A0A096NA40_PAPAN Loading...

NADH-cytochrome b5 reductase

NADH-cytochrome b5 reductases are involved in desaturation and elongation of fatty acids, cholesterol biosynthesis, drug metabolism, and, in erythrocyte, methemoglobin reduction.

AlphaFold DB (A0A2K5ZRY5), UniProt , Accession A0A096NA40, Species PAPAN (Papio anubis, Olive baboon), Gene CYB5RL, Length 315 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.9	Very low	52.7	Low	244 Å²	244	147.5 Å²	147.5	100%	1.202	74%	0.742	S	S	*	*				0	88	0	-72.2	177.5	-174.8	0	0	107.5
2	M	37.8	Very low	55.2	Low	190 Å²	190	146.3 Å²	146.3	94%	0.936	73%	0.732	S	S	*	*			trans	-88.7	114.8	162.4	-76.7	-173.8	179.7	0	0	104.8	E4	M2-E4 PolarHBondContact O-N 3.19Å
3	G	40.4	Very low	57.7	Low	74 Å²	74	146.8 Å²	146.8	76%	0.763	73%	0.73	S	S	*	*			trans	-65	121.5	177.4	0	0	0	0	0	109.3	R5	G3-R5 PolarHBondContact O-N 3.31Å
4	E	44.2	Very low	59.9	Low	185 Å²	185	137.9 Å²	137.9	86%	0.864	69%	0.691	S	S	*	*			trans	-57.2	117	160.3	-68.1	173	164.6	0	0	106.4	M2 E6	M2-E4 PolarHBondContact O-N 3.19Å; E4-E6 VanDerWaalsContact C-N 3.35Å; E4-E6 PolarHBondContact O-N 3.13Å
5	R	45.3	Very low	61.8	Low	240 Å²	240	129.3 Å²	129.3	91%	0.906	65%	0.648	S	S	*	*			trans	-69.4	100.8	166.5	-78.4	179.5	179.3	-173.1	-1.7	105.5	G3 E7	G3-R5 PolarHBondContact O-N 3.31Å; R5-E7 PolarHBondContact O-N 3.42Å
6	E	46.2	Very low	63.5	Low	188 Å²	188	126.5 Å²	126.5	88%	0.879	64%	0.635	S	S	*	*			trans	-58.2	106.7	158.7	-69.7	178.7	161.8	0	0	105.9	E4 D8	E4-E6 VanDerWaalsContact C-N 3.35Å; E4-E6 PolarHBondContact O-N 3.13Å; E6-D8 PolarHBondContact O-N 2.78Å; E6-D8 VanDerWaalsContact O-N 3.16Å
7	E	54.7	Low	65	Low	176 Å²	176	128.9 Å²	128.9	82%	0.822	64%	0.643	S	S	*	*			trans	-60.2	116.7	168.2	-75.3	180	165.7	0	0	106.6	R5 D9	R5-E7 PolarHBondContact O-N 3.42Å; E7-D9 VanDerWaalsContact C-N 3.32Å; E7-D9 PolarHBondContact O-N 3.07Å
8	D	57.1	Low	66.5	Low	118 Å²	118	125.8 Å²	125.8	63%	0.631	63%	0.629	S	S	*	*			trans	-66.6	96	179.9	-166.1	-1.7	0	0	0	108.2	E6 D10 T11	E6-D8 PolarHBondContact O-N 2.78Å; E6-D8 VanDerWaalsContact O-N 3.16Å; D8-D10 PolarHBondContact O-N 2.97Å; D8-T11 HydrophobicContact CB-CG2 4.01Å; D8-T11 WeakPolarHBondContact O-CG2 3.43Å; D8-T11 PolarHBondContact O-N 2.84Å; D8-T11 PolarHBondContact O-OG1 3.02Å
9	D	62.1	Low	67.9	Low	90 Å²	90	125.4 Å²	125.4	48%	0.481	62%	0.619	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.2	3.9	-169.1	-149.2	29.1	0	0	0	112.3	E7 R57	E7-D9 VanDerWaalsContact C-N 3.32Å; E7-D9 PolarHBondContact O-N 3.07Å; D9-R57 PolarHBondContact O-NE 3.31Å; D9-R57 PolarHBondContact O-NH2 2.72Å; D9-R57 IonicContact OD1-CZ 2.62Å; D9-R57 IonicContact OD1-NH1 3.94Å; D9-R57 PolarHBondContact OD1-NH1 2.63Å; D9-R57 IonicContact OD1-NH2 2.7Å; D9-R57 PolarHBondContact OD1-NH2 2.83Å; D9-R57 IonicContact OD2-CZ 2.73Å; D9-R57 IonicContact OD2-NE 2.83Å; D9-R57 IonicContact OD2-NH1 2.99Å; D9-R57 PolarHBondContact OD2-NH1 3.27Å; D9-R57 IonicContact OD2-NH2 3.66Å
10	D	69.6	Low	69.1	Low	59 Å²	59	120.7 Å²	120.7	32%	0.316	60%	0.598	S	S	.	*	T	Hydrogen-bonded Turn	trans	-116.9	15.5	179.8	-156.7	26.2	0	0	0	113.4	D8 W15 K55	D8-D10 PolarHBondContact O-N 2.97Å; D10-W15 PolarHBondContact OD1-NE1 2.84Å; D10-K55 VanDerWaalsContact OD2-CD 3.31Å; D10-K55 WeakPolarHBondContact OD2-CD 3.2Å; D10-K55 VanDerWaalsContact OD2-CE 3.31Å; D10-K55 WeakPolarHBondContact OD2-CE 3.19Å; D10-K55 IonicContact OD2-NZ 3.48Å; D10-K55 PolarHBondContact OD2-NZ 3.33Å
11	T	83.8	Confident	70.3	Confident	59 Å²	59	123.3 Å²	123.3	36%	0.362	61%	0.611	S	S	.	*			trans	-69.5	150.3	174.1	54.5	0	0	0	0	112.5	D8 E13 A14 W15	D8-T11 HydrophobicContact CB-CG2 4.01Å; D8-T11 WeakPolarHBondContact O-CG2 3.43Å; D8-T11 PolarHBondContact O-N 2.84Å; D8-T11 PolarHBondContact O-OG1 3.02Å; T11-E13 PolarHBondContact O-N 3.07Å; T11-A14 PolarHBondContact O-N 3.16Å; T11-A14 VanDerWaalsContact O-N 3.12Å; T11-A14 VanDerWaalsContact OG1-CB 3.3Å; T11-A14 WeakPolarHBondContact OG1-CB 3.22Å; T11-A14 PolarHBondContact OG1-N 3.04Å; T11-W15 PolarHBondContact O-N 3.47Å; T11-W15 VanDerWaalsContact O-N 3.16Å
12	E	82.4	Confident	72.9	Confident	132 Å²	132	117.7 Å²	117.7	62%	0.617	58%	0.582	S	S	*	*	H	α-helix	trans	-58.8	-37.8	177.6	-176.6	168.9	-161.9	0	0	112	W15 L16 R52	E12-W15 PolarHBondContact O-N 3.28Å; E12-L16 HydrophobicContact CG-CD1 4.35Å; E12-L16 WeakPolarHBondContact O-CG 3.37Å; E12-L16 PolarHBondContact O-N 3.09Å; E12-R52 IonicContact OE1-NH2 2.92Å
13	E	87.8	Confident	75.6	Confident	153 Å²	153	109.5 Å²	109.5	72%	0.715	54%	0.543	S	S	*	.	H	α-helix	trans	-63.1	-43.2	175.2	-67.2	-178.2	174.3	0	0	111.9	T11 W15 L16 Q17	T11-E13 PolarHBondContact O-N 3.07Å; E13-W15 VanDerWaalsContact C-N 3.34Å; E13-W15 PolarHBondContact O-N 2.65Å; E13-L16 PolarHBondContact O-N 3.16Å; E13-Q17 WeakPolarHBondContact O-CG 3.47Å; E13-Q17 PolarHBondContact O-N 3.28Å; E13-Q17 VanDerWaalsContact O-N 3.13Å
14	A	88.3	Confident	78.2	Confident	22 Å²	22	110.2 Å²	110.2	18%	0.182	53%	0.529	C	S	.	.	H	α-helix	trans	-62.2	-40.5	177.8	0	0	0	0	0	112	T11 Q17 L18	T11-A14 PolarHBondContact O-N 3.16Å; T11-A14 VanDerWaalsContact O-N 3.12Å; T11-A14 VanDerWaalsContact OG1-CB 3.3Å; T11-A14 WeakPolarHBondContact OG1-CB 3.22Å; T11-A14 PolarHBondContact OG1-N 3.04Å; A14-Q17 PolarHBondContact O-N 2.87Å; A14-L18 WeakPolarHBondContact O-CG 3.47Å
15	W	89	Confident	80.5	Confident	10 Å²	10	106.5 Å²	106.5	4%	0.038	52%	0.52	C	S	.	.	H	α-helix	trans	-66.3	-38	175	-78.9	105.8	0	0	0	113	D10 T11 E12 E13 Q17 L18 R19 W48 A51 R52 R57 L60	D10-W15 PolarHBondContact OD1-NE1 2.84Å; T11-W15 PolarHBondContact O-N 3.47Å; T11-W15 VanDerWaalsContact O-N 3.16Å; E12-W15 PolarHBondContact O-N 3.28Å; E13-W15 VanDerWaalsContact C-N 3.34Å; E13-W15 PolarHBondContact O-N 2.65Å; W15-Q17 VanDerWaalsContact C-N 3.32Å; W15-Q17 PolarHBondContact O-N 3.33Å; W15-L18 HydrophobicContact CE3-CD1 4.49Å; W15-L18 PolarHBondContact O-N 3.23Å; W15-R19 PolarHBondContact O-N 3.45Å; W15-W48 PolarHBondContact O-NE1 3.16Å; W15-A51 HydrophobicContact CH2-CB 4.13Å; W15-A51 WeakPolarHBondContact CH2-O 3.39Å; W15-A51 HydrophobicContact CZ3-CB 3.84Å; W15-R52 HydrophobicContact CB-CG 4.45Å; W15-R52 HydrophobicContact CD2-CB 4.19Å; W15-R52 HydrophobicContact CD2-CG 4.13Å; W15-R52 HydrophobicContact CE3-CB 3.85Å; W15-R52 HydrophobicContact CE3-CG 4.26Å; W15-R52 HydrophobicContact CG-CG 4.21Å; W15-R52 HydrophobicContact CZ3-CB 4.15Å; W15-R57 HydrophobicContact CH2-CB 4.43Å; W15-R57 HydrophobicContact CH2-CG 3.44Å; W15-R57 VanDerWaalsContact CH2-CG 3.44Å; W15-R57 HydrophobicContact CZ2-CG 3.83Å; W15-R57 HydrophobicContact CZ3-CG 4.06Å; W15-L60 HydrophobicContact CZ3-CD1 4.2Å
16	L	88.5	Confident	82.7	Confident	84 Å²	84	96.4 Å²	96.4	44%	0.44	49%	0.487	S	S	.	.	H	α-helix	trans	-65.5	-34.1	177.8	-74.1	172.1	0	0	0	112.5	E12 E13 L18 R19	E12-L16 HydrophobicContact CG-CD1 4.35Å; E12-L16 WeakPolarHBondContact O-CG 3.37Å; E12-L16 PolarHBondContact O-N 3.09Å; E13-L16 PolarHBondContact O-N 3.16Å; L16-L18 PolarHBondContact O-N 3.2Å; L16-R19 VanDerWaalsContact O-CB 3.32Å; L16-R19 WeakPolarHBondContact O-CB 3.36Å; L16-R19 PolarHBondContact O-N 3.08Å
17	Q	89.4	Confident	84.9	Confident	168 Å²	168	89.3 Å²	89.3	79%	0.785	45%	0.453	S	S	*	.	H	α-helix	trans	-66.5	-25.2	175	-66.1	-63	-20	0	0	113.1	E13 A14 W15 R19	E13-Q17 WeakPolarHBondContact O-CG 3.47Å; E13-Q17 PolarHBondContact O-N 3.28Å; E13-Q17 VanDerWaalsContact O-N 3.13Å; A14-Q17 PolarHBondContact O-N 2.87Å; W15-Q17 VanDerWaalsContact C-N 3.32Å; W15-Q17 PolarHBondContact O-N 3.33Å; Q17-R19 VanDerWaalsContact C-N 3.34Å
18	L	90.8	Very high	86.7	Confident	72 Å²	72	82.6 Å²	82.6	38%	0.377	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-4.9	177.8	-62.2	173.3	0	0	0	113.1	A14 W15 L16 W48 L60	A14-L18 WeakPolarHBondContact O-CG 3.47Å; W15-L18 HydrophobicContact CE3-CD1 4.49Å; W15-L18 PolarHBondContact O-N 3.23Å; L16-L18 PolarHBondContact O-N 3.2Å; L18-W48 VanDerWaalsContact O-CD1 3.27Å; L18-L60 HydrophobicContact CB-CD1 4.23Å; L18-L60 HydrophobicContact CD1-CD1 3.77Å; L18-L60 HydrophobicContact CG-CD1 4.46Å
19	R	93.1	Very high	88.3	Confident	118 Å²	118	77.4 Å²	77.4	45%	0.445	40%	0.398	S	S	.	.	S	Bend	trans	-68.9	129.6	-179.7	-171.2	-179.7	178	-174.2	-1.2	109.3	W15 L16 Q17 L45 W48	W15-R19 PolarHBondContact O-N 3.45Å; L16-R19 VanDerWaalsContact O-CB 3.32Å; L16-R19 WeakPolarHBondContact O-CB 3.36Å; L16-R19 PolarHBondContact O-N 3.08Å; Q17-R19 VanDerWaalsContact C-N 3.34Å; R19-L45 HydrophobicContact CG-CD1 4.28Å; R19-W48 HydrophobicContact CB-CD2 4.13Å; R19-W48 HydrophobicContact CB-CH2 4.35Å; R19-W48 HydrophobicContact CB-CZ2 3.79Å; R19-W48 HydrophobicContact CG-CD2 3.99Å; R19-W48 HydrophobicContact CG-CE3 4.07Å; R19-W48 HydrophobicContact CG-CH2 4.09Å; R19-W48 HydrophobicContact CG-CZ2 4.01Å; R19-W48 HydrophobicContact CG-CZ3 4.13Å
20	P	93.3	Very high	89.5	Confident	32 Å²	32	76.4 Å²	76.4	21%	0.208	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-62.4	142.7	175.8	26	-33.4	0	0	0	110.4	Y41 D44 L45	P20-Y41 HydrophobicContact CB-CD2 4.08Å; P20-Y41 HydrophobicContact CB-CE2 4.26Å; P20-Y41 HydrophobicContact CG-CD2 4.34Å; P20-Y41 HydrophobicContact CG-CE2 4.24Å; P20-Y41 WeakPolarHBondContact O-CE2 3.26Å; P20-D44 HydrophobicContact CB-CB 4.37Å; P20-D44 HydrophobicContact CG-CB 4.34Å; P20-L45 HydrophobicContact CG-CB 4.02Å; P20-L45 HydrophobicContact CG-CD1 4.22Å
21	M	92.9	Very high	90.2	Very high	176 Å²	176	76.3 Å²	76.3	87%	0.867	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-84	136.5	175.5	-65.6	-172.5	-172.2	0	0	110.1	Y41	M21-Y41 WeakPolarHBondContact O-CD2 3.24Å
