 3.14Å; Y440-L449 PolarHBondContact N-O 3.31Å; Y440-L449 PolarHBondContact O-N 2.94Å; L449-L455 VanDerWaalsContact CD1-CA 3.46Å; L449-L455 HydrophobicContact CD1-CB 4Å; L449-L455 HydrophobicContact CD1-CD1 3.99Å; L449-H458 HydrophobicContact CD1-CB 3.66Å
450	A	82.6	Confident	86.2	Confident	27 Å²	27	69.7 Å²	69.7	22%	0.223	37%	0.366	C	S	.	.	S	Bend	trans	-75.5	-25.3	-177.4	0	0	0	0	0	113.1	I432 Y440	I432-A450 HydrophobicContact CG2-CB 4.2Å; Y440-A450 WeakPolarHBondContact CD2-O 3.25Å; Y440-A450 WeakPolarHBondContact CE2-O 3.33Å
451	Y	83.1	Confident	86.1	Confident	82 Å²	82	70.2 Å²	70.2	32%	0.322	38%	0.378	S	S	.	.			trans	-130.1	143.8	-175.2	-49.1	-62	0	0	0	112.7	V429 T433 S453 T454 L455	V429-Y451 HydrophobicContact CG1-CD1 3.49Å; V429-Y451 VanDerWaalsContact CG1-CD1 3.49Å; V429-Y451 HydrophobicContact CG1-CE1 3.26Å; T433-Y451 VanDerWaalsContact CG2-OH 3.25Å; T433-Y451 WeakPolarHBondContact CG2-OH 3.23Å; Y451-S453 PolarHBondContact O-N 2.98Å; Y451-T454 HydrophobicContact CD2-CG2 4.26Å; Y451-T454 PolarHBondContact N-OG1 3.29Å; Y451-T454 PolarHBondContact O-N 3.3Å; Y451-T454 PolarHBondContact O-OG1 3.36Å; Y451-L455 PolarHBondContact O-N 3.49Å; Y451-L455 VanDerWaalsContact O-N 3.08Å
452	H	84.1	Confident	86.1	Confident	95 Å²	95	66.8 Å²	66.8	44%	0.44	36%	0.364	S	S	.	.	H	α-helix	trans	-61.6	-40.4	176.2	-179.2	-91.6	0	0	0	112.9	Y440 T454 L455 Q456	Y440-H452 HydrophobicContact CD1-CB 3.99Å; Y440-H452 HydrophobicContact CE1-CB 3.7Å; Y440-H452 HydrophobicContact CE2-CB 4.49Å; Y440-H452 HydrophobicContact CG-CB 4.49Å; H452-T454 VanDerWaalsContact C-N 3.31Å; H452-T454 PolarHBondContact O-N 3.35Å; H452-L455 WeakPolarHBondContact O-CB 3.22Å; H452-L455 PolarHBondContact O-N 3.36Å; H452-L455 VanDerWaalsContact O-N 3.11Å; H452-Q456 PolarHBondContact CE1-NE2 3.02Å; H452-Q456 PolarHBondContact O-N 2.93Å
453	S	84.4	Confident	85.9	Confident	79 Å²	79	70.4 Å²	70.4	55%	0.552	39%	0.386	S	S	*	.	H	α-helix	trans	-61.2	-39.9	177.7	50.6	0	0	0	0	112.1	Y451 L455 Q456 V457	Y451-S453 PolarHBondContact O-N 2.98Å; S453-L455 VanDerWaalsContact C-N 3.34Å; S453-Q456 PolarHBondContact O-N 2.93Å; S453-V457 WeakPolarHBondContact O-CG2 3.36Å; S453-V457 PolarHBondContact O-N 2.99Å; S453-V457 VanDerWaalsContact O-N 3.1Å
454	T	85.4	Confident	85.8	Confident	57 Å²	57	65.2 Å²	65.2	35%	0.35	37%	0.37	S	S	.	.	H	α-helix	trans	-67.7	-34.9	174.5	52.9	0	0	0	0	112	Y451 H452 H458	Y451-T454 HydrophobicContact CD2-CG2 4.26Å; Y451-T454 PolarHBondContact N-OG1 3.29Å; Y451-T454 PolarHBondContact O-N 3.3Å; Y451-T454 PolarHBondContact O-OG1 3.36Å; H452-T454 VanDerWaalsContact C-N 3.31Å; H452-T454 PolarHBondContact O-N 3.35Å; T454-H458 WeakPolarHBondContact O-CB 3.29Å; T454-H458 PolarHBondContact O-N 3.47Å
455	L	87.9	Confident	85.8	Confident	14 Å²	14	64.5 Å²	64.5	7%	0.073	37%	0.367	C	S	.	.	H	α-helix	trans	-64.7	-43.3	173.3	178	64	0	0	0	111.8	C442 L449 Y451 H452 S453 H458 Q459	C442-L455 HydrophobicContact CB-CD1 3.76Å; L449-L455 VanDerWaalsContact CD1-CA 3.46Å; L449-L455 HydrophobicContact CD1-CB 4Å; L449-L455 HydrophobicContact CD1-CD1 3.99Å; Y451-L455 PolarHBondContact O-N 3.49Å; Y451-L455 VanDerWaalsContact O-N 3.08Å; H452-L455 WeakPolarHBondContact O-CB 3.22Å; H452-L455 PolarHBondContact O-N 3.36Å; H452-L455 VanDerWaalsContact O-N 3.11Å; S453-L455 VanDerWaalsContact C-N 3.34Å; L455-H458 CarbonylContact O-C 3.53Å; L455-H458 WeakPolarHBondContact O-CB 3.4Å; L455-H458 PolarHBondContact O-N 2.87Å; L455-Q459 HydrophobicContact CD1-CG 4.29Å; L455-Q459 HydrophobicContact CG-CG 4.46Å; L455-Q459 WeakPolarHBondContact O-CG 3.37Å; L455-Q459 PolarHBondContact O-N 3.2Å
456	Q	86.4	Confident	85.9	Confident	96 Å²	96	67.6 Å²	67.6	45%	0.449	37%	0.373	S	S	.	.	H	α-helix	trans	-63.7	-43.5	177.3	-74.2	-151	-27.9	0	0	113	H452 S453 H458 Q459 R460	H452-Q456 PolarHBondContact CE1-NE2 3.02Å; H452-Q456 PolarHBondContact O-N 2.93Å; S453-Q456 PolarHBondContact O-N 2.93Å; Q456-H458 VanDerWaalsContact C-N 3.28Å; Q456-H458 PolarHBondContact O-N 3.46Å; Q456-Q459 PolarHBondContact O-N 3.25Å; Q456-R460 PolarHBondContact O-N 3.34Å
457	V	86.7	Confident	86.1	Confident	44 Å²	44	68.4 Å²	68.4	27%	0.267	37%	0.369	S	S	.	.	H	α-helix	trans	-65.2	-36.6	174.8	176	0	0	0	0	110.8	S453 R460 N479	S453-V457 WeakPolarHBondContact O-CG2 3.36Å; S453-V457 PolarHBondContact O-N 2.99Å; S453-V457 VanDerWaalsContact O-N 3.1Å; V457-R460 WeakPolarHBondContact O-CB 3.5Å; V457-R460 PolarHBondContact O-N 3.31Å; V457-N479 HydrophobicContact CG1-CB 3.99Å