22	E	94.9	Very high	90.2	Very high	126 Å²	126	77.1 Å²	77.1	59%	0.589	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-64.8	128.5	175.6	-171.6	166.8	-171.6	0	0	110.3	Y41	E22-Y41 HydrophobicContact CB-CE1 3.95Å; E22-Y41 HydrophobicContact CB-CE2 4.01Å; E22-Y41 HydrophobicContact CG-CD1 4.2Å; E22-Y41 HydrophobicContact CG-CE1 3.71Å
23	P	93.9	Very high	90.4	Very high	17 Å²	17	71.4 Å²	71.4	11%	0.11	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-63	144.5	178.8	-21.9	31.5	0	0	0	112.1	Q27 V37 F38 Y41	P23-Q27 HydrophobicContact CB-CB 4.4Å; P23-V37 HydrophobicContact CB-CB 4.34Å; P23-V37 HydrophobicContact CB-CG2 3.99Å; P23-V37 HydrophobicContact CG-CB 4.28Å; P23-V37 HydrophobicContact CG-CG2 4.33Å; P23-F38 HydrophobicContact CB-CD1 4.19Å; P23-F38 HydrophobicContact CB-CE1 3.92Å; P23-F38 HydrophobicContact CB-CZ 4.43Å; P23-F38 HydrophobicContact CG-CD1 4.15Å; P23-F38 HydrophobicContact CG-CE1 4.36Å; P23-F38 VanDerWaalsContact O-CE1 3.29Å; P23-F38 WeakPolarHBondContact O-CE1 3.22Å; P23-Y41 VanDerWaalsContact CD-CB 3.5Å; P23-Y41 VanDerWaalsContact CD-CG 3.47Å; P23-Y41 HydrophobicContact CG-CG 4.32Å
24	L	94.4	Very high	90.5	Very high	90 Å²	90	68.9 Å²	68.9	47%	0.471	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-73	152	169.8	-64.1	175.9	0	0	0	110.6	S26 Q27 L122	L24-S26 PolarHBondContact O-N 3.43Å; L24-Q27 HydrophobicContact CB-CG 4.42Å; L24-Q27 WeakPolarHBondContact O-CB 3.39Å; L24-Q27 PolarHBondContact O-N 3.04Å; L24-L122 HydrophobicContact CD1-CD1 3.66Å
25	P	93.1	Very high	90.6	Very high	106 Å²	106	69.1 Å²	69.1	69%	0.688	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-54.1	-28.6	173.6	-27.9	35.5	0	0	0	114	Q27 C28	P25-Q27 VanDerWaalsContact C-N 3.26Å; P25-Q27 PolarHBondContact O-N 2.91Å; P25-C28 WeakPolarHBondContact O-CB 3.23Å; P25-C28 PolarHBondContact O-N 3.43Å
26	S	92.1	Very high	90.8	Very high	28 Å²	28	69.6 Å²	69.6	20%	0.196	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	-65.6	-26.7	176.7	61.9	0	0	0	0	113.7	L24 C28 L122 E123 I124 Q125	L24-S26 PolarHBondContact O-N 3.43Å; S26-C28 VanDerWaalsContact C-N 3.28Å; S26-L122 WeakPolarHBondContact OG-CD1 3.47Å; S26-E123 WeakPolarHBondContact CB-O 3.3Å; S26-E123 PolarHBondContact OG-O 3.35Å; S26-I124 WeakPolarHBondContact O-CA 3.43Å; S26-Q125 PolarHBondContact O-N 3.45Å
27	Q	92.3	Very high	91	Very high	39 Å²	39	66.2 Å²	66.2	18%	0.182	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-79	-11.8	178.1	-62.7	179.1	-90.3	0	0	112.4	P23 L24 P25 V37 E123 Q125	P23-Q27 HydrophobicContact CB-CB 4.4Å; L24-Q27 HydrophobicContact CB-CG 4.42Å; L24-Q27 WeakPolarHBondContact O-CB 3.39Å; L24-Q27 PolarHBondContact O-N 3.04Å; P25-Q27 VanDerWaalsContact C-N 3.26Å; P25-Q27 PolarHBondContact O-N 2.91Å; Q27-V37 HydrophobicContact CB-CG2 4.39Å; Q27-E123 HydrophobicContact CG-CB 3.87Å; Q27-E123 HydrophobicContact CG-CG 4.05Å; Q27-E123 PolarHBondContact NE2-OE1 2.81Å; Q27-Q125 WeakPolarHBondContact O-CB 3.32Å; Q27-Q125 VanDerWaalsContact O-CG 3.3Å; Q27-Q125 WeakPolarHBondContact O-CG 3.41Å; Q27-Q125 PolarHBondContact O-NE2 2.9Å; Q27-Q125 PolarHBondContact O-OE1 2.71Å
28	C	92.4	Very high	91.3	Very high	36 Å²	36	60.9 Å²	60.9	24%	0.243	37%	0.369	C	S	.	.	S	Bend	trans	-74.1	133.9	168.6	-174.8	0	0	0	0	110.4	P25 S26 G30 F38	P25-C28 WeakPolarHBondContact O-CB 3.23Å; P25-C28 PolarHBondContact O-N 3.43Å; S26-C28 VanDerWaalsContact C-N 3.28Å; C28-G30 PolarHBondContact O-N 3.42Å; C28-G30 PolarHBondContact SG-N 2.68Å; C28-G30 VanDerWaalsContact SG-N 3.44Å; C28-F38 HydrophobicContact CB-CE2 3.9Å
29	C	90.3	Very high	91.4	Very high	8 Å²	8	61.1 Å²	61.1	5%	0.054	37%	0.37	C	S	.	.			trans	-71.5	-20.5	176.9	70.5	0	0	0	0	113.2	S31 C33 I114 Q125	C29-S31 VanDerWaalsContact C-N 3.27Å; C29-S31 PolarHBondContact O-N 3.2Å; C29-S31 PolarHBondContact SG-N 3.19Å; C29-S31 VanDerWaalsContact SG-N 3.42Å; C29-C33 PolarHBondContact SG-SG 2.83Å; C29-I114 HydrophobicContact CB-CD1 3.98Å; C29-I114 HydrophobicContact CB-CG1 4.2Å; C29-I114 HydrophobicContact CB-CG2 4.27Å; C29-Q125 WeakPolarHBondContact CA-O 3.3Å; C29-Q125 HydrophobicContact CB-CB 4.43Å
30	G	87.4	Confident	91.4	Very high	69 Å²	69	56.5 Å²	56.5	71%	0.711	36%	0.355	S	S	*	.	S	Bend	trans	78.1	4.1	-178.5	0	0	0	0	0	115.1	C28	C28-G30 PolarHBondContact O-N 3.42Å; C28-G30 PolarHBondContact SG-N 2.68Å; C28-G30 VanDerWaalsContact SG-N 3.44Å
31	S	84.4	Confident	91.4	Very high	57 Å²	57	56 Å²	56	40%	0.399	35%	0.349	S	S	.	.	S	Bend	trans	-103.2	10.2	-174.6	-54.5	0	0	0	0	114.2	C29 C33 A127	C29-S31 VanDerWaalsContact C-N 3.27Å; C29-S31 PolarHBondContact O-N 3.2Å; C29-S31 PolarHBondContact SG-N 3.19Å; C29-S31 VanDerWaalsContact SG-N 3.42Å; S31-C33 VanDerWaalsContact C-N 3.33Å; S31-C33 PolarHBondContact O-N 3.46Å; S31-A127 WeakPolarHBondContact OG-CB 3.48Å
32	G	84.1	Confident	91.6	Very high	77 Å²	77	52.6 Å²	52.6	79%	0.794	33%	0.33	S	S	*	.			trans	68.2	26.8	180	0	0	0	0	0	114.7
33	C	86.7	Confident	91.5	Very high	11 Å²	11	50.3 Å²	50.3	7%	0.074	32%	0.316	C	S	.	.			trans	-61.7	143.7	179.6	64.4	0	0	0	0	112.2	C29 S31 P35 C36 I114 F171	C29-C33 PolarHBondContact SG-SG 2.83Å; S31-C33 VanDerWaalsContact C-N 3.33Å; S31-C33 PolarHBondContact O-N 3.46Å; C33-P35 CarbonylContact O-C 3.55Å; C33-C36 WeakPolarHBondContact O-CA 3.46Å; C33-C36 WeakPolarHBondContact O-CB 3.3Å; C33-C36 PolarHBondContact O-N 2.83Å; C33-C36 VanDerWaalsContact O-N 3.16Å; C33-I114 HydrophobicContact CB-CD1 3.75Å; C33-I114 VanDerWaalsContact SG-CD1 3.56Å; C33-F171 HydrophobicContact CB-CD1 3.63Å; C33-F171 HydrophobicContact CB-CE1 3.95Å; C33-F171 HydrophobicContact CB-CG 4.08Å
34	S	89.4	Confident	91.5	Very high	100 Å²	100	52.3 Å²	52.3	70%	0.699	33%	0.326	S	S	*	.	S	Bend	trans	-125.5	124.2	170.5	-168.2	0	0	0	0	110.1
35	P	91.2	Very high	91.5	Very high	28 Å²	28	49.1 Å²	49.1	18%	0.182	31%	0.309	C	S	.	.	S	Bend	cis	-72.2	136.9	-3.1	30.1	-34	0	0	0	112.8	C33 D39 L40 P74 E75 R168	C33-P35 CarbonylContact O-C 3.55Å; P35-D39 HydrophobicContact CB-CB 4.21Å; P35-L40 HydrophobicContact CB-CD2 3.83Å; P35-L40 HydrophobicContact CB-CG 4.23Å; P35-L40 HydrophobicContact CG-CD2 3.91Å; P35-P74 HydrophobicContact CG-CB 4.29Å; P35-E75 HydrophobicContact CG-CG 4.13Å; P35-R168 PolarHBondContact O-NH1 3.01Å
36	C	92.7	Very high	91.6	Very high	19 Å²	19	46.6 Å²	46.6	13%	0.128	30%	0.298	C	S	.	.			trans	-76.5	159.4	167.3	-175.2	0	0	0	0	110.5	C33 F38 D39 L40	C33-C36 WeakPolarHBondContact O-CA 3.46Å; C33-C36 WeakPolarHBondContact O-CB 3.3Å; C33-C36 PolarHBondContact O-N 2.83Å; C33-C36 VanDerWaalsContact O-N 3.16Å; C36-F38 PolarHBondContact O-N 2.78Å; C36-D39 WeakPolarHBondContact CB-OD2 3.46Å; C36-D39 PolarHBondContact N-OD2 3.23Å; C36-D39 WeakPolarHBondContact O-CB 3.04Å; C36-D39 PolarHBondContact O-N 3.19Å; C36-L40 WeakPolarHBondContact O-CG 3.32Å; C36-L40 PolarHBondContact O-N 2.86Å
37	V	92.9	Very high	91.7	Very high	14 Å²	14	48.8 Å²	48.8	9%	0.085	30%	0.302	C	S	.	.	H	α-helix	trans	-56.5	-32.6	174.4	-64.1	0	0	0	0	112.5	P23 Q27 Y41	P23-V37 HydrophobicContact CB-CB 4.34Å; P23-V37 HydrophobicContact CB-CG2 3.99Å; P23-V37 HydrophobicContact CG-CB 4.28Å; P23-V37 HydrophobicContact CG-CG2 4.33Å; Q27-V37 HydrophobicContact CB-CG2 4.39Å; V37-Y41 WeakPolarHBondContact O-CB 3.21Å; V37-Y41 PolarHBondContact O-N 3.24Å
38	F	94.4	Very high	91.8	Very high	56 Å²	56	47.3 Å²	47.3	25%	0.246	29%	0.294	C	S	.	.	H	α-helix	trans	-71.7	-35.7	174.9	-64.2	-69.8	0	0	0	112.4	P23 C28 C36 L40 Y41 H42	P23-F38 HydrophobicContact CB-CD1 4.19Å; P23-F38 HydrophobicContact CB-CE1 3.92Å; P23-F38 HydrophobicContact CB-CZ 4.43Å; P23-F38 HydrophobicContact CG-CD1 4.15Å; P23-F38 HydrophobicContact CG-CE1 4.36Å; P23-F38 VanDerWaalsContact O-CE1 3.29Å; P23-F38 WeakPolarHBondContact O-CE1 3.22Å; C28-F38 HydrophobicContact CB-CE2 3.9Å; C36-F38 PolarHBondContact O-N 2.78Å; F38-L40 VanDerWaalsContact C-N 3.34Å; F38-Y41 PolarHBondContact O-N 3.25Å; F38-H42 PolarHBondContact O-CD2 3.33Å; F38-H42 PolarHBondContact O-N 2.84Å
39	D	93.6	Very high	91.9	Very high	76 Å²	76	50.6 Å²	50.6	41%	0.406	31%	0.306	S	S	.	.	H	α-helix	trans	-64.5	-43.1	175.1	-56.9	-31.5	0	0	0	110.5	P35 C36 H42 R43	P35-D39 HydrophobicContact CB-CB 4.21Å; C36-D39 WeakPolarHBondContact CB-OD2 3.46Å; C36-D39 PolarHBondContact N-OD2 3.23Å; C36-D39 WeakPolarHBondContact O-CB 3.04Å; C36-D39 PolarHBondContact O-N 3.19Å; D39-H42 PolarHBondContact O-N 3.33Å; D39-R43 WeakPolarHBondContact O-CB 3.49Å; D39-R43 PolarHBondContact O-N 3.49Å
40	L	92.5	Very high	92.1	Very high	22 Å²	22	52.5 Å²	52.5	12%	0.115	32%	0.323	C	S	.	.	H	α-helix	trans	-60.2	-48.5	174.6	-59.8	176.9	0	0	0	110.5	P35 C36 F38 R43 D44 E75	P35-L40 HydrophobicContact CB-CD2 3.83Å; P35-L40 HydrophobicContact CB-CG 4.23Å; P35-L40 HydrophobicContact CG-CD2 3.91Å; C36-L40 WeakPolarHBondContact O-CG 3.32Å; C36-L40 PolarHBondContact O-N 2.86Å; F38-L40 VanDerWaalsContact C-N 3.34Å; L40-R43 PolarHBondContact O-N 2.96Å; L40-D44 WeakPolarHBondContact O-CB 3.41Å; L40-D44 VanDerWaalsContact O-CG 3.29Å; L40-D44 PolarHBondContact O-N 3.17Å; L40-E75 HydrophobicContact CD2-CB 4.06Å; L40-E75 HydrophobicContact CD2-CG 3.88Å
41	Y	94.5	Very high	92.3	Very high	20 Å²	20	49.2 Å²	49.2	8%	0.078	29%	0.289	C	S	.	.	H	α-helix	trans	-57.4	-50.6	176.9	166	-110.6	0	0	0	112.8	P20 M21 E22 P23 V37 F38 R43 D44 L45	P20-Y41 HydrophobicContact CB-CD2 4.08Å; P20-Y41 HydrophobicContact CB-CE2 4.26Å; P20-Y41 HydrophobicContact CG-CD2 4.34Å; P20-Y41 HydrophobicContact CG-CE2 4.24Å; P20-Y41 WeakPolarHBondContact O-CE2 3.26Å; M21-Y41 WeakPolarHBondContact O-CD2 3.24Å; E22-Y41 HydrophobicContact CB-CE1 3.95Å; E22-Y41 HydrophobicContact CB-CE2 4.01Å; E22-Y41 HydrophobicContact CG-CD1 4.2Å; E22-Y41 HydrophobicContact CG-CE1 3.71Å; P23-Y41 VanDerWaalsContact CD-CB 3.5Å; P23-Y41 VanDerWaalsContact CD-CG 3.47Å; P23-Y41 HydrophobicContact CG-CG 4.32Å; V37-Y41 WeakPolarHBondContact O-CB 3.21Å; V37-Y41 PolarHBondContact O-N 3.24Å; F38-Y41 PolarHBondContact O-N 3.25Å; Y41-R43 VanDerWaalsContact C-N 3.3Å; Y41-R43 PolarHBondContact O-N 3.18Å; Y41-D44 PolarHBondContact O-N 3.19Å; Y41-L45 HydrophobicContact CE1-CD2 4.35Å; Y41-L45 HydrophobicContact CE2-CB 4.47Å; Y41-L45 VanDerWaalsContact O-CB 3.28Å; Y41-L45 WeakPolarHBondContact O-CB 3.37Å; Y41-L45 PolarHBondContact O-N 3.43Å
42	H	95.6	Very high	92.7	Very high	105 Å²	105	51.4 Å²	51.4	49%	0.486	29%	0.288	S	S	.	.	H	α-helix	trans	-63.6	-37.7	-178.8	-72.2	-51	0	0	0	112.3	F38 D39 A46	F38-H42 PolarHBondContact O-CD2 3.33Å; F38-H42 PolarHBondContact O-N 2.84Å; D39-H42 PolarHBondContact O-N 3.33Å; H42-A46 WeakPolarHBondContact O-CB 3.44Å; H42-A46 PolarHBondContact O-N 3.24Å
43	R	94.1	Very high	93.1	Very high	78 Å²	78	52 Å²	52	29%	0.294	29%	0.286	S	S	.	.	H	α-helix	trans	-65.2	-44.5	174.9	-177.1	-178.1	65.2	-172.5	8.4	111.8	D39 L40 Y41 L45 A46 R47 E75	D39-R43 WeakPolarHBondContact O-CB 3.49Å; D39-R43 PolarHBondContact O-N 3.49Å; L40-R43 PolarHBondContact O-N 2.96Å; Y41-R43 VanDerWaalsContact C-N 3.3Å; Y41-R43 PolarHBondContact O-N 3.18Å; R43-L45 VanDerWaalsContact C-N 3.35Å; R43-A46 PolarHBondContact O-N 3.03Å; R43-R47 WeakPolarHBondContact O-CG 3.42Å; R43-R47 PolarHBondContact O-N 2.94Å; R43-E75 IonicContact CZ-OE1 3.37Å; R43-E75 IonicContact CZ-OE2 2.78Å; R43-E75 IonicContact NH1-OE1 3.39Å; R43-E75 PolarHBondContact NH1-OE1 3.25Å; R43-E75 IonicContact NH1-OE2 3.78Å; R43-E75 PolarHBondContact NH1-OE2 3.09Å; R43-E75 IonicContact NH2-OE1 3.05Å; R43-E75 PolarHBondContact NH2-OE1 3.42Å; R43-E75 IonicContact NH2-OE2 3.19Å; R43-E75 PolarHBondContact NH2-OE2 3.41Å
44	D	93.4	Very high	93.4	Very high	60 Å²	60	54.7 Å²	54.7	32%	0.321	31%	0.305	S	S	.	.	H	α-helix	trans	-71.7	-32.6	179.9	-67.2	-19.9	0	0	0	111.5	P20 L40 Y41 R47 W48	P20-D44 HydrophobicContact CB-CB 4.37Å; P20-D44 HydrophobicContact CG-CB 4.34Å; L40-D44 WeakPolarHBondContact O-CB 3.41Å; L40-D44 VanDerWaalsContact O-CG 3.29Å; L40-D44 PolarHBondContact O-N 3.17Å; Y41-D44 PolarHBondContact O-N 3.19Å; D44-R47 PolarHBondContact O-N 2.82Å; D44-R47 IonicContact OD1-CZ 2.83Å; D44-R47 IonicContact OD1-NH1 2.81Å; D44-R47 PolarHBondContact OD1-NH1 3.26Å; D44-W48 WeakPolarHBondContact O-CB 3.49Å; D44-W48 PolarHBondContact O-N 3.36Å
45	L	95.2	Very high	93.4	Very high	22 Å²	22	56.6 Å²	56.6	12%	0.115	30%	0.3	C	S	.	.	H	α-helix	trans	-63.1	-46	172.1	-178.3	66	0	0	0	110.7	R19 P20 Y41 R43 R47 W48 E49	R19-L45 HydrophobicContact CG-CD1 4.28Å; P20-L45 HydrophobicContact CG-CB 4.02Å; P20-L45 HydrophobicContact CG-CD1 4.22Å; Y41-L45 HydrophobicContact CE1-CD2 4.35Å; Y41-L45 HydrophobicContact CE2-CB 4.47Å; Y41-L45 VanDerWaalsContact O-CB 3.28Å; Y41-L45 WeakPolarHBondContact O-CB 3.37Å; Y41-L45 PolarHBondContact O-N 3.43Å; R43-L45 VanDerWaalsContact C-N 3.35Å; L45-R47 VanDerWaalsContact C-N 3.32Å; L45-R47 PolarHBondContact O-N 2.78Å; L45-W48 HydrophobicContact CD1-CE3 4.09Å; L45-W48 PolarHBondContact O-N 3.23Å; L45-W48 VanDerWaalsContact O-N 3.17Å; L45-E49 WeakPolarHBondContact O-CG 3.35Å; L45-E49 PolarHBondContact O-N 2.91Å
46	A	94.9	Very high	93.4	Very high	54 Å²	54	58.3 Å²	58.3	45%	0.446	31%	0.308	S	S	.	.	H	α-helix	trans	-62	-39.1	176.3	0	0	0	0	0	112.2	H42 R43 E49 A50	H42-A46 WeakPolarHBondContact O-CB 3.44Å; H42-A46 PolarHBondContact O-N 3.24Å; R43-A46 PolarHBondContact O-N 3.03Å; A46-E49 PolarHBondContact O-N 2.95Å; A46-A50 WeakPolarHBondContact O-CB 3.44Å; A46-A50 PolarHBondContact O-N 2.94Å
47	R	93.7	Very high	93.1	Very high	74 Å²	74	60.7 Å²	60.7	28%	0.279	32%	0.315	S	S	.	.	H	α-helix	trans	-62.6	-44.5	172.6	-73.3	174.7	-179.8	158.2	-6.8	111.6	R43 D44 L45 A50 A51	R43-R47 WeakPolarHBondContact O-CG 3.42Å; R43-R47 PolarHBondContact O-N 2.94Å; D44-R47 PolarHBondContact O-N 2.82Å; D44-R47 IonicContact OD1-CZ 2.83Å; D44-R47 IonicContact OD1-NH1 2.81Å; D44-R47 PolarHBondContact OD1-NH1 3.26Å; L45-R47 VanDerWaalsContact C-N 3.32Å; L45-R47 PolarHBondContact O-N 2.78Å; R47-A50 PolarHBondContact O-N 3.25Å; R47-A51 VanDerWaalsContact O-CB 3.32Å; R47-A51 WeakPolarHBondContact O-CB 3.5Å; R47-A51 PolarHBondContact O-N 3.05Å
48	W	94.5	Very high	92.8	Very high	7 Å²	7	63.2 Å²	63.2	3%	0.027	33%	0.333	C	S	.	.	H	α-helix	trans	-62.8	-42.8	177.6	174.7	88.6	0	0	0	112.2	W15 L18 R19 D44 L45 A50 A51 R52 L60	W15-W48 PolarHBondContact O-NE1 3.16Å; L18-W48 VanDerWaalsContact O-CD1 3.27Å; R19-W48 HydrophobicContact CB-CD2 4.13Å; R19-W48 HydrophobicContact CB-CH2 4.35Å; R19-W48 HydrophobicContact CB-CZ2 3.79Å; R19-W48 HydrophobicContact CG-CD2 3.99Å; R19-W48 HydrophobicContact CG-CE3 4.07Å; R19-W48 HydrophobicContact CG-CH2 4.09Å; R19-W48 HydrophobicContact CG-CZ2 4.01Å; R19-W48 HydrophobicContact CG-CZ3 4.13Å; D44-W48 WeakPolarHBondContact O-CB 3.49Å; D44-W48 PolarHBondContact O-N 3.36Å; L45-W48 HydrophobicContact CD1-CE3 4.09Å; L45-W48 PolarHBondContact O-N 3.23Å; L45-W48 VanDerWaalsContact O-N 3.17Å; W48-A50 PolarHBondContact O-N 3.1Å; W48-A51 PolarHBondContact O-N 3.18Å; W48-R52 VanDerWaalsContact O-CB 3.31Å; W48-R52 WeakPolarHBondContact O-CB 3.48Å; W48-R52 PolarHBondContact O-N 2.99Å; W48-L60 HydrophobicContact CB-CD2 4.07Å; W48-L60 HydrophobicContact CG-CD2 4.49Å
49	E	94.5	Very high	92.5	Very high	105 Å²	105	64.2 Å²	64.2	49%	0.491	34%	0.34	S	S	.	.	H	α-helix	trans	-61	-43.7	175.6	-72	176.2	168.6	0	0	111.5	L45 A46 A53	L45-E49 WeakPolarHBondContact O-CG 3.35Å; L45-E49 PolarHBondContact O-N 2.91Å; A46-E49 PolarHBondContact O-N 2.95Å; E49-A53 VanDerWaalsContact O-CB 3.29Å; E49-A53 WeakPolarHBondContact O-CB 3.46Å; E49-A53 PolarHBondContact O-N 3.2Å
50	A	93.8	Very high	92	Very high	48 Å²	48	63.1 Å²	63.1	40%	0.397	33%	0.334	S	S	.	.	H	α-helix	trans	-66	-43.1	176.3	0	0	0	0	0	112.7	A46 R47 W48 A53 S54	A46-A50 WeakPolarHBondContact O-CB 3.44Å; A46-A50 PolarHBondContact O-N 2.94Å; R47-A50 PolarHBondContact O-N 3.25Å; W48-A50 PolarHBondContact O-N 3.1Å; A50-A53 PolarHBondContact O-N 3.39Å; A50-S54 WeakPolarHBondContact O-CB 3.44Å; A50-S54 PolarHBondContact O-N 3.47Å; A50-S54 PolarHBondContact O-OG 2.82Å
51	A	92.9	Very high	91.2	Very high	0 Å²	0	71.2 Å²	71.2	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-60.7	-47.2	176.4	0	0	0	0	0	111.4	W15 R47 W48 S54 K55 D56 L59 L60	W15-A51 HydrophobicContact CH2-CB 4.13Å; W15-A51 WeakPolarHBondContact CH2-O 3.39Å; W15-A51 HydrophobicContact CZ3-CB 3.84Å; R47-A51 VanDerWaalsContact O-CB 3.32Å; R47-A51 WeakPolarHBondContact O-CB 3.5Å; R47-A51 PolarHBondContact O-N 3.05Å; W48-A51 PolarHBondContact O-N 3.18Å; A51-S54 PolarHBondContact O-N 3.05Å; A51-S54 PolarHBondContact O-OG 3.36Å; A51-K55 WeakPolarHBondContact O-CA 3.26Å; A51-K55 PolarHBondContact O-N 3.09Å; A51-D56 WeakPolarHBondContact CB-O 3.47Å; A51-D56 PolarHBondContact O-N 2.86Å; A51-L59 HydrophobicContact CB-CB 3.97Å; A51-L60 HydrophobicContact CB-CD2 3.59Å; A51-L60 HydrophobicContact CB-CG 3.81Å
52	R	92.2	Very high	89.8	Confident	103 Å²	103	71.8 Å²	71.8	39%	0.389	38%	0.375	S	S	.	.	H	α-helix	trans	-64.5	-41.6	177.9	-176.6	-177.4	167.1	-160.1	1.4	111.9	E12 W15 W48 S54 K55	E12-R52 IonicContact OE1-NH2 2.92Å; W15-R52 HydrophobicContact CB-CG 4.45Å; W15-R52 HydrophobicContact CD2-CB 4.19Å; W15-R52 HydrophobicContact CD2-CG 4.13Å; W15-R52 HydrophobicContact CE3-CB 3.85Å; W15-R52 HydrophobicContact CE3-CG 4.26Å; W15-R52 HydrophobicContact CG-CG 4.21Å; W15-R52 HydrophobicContact CZ3-CB 4.15Å; W48-R52 VanDerWaalsContact O-CB 3.31Å; W48-R52 WeakPolarHBondContact O-CB 3.48Å; W48-R52 PolarHBondContact O-N 2.99Å; R52-S54 VanDerWaalsContact C-N 3.31Å; R52-S54 PolarHBondContact O-N 2.98Å; R52-K55 PolarHBondContact O-N 2.91Å
53	A	92.4	Very high	88	Confident	91 Å²	91	71.2 Å²	71.2	75%	0.752	38%	0.381	S	S	*	.	H	α-helix	trans	-66.1	-33.5	179	0	0	0	0	0	112.9	E49 A50	E49-A53 VanDerWaalsContact O-CB 3.29Å; E49-A53 WeakPolarHBondContact O-CB 3.46Å; E49-A53 PolarHBondContact O-N 3.2Å; A50-A53 PolarHBondContact O-N 3.39Å
54	S	92.7	Very high	85.8	Confident	66 Å²	66	75.2 Å²	75.2	46%	0.462	40%	0.403	S	S	.	.	H	α-helix	trans	-94	-7.5	179.7	56.6	0	0	0	0	114.2	A50 A51 R52 D56 L59	A50-S54 WeakPolarHBondContact O-CB 3.44Å; A50-S54 PolarHBondContact O-N 3.47Å; A50-S54 PolarHBondContact O-OG 2.82Å; A51-S54 PolarHBondContact O-N 3.05Å; A51-S54 PolarHBondContact O-OG 3.36Å; R52-S54 VanDerWaalsContact C-N 3.31Å; R52-S54 PolarHBondContact O-N 2.98Å; S54-D56 PolarHBondContact O-N 2.68Å; S54-L59 WeakPolarHBondContact OG-CD1 3.31Å
55	K	90.4	Very high	83.6	Confident	140 Å²	140	75.4 Å²	75.4	61%	0.609	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	27.2	-168.8	-60.3	179.7	164.7	-146.7	0	113.4	D10 A51 R52	D10-K55 VanDerWaalsContact OD2-CD 3.31Å; D10-K55 WeakPolarHBondContact OD2-CD 3.2Å; D10-K55 VanDerWaalsContact OD2-CE 3.31Å; D10-K55 WeakPolarHBondContact OD2-CE 3.19Å; D10-K55 IonicContact OD2-NZ 3.48Å; D10-K55 PolarHBondContact OD2-NZ 3.33Å; A51-K55 WeakPolarHBondContact O-CA 3.26Å; A51-K55 PolarHBondContact O-N 3.09Å; R52-K55 PolarHBondContact O-N 2.91Å
56	D	89.6	Confident	81.2	Confident	65 Å²	65	82.8 Å²	82.8	35%	0.348	44%	0.443	S	S	.	.			trans	-110.5	97.4	-179.3	-175.7	0.9	0	0	0	110.3	A51 S54 S58 L59	A51-D56 WeakPolarHBondContact CB-O 3.47Å; A51-D56 PolarHBondContact O-N 2.86Å; S54-D56 PolarHBondContact O-N 2.68Å; D56-S58 PolarHBondContact O-N 3.39Å; D56-S58 WeakPolarHBondContact OD1-CB 3.39Å; D56-S58 PolarHBondContact OD1-N 3.21Å; D56-S58 PolarHBondContact OD1-OG 2.88Å; D56-S58 PolarHBondContact OD2-OG 3.31Å; D56-S58 VanDerWaalsContact OD2-OG 3.07Å; D56-L59 HydrophobicContact CB-CD1 4.23Å; D56-L59 HydrophobicContact CB-CG 4.26Å; D56-L59 WeakPolarHBondContact O-CB 3.3Å; D56-L59 PolarHBondContact O-N 3.39Å