458	H	87.6	Confident	86.4	Confident	26 Å²	26	65.7 Å²	65.7	12%	0.12	36%	0.355	C	S	.	.	H	α-helix	trans	-65.9	-39.9	174.5	172.5	49.5	0	0	0	112.4	C445 L449 T454 L455 Q456 R460 T461 H462	C445-H458 PolarHBondContact SG-NE2 3.4Å; L449-H458 HydrophobicContact CD1-CB 3.66Å; T454-H458 WeakPolarHBondContact O-CB 3.29Å; T454-H458 PolarHBondContact O-N 3.47Å; L455-H458 CarbonylContact O-C 3.53Å; L455-H458 WeakPolarHBondContact O-CB 3.4Å; L455-H458 PolarHBondContact O-N 2.87Å; Q456-H458 VanDerWaalsContact C-N 3.28Å; Q456-H458 PolarHBondContact O-N 3.46Å; H458-R460 PolarHBondContact O-N 3.39Å; H458-R460 VanDerWaalsContact O-N 3.16Å; H458-T461 PolarHBondContact ND1-OG1 2.88Å; H458-T461 WeakPolarHBondContact O-CB 3.36Å; H458-T461 PolarHBondContact O-N 3.19Å; H458-T461 PolarHBondContact O-OG1 3.14Å; H458-H462 AromaticContact CE1-CE1 3.75Å; H458-H462 AromaticContact CE1-NE2 3.38Å; H458-H462 PolarHBondContact CE1-NE2 3.06Å; H458-H462 AromaticContact NE2-CE1 3.97Å; H458-H462 AromaticContact NE2-NE2 3.25Å; H458-H462 PolarHBondContact NE2-NE2 3.4Å
459	Q	87.3	Confident	86.6	Confident	73 Å²	73	70.2 Å²	70.2	34%	0.341	37%	0.371	S	S	.	.	H	α-helix	trans	-58.6	-30.6	177.6	-76.8	170.5	-38.3	0	0	112.3	L455 Q456 T461 H462 T463	L455-Q459 HydrophobicContact CD1-CG 4.29Å; L455-Q459 HydrophobicContact CG-CG 4.46Å; L455-Q459 WeakPolarHBondContact O-CG 3.37Å; L455-Q459 PolarHBondContact O-N 3.2Å; Q456-Q459 PolarHBondContact O-N 3.25Å; Q459-T461 PolarHBondContact O-N 2.93Å; Q459-H462 WeakPolarHBondContact O-CB 3.39Å; Q459-H462 PolarHBondContact O-N 2.89Å; Q459-H462 VanDerWaalsContact O-N 3.09Å; Q459-T463 PolarHBondContact O-N 3.25Å
460	R	90.3	Very high	86.9	Confident	53 Å²	53	68.8 Å²	68.8	20%	0.2	36%	0.364	C	S	.	.	H	α-helix	trans	-64.5	-21.2	173.5	-64.6	178.5	-178.3	160.5	0.6	114.2	Q456 V457 H458 H462 T463 G464 E465 A478	Q456-R460 PolarHBondContact O-N 3.34Å; V457-R460 WeakPolarHBondContact O-CB 3.5Å; V457-R460 PolarHBondContact O-N 3.31Å; H458-R460 PolarHBondContact O-N 3.39Å; H458-R460 VanDerWaalsContact O-N 3.16Å; R460-H462 PolarHBondContact O-N 3.4Å; R460-T463 WeakPolarHBondContact CA-OG1 3.33Å; R460-G464 WeakPolarHBondContact O-CA 3.45Å; R460-G464 PolarHBondContact O-N 3.2Å; R460-E465 HydrophobicContact CB-CB 4.4Å; R460-E465 WeakPolarHBondContact CB-O 3.46Å; R460-E465 HydrophobicContact CG-CB 4.22Å; R460-E465 PolarHBondContact O-N 3.13Å; R460-A478 HydrophobicContact CB-CB 4.18Å; R460-A478 WeakPolarHBondContact CD-O 3.48Å; R460-A478 PolarHBondContact NH1-O 3.03Å
461	T	86.1	Confident	87.1	Confident	93 Å²	93	76.8 Å²	76.8	57%	0.571	40%	0.397	S	S	*	.	H	α-helix	trans	-70.9	-23.6	174.7	69	0	0	0	0	112	H458 Q459	H458-T461 PolarHBondContact ND1-OG1 2.88Å; H458-T461 WeakPolarHBondContact O-CB 3.36Å; H458-T461 PolarHBondContact O-N 3.19Å; H458-T461 PolarHBondContact O-OG1 3.14Å; Q459-T461 PolarHBondContact O-N 2.93Å
462	H	86.1	Confident	87.3	Confident	73 Å²	73	79.6 Å²	79.6	34%	0.338	41%	0.413	S	S	.	.	H	α-helix	trans	-87.7	-37.8	177.3	-57	-53.3	0	0	0	112	C442 Q444 C445 H458 Q459 R460 G464	C442-H462 PolarHBondContact SG-NE2 3.15Å; C442-H462 VanDerWaalsContact SG-NE2 3.37Å; Q444-H462 PolarHBondContact OE1-CD2 2.88Å; C445-H462 VanDerWaalsContact SG-CE1 3.51Å; C445-H462 PolarHBondContact SG-NE2 3.39Å; H458-H462 AromaticContact CE1-CE1 3.75Å; H458-H462 AromaticContact CE1-NE2 3.38Å; H458-H462 PolarHBondContact CE1-NE2 3.06Å; H458-H462 AromaticContact NE2-CE1 3.97Å; H458-H462 AromaticContact NE2-NE2 3.25Å; H458-H462 PolarHBondContact NE2-NE2 3.4Å; Q459-H462 WeakPolarHBondContact O-CB 3.39Å; Q459-H462 PolarHBondContact O-N 2.89Å; Q459-H462 VanDerWaalsContact O-N 3.09Å; R460-H462 PolarHBondContact O-N 3.4Å; H462-G464 VanDerWaalsContact C-N 3.34Å
463	T	86.3	Confident	87.5	Confident	78 Å²	78	77.5 Å²	77.5	48%	0.479	41%	0.409	S	S	.	.	H	α-helix	trans	-81.8	-14.8	177.9	61.7	0	0	0	0	113.1	Q459 R460 E465	Q459-T463 PolarHBondContact O-N 3.25Å; R460-T463 WeakPolarHBondContact CA-OG1 3.33Å; T463-E465 PolarHBondContact O-N 3.4Å; T463-E465 WeakPolarHBondContact OG1-CG 3.3Å; T463-E465 PolarHBondContact OG1-N 2.97Å
464	G	84.1	Confident	87.5	Confident	51 Å²	51	76 Å²	76	53%	0.526	41%	0.405	S	S	.	.			trans	72.8	2.3	-173.3	0	0	0	0	0	114.1	R460 H462 K466	R460-G464 WeakPolarHBondContact O-CA 3.45Å; R460-G464 PolarHBondContact O-N 3.2Å; H462-G464 VanDerWaalsContact C-N 3.34Å; G464-K466 PolarHBondContact O-N 3.31Å
465	E	87.1	Confident	87.7	Confident	115 Å²	115	79.3 Å²	79.3	54%	0.537	42%	0.415	S	S	.	.			trans	-61.3	122.5	-177.9	-77.4	-178.5	179.8	0	0	111.8	R460 T463 P467	R460-E465 HydrophobicContact CB-CB 4.4Å; R460-E465 WeakPolarHBondContact CB-O 3.46Å; R460-E465 HydrophobicContact CG-CB 4.22Å; R460-E465 PolarHBondContact O-N 3.13Å; T463-E465 PolarHBondContact O-N 3.4Å; T463-E465 WeakPolarHBondContact OG1-CG 3.3Å; T463-E465 PolarHBondContact OG1-N 2.97Å; E465-P467 WeakPolarHBondContact O-CD 3.36Å
466	K	87.9	Confident	87.7	Confident	129 Å²	129	80.2 Å²	80.2	56%	0.561	42%	0.424	S	S	*	.			trans	-123.5	79.1	175.5	-70.1	170.1	174.7	-177.2	0	110	G464 Y468 A476 F477 A478	G464-K466 PolarHBondContact O-N 3.31Å; K466-Y468 PolarHBondContact O-N 2.81Å; K466-A476 HydrophobicContact CB-CB 3.61Å; K466-A476 HydrophobicContact CD-CB 4.07Å; K466-A476 WeakPolarHBondContact CD-O 3.18Å; K466-A476 HydrophobicContact CG-CB 4.46Å; K466-F477 CarbonylContact C-O 3.49Å; K466-F477 WeakPolarHBondContact CA-O 3.44Å; K466-A478 HydrophobicContact CG-CB 4.46Å