57	R	87.4	Confident	78.6	Confident	69 Å²	69	84.6 Å²	84.6	26%	0.26	45%	0.452	S	S	.	.	G	3₁₀ helix	trans	-67.5	-16	177.4	-70.3	179	168.1	-151	-0	113.3	D9 W15 L59 L60	D9-R57 PolarHBondContact O-NE 3.31Å; D9-R57 PolarHBondContact O-NH2 2.72Å; D9-R57 IonicContact OD1-CZ 2.62Å; D9-R57 IonicContact OD1-NH1 3.94Å; D9-R57 PolarHBondContact OD1-NH1 2.63Å; D9-R57 IonicContact OD1-NH2 2.7Å; D9-R57 PolarHBondContact OD1-NH2 2.83Å; D9-R57 IonicContact OD2-CZ 2.73Å; D9-R57 IonicContact OD2-NE 2.83Å; D9-R57 IonicContact OD2-NH1 2.99Å; D9-R57 PolarHBondContact OD2-NH1 3.27Å; D9-R57 IonicContact OD2-NH2 3.66Å; W15-R57 HydrophobicContact CH2-CB 4.43Å; W15-R57 HydrophobicContact CH2-CG 3.44Å; W15-R57 VanDerWaalsContact CH2-CG 3.44Å; W15-R57 HydrophobicContact CZ2-CG 3.83Å; W15-R57 HydrophobicContact CZ3-CG 4.06Å; R57-L59 PolarHBondContact O-N 3.43Å; R57-L60 HydrophobicContact CB-CD1 4.42Å; R57-L60 HydrophobicContact CG-CD1 4.43Å; R57-L60 WeakPolarHBondContact O-CB 3.31Å; R57-L60 PolarHBondContact O-N 2.91Å
58	S	87.3	Confident	76.3	Confident	67 Å²	67	84.3 Å²	84.3	47%	0.469	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	-62.7	-26.9	177.5	77.4	0	0	0	0	111.8	D56 L60 R61	D56-S58 PolarHBondContact O-N 3.39Å; D56-S58 WeakPolarHBondContact OD1-CB 3.39Å; D56-S58 PolarHBondContact OD1-N 3.21Å; D56-S58 PolarHBondContact OD1-OG 2.88Å; D56-S58 PolarHBondContact OD2-OG 3.31Å; D56-S58 VanDerWaalsContact OD2-OG 3.07Å; S58-L60 PolarHBondContact O-N 3Å; S58-R61 WeakPolarHBondContact O-CB 3.45Å; S58-R61 PolarHBondContact O-N 3.34Å; S58-R61 VanDerWaalsContact O-N 3.13Å
59	L	86.3	Confident	74.3	Confident	76 Å²	76	88.3 Å²	88.3	40%	0.398	49%	0.487	S	S	.	.	G	3₁₀ helix	trans	-67.4	-16.8	175.9	-60.3	-180	0	0	0	114	A51 S54 D56 R57 R61	A51-L59 HydrophobicContact CB-CB 3.97Å; S54-L59 WeakPolarHBondContact OG-CD1 3.31Å; D56-L59 HydrophobicContact CB-CD1 4.23Å; D56-L59 HydrophobicContact CB-CG 4.26Å; D56-L59 WeakPolarHBondContact O-CB 3.3Å; D56-L59 PolarHBondContact O-N 3.39Å; R57-L59 PolarHBondContact O-N 3.43Å; L59-R61 VanDerWaalsContact C-N 3.29Å
60	L	84.4	Confident	72.5	Confident	54 Å²	54	86 Å²	86	28%	0.283	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-76.8	-17.7	174.5	-60	176.8	0	0	0	112.4	W15 L18 W48 A51 R57 S58 G62	W15-L60 HydrophobicContact CZ3-CD1 4.2Å; L18-L60 HydrophobicContact CB-CD1 4.23Å; L18-L60 HydrophobicContact CD1-CD1 3.77Å; L18-L60 HydrophobicContact CG-CD1 4.46Å; W48-L60 HydrophobicContact CB-CD2 4.07Å; W48-L60 HydrophobicContact CG-CD2 4.49Å; A51-L60 HydrophobicContact CB-CD2 3.59Å; A51-L60 HydrophobicContact CB-CG 3.81Å; R57-L60 HydrophobicContact CB-CD1 4.42Å; R57-L60 HydrophobicContact CG-CD1 4.43Å; R57-L60 WeakPolarHBondContact O-CB 3.31Å; R57-L60 PolarHBondContact O-N 2.91Å; S58-L60 PolarHBondContact O-N 3Å; L60-G62 PolarHBondContact O-N 2.75Å; L60-G62 VanDerWaalsContact O-N 3.07Å
61	R	76	Confident	71.6	Confident	192 Å²	192	91.6 Å²	91.6	73%	0.725	50%	0.498	S	S	*	.			trans	-70.9	107.8	174.6	-66.8	-173.3	-177.6	-132.2	0.2	108.4	S58 L59	S58-R61 WeakPolarHBondContact O-CB 3.45Å; S58-R61 PolarHBondContact O-N 3.34Å; S58-R61 VanDerWaalsContact O-N 3.13Å; L59-R61 VanDerWaalsContact C-N 3.29Å
62	G	64.8	Low	71.5	Confident	32 Å²	32	92.6 Å²	92.6	33%	0.33	50%	0.504	S	S	.	.			trans	-59.1	168.5	164.7	0	0	0	0	0	111.1	L60 E64	L60-G62 PolarHBondContact O-N 2.75Å; L60-G62 VanDerWaalsContact O-N 3.07Å; G62-E64 PolarHBondContact O-N 3.26Å; G62-E64 VanDerWaalsContact O-N 3.1Å
63	P	57.6	Low	71.4	Confident	93 Å²	93	90 Å²	90	60%	0.604	50%	0.497	S	S	*	.			trans	-50.7	125.1	172.9	21.9	-31.2	0	0	0	108.8	S65	P63-S65 PolarHBondContact O-N 2.79Å
64	E	48.3	Very low	71.4	Confident	161 Å²	161	87.5 Å²	87.5	75%	0.752	47%	0.474	S	S	*	.			trans	-57.1	101.2	176.4	-74.1	-173.6	163.3	0	0	108	G62 Q66	G62-E64 PolarHBondContact O-N 3.26Å; G62-E64 VanDerWaalsContact O-N 3.1Å; E64-Q66 PolarHBondContact O-N 3.25Å
65	S	47.4	Very low	71.3	Confident	65 Å²	65	87.6 Å²	87.6	46%	0.455	47%	0.467	S	S	.	.			trans	-70.6	102.3	167.1	54.7	0	0	0	0	105.5	P63 S67	P63-S65 PolarHBondContact O-N 2.79Å; S65-S67 PolarHBondContact O-N 2.84Å
66	Q	43.4	Very low	71.3	Confident	177 Å²	177	83.2 Å²	83.2	83%	0.827	45%	0.452	S	S	*	.			trans	-59.4	87	156.9	-72.4	-178.2	4.6	0	0	106.1	E64 C68	E64-Q66 PolarHBondContact O-N 3.25Å; Q66-C68 PolarHBondContact O-N 2.89Å
67	S	41.7	Very low	71.5	Confident	92 Å²	92	82.4 Å²	82.4	64%	0.643	45%	0.446	S	S	*	.			trans	-74.4	83.5	178.1	67.7	0	0	0	0	107	S65 P69	S65-S67 PolarHBondContact O-N 2.84Å; S67-P69 WeakPolarHBondContact O-CD 3.41Å
68	C	45.7	Very low	71.8	Confident	68 Å²	68	80 Å²	80	46%	0.459	44%	0.438	S	S	.	.			trans	-62.5	118.7	150.2	-73.4	0	0	0	0	105.3	Q66 S70 K71	Q66-C68 PolarHBondContact O-N 2.89Å; C68-S70 PolarHBondContact O-N 3.13Å; C68-K71 PolarHBondContact O-N 2.96Å
69	P	51.5	Low	72.2	Confident	90 Å²	90	79.3 Å²	79.3	58%	0.584	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-4.4	177.5	22	-32	0	0	0	113.3	S67 V78	S67-P69 WeakPolarHBondContact O-CD 3.41Å; P69-V78 WeakPolarHBondContact O-CG1 3.38Å
70	S	56.3	Low	72.7	Confident	58 Å²	58	75.9 Å²	75.9	41%	0.406	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-12.5	172.9	54.4	0	0	0	0	115.1	C68	C68-S70 PolarHBondContact O-N 3.13Å
71	K	76.1	Confident	73.3	Confident	164 Å²	164	76 Å²	76	71%	0.713	42%	0.423	S	S	*	.	S	Bend	trans	-113.2	113.1	-173.8	-158.7	172.3	-175.7	179.2	0	111.6	C68	C68-K71 PolarHBondContact O-N 2.96Å
72	L	89.1	Confident	74.4	Confident	22 Å²	22	66.9 Å²	66.9	12%	0.115	39%	0.389	C	S	.	.			trans	-59.6	146.7	171.5	-70.8	167	0	0	0	111.1	F80 L105 L107 L113 G169	L72-F80 HydrophobicContact CD2-CE2 3.78Å; L72-F80 HydrophobicContact CD2-CZ 3.9Å; L72-F80 HydrophobicContact CG-CZ 4.47Å; L72-L105 HydrophobicContact CD1-CD1 3.69Å; L72-L105 HydrophobicContact CD1-CG 3.84Å; L72-L105 HydrophobicContact CG-CD1 4.43Å; L72-L107 HydrophobicContact CD1-CD1 3.61Å; L72-L113 HydrophobicContact CD1-CD1 4.2Å; L72-L113 HydrophobicContact CD1-CD2 3.65Å; L72-L113 HydrophobicContact CD2-CD1 4.48Å; L72-L113 HydrophobicContact CD2-CD2 4.29Å; L72-G169 CarbonylContact C-O 3.59Å; L72-G169 WeakPolarHBondContact CB-O 3.14Å
73	N	90.2	Very high	76	Confident	47 Å²	47	68 Å²	68	25%	0.251	39%	0.392	S	S	.	.			trans	-138.3	134.8	175.1	-177.3	-34.2	0	0	0	109.2	E75 T76 R168 G169	N73-E75 PolarHBondContact O-N 2.93Å; N73-E75 WeakPolarHBondContact OD1-CB 3.48Å; N73-E75 PolarHBondContact OD1-N 3.18Å; N73-T76 WeakPolarHBondContact CB-OG1 3.28Å; N73-T76 PolarHBondContact O-N 3.29Å; N73-T76 VanDerWaalsContact O-O 3.09Å; N73-R168 WeakPolarHBondContact O-CB 3.45Å; N73-G169 CarbonylContact C-O 3.54Å; N73-G169 WeakPolarHBondContact CA-O 3.39Å; N73-G169 PolarHBondContact N-O 3.08Å; N73-G169 PolarHBondContact O-N 3.01Å; N73-G169 VanDerWaalsContact O-N 3.11Å
74	P	92.7	Very high	77.9	Confident	39 Å²	39	64.8 Å²	64.8	25%	0.253	37%	0.373	S	S	.	.	S	Bend	trans	-61.9	-20.9	177.4	-25.9	35.8	0	0	0	114.5	P35 R168 G169 F171	P35-P74 HydrophobicContact CG-CB 4.29Å; P74-R168 WeakPolarHBondContact O-CD 3.38Å; P74-R168 PolarHBondContact O-NH1 3.32Å; P74-G169 WeakPolarHBondContact CD-O 3.44Å; P74-F171 HydrophobicContact CB-CE1 3.88Å; P74-F171 HydrophobicContact CB-CZ 3.88Å
75	E	91.2	Very high	80.2	Confident	68 Å²	68	59.1 Å²	59.1	32%	0.318	35%	0.349	S	S	.	.	S	Bend	trans	-99.1	-22	-174.6	-50.3	-166	171	0	0	113.5	P35 L40 R43 N73	P35-E75 HydrophobicContact CG-CG 4.13Å; L40-E75 HydrophobicContact CD2-CB 4.06Å; L40-E75 HydrophobicContact CD2-CG 3.88Å; R43-E75 IonicContact CZ-OE1 3.37Å; R43-E75 IonicContact CZ-OE2 2.78Å; R43-E75 IonicContact NH1-OE1 3.39Å; R43-E75 PolarHBondContact NH1-OE1 3.25Å; R43-E75 IonicContact NH1-OE2 3.78Å; R43-E75 PolarHBondContact NH1-OE2 3.09Å; R43-E75 IonicContact NH2-OE1 3.05Å; R43-E75 PolarHBondContact NH2-OE1 3.42Å; R43-E75 IonicContact NH2-OE2 3.19Å; R43-E75 PolarHBondContact NH2-OE2 3.41Å; N73-E75 PolarHBondContact O-N 2.93Å; N73-E75 WeakPolarHBondContact OD1-CB 3.48Å; N73-E75 PolarHBondContact OD1-N 3.18Å
76	T	91.1	Very high	82.6	Confident	49 Å²	49	58.9 Å²	58.9	30%	0.301	34%	0.343	S	S	.	.	S	Bend	trans	-127.7	136.5	-174.6	64	0	0	0	0	112.2	N73 R168	N73-T76 WeakPolarHBondContact CB-OG1 3.28Å; N73-T76 PolarHBondContact O-N 3.29Å; N73-T76 VanDerWaalsContact O-O 3.09Å; T76-R168 WeakPolarHBondContact O-CB 3.29Å
77	F	93.6	Very high	85	Confident	48 Å²	48	57.8 Å²	57.8	21%	0.211	33%	0.331	C	S	.	.			trans	-77.1	133.1	174.5	-73.7	-83.1	0	0	0	111.9	I114 R116 Q125 F166 W167 R168	F77-I114 HydrophobicContact CE1-CG2 4.42Å; F77-I114 HydrophobicContact CZ-CG2 4.45Å; F77-R116 HydrophobicContact CD1-CB 3.79Å; F77-R116 HydrophobicContact CE1-CB 3.38Å; F77-R116 HydrophobicContact CE1-CG 4.48Å; F77-R116 HydrophobicContact CE2-CB 4.38Å; F77-R116 HydrophobicContact CG-CB 4.46Å; F77-R116 HydrophobicContact CZ-CB 3.71Å; F77-R116 HydrophobicContact CZ-CG 4.44Å; F77-Q125 HydrophobicContact CZ-CG 4.35Å; F77-F166 HydrophobicContact CB-CB 4.19Å; F77-F166 HydrophobicContact CD1-CB 4.14Å; F77-F166 HydrophobicContact CG-CB 4.46Å; F77-W167 CarbonylContact C-O 3.5Å; F77-W167 WeakPolarHBondContact CA-O 3.39Å; F77-R168 HydrophobicContact CD1-CB 3.89Å; F77-R168 HydrophobicContact CD1-CG 4.04Å; F77-R168 HydrophobicContact CE1-CB 3.95Å; F77-R168 HydrophobicContact CE1-CG 3.56Å; F77-R168 HydrophobicContact CE2-CG 4.27Å; F77-R168 HydrophobicContact CG-CB 4.23Å; F77-R168 HydrophobicContact CZ-CB 4.37Å; F77-R168 VanDerWaalsContact CZ-CD 3.41Å; F77-R168 HydrophobicContact CZ-CG 3.7Å