467	P	89.3	Confident	87.8	Confident	71 Å²	71	77.9 Å²	77.9	46%	0.461	41%	0.413	S	S	.	.			trans	-68	-9.6	-171.1	-20.8	33.9	0	0	0	115	E465	E465-P467 WeakPolarHBondContact O-CD 3.36Å
468	Y	90.8	Very high	87.8	Confident	61 Å²	61	77 Å²	77	24%	0.239	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	94.3	-174.4	-54.7	-72.6	0	0	0	110	K466 A476 F477 Q480 F483	K466-Y468 PolarHBondContact O-N 2.81Å; Y468-A476 CarbonylContact O-C 3.52Å; Y468-A476 WeakPolarHBondContact O-CA 3.42Å; Y468-F477 WeakPolarHBondContact CD2-O 3.45Å; Y468-F477 PolarHBondContact N-O 3.46Å; Y468-F477 PolarHBondContact O-N 3.08Å; Y468-Q480 HydrophobicContact CD1-CB 4.36Å; Y468-Q480 HydrophobicContact CD1-CG 4.26Å; Y468-Q480 HydrophobicContact CD2-CB 4.3Å; Y468-Q480 HydrophobicContact CE1-CB 3.87Å; Y468-Q480 HydrophobicContact CE1-CG 3.84Å; Y468-Q480 HydrophobicContact CE2-CB 3.79Å; Y468-Q480 VanDerWaalsContact CE2-N 3.29Å; Y468-F483 HydrophobicContact CD1-CD1 4.33Å; Y468-F483 HydrophobicContact CG-CB 4.4Å; Y468-F483 HydrophobicContact CG-CD1 4.37Å
469	E	89.4	Confident	87.8	Confident	125 Å²	125	77.7 Å²	77.7	58%	0.584	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.2	137.4	179.5	-169.7	173.4	170.9	0	0	111.9	A476 F483	E469-A476 HydrophobicContact CB-CB 4.37Å; E469-A476 HydrophobicContact CG-CB 4.39Å; E469-F483 VanDerWaalsContact C-CE2 3.49Å; E469-F483 VanDerWaalsContact O-CE2 3.27Å; E469-F483 WeakPolarHBondContact O-CE2 3.47Å; E469-F483 VanDerWaalsContact O-CZ 3.22Å; E469-F483 WeakPolarHBondContact O-CZ 3.28Å
470	C	91.1	Very high	87.9	Confident	2 Å²	2	79 Å²	79	1%	0.014	42%	0.421	C	S	.	.			trans	-90.2	107.2	174.6	-173.8	0	0	0	0	110.1	Q472 C473 G474 K475 F483 H490	C470-Q472 PolarHBondContact O-N 2.83Å; C470-Q472 VanDerWaalsContact O-N 3.16Å; C470-C473 PolarHBondContact O-N 2.95Å; C470-G474 VanDerWaalsContact O-CA 3.31Å; C470-G474 WeakPolarHBondContact O-CA 3.29Å; C470-G474 PolarHBondContact O-N 3.31Å; C470-K475 WeakPolarHBondContact CB-O 3.37Å; C470-K475 PolarHBondContact N-O 2.6Å; C470-F483 HydrophobicContact CB-CE2 3.93Å; C470-H490 PolarHBondContact SG-NE2 3.09Å
471	E	88.4	Confident	87.7	Confident	195 Å²	195	80.2 Å²	80.2	91%	0.911	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-29.8	178.6	-64.8	173.6	-177.3	0	0	113.1	C473	E471-C473 PolarHBondContact O-N 2.99Å
472	Q	86.2	Confident	87.8	Confident	141 Å²	141	83.4 Å²	83.4	66%	0.659	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-22.4	-178.2	-69.9	176	-15.8	0	0	114.1	C470 H490	C470-Q472 PolarHBondContact O-N 2.83Å; C470-Q472 VanDerWaalsContact O-N 3.16Å; Q472-H490 PolarHBondContact OE1-CD2 3.08Å
473	C	88.6	Confident	87.9	Confident	52 Å²	52	80.7 Å²	80.7	35%	0.351	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-145.4	11.3	-176.6	77.4	0	0	0	0	114.8	C470 E471 K475 H486	C470-C473 PolarHBondContact O-N 2.95Å; E471-C473 PolarHBondContact O-N 2.99Å; C473-K475 PolarHBondContact O-N 3.3Å; C473-H486 PolarHBondContact SG-NE2 3.21Å
474	G	85.3	Confident	88	Confident	47 Å²	47	80.8 Å²	80.8	49%	0.485	42%	0.423	S	S	.	.			trans	63.7	4.9	-179.9	0	0	0	0	0	115.9	C470 A476	C470-G474 VanDerWaalsContact O-CA 3.31Å; C470-G474 WeakPolarHBondContact O-CA 3.29Å; C470-G474 PolarHBondContact O-N 3.31Å; G474-A476 PolarHBondContact O-N 3.49Å
475	K	88.3	Confident	88.1	Confident	126 Å²	126	80.7 Å²	80.7	55%	0.548	41%	0.412	S	S	.	.			trans	-77.5	123.3	-177.2	-74.1	-178.2	-178.9	176.4	0	110.4	C470 C473 F477	C470-K475 WeakPolarHBondContact CB-O 3.37Å; C470-K475 PolarHBondContact N-O 2.6Å; C473-K475 PolarHBondContact O-N 3.3Å; K475-F477 HydrophobicContact CB-CE2 3.83Å; K475-F477 HydrophobicContact CB-CZ 4.07Å; K475-F477 WeakPolarHBondContact O-CE2 3.38Å
476	A	89.3	Confident	88.2	Confident	33 Å²	33	76 Å²	76	27%	0.273	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	142.5	177.7	0	0	0	0	0	112.8	K466 Y468 E469 G474	K466-A476 HydrophobicContact CB-CB 3.61Å; K466-A476 HydrophobicContact CD-CB 4.07Å; K466-A476 WeakPolarHBondContact CD-O 3.18Å; K466-A476 HydrophobicContact CG-CB 4.46Å; Y468-A476 CarbonylContact O-C 3.52Å; Y468-A476 WeakPolarHBondContact O-CA 3.42Å; E469-A476 HydrophobicContact CB-CB 4.37Å; E469-A476 HydrophobicContact CG-CB 4.39Å; G474-A476 PolarHBondContact O-N 3.49Å
477	F	87.8	Confident	88.2	Confident	47 Å²	47	74.1 Å²	74.1	21%	0.206	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	143.3	-175.9	-59.2	-94.9	0	0	0	111.4	K466 Y468 K475 F483 H486	K466-F477 CarbonylContact C-O 3.49Å; K466-F477 WeakPolarHBondContact CA-O 3.44Å; Y468-F477 WeakPolarHBondContact CD2-O 3.45Å; Y468-F477 PolarHBondContact N-O 3.46Å; Y468-F477 PolarHBondContact O-N 3.08Å; K475-F477 HydrophobicContact CB-CE2 3.83Å; K475-F477 HydrophobicContact CB-CZ 4.07Å; K475-F477 WeakPolarHBondContact O-CE2 3.38Å; F477-F483 HydrophobicContact CB-CB 4.11Å; F477-F483 HydrophobicContact CD2-CB 4.14Å; F477-F483 AromaticContact CD2-CD2 3.76Å; F477-F483 HydrophobicContact CD2-CD2 3.76Å; F477-F483 HydrophobicContact CD2-CG 4.45Å; F477-F483 HydrophobicContact CE2-CD2 4.23Å; F477-F483 HydrophobicContact CG-CB 4.25Å; F477-H486 HydrophobicContact CE1-CB 4.12Å; F477-H486 HydrophobicContact CE2-CB 3.86Å; F477-H486 AromaticContact CE2-CD2 3.42Å; F477-H486 VanDerWaalsContact CE2-CD2 3.42Å; F477-H486 WeakPolarHBondContact CE2-CD2 3.39Å; F477-H486 AromaticContact CE2-CG 3.52Å; F477-H486 HydrophobicContact CZ-CB 3.52Å; F477-H486 AromaticContact CZ-CD2 3.66Å; F477-H486 AromaticContact CZ-CG 3.26Å; F477-H486 AromaticContact CZ-ND1 3.6Å
478	A	86.7	Confident	88.2	Confident	26 Å²	26	73.6 Å²	73.6	22%	0.215	37%	0.37	C	S	.	.	S	Bend	trans	-79.8	-17.6	175.9	0	0	0	0	0	113.4	R460 K466	R460-A478 HydrophobicContact CB-CB 4.18Å; R460-A478 WeakPolarHBondContact CD-O 3.48Å; R460-A478 PolarHBondContact NH1-O 3.03Å; K466-A478 HydrophobicContact CG-CB 4.46Å
479	N	88.1	Confident	87.9	Confident	41 Å²	41	75.7 Å²	75.7	22%	0.219	39%	0.385	C	S	.	.			trans	-124.6	129.7	-176.4	-175.5	-10	0	0	0	111	V457 S481 Y482 F483	V457-N479 HydrophobicContact CG1-CB 3.99Å; N479-S481 VanDerWaalsContact C-N 3.32Å; N479-S481 PolarHBondContact O-N 3.14Å; N479-S481 PolarHBondContact OD1-N 3.12Å; N479-Y482 HydrophobicContact CB-CD2 3.73Å; N479-Y482 HydrophobicContact CB-CE2 4.4Å; N479-Y482 HydrophobicContact CB-CG 4.43Å; N479-Y482 PolarHBondContact O-N 3.48Å; N479-F483 PolarHBondContact O-N 3.48Å; N479-F483 VanDerWaalsContact O-N 3.14Å
480	Q	88.6	Confident	87.7	Confident	100 Å²	100	73.3 Å²	73.3	47%	0.467	37%	0.373	S	S	.	.	H	α-helix	trans	-60	-39.9	179.1	-166.3	176.7	-1.4	0	0	112.2	Y468 Y482 F483 Q484	Y468-Q480 HydrophobicContact CD1-CB 4.36Å; Y468-Q480 HydrophobicContact CD1-CG 4.26Å; Y468-Q480 HydrophobicContact CD2-CB 4.3Å; Y468-Q480 HydrophobicContact CE1-CB 3.87Å; Y468-Q480 HydrophobicContact CE1-CG 3.84Å; Y468-Q480 HydrophobicContact CE2-CB 3.79Å; Y468-Q480 VanDerWaalsContact CE2-N 3.29Å; Q480-Y482 VanDerWaalsContact C-N 3.34Å; Q480-Y482 PolarHBondContact O-N 2.77Å; Q480-F483 WeakPolarHBondContact O-CB 3.48Å; Q480-F483 PolarHBondContact O-N 3.46Å; Q480-Q484 HydrophobicContact CG-CG 4.44Å; Q480-Q484 WeakPolarHBondContact O-CG 3.22Å; Q480-Q484 PolarHBondContact O-N 3.42Å
481	S	86.9	Confident	87.4	Confident	78 Å²	78	77.2 Å²	77.2	55%	0.545	40%	0.397	S	S	.	.	H	α-helix	trans	-64	-40.7	-177.8	-58.2	0	0	0	0	111.9	N479 Q484 V485	N479-S481 VanDerWaalsContact C-N 3.32Å; N479-S481 PolarHBondContact O-N 3.14Å; N479-S481 PolarHBondContact OD1-N 3.12Å; S481-Q484 PolarHBondContact O-N 3.06Å; S481-V485 WeakPolarHBondContact O-CG2 3.38Å; S481-V485 PolarHBondContact O-N 3.01Å; S481-V485 VanDerWaalsContact O-N 3.07Å
482	Y	87.1	Confident	87.2	Confident	160 Å²	160	70.3 Å²	70.3	63%	0.627	38%	0.378	S	S	*	.	H	α-helix	trans	-68.3	-37.2	175.5	-67.1	-42	0	0	0	111.9	N479 Q480 V485 H486	N479-Y482 HydrophobicContact CB-CD2 3.73Å; N479-Y482 HydrophobicContact CB-CE2 4.4Å; N479-Y482 HydrophobicContact CB-CG 4.43Å; N479-Y482 PolarHBondContact O-N 3.48Å; Q480-Y482 VanDerWaalsContact C-N 3.34Å; Q480-Y482 PolarHBondContact O-N 2.77Å; Y482-V485 PolarHBondContact O-N 2.81Å; Y482-H486 WeakPolarHBondContact O-CB 3.22Å; Y482-H486 PolarHBondContact O-N 2.83Å
483	F	89.5	Confident	87.2	Confident	16 Å²	16	69 Å²	69	7%	0.07	37%	0.372	C	S	.	.	H	α-helix	trans	-61.1	-42.9	172.3	174.8	-120.1	0	0	0	112.8	Y468 E469 C470 F477 N479 Q480 H486 K487	Y468-F483 HydrophobicContact CD1-CD1 4.33Å; Y468-F483 HydrophobicContact CG-CB 4.4Å; Y468-F483 HydrophobicContact CG-CD1 4.37Å; E469-F483 VanDerWaalsContact C-CE2 3.49Å; E469-F483 VanDerWaalsContact O-CE2 3.27Å; E469-F483 WeakPolarHBondContact O-CE2 3.47Å; E469-F483 VanDerWaalsContact O-CZ 3.22Å; E469-F483 WeakPolarHBondContact O-CZ 3.28Å; C470-F483 HydrophobicContact CB-CE2 3.93Å; F477-F483 HydrophobicContact CB-CB 4.11Å; F477-F483 HydrophobicContact CD2-CB 4.14Å; F477-F483 AromaticContact CD2-CD2 3.76Å; F477-F483 HydrophobicContact CD2-CD2 3.76Å; F477-F483 HydrophobicContact CD2-CG 4.45Å; F477-F483 HydrophobicContact CE2-CD2 4.23Å; F477-F483 HydrophobicContact CG-CB 4.25Å; N479-F483 PolarHBondContact O-N 3.48Å; N479-F483 VanDerWaalsContact O-N 3.14Å; Q480-F483 WeakPolarHBondContact O-CB 3.48Å; Q480-F483 PolarHBondContact O-N 3.46Å; F483-H486 WeakPolarHBondContact O-CB 3.31Å; F483-H486 PolarHBondContact O-N 3.49Å; F483-K487 HydrophobicContact CE1-CD 4.15Å; F483-K487 HydrophobicContact CE2-CG 4.31Å; F483-K487 HydrophobicContact CZ-CD 4.15Å; F483-K487 HydrophobicContact CZ-CG 4.37Å; F483-K487 PolarHBondContact O-N 3.18Å
484	Q	87.4	Confident	87.1	Confident	81 Å²	81	72 Å²	72	38%	0.379	38%	0.379	S	S	.	.	H	α-helix	trans	-65.6	-40	177	-65.9	-56.1	-33.8	0	0	112.3	Q480 S481 H486 K487	Q480-Q484 HydrophobicContact CG-CG 4.44Å; Q480-Q484 WeakPolarHBondContact O-CG 3.22Å; Q480-Q484 PolarHBondContact O-N 3.42Å; S481-Q484 PolarHBondContact O-N 3.06Å; Q484-H486 VanDerWaalsContact C-N 3.32Å; Q484-K487 PolarHBondContact O-N 3.18Å