78	V	94.3	Very high	87.5	Confident	17 Å²	17	56.4 Å²	56.4	10%	0.103	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	138.7	173.9	-176.9	0	0	0	0	108.8	P69 F80 F166 W167	P69-V78 WeakPolarHBondContact O-CG1 3.38Å; V78-F80 HydrophobicContact CB-CE2 3.82Å; V78-F80 HydrophobicContact CB-CZ 4.21Å; V78-F80 HydrophobicContact CG1-CD2 4.48Å; V78-F80 HydrophobicContact CG1-CE1 4.47Å; V78-F80 HydrophobicContact CG1-CE2 3.82Å; V78-F80 HydrophobicContact CG1-CZ 3.82Å; V78-F166 WeakPolarHBondContact O-CA 3.49Å; V78-W167 PolarHBondContact N-O 3.45Å; V78-W167 PolarHBondContact O-N 2.76Å
79	A	95.3	Very high	89.8	Confident	53 Å²	53	54 Å²	54	44%	0.438	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	132.5	179.3	0	0	0	0	0	110.9	T164 A165 F166	A79-T164 HydrophobicContact CB-CG2 3.69Å; A79-A165 WeakPolarHBondContact CA-O 3.19Å; A79-F166 HydrophobicContact CB-CD1 4.06Å; A79-F166 HydrophobicContact CB-CE1 3.78Å; A79-F166 HydrophobicContact CB-CZ 4.39Å
80	F	96.2	Very high	91.7	Very high	5 Å²	5	58.5 Å²	58.5	2%	0.022	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	135.3	173.1	-64.4	-83.6	0	0	0	110.4	L72 V78 F97 L99 F140 T164 A165 W167	L72-F80 HydrophobicContact CD2-CE2 3.78Å; L72-F80 HydrophobicContact CD2-CZ 3.9Å; L72-F80 HydrophobicContact CG-CZ 4.47Å; V78-F80 HydrophobicContact CB-CE2 3.82Å; V78-F80 HydrophobicContact CB-CZ 4.21Å; V78-F80 HydrophobicContact CG1-CD2 4.48Å; V78-F80 HydrophobicContact CG1-CE1 4.47Å; V78-F80 HydrophobicContact CG1-CE2 3.82Å; V78-F80 HydrophobicContact CG1-CZ 3.82Å; F80-F97 HydrophobicContact CB-CB 4.09Å; F80-F97 HydrophobicContact CB-CD1 4.08Å; F80-F97 HydrophobicContact CB-CG 4.48Å; F80-L99 HydrophobicContact CD1-CD2 3.8Å; F80-L99 HydrophobicContact CE1-CD2 3.33Å; F80-L99 HydrophobicContact CZ-CD2 4.24Å; F80-F140 HydrophobicContact CB-CE1 4.3Å; F80-F140 AromaticContact CD1-CE1 3.95Å; F80-F140 HydrophobicContact CD1-CE1 3.95Å; F80-F140 HydrophobicContact CD2-CE1 4.18Å; F80-F140 HydrophobicContact CD2-CZ 4.33Å; F80-F140 HydrophobicContact CE1-CE1 4.31Å; F80-F140 HydrophobicContact CE2-CE1 4.49Å; F80-F140 AromaticContact CG-CE1 3.87Å; F80-F140 HydrophobicContact CG-CE1 3.87Å; F80-F140 HydrophobicContact CG-CZ 4.32Å; F80-T164 WeakPolarHBondContact O-CA 3.41Å; F80-A165 PolarHBondContact N-O 2.91Å; F80-A165 PolarHBondContact O-N 2.65Å; F80-W167 HydrophobicContact CD2-CB 3.98Å; F80-W167 AromaticContact CD2-CD1 3.69Å; F80-W167 HydrophobicContact CD2-CG 4.13Å; F80-W167 HydrophobicContact CE2-CB 4.03Å
81	C	97.4	Very high	93.5	Very high	56 Å²	56	57.9 Å²	57.9	38%	0.378	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	134.1	176.6	-178.6	0	0	0	0	110.1	S83 F97 A98 D163	C81-S83 PolarHBondContact O-N 2.86Å; C81-F97 CarbonylContact O-C 3.6Å; C81-F97 VanDerWaalsContact O-CA 3.29Å; C81-F97 WeakPolarHBondContact O-CA 3.47Å; C81-A98 PolarHBondContact O-N 3.27Å; C81-D163 CarbonylContact C-O 3.56Å; C81-D163 WeakPolarHBondContact CA-O 3.24Å
82	I	98.4	Very high	94.4	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	111.2	173.7	-63.8	174.2	0	0	0	107.9	V85 V95 R96 F97 W159 A161 G162 D163 A165	I82-V85 HydrophobicContact CG2-CG2 3.5Å; I82-V85 VanDerWaalsContact CG2-CG2 3.5Å; I82-V95 HydrophobicContact CG1-CG1 4.38Å; I82-V95 HydrophobicContact CG2-CG1 3.83Å; I82-R96 CarbonylContact C-O 3.5Å; I82-R96 WeakPolarHBondContact CA-O 3.4Å; I82-F97 HydrophobicContact CD1-CE1 4.06Å; I82-F97 HydrophobicContact CG1-CD1 3.86Å; I82-F97 HydrophobicContact CG1-CE1 3.42Å; I82-F97 VanDerWaalsContact CG1-CE1 3.42Å; I82-F97 HydrophobicContact CG1-CZ 4.17Å; I82-W159 HydrophobicContact CD1-CB 3.92Å; I82-W159 HydrophobicContact CD1-CD2 3.41Å; I82-W159 VanDerWaalsContact CD1-CD2 3.41Å; I82-W159 HydrophobicContact CD1-CE3 3.66Å; I82-W159 HydrophobicContact CD1-CG 3.56Å; I82-W159 HydrophobicContact CD1-CZ2 4.4Å; I82-W159 HydrophobicContact CD1-CZ3 4.26Å; I82-A161 CarbonylContact O-C 3.57Å; I82-A161 WeakPolarHBondContact O-CA 3.46Å; I82-G162 PolarHBondContact O-N 2.95Å; I82-D163 HydrophobicContact CD1-CB 4.06Å; I82-D163 PolarHBondContact N-O 2.74Å; I82-A165 HydrophobicContact CD1-CB 4.47Å
83	S	97.9	Very high	94.8	Very high	56 Å²	56	50.6 Å²	50.6	39%	0.392	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	-27.5	178.8	63.1	0	0	0	0	112.8	C81 R96	C81-S83 PolarHBondContact O-N 2.86Å; S83-R96 PolarHBondContact N-O 3.43Å; S83-R96 WeakPolarHBondContact OG-CB 3.19Å; S83-R96 WeakPolarHBondContact OG-CD 3.36Å; S83-R96 WeakPolarHBondContact OG-CG 3.39Å; S83-R96 PolarHBondContact OG-O 3.27Å
84	A	98.1	Very high	95.2	Very high	25 Å²	25	51.7 Å²	51.7	21%	0.207	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	147.9	178.3	0	0	0	0	0	112.2	R96	A84-R96 HydrophobicContact CB-CB 4.05Å; A84-R96 PolarHBondContact N-O 3.02Å; A84-R96 PolarHBondContact O-N 2.82Å
85	V	97.9	Very high	95.4	Very high	43 Å²	43	49.8 Å²	49.8	26%	0.261	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	101.8	174.3	-176.7	0	0	0	0	108	I82 Y93 V95 W159	I82-V85 HydrophobicContact CG2-CG2 3.5Å; I82-V85 VanDerWaalsContact CG2-CG2 3.5Å; V85-Y93 HydrophobicContact CG1-CD1 4.02Å; V85-V95 HydrophobicContact CG1-CG2 4.42Å; V85-V95 HydrophobicContact CG2-CG1 4.27Å; V85-W159 HydrophobicContact CG2-CB 4.4Å
86	D	96.1	Very high	95.8	Very high	60 Å²	60	50.5 Å²	50.5	32%	0.321	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	123.1	-180	-61.5	-36.5	0	0	0	110.1	L88 Y93 R94	D86-L88 HydrophobicContact CB-CD2 4.38Å; D86-L88 PolarHBondContact O-N 2.92Å; D86-Y93 CarbonylContact O-C 3.54Å; D86-Y93 VanDerWaalsContact O-CA 3.28Å; D86-Y93 WeakPolarHBondContact O-CA 3.36Å; D86-R94 HydrophobicContact CB-CB 4.35Å; D86-R94 PolarHBondContact N-O 3.47Å; D86-R94 PolarHBondContact O-N 2.94Å; D86-R94 IonicContact OD2-CZ 3.44Å; D86-R94 IonicContact OD2-NE 3.22Å; D86-R94 PolarHBondContact OD2-NE 2.9Å; D86-R94 IonicContact OD2-NH2 2.78Å; D86-R94 PolarHBondContact OD2-NH2 2.82Å
87	R	95.2	Very high	96.1	Very high	154 Å²	154	48.1 Å²	48.1	58%	0.581	24%	0.243	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-82.9	109.3	172.1	-173	175.5	-174.7	-179.4	8.3	109.8	T89 K90 Y93	R87-T89 WeakPolarHBondContact CG-O 3.34Å; R87-T89 PolarHBondContact NE-O 3.47Å; R87-K90 PolarHBondContact NE-O 2.49Å; R87-K90 PolarHBondContact NH2-O 2.93Å; R87-Y93 HydrophobicContact CB-CD1 3.93Å; R87-Y93 HydrophobicContact CB-CE1 3.81Å; R87-Y93 HydrophobicContact CG-CD1 4.19Å; R87-Y93 HydrophobicContact CG-CE1 3.83Å
88	L	94.4	Very high	96.2	Very high	62 Å²	62	47.6 Å²	47.6	33%	0.325	25%	0.247	S	C	.	.			trans	-85.4	-36.3	-177.4	-62	-169.9	0	0	0	113	D86 T92 R94 L143 L227	D86-L88 HydrophobicContact CB-CD2 4.38Å; D86-L88 PolarHBondContact O-N 2.92Å; L88-T92 PolarHBondContact N-O 3.21Å; L88-R94 HydrophobicContact CD1-CB 3.86Å; L88-R94 HydrophobicContact CD2-CB 4.2Å; L88-R94 HydrophobicContact CG-CB 3.94Å; L88-L143 HydrophobicContact CD1-CD2 3.68Å; L88-L227 HydrophobicContact CD1-CD2 4.43Å
89	T	93.1	Very high	96.2	Very high	19 Å²	19	47.5 Å²	47.5	12%	0.117	25%	0.246	C	C	.	.	S	Bend	trans	-137.5	-174.9	178.3	75	0	0	0	0	109.9	R87 D91 T92	R87-T89 WeakPolarHBondContact CG-O 3.34Å; R87-T89 PolarHBondContact NE-O 3.47Å; T89-D91 PolarHBondContact O-N 2.93Å; T89-D91 PolarHBondContact OG1-N 3.1Å; T89-D91 PolarHBondContact OG1-OD1 3.29Å; T89-D91 VanDerWaalsContact OG1-OD1 3.14Å; T89-T92 PolarHBondContact N-O 2.98Å; T89-T92 VanDerWaalsContact OG1-CB 3.24Å; T89-T92 WeakPolarHBondContact OG1-CB 3.35Å; T89-T92 PolarHBondContact OG1-N 3.24Å; T89-T92 PolarHBondContact OG1-OG1 3.03Å
90	K	92	Very high	95.8	Very high	183 Å²	183	47.9 Å²	47.9	80%	0.796	24%	0.244	S	C	*	.	S	Bend	trans	-55.3	-34.3	174.4	-176.7	177.3	176.5	-179.9	0	112.6	R87	R87-K90 PolarHBondContact NE-O 2.49Å; R87-K90 PolarHBondContact NH2-O 2.93Å
91	D	93.6	Very high	95.4	Very high	46 Å²	46	50.5 Å²	50.5	25%	0.246	27%	0.272	C	S	.	.	S	Bend	trans	-129.6	5.3	-170.8	65.1	-0.2	0	0	0	113.7	T89 K145 C146	T89-D91 PolarHBondContact O-N 2.93Å; T89-D91 PolarHBondContact OG1-N 3.1Å; T89-D91 PolarHBondContact OG1-OD1 3.29Å; T89-D91 VanDerWaalsContact OG1-OD1 3.14Å; D91-K145 CarbonylContact O-C 3.57Å; D91-K145 WeakPolarHBondContact O-CA 3.33Å; D91-K145 WeakPolarHBondContact OD2-CE 3.39Å; D91-K145 IonicContact OD2-NZ 3.28Å; D91-C146 PolarHBondContact O-N 3.02Å
92	T	95.8	Very high	94.8	Very high	2 Å²	2	54 Å²	54	1%	0.012	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	133	-175.2	-52.6	0	0	0	0	111.3	L88 T89 I144 T191 Y226	L88-T92 PolarHBondContact N-O 3.21Å; T89-T92 PolarHBondContact N-O 2.98Å; T89-T92 VanDerWaalsContact OG1-CB 3.24Å; T89-T92 WeakPolarHBondContact OG1-CB 3.35Å; T89-T92 PolarHBondContact OG1-N 3.24Å; T89-T92 PolarHBondContact OG1-OG1 3.03Å; T92-I144 CarbonylContact C-O 3.58Å; T92-I144 WeakPolarHBondContact CA-O 3.36Å; T92-T191 HydrophobicContact CG2-CG2 4.19Å; T92-Y226 HydrophobicContact CG2-CD1 4.1Å
93	Y	96.6	Very high	94.5	Very high	30 Å²	30	55.5 Å²	55.5	12%	0.118	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	144.2	-179.5	-61.1	-94.8	0	0	0	110.4	V85 D86 R87 L143 I144 C146 E157	V85-Y93 HydrophobicContact CG1-CD1 4.02Å; D86-Y93 CarbonylContact O-C 3.54Å; D86-Y93 VanDerWaalsContact O-CA 3.28Å; D86-Y93 WeakPolarHBondContact O-CA 3.36Å; R87-Y93 HydrophobicContact CB-CD1 3.93Å; R87-Y93 HydrophobicContact CB-CE1 3.81Å; R87-Y93 HydrophobicContact CG-CD1 4.19Å; R87-Y93 HydrophobicContact CG-CE1 3.83Å; Y93-L143 WeakPolarHBondContact O-CA 3.48Å; Y93-I144 PolarHBondContact N-O 3.47Å; Y93-I144 PolarHBondContact O-N 3.15Å; Y93-C146 HydrophobicContact CE2-CB 4.29Å; Y93-E157 HydrophobicContact CE2-CG 4.35Å