485	V	86.8	Confident	87.3	Confident	48 Å²	48	73.1 Å²	73.1	29%	0.291	38%	0.378	S	S	.	.	H	α-helix	trans	-65.2	-38.9	173.1	175.4	0	0	0	0	110.7	S481 Y482 R488 V506	S481-V485 WeakPolarHBondContact O-CG2 3.38Å; S481-V485 PolarHBondContact O-N 3.01Å; S481-V485 VanDerWaalsContact O-N 3.07Å; Y482-V485 PolarHBondContact O-N 2.81Å; V485-R488 WeakPolarHBondContact O-CB 3.38Å; V485-R488 PolarHBondContact O-N 3.38Å; V485-V506 HydrophobicContact CG1-CG1 4.2Å; V485-V506 WeakPolarHBondContact O-CG1 3.35Å
486	H	88.2	Confident	87.3	Confident	17 Å²	17	71 Å²	71	8%	0.079	37%	0.367	C	S	.	.	H	α-helix	trans	-62.8	-43.3	175.9	172.3	71.8	0	0	0	112.5	C473 F477 Y482 F483 Q484 R488 I489 H490	C473-H486 PolarHBondContact SG-NE2 3.21Å; F477-H486 HydrophobicContact CE1-CB 4.12Å; F477-H486 HydrophobicContact CE2-CB 3.86Å; F477-H486 AromaticContact CE2-CD2 3.42Å; F477-H486 VanDerWaalsContact CE2-CD2 3.42Å; F477-H486 WeakPolarHBondContact CE2-CD2 3.39Å; F477-H486 AromaticContact CE2-CG 3.52Å; F477-H486 HydrophobicContact CZ-CB 3.52Å; F477-H486 AromaticContact CZ-CD2 3.66Å; F477-H486 AromaticContact CZ-CG 3.26Å; F477-H486 AromaticContact CZ-ND1 3.6Å; Y482-H486 WeakPolarHBondContact O-CB 3.22Å; Y482-H486 PolarHBondContact O-N 2.83Å; F483-H486 WeakPolarHBondContact O-CB 3.31Å; F483-H486 PolarHBondContact O-N 3.49Å; Q484-H486 VanDerWaalsContact C-N 3.32Å; H486-R488 PolarHBondContact O-N 2.84Å; H486-R488 VanDerWaalsContact O-N 3.12Å; H486-I489 VanDerWaalsContact O-CB 3.24Å; H486-I489 WeakPolarHBondContact O-CB 3.33Å; H486-I489 WeakPolarHBondContact O-CG1 3.32Å; H486-I489 PolarHBondContact O-N 3.34Å; H486-H490 AromaticContact CD2-NE2 3.9Å; H486-H490 AromaticContact CE1-NE2 3.53Å; H486-H490 AromaticContact NE2-CD2 3.94Å; H486-H490 AromaticContact NE2-CE1 3.97Å; H486-H490 AromaticContact NE2-NE2 3.06Å; H486-H490 PolarHBondContact NE2-NE2 3.08Å
487	K	87.4	Confident	87.2	Confident	90 Å²	90	76.1 Å²	76.1	39%	0.391	38%	0.384	S	S	.	.	H	α-helix	trans	-53.9	-34.1	176.7	-82.6	-169.8	163.5	-176.7	0	112.9	F483 Q484 I489 H490 T491	F483-K487 HydrophobicContact CE1-CD 4.15Å; F483-K487 HydrophobicContact CE2-CG 4.31Å; F483-K487 HydrophobicContact CZ-CD 4.15Å; F483-K487 HydrophobicContact CZ-CG 4.37Å; F483-K487 PolarHBondContact O-N 3.18Å; Q484-K487 PolarHBondContact O-N 3.18Å; K487-I489 PolarHBondContact O-N 3.17Å; K487-H490 PolarHBondContact O-N 3.38Å; K487-T491 PolarHBondContact O-N 3.19Å
488	R	89.3	Confident	87.3	Confident	59 Å²	59	74 Å²	74	22%	0.223	38%	0.375	C	S	.	.	H	α-helix	trans	-64.7	-24.7	179	-67.5	176.6	-175.9	164.9	0	113.7	V485 H486 H490 T491 G492 E493 Y496 V506	V485-R488 WeakPolarHBondContact O-CB 3.38Å; V485-R488 PolarHBondContact O-N 3.38Å; H486-R488 PolarHBondContact O-N 2.84Å; H486-R488 VanDerWaalsContact O-N 3.12Å; R488-H490 VanDerWaalsContact C-N 3.29Å; R488-H490 PolarHBondContact O-N 3.21Å; R488-T491 VanDerWaalsContact CA-OG1 3.27Å; R488-T491 WeakPolarHBondContact CA-OG1 3.41Å; R488-T491 PolarHBondContact O-N 2.98Å; R488-T491 PolarHBondContact O-OG1 2.84Å; R488-G492 PolarHBondContact O-N 3.39Å; R488-E493 HydrophobicContact CB-CB 4.32Å; R488-E493 HydrophobicContact CG-CB 4.3Å; R488-E493 PolarHBondContact O-N 3.03Å; R488-Y496 VanDerWaalsContact NH1-CE2 3.31Å; R488-V506 HydrophobicContact CB-CG1 3.44Å; R488-V506 VanDerWaalsContact CB-CG1 3.44Å; R488-V506 PolarHBondContact NH1-O 3.19Å
489	I	85.4	Confident	87.4	Confident	105 Å²	105	80.3 Å²	80.3	54%	0.538	40%	0.404	S	S	.	.	H	α-helix	trans	-61.2	-41.7	175.8	-59.1	175.1	0	0	0	110.2	H486 K487 G492 V506	H486-I489 VanDerWaalsContact O-CB 3.24Å; H486-I489 WeakPolarHBondContact O-CB 3.33Å; H486-I489 WeakPolarHBondContact O-CG1 3.32Å; H486-I489 PolarHBondContact O-N 3.34Å; K487-I489 PolarHBondContact O-N 3.17Å; I489-G492 PolarHBondContact O-N 3.41Å; I489-V506 HydrophobicContact CG1-CG1 4.24Å
490	H	85.9	Confident	87.3	Confident	75 Å²	75	85 Å²	85	35%	0.347	43%	0.425	S	S	.	.	H	α-helix	trans	-73.8	-35	-179.6	-57.2	-56.4	0	0	0	112.6	C470 Q472 H486 K487 R488 G492	C470-H490 PolarHBondContact SG-NE2 3.09Å; Q472-H490 PolarHBondContact OE1-CD2 3.08Å; H486-H490 AromaticContact CD2-NE2 3.9Å; H486-H490 AromaticContact CE1-NE2 3.53Å; H486-H490 AromaticContact NE2-CD2 3.94Å; H486-H490 AromaticContact NE2-CE1 3.97Å; H486-H490 AromaticContact NE2-NE2 3.06Å; H486-H490 PolarHBondContact NE2-NE2 3.08Å; K487-H490 PolarHBondContact O-N 3.38Å; R488-H490 VanDerWaalsContact C-N 3.29Å; R488-H490 PolarHBondContact O-N 3.21Å; H490-G492 VanDerWaalsContact C-N 3.3Å
491	T	85.2	Confident	87.3	Confident	84 Å²	84	82.9 Å²	82.9	52%	0.515	42%	0.42	S	S	.	.	H	α-helix	trans	-79.1	-12.7	176.1	60.5	0	0	0	0	113.6	K487 R488 E493	K487-T491 PolarHBondContact O-N 3.19Å; R488-T491 VanDerWaalsContact CA-OG1 3.27Å; R488-T491 WeakPolarHBondContact CA-OG1 3.41Å; R488-T491 PolarHBondContact O-N 2.98Å; R488-T491 PolarHBondContact O-OG1 2.84Å; T491-E493 PolarHBondContact O-N 3.45Å; T491-E493 WeakPolarHBondContact OG1-CG 3.29Å; T491-E493 PolarHBondContact OG1-N 3.31Å
492	G	82.7	Confident	87.2	Confident	50 Å²	50	81.7 Å²	81.7	52%	0.515	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.2	1.4	-171.2	0	0	0	0	0	115.3	R488 I489 H490 K494	R488-G492 PolarHBondContact O-N 3.39Å; I489-G492 PolarHBondContact O-N 3.41Å; H490-G492 VanDerWaalsContact C-N 3.3Å; G492-K494 PolarHBondContact O-N 3.38Å