94	R	97.7	Very high	94.1	Very high	70 Å²	70	57.1 Å²	57.1	26%	0.264	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	118.5	161.4	177	178.1	68.1	179.6	1.8	107.5	D86 L88 I131 E141 V142 L143	D86-R94 HydrophobicContact CB-CB 4.35Å; D86-R94 PolarHBondContact N-O 3.47Å; D86-R94 PolarHBondContact O-N 2.94Å; D86-R94 IonicContact OD2-CZ 3.44Å; D86-R94 IonicContact OD2-NE 3.22Å; D86-R94 PolarHBondContact OD2-NE 2.9Å; D86-R94 IonicContact OD2-NH2 2.78Å; D86-R94 PolarHBondContact OD2-NH2 2.82Å; L88-R94 HydrophobicContact CD1-CB 3.86Å; L88-R94 HydrophobicContact CD2-CB 4.2Å; L88-R94 HydrophobicContact CG-CB 3.94Å; R94-I131 HydrophobicContact CG-CD1 4.39Å; R94-E141 HydrophobicContact CG-CB 4.45Å; R94-V142 WeakPolarHBondContact CA-O 3.32Å; R94-L143 HydrophobicContact CB-CD2 4.04Å; R94-L143 HydrophobicContact CG-CD2 4.48Å
95	V	98.3	Very high	93.8	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	128.3	-178.3	-171.9	0	0	0	0	108.6	I82 V85 F97 E141 V142 I144 W159	I82-V95 HydrophobicContact CG1-CG1 4.38Å; I82-V95 HydrophobicContact CG2-CG1 3.83Å; V85-V95 HydrophobicContact CG1-CG2 4.42Å; V85-V95 HydrophobicContact CG2-CG1 4.27Å; V95-F97 HydrophobicContact CB-CE2 3.81Å; V95-F97 HydrophobicContact CB-CZ 4.13Å; V95-F97 HydrophobicContact CG1-CD2 4.33Å; V95-F97 HydrophobicContact CG1-CE1 4.24Å; V95-F97 HydrophobicContact CG1-CE2 3.49Å; V95-F97 VanDerWaalsContact CG1-CE2 3.49Å; V95-F97 HydrophobicContact CG1-CZ 3.45Å; V95-F97 VanDerWaalsContact CG1-CZ 3.45Å; V95-E141 VanDerWaalsContact O-CA 3.28Å; V95-E141 WeakPolarHBondContact O-CA 3.08Å; V95-V142 HydrophobicContact CB-CG2 4.47Å; V95-V142 PolarHBondContact N-O 3.4Å; V95-V142 PolarHBondContact O-N 3.08Å; V95-I144 HydrophobicContact CG2-CD1 4.18Å; V95-W159 HydrophobicContact CB-CZ3 4.37Å; V95-W159 HydrophobicContact CG1-CE3 3.99Å; V95-W159 HydrophobicContact CG1-CZ3 3.96Å; V95-W159 HydrophobicContact CG2-CE3 4.14Å; V95-W159 HydrophobicContact CG2-CZ3 4.12Å
96	R	98.2	Very high	93.3	Very high	82 Å²	82	57.9 Å²	57.9	31%	0.309	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	133	177.7	-172.2	-178.3	-70.1	-164.2	-7.2	110.3	I82 S83 A84 Y139 F140 E141	I82-R96 CarbonylContact C-O 3.5Å; I82-R96 WeakPolarHBondContact CA-O 3.4Å; S83-R96 PolarHBondContact N-O 3.43Å; S83-R96 WeakPolarHBondContact OG-CB 3.19Å; S83-R96 WeakPolarHBondContact OG-CD 3.36Å; S83-R96 WeakPolarHBondContact OG-CG 3.39Å; S83-R96 PolarHBondContact OG-O 3.27Å; A84-R96 HydrophobicContact CB-CB 4.05Å; A84-R96 PolarHBondContact N-O 3.02Å; A84-R96 PolarHBondContact O-N 2.82Å; R96-Y139 HydrophobicContact CG-CD2 3.8Å; R96-Y139 HydrophobicContact CG-CG 4.14Å; R96-F140 WeakPolarHBondContact CA-O 3.35Å; R96-E141 HydrophobicContact CB-CG 3.9Å; R96-E141 HydrophobicContact CG-CG 3.87Å; R96-E141 IonicContact CZ-OE1 3.16Å; R96-E141 IonicContact NE-OE1 2.76Å; R96-E141 PolarHBondContact NE-OE1 3.28Å; R96-E141 IonicContact NH2-OE1 2.71Å; R96-E141 PolarHBondContact NH2-OE1 2.75Å
97	F	97.8	Very high	93	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	132.9	178.1	-62.5	-89.9	0	0	0	109.7	F80 C81 I82 V95 Y139 F140 V142 W159 A165 W167	F80-F97 HydrophobicContact CB-CB 4.09Å; F80-F97 HydrophobicContact CB-CD1 4.08Å; F80-F97 HydrophobicContact CB-CG 4.48Å; C81-F97 CarbonylContact O-C 3.6Å; C81-F97 VanDerWaalsContact O-CA 3.29Å; C81-F97 WeakPolarHBondContact O-CA 3.47Å; I82-F97 HydrophobicContact CD1-CE1 4.06Å; I82-F97 HydrophobicContact CG1-CD1 3.86Å; I82-F97 HydrophobicContact CG1-CE1 3.42Å; I82-F97 VanDerWaalsContact CG1-CE1 3.42Å; I82-F97 HydrophobicContact CG1-CZ 4.17Å; V95-F97 HydrophobicContact CB-CE2 3.81Å; V95-F97 HydrophobicContact CB-CZ 4.13Å; V95-F97 HydrophobicContact CG1-CD2 4.33Å; V95-F97 HydrophobicContact CG1-CE1 4.24Å; V95-F97 HydrophobicContact CG1-CE2 3.49Å; V95-F97 VanDerWaalsContact CG1-CE2 3.49Å; V95-F97 HydrophobicContact CG1-CZ 3.45Å; V95-F97 VanDerWaalsContact CG1-CZ 3.45Å; F97-Y139 CarbonylContact O-C 3.58Å; F97-Y139 WeakPolarHBondContact O-CA 3.44Å; F97-Y139 WeakPolarHBondContact O-CB 3.29Å; F97-F140 HydrophobicContact CB-CD1 3.76Å; F97-F140 HydrophobicContact CB-CD2 4.39Å; F97-F140 HydrophobicContact CB-CE1 3.34Å; F97-F140 HydrophobicContact CB-CE2 4Å; F97-F140 HydrophobicContact CB-CG 4.29Å; F97-F140 HydrophobicContact CB-CZ 3.47Å; F97-F140 VanDerWaalsContact CB-CZ 3.47Å; F97-F140 HydrophobicContact CD1-CZ 4.33Å; F97-F140 HydrophobicContact CD2-CD2 4.06Å; F97-F140 HydrophobicContact CD2-CE1 4.44Å; F97-F140 AromaticContact CD2-CE2 3.52Å; F97-F140 HydrophobicContact CD2-CE2 3.52Å; F97-F140 AromaticContact CD2-CZ 3.75Å; F97-F140 HydrophobicContact CD2-CZ 3.75Å; F97-F140 HydrophobicContact CE2-CE2 4.28Å; F97-F140 HydrophobicContact CG-CE1 4Å; F97-F140 AromaticContact CG-CE2 3.87Å; F97-F140 HydrophobicContact CG-CE2 3.87Å; F97-F140 AromaticContact CG-CZ 3.57Å; F97-F140 HydrophobicContact CG-CZ 3.57Å; F97-F140 PolarHBondContact N-O 3.22Å; F97-F140 PolarHBondContact O-N 3.02Å; F97-V142 HydrophobicContact CE2-CG2 3.73Å; F97-W159 HydrophobicContact CE1-CH2 4.44Å; F97-W159 AromaticContact CZ-CH2 3.93Å; F97-W159 HydrophobicContact CZ-CH2 3.93Å; F97-W159 AromaticContact CZ-CZ3 3.77Å; F97-W159 HydrophobicContact CZ-CZ3 3.77Å; F97-A165 HydrophobicContact CD1-CB 4.36Å; F97-A165 HydrophobicContact CE1-CB 3.56Å; F97-A165 HydrophobicContact CZ-CB 4.39Å; F97-W167 AromaticContact CD1-NE1 3.63Å; F97-W167 HydrophobicContact CD2-CZ2 4.4Å; F97-W167 HydrophobicContact CE1-CZ2 4.14Å; F97-W167 AromaticContact CE1-NE1 3.4Å; F97-W167 AromaticContact CE2-CZ2 3.7Å; F97-W167 HydrophobicContact CE2-CZ2 3.7Å; F97-W167 AromaticContact CZ-CE2 3.95Å; F97-W167 AromaticContact CZ-CZ2 3.54Å; F97-W167 HydrophobicContact CZ-CZ2 3.54Å; F97-W167 AromaticContact CZ-NE1 3.75Å
98	A	96.5	Very high	92.7	Very high	37 Å²	37	53.8 Å²	53.8	31%	0.306	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	134.3	178	0	0	0	0	0	111	C81	C81-A98 PolarHBondContact O-N 3.27Å
99	L	94.1	Very high	92.4	Very high	14 Å²	14	51.6 Å²	51.6	7%	0.073	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-96.4	151.8	168.4	-64.5	175.7	0	0	0	110.2	F80 G101 S103 L105 G138 F140	F80-L99 HydrophobicContact CD1-CD2 3.8Å; F80-L99 HydrophobicContact CE1-CD2 3.33Å; F80-L99 HydrophobicContact CZ-CD2 4.24Å; L99-G101 PolarHBondContact O-N 3.01Å; L99-S103 WeakPolarHBondContact CD1-O 3.45Å; L99-L105 HydrophobicContact CD1-CB 4.1Å; L99-L105 HydrophobicContact CD1-CD1 4.47Å; L99-L105 HydrophobicContact CD2-CD1 3.85Å; L99-G138 PolarHBondContact N-O 3.01Å; L99-F140 HydrophobicContact CD2-CD1 3.92Å; L99-F140 HydrophobicContact CD2-CE1 4.24Å; L99-F140 HydrophobicContact CG-CD1 4.26Å
100	P	87.3	Confident	91.9	Very high	61 Å²	61	50.8 Å²	50.8	40%	0.396	28%	0.283	S	S	.	.	S	Bend	trans	-62.2	124.8	176.1	-22.6	33.8	0	0	0	112.2	S103	P100-S103 WeakPolarHBondContact O-CB 3.08Å; P100-S103 PolarHBondContact O-N 3.46Å; P100-S103 PolarHBondContact O-OG 3.42Å
101	G	86.5	Confident	91.9	Very high	60 Å²	60	43.2 Å²	43.2	62%	0.619	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	-139	180	0	0	0	0	0	112.6	L99 S103 G138	L99-G101 PolarHBondContact O-N 3.01Å; G101-S103 VanDerWaalsContact C-N 3.33Å; G101-G138 WeakPolarHBondContact O-CA 3.46Å
102	N	86.2	Confident	92	Very high	130 Å²	130	42.1 Å²	42.1	70%	0.695	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.7	31.6	175.3	-62.4	-8.1	0	0	0	111.6	E137	N102-E137 HydrophobicContact CB-CB 4.36Å
103	S	90.8	Very high	92.1	Very high	32 Å²	32	42 Å²	42	22%	0.224	24%	0.243	C	C	.	.			trans	-71.3	154.2	177	59.1	0	0	0	0	111.5	L99 P100 G101 G138	L99-S103 WeakPolarHBondContact CD1-O 3.45Å; P100-S103 WeakPolarHBondContact O-CB 3.08Å; P100-S103 PolarHBondContact O-N 3.46Å; P100-S103 PolarHBondContact O-OG 3.42Å; G101-S103 VanDerWaalsContact C-N 3.33Å; S103-G138 PolarHBondContact O-N 2.82Å
104	Q	90.9	Very high	92.1	Very high	90 Å²	90	40.6 Å²	40.6	42%	0.421	24%	0.237	S	C	.	.	B	Isolated β-bridge	trans	-101	151.9	173.2	-64.6	176.8	-14.3	0	0	109.6	G106 N135 E137	Q104-G106 PolarHBondContact O-N 2.66Å; Q104-N135 PolarHBondContact NE2-O 3.29Å; Q104-E137 HydrophobicContact CG-CG 4.09Å
105	L	90.8	Very high	92.1	Very high	27 Å²	27	37.2 Å²	37.2	14%	0.141	23%	0.225	C	C	.	.			trans	-64.9	-29.6	178.5	-164.8	71.2	0	0	0	112.2	L72 L99 L107 L113 P130 F140	L72-L105 HydrophobicContact CD1-CD1 3.69Å; L72-L105 HydrophobicContact CD1-CG 3.84Å; L72-L105 HydrophobicContact CG-CD1 4.43Å; L99-L105 HydrophobicContact CD1-CB 4.1Å; L99-L105 HydrophobicContact CD1-CD1 4.47Å; L99-L105 HydrophobicContact CD2-CD1 3.85Å; L105-L107 HydrophobicContact CB-CD1 4.46Å; L105-L107 HydrophobicContact CD2-CD1 3.76Å; L105-L107 HydrophobicContact CD2-CD2 4.06Å; L105-L107 HydrophobicContact CD2-CG 4.36Å; L105-L107 HydrophobicContact CG-CD1 3.68Å; L105-L113 HydrophobicContact CD1-CD1 4.38Å; L105-L113 HydrophobicContact CD2-CD1 4.05Å; L105-P130 HydrophobicContact CD2-CB 4.16Å; L105-P130 HydrophobicContact CD2-CG 3.77Å; L105-F140 HydrophobicContact CB-CB 4.43Å; L105-F140 HydrophobicContact CD1-CB 4.29Å; L105-F140 HydrophobicContact CD1-CD1 3.47Å; L105-F140 VanDerWaalsContact CD1-CD1 3.47Å; L105-F140 HydrophobicContact CD1-CE1 3.82Å; L105-F140 HydrophobicContact CD1-CG 3.91Å; L105-F140 HydrophobicContact CD2-CB 3.74Å; L105-F140 HydrophobicContact CD2-CD1 4.31Å; L105-F140 HydrophobicContact CD2-CD2 4.21Å; L105-F140 HydrophobicContact CD2-CG 3.85Å; L105-F140 HydrophobicContact CG-CB 4.38Å; L105-F140 HydrophobicContact CG-CD1 4.42Å; L105-F140 HydrophobicContact CG-CG 4.42Å
106	G	87.9	Confident	92.1	Very high	56 Å²	56	40.1 Å²	40.1	58%	0.577	24%	0.235	S	C	*	.			trans	75.9	24.5	175	0	0	0	0	0	115.1	Q104	Q104-G106 PolarHBondContact O-N 2.66Å