493	E	86.6	Confident	87.3	Confident	113 Å²	113	80 Å²	80	53%	0.528	42%	0.417	S	S	.	.			trans	-60.1	122.9	179.9	-74.4	-173.7	174.1	0	0	111.9	R488 T491 P495	R488-E493 HydrophobicContact CB-CB 4.32Å; R488-E493 HydrophobicContact CG-CB 4.3Å; R488-E493 PolarHBondContact O-N 3.03Å; T491-E493 PolarHBondContact O-N 3.45Å; T491-E493 WeakPolarHBondContact OG1-CG 3.29Å; T491-E493 PolarHBondContact OG1-N 3.31Å; E493-P495 WeakPolarHBondContact O-CD 3.36Å
494	K	87.4	Confident	87.2	Confident	116 Å²	116	81 Å²	81	50%	0.504	43%	0.427	S	S	.	.			trans	-123	78	175.3	-68.5	173.8	178.3	-175.2	0	110.5	G492 Y496 A504 F505 V506	G492-K494 PolarHBondContact O-N 3.38Å; K494-Y496 PolarHBondContact O-N 3.46Å; K494-A504 HydrophobicContact CB-CB 3.63Å; K494-A504 HydrophobicContact CD-CB 4.2Å; K494-A504 WeakPolarHBondContact CD-O 3.44Å; K494-F505 CarbonylContact C-O 3.5Å; K494-F505 WeakPolarHBondContact CA-O 3.46Å; K494-V506 HydrophobicContact CG-CG2 3.9Å
495	P	88.4	Confident	87.2	Confident	71 Å²	71	79.1 Å²	79.1	46%	0.461	42%	0.418	S	S	.	.			trans	-70.1	-18.2	-172	-19.1	33	0	0	0	114.2	E493	E493-P495 WeakPolarHBondContact O-CD 3.36Å
496	Y	88.4	Confident	87.2	Confident	80 Å²	80	78.2 Å²	78.2	31%	0.314	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	106.6	-172.6	-56.5	-76.1	0	0	0	110	R488 K494 A504 F505 S508	R488-Y496 VanDerWaalsContact NH1-CE2 3.31Å; K494-Y496 PolarHBondContact O-N 3.46Å; Y496-A504 CarbonylContact O-C 3.31Å; Y496-A504 WeakPolarHBondContact O-CA 3.34Å; Y496-F505 PolarHBondContact N-O 3Å; Y496-F505 PolarHBondContact O-N 3.03Å; Y496-S508 VanDerWaalsContact CE2-N 3.31Å
497	K	87.5	Confident	87.2	Confident	142 Å²	142	77.6 Å²	77.6	62%	0.617	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100	140.3	178.2	-63.8	-177.1	-179.8	-178.9	0	110.2	A504	K497-A504 HydrophobicContact CG-CB 4.05Å
498	C	90.7	Very high	87.2	Confident	3 Å²	3	75.6 Å²	75.6	2%	0.02	41%	0.408	C	S	.	.			trans	-79	121.6	170.8	-180	0	0	0	0	109.2	Q500 G502 K503 F505 L511	C498-Q500 PolarHBondContact O-N 2.8Å; C498-G502 WeakPolarHBondContact O-CA 3.3Å; C498-G502 PolarHBondContact O-N 2.85Å; C498-K503 WeakPolarHBondContact CB-O 3.41Å; C498-K503 PolarHBondContact N-O 3.34Å; C498-F505 HydrophobicContact CB-CE2 4.31Å; C498-L511 HydrophobicContact CB-CD1 3.64Å
499	D	87.8	Confident	87	Confident	157 Å²	157	77.3 Å²	77.3	84%	0.84	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-24.4	-178.6	-62.7	-29.9	0	0	0	112.5
500	Q	85.2	Confident	87	Confident	141 Å²	141	74.9 Å²	74.9	66%	0.659	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-29.6	-177.9	-62.2	-162.4	6.5	0	0	114.2	C498	C498-Q500 PolarHBondContact O-N 2.8Å
501	C	89.1	Confident	87.1	Confident	54 Å²	54	72.1 Å²	72.1	37%	0.365	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.3	4.3	-174.8	74.1	0	0	0	0	114.3	K503 H514	C501-K503 PolarHBondContact O-N 3.35Å; C501-H514 PolarHBondContact SG-NE2 3.34Å
502	G	85.1	Confident	87.2	Confident	53 Å²	53	74 Å²	74	55%	0.546	41%	0.406	S	S	.	.			trans	70.3	-6	178.7	0	0	0	0	0	115.7	C498 A504	C498-G502 WeakPolarHBondContact O-CA 3.3Å; C498-G502 PolarHBondContact O-N 2.85Å; G502-A504 PolarHBondContact O-N 3.17Å
503	K	88.4	Confident	87.5	Confident	126 Å²	126	79.4 Å²	79.4	55%	0.548	41%	0.411	S	S	.	.			trans	-61.4	130.8	-178.6	-73.1	-177.6	179.9	178.1	0	111	C498 C501 F505	C498-K503 WeakPolarHBondContact CB-O 3.41Å; C498-K503 PolarHBondContact N-O 3.34Å; C501-K503 PolarHBondContact O-N 3.35Å; K503-F505 HydrophobicContact CB-CE2 3.76Å; K503-F505 HydrophobicContact CB-CZ 3.91Å; K503-F505 WeakPolarHBondContact O-CD2 3.27Å; K503-F505 VanDerWaalsContact O-CE2 3.28Å; K503-F505 WeakPolarHBondContact O-CE2 3.3Å
504	A	88.6	Confident	87.5	Confident	35 Å²	35	75.3 Å²	75.3	29%	0.289	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	141	-178.8	0	0	0	0	0	111.8	K494 Y496 K497 G502	K494-A504 HydrophobicContact CB-CB 3.63Å; K494-A504 HydrophobicContact CD-CB 4.2Å; K494-A504 WeakPolarHBondContact CD-O 3.44Å; Y496-A504 CarbonylContact O-C 3.31Å; Y496-A504 WeakPolarHBondContact O-CA 3.34Å; K497-A504 HydrophobicContact CG-CB 4.05Å; G502-A504 PolarHBondContact O-N 3.17Å
505	F	88	Confident	87.4	Confident	42 Å²	42	73.3 Å²	73.3	18%	0.184	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	151.1	-175.1	-60.1	-89.2	0	0	0	111.3	K494 Y496 C498 K503 D510 L511 H514	K494-F505 CarbonylContact C-O 3.5Å; K494-F505 WeakPolarHBondContact CA-O 3.46Å; Y496-F505 PolarHBondContact N-O 3Å; Y496-F505 PolarHBondContact O-N 3.03Å; C498-F505 HydrophobicContact CB-CE2 4.31Å; K503-F505 HydrophobicContact CB-CE2 3.76Å; K503-F505 HydrophobicContact CB-CZ 3.91Å; K503-F505 WeakPolarHBondContact O-CD2 3.27Å; K503-F505 VanDerWaalsContact O-CE2 3.28Å; K503-F505 WeakPolarHBondContact O-CE2 3.3Å; F505-D510 HydrophobicContact CB-CB 4.13Å; F505-D510 HydrophobicContact CD1-CB 3.95Å; F505-D510 HydrophobicContact CG-CB 4.33Å; F505-L511 HydrophobicContact CB-CB 4.31Å; F505-L511 HydrophobicContact CD2-CB 3.97Å; F505-L511 HydrophobicContact CD2-CD1 3.8Å; F505-L511 HydrophobicContact CD2-CG 4.5Å; F505-L511 HydrophobicContact CE2-CD1 3.97Å; F505-L511 HydrophobicContact CG-CB 4.29Å; F505-H514 HydrophobicContact CE1-CB 3.85Å; F505-H514 HydrophobicContact CE2-CB 3.89Å; F505-H514 AromaticContact CE2-CD2 3.5Å; F505-H514 VanDerWaalsContact CE2-CD2 3.5Å; F505-H514 WeakPolarHBondContact CE2-CD2 3.04Å; F505-H514 AromaticContact CE2-CG 3.72Å; F505-H514 HydrophobicContact CZ-CB 3.39Å; F505-H514 AromaticContact CZ-CD2 3.43Å; F505-H514 VanDerWaalsContact CZ-CD2 3.43Å; F505-H514 WeakPolarHBondContact CZ-CD2 3.35Å; F505-H514 AromaticContact CZ-CG 3.2Å; F505-H514 AromaticContact CZ-ND1 3.77Å