107	L	89.6	Confident	92	Very high	19 Å²	19	36.2 Å²	36.2	10%	0.099	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-86.7	144.9	174.4	-90	61.9	0	0	0	111.4	L72 L105 Q111 L113 P130 P170	L72-L107 HydrophobicContact CD1-CD1 3.61Å; L105-L107 HydrophobicContact CB-CD1 4.46Å; L105-L107 HydrophobicContact CD2-CD1 3.76Å; L105-L107 HydrophobicContact CD2-CD2 4.06Å; L105-L107 HydrophobicContact CD2-CG 4.36Å; L105-L107 HydrophobicContact CG-CD1 3.68Å; L107-Q111 HydrophobicContact CB-CB 4.33Å; L107-Q111 HydrophobicContact CD2-CB 4.11Å; L107-Q111 HydrophobicContact CG-CB 4.05Å; L107-L113 HydrophobicContact CD1-CD2 4.2Å; L107-L113 HydrophobicContact CD2-CD2 3.93Å; L107-L113 HydrophobicContact CD2-CG 3.98Å; L107-P130 HydrophobicContact CD2-CG 3.87Å; L107-P170 HydrophobicContact CD1-CB 4.09Å; L107-P170 HydrophobicContact CG-CB 3.94Å
108	Q	88.7	Confident	91.8	Very high	109 Å²	109	40.9 Å²	40.9	51%	0.509	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-81.9	147.1	166	-60.3	-62.5	-65.4	0	0	110.3	G110 Q111 F175	Q108-G110 PolarHBondContact O-N 3.33Å; Q108-Q111 HydrophobicContact CB-CG 4.22Å; Q108-Q111 WeakPolarHBondContact O-CB 3.23Å; Q108-Q111 WeakPolarHBondContact O-CG 3.1Å; Q108-Q111 PolarHBondContact O-N 3.39Å; Q108-F175 HydrophobicContact CB-CD1 4.1Å; Q108-F175 HydrophobicContact CB-CE1 4.36Å; Q108-F175 HydrophobicContact CG-CD1 4.31Å; Q108-F175 HydrophobicContact CG-CE1 4.44Å
109	P	87.4	Confident	91.7	Very high	17 Å²	17	39.7 Å²	39.7	11%	0.11	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	127.9	173.4	-26.2	34.8	0	0	0	111.9	P198 I199	P109-P198 HydrophobicContact CB-CB 4.36Å; P109-I199 HydrophobicContact CB-CB 4.47Å; P109-I199 HydrophobicContact CB-CG1 3.73Å
110	G	83.3	Confident	91.6	Very high	2 Å²	2	44.6 Å²	44.6	2%	0.021	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	100.6	-12.1	-174.4	0	0	0	0	0	114.6	Q108	Q108-G110 PolarHBondContact O-N 3.33Å
111	Q	92.6	Very high	91.8	Very high	24 Å²	24	49.4 Å²	49.4	11%	0.112	28%	0.283	C	S	.	.			trans	-83.4	153.9	173.7	-64.2	-171	-55	0	0	112.7	L107 Q108 T129 P170 F171 F175	L107-Q111 HydrophobicContact CB-CB 4.33Å; L107-Q111 HydrophobicContact CD2-CB 4.11Å; L107-Q111 HydrophobicContact CG-CB 4.05Å; Q108-Q111 HydrophobicContact CB-CG 4.22Å; Q108-Q111 WeakPolarHBondContact O-CB 3.23Å; Q108-Q111 WeakPolarHBondContact O-CG 3.1Å; Q108-Q111 PolarHBondContact O-N 3.39Å; Q111-T129 WeakPolarHBondContact O-CG2 3.33Å; Q111-P170 HydrophobicContact CB-CB 4.35Å; Q111-F171 CarbonylContact C-O 3.54Å; Q111-F171 WeakPolarHBondContact CA-O 3.5Å; Q111-F171 VanDerWaalsContact CB-O 3.29Å; Q111-F171 WeakPolarHBondContact CB-O 3.48Å; Q111-F175 HydrophobicContact CG-CE1 4.32Å
112	H	95.1	Very high	92.2	Very high	22 Å²	22	49.3 Å²	49.3	10%	0.102	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	168.1	179.5	65	-89.8	0	0	0	111.9	Y128 F171	H112-Y128 WeakPolarHBondContact CB-O 3.44Å; H112-F171 PolarHBondContact N-O 2.93Å; H112-F171 PolarHBondContact ND1-O 2.85Å; H112-F171 WeakPolarHBondContact NE2-CB 3.26Å; H112-F171 PolarHBondContact O-N 2.52Å
113	L	96.9	Very high	92.6	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	157.6	176.7	-60.2	-177.7	0	0	0	110.8	L72 L105 L107 A127 Y128 P130 F140 W167	L72-L113 HydrophobicContact CD1-CD1 4.2Å; L72-L113 HydrophobicContact CD1-CD2 3.65Å; L72-L113 HydrophobicContact CD2-CD1 4.48Å; L72-L113 HydrophobicContact CD2-CD2 4.29Å; L105-L113 HydrophobicContact CD1-CD1 4.38Å; L105-L113 HydrophobicContact CD2-CD1 4.05Å; L107-L113 HydrophobicContact CD1-CD2 4.2Å; L107-L113 HydrophobicContact CD2-CD2 3.93Å; L107-L113 HydrophobicContact CD2-CG 3.98Å; L113-A127 CarbonylContact O-C 3.54Å; L113-A127 VanDerWaalsContact O-CA 3.32Å; L113-A127 WeakPolarHBondContact O-CA 3.41Å; L113-Y128 PolarHBondContact N-O 3.24Å; L113-Y128 PolarHBondContact O-N 3.31Å; L113-P130 HydrophobicContact CD1-CG 4.22Å; L113-P130 HydrophobicContact CG-CG 4.28Å; L113-F140 HydrophobicContact CD1-CE2 4.13Å; L113-F140 HydrophobicContact CD1-CZ 4.33Å; L113-W167 HydrophobicContact CB-CE3 3.56Å; L113-W167 HydrophobicContact CB-CZ3 3.97Å; L113-W167 HydrophobicContact CD1-CE3 4.22Å
114	I	97.7	Very high	92.8	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	118.3	173.4	-66.6	174.5	0	0	0	108.9	C29 C33 F77 Q125 R126 W167 R168 F171	C29-I114 HydrophobicContact CB-CD1 3.98Å; C29-I114 HydrophobicContact CB-CG1 4.2Å; C29-I114 HydrophobicContact CB-CG2 4.27Å; C33-I114 HydrophobicContact CB-CD1 3.75Å; C33-I114 VanDerWaalsContact SG-CD1 3.56Å; F77-I114 HydrophobicContact CE1-CG2 4.42Å; F77-I114 HydrophobicContact CZ-CG2 4.45Å; I114-Q125 HydrophobicContact CG2-CB 3.81Å; I114-Q125 HydrophobicContact CG2-CG 4.36Å; I114-R126 WeakPolarHBondContact CA-O 3.45Å; I114-W167 WeakPolarHBondContact O-CA 3.43Å; I114-R168 HydrophobicContact CB-CG 3.9Å; I114-R168 HydrophobicContact CG2-CG 4.34Å; I114-R168 PolarHBondContact N-O 2.87Å; I114-R168 PolarHBondContact O-N 3Å; I114-F171 HydrophobicContact CB-CE2 4.1Å; I114-F171 HydrophobicContact CD1-CD2 3.72Å; I114-F171 HydrophobicContact CD1-CE1 4.34Å; I114-F171 HydrophobicContact CD1-CE2 3.43Å; I114-F171 VanDerWaalsContact CD1-CE2 3.43Å; I114-F171 HydrophobicContact CD1-CG 4.32Å; I114-F171 HydrophobicContact CD1-CZ 3.8Å; I114-F171 HydrophobicContact CG1-CD2 3.75Å; I114-F171 HydrophobicContact CG1-CE2 3.66Å
115	L	97.9	Very high	93.1	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	132.3	171	176	61.4	0	0	0	109.6	Q125 R126 Y128 M152 W159 A165 W167	L115-Q125 CarbonylContact O-C 3.51Å; L115-Q125 WeakPolarHBondContact O-CA 3.46Å; L115-R126 PolarHBondContact N-O 2.94Å; L115-R126 PolarHBondContact O-N 2.94Å; L115-Y128 HydrophobicContact CB-CD2 3.8Å; L115-Y128 HydrophobicContact CB-CE2 3.9Å; L115-Y128 HydrophobicContact CD2-CD2 4.17Å; L115-Y128 HydrophobicContact CD2-CE2 3.7Å; L115-Y128 HydrophobicContact CG-CE2 4.44Å; L115-M152 HydrophobicContact CD2-CE 4.11Å; L115-M152 HydrophobicContact CD2-SD 3.59Å; L115-M152 VanDerWaalsContact CD2-SD 3.59Å; L115-M152 HydrophobicContact CG-CE 4.1Å; L115-M152 HydrophobicContact CG-SD 4.18Å; L115-W159 HydrophobicContact CD1-CH2 4.05Å; L115-W159 HydrophobicContact CD1-CZ2 4.09Å; L115-W159 HydrophobicContact CD2-CH2 3.54Å; L115-W159 HydrophobicContact CD2-CZ2 3.93Å; L115-W159 HydrophobicContact CG-CH2 4.47Å; L115-A165 HydrophobicContact CD1-CB 3.89Å; L115-W167 HydrophobicContact CB-CD2 4.29Å; L115-W167 HydrophobicContact CB-CE3 3.84Å; L115-W167 HydrophobicContact CB-CH2 3.73Å; L115-W167 HydrophobicContact CB-CZ2 4.16Å; L115-W167 HydrophobicContact CB-CZ3 3.56Å; L115-W167 HydrophobicContact CD1-CD2 4.1Å; L115-W167 HydrophobicContact CD1-CH2 4.26Å; L115-W167 HydrophobicContact CD1-CZ2 3.79Å; L115-W167 HydrophobicContact CD2-CH2 4.24Å; L115-W167 HydrophobicContact CD2-CZ2 4.29Å; L115-W167 HydrophobicContact CG-CH2 4.29Å; L115-W167 HydrophobicContact CG-CZ2 4.29Å
116	R	97.4	Very high	93.4	Very high	60 Å²	60	43.3 Å²	43.3	23%	0.226	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	132.4	166.2	177.6	179.4	68.1	175.2	2.6	110.4	F77 E123 I124 Q125 F166	F77-R116 HydrophobicContact CD1-CB 3.79Å; F77-R116 HydrophobicContact CE1-CB 3.38Å; F77-R116 HydrophobicContact CE1-CG 4.48Å; F77-R116 HydrophobicContact CE2-CB 4.38Å; F77-R116 HydrophobicContact CG-CB 4.46Å; F77-R116 HydrophobicContact CZ-CB 3.71Å; F77-R116 HydrophobicContact CZ-CG 4.44Å; R116-E123 VanDerWaalsContact CD-CD 3.49Å; R116-E123 WeakPolarHBondContact CD-OE2 3.24Å; R116-E123 HydrophobicContact CG-CG 3.78Å; R116-I124 WeakPolarHBondContact CA-O 3.45Å; R116-Q125 HydrophobicContact CB-CG 4.43Å; R116-F166 HydrophobicContact CB-CB 4.27Å; R116-F166 PolarHBondContact N-O 3.47Å; R116-F166 VanDerWaalsContact NH2-CD1 3.29Å
117	G	95.9	Very high	93.8	Very high	1 Å²	1	42 Å²	42	1%	0.01	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	157	171.2	0	0	0	0	0	111.5	E123 I124	G117-E123 WeakPolarHBondContact O-CA 3.44Å; G117-I124 PolarHBondContact N-O 2.88Å; G117-I124 WeakPolarHBondContact O-CG1 3.21Å; G117-I124 PolarHBondContact O-N 2.9Å
118	I	94.9	Very high	94.1	Very high	97 Å²	97	42.7 Å²	42.7	50%	0.497	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	124.1	174.3	-58.1	174.7	0	0	0	107.1	L122	I118-L122 WeakPolarHBondContact CA-O 3.38Å
119	V	93.6	Very high	94.5	Very high	13 Å²	13	38.5 Å²	38.5	8%	0.079	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	124.4	178.1	-179.1	0	0	0	0	108.1	D121 L122 I124 L151 Y155	V119-D121 VanDerWaalsContact C-N 3.27Å; V119-D121 PolarHBondContact O-N 3.31Å; V119-L122 PolarHBondContact N-O 3.01Å; V119-L122 WeakPolarHBondContact O-CB 3.49Å; V119-L122 PolarHBondContact O-N 2.84Å; V119-I124 HydrophobicContact CG2-CD1 4.25Å; V119-L151 HydrophobicContact CG1-CD2 4.2Å; V119-Y155 HydrophobicContact CG2-CD2 4.34Å; V119-Y155 HydrophobicContact CG2-CG 4.37Å
120	D	92.3	Very high	94.9	Very high	117 Å²	117	38.1 Å²	38.1	63%	0.626	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.9	47.1	-179.6	-50.3	-36	0	0	0	111.4	L122 R154	D120-L122 PolarHBondContact O-N 3.47Å; D120-R154 IonicContact OD1-NH2 3.49Å; D120-R154 PolarHBondContact OD1-NH2 2.93Å; D120-R154 IonicContact OD2-CZ 3.74Å; D120-R154 IonicContact OD2-NH1 2.72Å; D120-R154 PolarHBondContact OD2-NH1 2.85Å; D120-R154 IonicContact OD2-NH2 3.91Å; D120-R154 PolarHBondContact OD2-NH2 2.84Å
121	D	91.7	Very high	95.5	Very high	162 Å²	162	38.4 Å²	38.4	87%	0.866	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.8	5.3	-174.5	-58.8	-46.4	0	0	0	116.3	V119	V119-D121 VanDerWaalsContact C-N 3.27Å; V119-D121 PolarHBondContact O-N 3.31Å