506	V	86.4	Confident	87.3	Confident	30 Å²	30	76.9 Å²	76.9	18%	0.182	39%	0.388	C	S	.	.	S	Bend	trans	-75.5	-32.1	-178.4	-175.5	0	0	0	0	111.6	V485 R488 I489 K494	V485-V506 HydrophobicContact CG1-CG1 4.2Å; V485-V506 WeakPolarHBondContact O-CG1 3.35Å; R488-V506 HydrophobicContact CB-CG1 3.44Å; R488-V506 VanDerWaalsContact CB-CG1 3.44Å; R488-V506 PolarHBondContact NH1-O 3.19Å; I489-V506 HydrophobicContact CG1-CG1 4.24Å; K494-V506 HydrophobicContact CG-CG2 3.9Å
507	G	87.8	Confident	87.2	Confident	4 Å²	4	78.2 Å²	78.2	4%	0.041	40%	0.404	C	S	.	.	S	Bend	trans	-126.8	149.9	179.9	0	0	0	0	0	113.7	S509 D510 L511	G507-S509 VanDerWaalsContact C-N 3.29Å; G507-S509 PolarHBondContact O-N 3.33Å; G507-D510 PolarHBondContact O-N 3.22Å; G507-L511 PolarHBondContact O-N 3.48Å
508	S	86.7	Confident	86.9	Confident	47 Å²	47	74.8 Å²	74.8	33%	0.329	39%	0.391	S	S	.	.	H	α-helix	trans	-64.2	-32.6	176.7	172.7	0	0	0	0	112.6	Y496 D510 L511 K512	Y496-S508 VanDerWaalsContact CE2-N 3.31Å; S508-D510 VanDerWaalsContact C-N 3.31Å; S508-D510 PolarHBondContact O-N 3.49Å; S508-L511 PolarHBondContact O-N 3.03Å; S508-K512 WeakPolarHBondContact O-CG 3.36Å; S508-K512 PolarHBondContact O-N 3.46Å
509	S	85.4	Confident	86.1	Confident	96 Å²	96	79 Å²	79	67%	0.671	42%	0.416	S	S	*	.	H	α-helix	trans	-65.3	-35.5	176.5	-53	0	0	0	0	112.2	G507 K512 R513	G507-S509 VanDerWaalsContact C-N 3.29Å; G507-S509 PolarHBondContact O-N 3.33Å; S509-K512 PolarHBondContact O-N 3.43Å; S509-R513 WeakPolarHBondContact O-CB 3.42Å; S509-R513 PolarHBondContact O-N 3.46Å
510	D	86.8	Confident	84.7	Confident	53 Å²	53	74.8 Å²	74.8	28%	0.283	41%	0.41	S	S	.	.	H	α-helix	trans	-69.7	-42.6	177	-61.7	-55.7	0	0	0	111.2	F505 G507 S508 R513 H514	F505-D510 HydrophobicContact CB-CB 4.13Å; F505-D510 HydrophobicContact CD1-CB 3.95Å; F505-D510 HydrophobicContact CG-CB 4.33Å; G507-D510 PolarHBondContact O-N 3.22Å; S508-D510 VanDerWaalsContact C-N 3.31Å; S508-D510 PolarHBondContact O-N 3.49Å; D510-R513 PolarHBondContact O-N 3.44Å; D510-R513 IonicContact OD1-CZ 3.65Å; D510-R513 IonicContact OD1-NH2 2.67Å; D510-R513 PolarHBondContact OD1-NH2 3.41Å; D510-H514 WeakPolarHBondContact O-CB 3.41Å; D510-H514 PolarHBondContact O-N 2.72Å
511	L	87.9	Confident	83	Confident	17 Å²	17	78 Å²	78	9%	0.089	42%	0.416	C	S	.	.	H	α-helix	trans	-58.2	-50.5	171.3	173.5	61	0	0	0	110.9	C498 F505 G507 S508 R513 H514 E515	C498-L511 HydrophobicContact CB-CD1 3.64Å; F505-L511 HydrophobicContact CB-CB 4.31Å; F505-L511 HydrophobicContact CD2-CB 3.97Å; F505-L511 HydrophobicContact CD2-CD1 3.8Å; F505-L511 HydrophobicContact CD2-CG 4.5Å; F505-L511 HydrophobicContact CE2-CD1 3.97Å; F505-L511 HydrophobicContact CG-CB 4.29Å; G507-L511 PolarHBondContact O-N 3.48Å; S508-L511 PolarHBondContact O-N 3.03Å; L511-R513 VanDerWaalsContact C-N 3.27Å; L511-R513 PolarHBondContact O-N 2.83Å; L511-H514 CarbonylContact O-C 3.37Å; L511-H514 WeakPolarHBondContact O-CA 3.32Å; L511-H514 WeakPolarHBondContact O-CB 3.48Å; L511-H514 PolarHBondContact O-N 2.92Å; L511-E515 HydrophobicContact CD1-CG 3.96Å; L511-E515 HydrophobicContact CG-CG 4.24Å; L511-E515 WeakPolarHBondContact O-CG 3.47Å; L511-E515 PolarHBondContact O-N 3.37Å
512	K	86.4	Confident	80.8	Confident	124 Å²	124	84.3 Å²	84.3	54%	0.539	44%	0.44	S	S	.	.	H	α-helix	trans	-59.7	-35.3	178.5	-76.6	-176.2	179.5	-173.5	0	113.5	S508 S509 R516	S508-K512 WeakPolarHBondContact O-CG 3.36Å; S508-K512 PolarHBondContact O-N 3.46Å; S509-K512 PolarHBondContact O-N 3.43Å; K512-R516 WeakPolarHBondContact O-CG 3.42Å
513	R	88.3	Confident	78.6	Confident	163 Å²	163	87.1 Å²	87.1	62%	0.615	45%	0.447	S	S	*	.	H	α-helix	trans	-68.9	-40.3	174.2	174.9	171.1	54.6	172.5	-3.9	110.7	S509 D510 L511 R516	S509-R513 WeakPolarHBondContact O-CB 3.42Å; S509-R513 PolarHBondContact O-N 3.46Å; D510-R513 PolarHBondContact O-N 3.44Å; D510-R513 IonicContact OD1-CZ 3.65Å; D510-R513 IonicContact OD1-NH2 2.67Å; D510-R513 PolarHBondContact OD1-NH2 3.41Å; L511-R513 VanDerWaalsContact C-N 3.27Å; L511-R513 PolarHBondContact O-N 2.83Å; R513-R516 WeakPolarHBondContact O-CB 3.46Å; R513-R516 PolarHBondContact O-N 3.44Å
514	H	87.3	Confident	76.3	Confident	28 Å²	28	89.5 Å²	89.5	13%	0.13	47%	0.465	C	S	.	.	H	α-helix	trans	-66.8	-41.2	176	175.9	66	0	0	0	112.7	C501 F505 D510 L511 R516 V517 H518	C501-H514 PolarHBondContact SG-NE2 3.34Å; F505-H514 HydrophobicContact CE1-CB 3.85Å; F505-H514 HydrophobicContact CE2-CB 3.89Å; F505-H514 AromaticContact CE2-CD2 3.5Å; F505-H514 VanDerWaalsContact CE2-CD2 3.5Å; F505-H514 WeakPolarHBondContact CE2-CD2 3.04Å; F505-H514 AromaticContact CE2-CG 3.72Å; F505-H514 HydrophobicContact CZ-CB 3.39Å; F505-H514 AromaticContact CZ-CD2 3.43Å; F505-H514 VanDerWaalsContact CZ-CD2 3.43Å; F505-H514 WeakPolarHBondContact CZ-CD2 3.35Å; F505-H514 AromaticContact CZ-CG 3.2Å; F505-H514 AromaticContact CZ-ND1 3.77Å; D510-H514 WeakPolarHBondContact O-CB 3.41Å; D510-H514 PolarHBondContact O-N 2.72Å; L511-H514 CarbonylContact O-C 3.37Å; L511-H514 WeakPolarHBondContact O-CA 3.32Å; L511-H514 WeakPolarHBondContact O-CB 3.48Å; L511-H514 PolarHBondContact O-N 2.92Å; H514-R516 PolarHBondContact O-N 3.04Å; H514-R516 VanDerWaalsContact O-N 3.17Å; H514-V517 WeakPolarHBondContact O-CB 3.47Å; H514-V517 WeakPolarHBondContact O-CG2 3.28Å; H514-V517 PolarHBondContact O-N 3.43Å; H514-H518 AromaticContact CD2-NE2 3.7Å; H514-H518 AromaticContact CE1-NE2 3.55Å; H514-H518 AromaticContact NE2-CD2 3.89Å; H514-H518 AromaticContact NE2-CE1 3.82Å; H514-H518 AromaticContact NE2-NE2 2.97Å; H514-H518 PolarHBondContact NE2-NE2 3.02Å
515	E	86.3	Confident	73.9	Confident	73 Å²	73	96.8 Å²	96.8	34%	0.341	49%	0.493	S	S	.	.	H	α-helix	trans	-57.3	-30.6	176.6	-74.1	169.8	164.7	0	0	112.2	L511 V517 H518 T519	L511-E515 HydrophobicContact CD1-CG 3.96Å; L511-E515 HydrophobicContact CG-CG 4.24Å; L511-E515 WeakPolarHBondContact O-CG 3.47Å; L511-E515 PolarHBondContact O-N 3.37Å; E515-V517 PolarHBondContact O-N 3.18Å; E515-H518 PolarHBondContact O-N 3.42Å; E515-H518 VanDerWaalsContact O-N 3.09Å; E515-T519 PolarHBondContact O-N 2.97Å
516	R	86.6	Confident	71.2	Confident	147 Å²	147	107.3 Å²	107.3	56%	0.555	55%	0.546	S	S	*	.	H	α-helix	trans	-62.6	-27.3	175.3	-66.6	176.6	-163.5	-178.5	1.7	113.7	K512 R513 H514 H518 T519 G520	K512-R516 WeakPolarHBondContact O-CG 3.42Å; R513-R516 WeakPolarHBondContact O-CB 3.46Å; R513-R516 PolarHBondContact O-N 3.44Å; H514-R516 PolarHBondContact O-N 3.04Å; H514-R516 VanDerWaalsContact O-N 3.17Å; R516-H518 VanDerWaalsContact C-N 3.27Å; R516-T519 WeakPolarHBondContact CA-OG1 3.48Å; R516-T519 PolarHBondContact O-N 2.86Å; R516-T519 PolarHBondContact O-OG1 3.49Å; R516-G520 PolarHBondContact O-N 3.4Å
517	V	85.3	Confident	70.4	Confident	107 Å²	107	111.2 Å²	111.2	65%	0.648	56%	0.564	S	S	*	*	H	α-helix	trans	-66.4	-35.1	176.9	-176.7	0	0	0	0	110.2	H514 E515	H514-V517 WeakPolarHBondContact O-CB 3.47Å; H514-V517 WeakPolarHBondContact O-CG2 3.28Å; H514-V517 PolarHBondContact O-N 3.43Å; E515-V517 PolarHBondContact O-N 3.18Å
518	H	80.9	Confident	69.5	Low	71 Å²	71	116.8 Å²	116.8	33%	0.329	59%	0.592	S	S	.	*	H	α-helix	trans	-77.9	-24.8	176	-57.8	-57.1	0	0	0	112.9	H514 E515 R516	H514-H518 AromaticContact CD2-NE2 3.7Å; H514-H518 AromaticContact CE1-NE2 3.55Å; H514-H518 AromaticContact NE2-CD2 3.89Å; H514-H518 AromaticContact NE2-CE1 3.82Å; H514-H518 AromaticContact NE2-NE2 2.97Å; H514-H518 PolarHBondContact NE2-NE2 3.02Å; E515-H518 PolarHBondContact O-N 3.42Å; E515-H518 VanDerWaalsContact O-N 3.09Å; R516-H518 VanDerWaalsContact C-N 3.27Å
519	T	74	Confident	68.5	Low	91 Å²	91	120.7 Å²	120.7	56%	0.558	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	5.7	-179.8	64.1	0	0	0	0	114.3	E515 R516 R521	E515-T519 PolarHBondContact O-N 2.97Å; R516-T519 WeakPolarHBondContact CA-OG1 3.48Å; R516-T519 PolarHBondContact O-N 2.86Å; R516-T519 PolarHBondContact O-OG1 3.49Å; T519-R521 PolarHBondContact O-N 3.47Å
520	G	59.5	Low	67.5	Low	69 Å²	69	122.2 Å²	122.2	71%	0.711	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	57.7	33.4	169.6	0	0	0	0	0	116.7	R516	R516-G520 PolarHBondContact O-N 3.4Å
521	R	48.1	Very low	66.3	Low	207 Å²	207	126.5 Å²	126.5	78%	0.781	62%	0.622	S	S	*	*			trans	-105.3	92.8	172.6	-89.6	-173.3	176.6	179.7	-0.2	111.2	T519 T523	T519-R521 PolarHBondContact O-N 3.47Å; R521-T523 PolarHBondContact O-N 3.47Å
522	E	43.4	Very low	64.9	Low	187 Å²	187	133.8 Å²	133.8	87%	0.874	66%	0.658	S	S	*	*			trans	-59.7	110.9	153.7	-70.2	-179.3	153.3	0	0	108.2	L524	E522-L524 PolarHBondContact O-N 3.2Å
523	T	39.6	Very low	63.3	Low	113 Å²	113	134.5 Å²	134.5	69%	0.693	67%	0.666	S	S	*	*			trans	-76.3	99.6	162	43.5	0	0	0	0	107.4	R521 Q525	R521-T523 PolarHBondContact O-N 3.47Å; T523-Q525 PolarHBondContact O-N 2.9Å
524	L	38.5	Very low	61.4	Low	175 Å²	175	132.3 Å²	132.3	92%	0.916	67%	0.67	S	S	*	*			trans	-49	119.1	154.3	-87	155.8	0	0	0	108	E522	E522-L524 PolarHBondContact O-N 3.2Å
525	Q	38.2	Very low	59.3	Low	188 Å²	188	141 Å²	141	88%	0.879	72%	0.716	S	S	*	*			trans	-102.1	110.9	174.5	-154.9	173.4	0.1	0	0	106.3	T523	T523-Q525 PolarHBondContact O-N 2.9Å
526	M	31.1	Very low	56.8	Low	264 Å²	264	147.2 Å²	147.2	100%	1.3	75%	0.75	S	S	*	*			trans	-105.1	0	150.1	-79.2	-169.8	94.6	0	0	107.7

Retrieved 526 of 526 residues in 515.5 ms (Link to these results)

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