122	L	93.9	Very high	95.5	Very high	57 Å²	57	37.8 Å²	37.8	30%	0.298	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	119.5	175.8	-172.9	65	0	0	0	110.9	L24 S26 I118 V119 D120 I124 L151	L24-L122 HydrophobicContact CD1-CD1 3.66Å; S26-L122 WeakPolarHBondContact OG-CD1 3.47Å; I118-L122 WeakPolarHBondContact CA-O 3.38Å; V119-L122 PolarHBondContact N-O 3.01Å; V119-L122 WeakPolarHBondContact O-CB 3.49Å; V119-L122 PolarHBondContact O-N 2.84Å; D120-L122 PolarHBondContact O-N 3.47Å; L122-I124 HydrophobicContact CG-CG2 4.44Å; L122-L151 HydrophobicContact CD2-CD1 3.79Å
123	E	95.3	Very high	95.1	Very high	40 Å²	40	38.2 Å²	38.2	19%	0.187	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	132.7	170.7	-170.8	-175.3	117.5	0	0	110.8	S26 Q27 R116 G117 Q125	S26-E123 WeakPolarHBondContact CB-O 3.3Å; S26-E123 PolarHBondContact OG-O 3.35Å; Q27-E123 HydrophobicContact CG-CB 3.87Å; Q27-E123 HydrophobicContact CG-CG 4.05Å; Q27-E123 PolarHBondContact NE2-OE1 2.81Å; R116-E123 VanDerWaalsContact CD-CD 3.49Å; R116-E123 WeakPolarHBondContact CD-OE2 3.24Å; R116-E123 HydrophobicContact CG-CG 3.78Å; G117-E123 WeakPolarHBondContact O-CA 3.44Å; E123-Q125 PolarHBondContact OE1-NE2 2.79Å
124	I	95.9	Very high	94.4	Very high	3 Å²	3	41 Å²	41	2%	0.015	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	146.8	177.5	56.6	172.8	0	0	0	110.5	S26 R116 G117 V119 L122 L151 M152	S26-I124 WeakPolarHBondContact O-CA 3.43Å; R116-I124 WeakPolarHBondContact CA-O 3.45Å; G117-I124 PolarHBondContact N-O 2.88Å; G117-I124 WeakPolarHBondContact O-CG1 3.21Å; G117-I124 PolarHBondContact O-N 2.9Å; V119-I124 HydrophobicContact CG2-CD1 4.25Å; L122-I124 HydrophobicContact CG-CG2 4.44Å; I124-L151 VanDerWaalsContact CD1-C 3.48Å; I124-L151 HydrophobicContact CD1-CB 3.66Å; I124-L151 HydrophobicContact CG2-CB 4.3Å; I124-L151 HydrophobicContact CG2-CD1 3.93Å; I124-M152 HydrophobicContact CD1-CB 3.91Å; I124-M152 HydrophobicContact CD1-CE 3.95Å; I124-M152 VanDerWaalsContact CD1-N 3.27Å; I124-M152 HydrophobicContact CD1-SD 4.19Å; I124-M152 HydrophobicContact CG1-CE 3.9Å
125	Q	96.8	Very high	93.8	Very high	2 Å²	2	45.9 Å²	45.9	1%	0.009	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	141.6	176.4	-60.9	-174.3	26.8	0	0	111.9	S26 Q27 C29 F77 I114 L115 R116 E123	S26-Q125 PolarHBondContact O-N 3.45Å; Q27-Q125 WeakPolarHBondContact O-CB 3.32Å; Q27-Q125 VanDerWaalsContact O-CG 3.3Å; Q27-Q125 WeakPolarHBondContact O-CG 3.41Å; Q27-Q125 PolarHBondContact O-NE2 2.9Å; Q27-Q125 PolarHBondContact O-OE1 2.71Å; C29-Q125 WeakPolarHBondContact CA-O 3.3Å; C29-Q125 HydrophobicContact CB-CB 4.43Å; F77-Q125 HydrophobicContact CZ-CG 4.35Å; I114-Q125 HydrophobicContact CG2-CB 3.81Å; I114-Q125 HydrophobicContact CG2-CG 4.36Å; L115-Q125 CarbonylContact O-C 3.51Å; L115-Q125 WeakPolarHBondContact O-CA 3.46Å; R116-Q125 HydrophobicContact CB-CG 4.43Å; E123-Q125 PolarHBondContact OE1-NE2 2.79Å
126	R	96.3	Very high	93.5	Very high	108 Å²	108	46.4 Å²	46.4	41%	0.408	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	144.1	175.3	-68.6	-63.4	179.8	-93.2	4.3	111.6	I114 L115 Y128 M152	I114-R126 WeakPolarHBondContact CA-O 3.45Å; L115-R126 PolarHBondContact N-O 2.94Å; L115-R126 PolarHBondContact O-N 2.94Å; R126-Y128 HydrophobicContact CB-CD2 4.43Å; R126-Y128 HydrophobicContact CB-CE2 3.65Å; R126-M152 HydrophobicContact CB-CE 4Å; R126-M152 HydrophobicContact CB-CG 4.32Å; R126-M152 HydrophobicContact CG-CB 4.03Å; R126-M152 HydrophobicContact CG-CE 3.92Å; R126-M152 HydrophobicContact CG-CG 3.96Å
127	A	95.9	Very high	93.3	Very high	28 Å²	28	48.8 Å²	48.8	23%	0.231	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	136.8	174.7	0	0	0	0	0	111.2	S31 L113	S31-A127 WeakPolarHBondContact OG-CB 3.48Å; L113-A127 CarbonylContact O-C 3.54Å; L113-A127 VanDerWaalsContact O-CA 3.32Å; L113-A127 WeakPolarHBondContact O-CA 3.41Å
128	Y	96.8	Very high	93.3	Very high	34 Å²	34	49.6 Å²	49.6	13%	0.133	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	135.5	170.6	-63.9	-83.1	0	0	0	110.5	H112 L113 L115 R126 I144 M152 W167	H112-Y128 WeakPolarHBondContact CB-O 3.44Å; L113-Y128 PolarHBondContact N-O 3.24Å; L113-Y128 PolarHBondContact O-N 3.31Å; L115-Y128 HydrophobicContact CB-CD2 3.8Å; L115-Y128 HydrophobicContact CB-CE2 3.9Å; L115-Y128 HydrophobicContact CD2-CD2 4.17Å; L115-Y128 HydrophobicContact CD2-CE2 3.7Å; L115-Y128 HydrophobicContact CG-CE2 4.44Å; R126-Y128 HydrophobicContact CB-CD2 4.43Å; R126-Y128 HydrophobicContact CB-CE2 3.65Å; Y128-I144 HydrophobicContact CD1-CG1 3.9Å; Y128-I144 HydrophobicContact CE1-CB 4.08Å; Y128-I144 HydrophobicContact CE1-CD1 4.34Å; Y128-I144 HydrophobicContact CE1-CG1 3.7Å; Y128-I144 HydrophobicContact CE1-CG2 3.76Å; Y128-M152 HydrophobicContact CE2-CG 4.42Å; Y128-M152 WeakPolarHBondContact OH-CG 3.34Å; Y128-W167 AromaticContact CD2-CH2 3.83Å; Y128-W167 HydrophobicContact CD2-CH2 3.83Å; Y128-W167 AromaticContact CD2-CZ3 3.94Å; Y128-W167 HydrophobicContact CD2-CZ3 3.94Å; Y128-W167 HydrophobicContact CG-CH2 4.15Å; Y128-W167 HydrophobicContact CG-CZ3 4.35Å
129	T	95.9	Very high	93.3	Very high	21 Å²	21	47.9 Å²	47.9	13%	0.129	26%	0.258	C	S	.	.			trans	-91.9	123.7	176.9	-52.1	0	0	0	0	109.7	Q111 P195	Q111-T129 WeakPolarHBondContact O-CG2 3.33Å; T129-P195 HydrophobicContact CG2-CB 4.08Å
130	P	95.8	Very high	93.5	Very high	9 Å²	9	47.3 Å²	47.3	6%	0.058	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-60.7	139.3	171.9	-28.1	40	0	0	0	112.1	L105 L107 L113 F140 E141 V142	L105-P130 HydrophobicContact CD2-CB 4.16Å; L105-P130 HydrophobicContact CD2-CG 3.77Å; L107-P130 HydrophobicContact CD2-CG 3.87Å; L113-P130 HydrophobicContact CD1-CG 4.22Å; L113-P130 HydrophobicContact CG-CG 4.28Å; P130-F140 HydrophobicContact CG-CD2 4.36Å; P130-E141 CarbonylContact C-O 3.53Å; P130-E141 WeakPolarHBondContact CA-O 3.33Å; P130-V142 HydrophobicContact CG-CG1 4.33Å
131	I	96	Very high	93.7	Very high	8 Å²	8	42.3 Å²	42.3	4%	0.041	23%	0.228	C	C	.	.			trans	-108.9	0.6	179.4	59.6	145.6	0	0	0	112.6	R94 E141 L143 A194 V197 L227	R94-I131 HydrophobicContact CG-CD1 4.39Å; I131-E141 HydrophobicContact CD1-CB 4.32Å; I131-E141 HydrophobicContact CG1-CB 3.91Å; I131-E141 WeakPolarHBondContact CG1-O 3.29Å; I131-E141 PolarHBondContact N-O 2.76Å; I131-L143 HydrophobicContact CD1-CD1 4.27Å; I131-L143 HydrophobicContact CD1-CD2 3.85Å; I131-L143 HydrophobicContact CD1-CG 3.69Å; I131-L143 HydrophobicContact CG1-CG 4.23Å; I131-L143 HydrophobicContact CG2-CD1 4.1Å; I131-L143 HydrophobicContact CG2-CG 4.05Å; I131-A194 HydrophobicContact CG2-CB 3.75Å; I131-V197 HydrophobicContact CB-CB 4.35Å; I131-V197 HydrophobicContact CB-CG1 4.13Å; I131-V197 HydrophobicContact CG2-CB 4.36Å; I131-V197 HydrophobicContact CG2-CG2 4.4Å; I131-V197 WeakPolarHBondContact O-CG1 3.2Å; I131-L227 HydrophobicContact CD1-CD1 4.17Å; I131-L227 HydrophobicContact CD1-CD2 4.26Å
132	S	92.8	Very high	94	Very high	11 Å²	11	34.6 Å²	34.6	8%	0.077	19%	0.186	C	C	.	.	S	Bend	trans	-72.4	148.4	172.8	48.3	0	0	0	0	110.3	F140 E141	S132-F140 WeakPolarHBondContact OG-CA 3.19Å; S132-E141 PolarHBondContact OG-N 3.35Å
133	P	86.8	Confident	94.1	Very high	32 Å²	32	32.1 Å²	32.1	21%	0.208	17%	0.173	C	C	.	.			trans	-51.4	148.1	171	-26.7	34.3	0	0	0	112.2	N135 A136	P133-N135 WeakPolarHBondContact CB-OD1 3.45Å; P133-N135 PolarHBondContact O-N 3.23Å; P133-A136 HydrophobicContact CB-CB 4.45Å; P133-A136 WeakPolarHBondContact O-CB 3.33Å; P133-A136 PolarHBondContact O-N 3.22Å
134	A	82.7	Confident	94.2	Very high	57 Å²	57	30.3 Å²	30.3	47%	0.471	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-28.9	-179.4	0	0	0	0	0	112.8
135	N	86.1	Confident	94.2	Very high	103 Å²	103	32.1 Å²	32.1	55%	0.551	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.4	7.8	176.9	65.8	-16.2	0	0	0	113.8	Q104 P133 E137	Q104-N135 PolarHBondContact NE2-O 3.29Å; P133-N135 WeakPolarHBondContact CB-OD1 3.45Å; P133-N135 PolarHBondContact O-N 3.23Å; N135-E137 PolarHBondContact O-N 2.78Å
136	A	90.9	Very high	94.1	Very high	11 Å²	11	32.3 Å²	32.3	9%	0.091	17%	0.174	C	C	.	.			trans	-62	123.5	178.3	0	0	0	0	0	110.9	P133 Y139	P133-A136 HydrophobicContact CB-CB 4.45Å; P133-A136 WeakPolarHBondContact O-CB 3.33Å; P133-A136 PolarHBondContact O-N 3.22Å; A136-Y139 HydrophobicContact CB-CE1 4.18Å; A136-Y139 HydrophobicContact CB-CE2 4.46Å
137	E	93.8	Very high	94	Very high	111 Å²	111	33.8 Å²	33.8	52%	0.519	18%	0.181	S	C	.	.	B	Isolated β-bridge	trans	-98.6	136.4	-180	-64.5	-175.1	176.3	0	0	111	N102 Q104 N135 Y139	N102-E137 HydrophobicContact CB-CB 4.36Å; Q104-E137 HydrophobicContact CG-CG 4.09Å; N135-E137 PolarHBondContact O-N 2.78Å; E137-Y139 WeakPolarHBondContact O-CD1 3.38Å; E137-Y139 PolarHBondContact O-N 2.77Å
138	G	94.8	Very high	93.8	Very high	18 Å²	18	41.3 Å²	41.3	19%	0.186	21%	0.211	C	C	.	.	S	Bend	trans	77.9	-1.7	172.5	0	0	0	0	0	115	L99 G101 S103	L99-G138 PolarHBondContact N-O 3.01Å; G101-G138 WeakPolarHBondContact O-CA 3.46Å; S103-G138 PolarHBondContact O-N 2.82Å
139	Y	96.1	Very high	93.4	Very high	61 Å²	61	47.8 Å²	47.8	24%	0.239	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	164.9	175.7	74.8	-83.2	0	0	0	114.3	R96 F97 A136 E137 E141	R96-Y139 HydrophobicContact CG-CD2 3.8Å; R96-Y139 HydrophobicContact CG-CG 4.14Å; F97-Y139 CarbonylContact O-C 3.58Å; F97-Y139 WeakPolarHBondContact O-CA 3.44Å; F97-Y139 WeakPolarHBondContact O-CB 3.29Å; A136-Y139 HydrophobicContact CB-CE1 4.18Å; A136-Y139 HydrophobicContact CB-CE2 4.46Å; E137-Y139 WeakPolarHBondContact O-CD1 3.38Å; E137-Y139 PolarHBondContact O-N 2.77Å; Y139-E141 HydrophobicContact CD2-CG 3.87Å; Y139-E141 HydrophobicContact CE2-CG 3.87Å
140	F	96.7	Very high	93.3	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	158.1	158.4	70.3	-84.5	0	0	0	110.8	F80 R96 F97 L99 L105 L113 P130 S132 V142 W167	F80-F140 HydrophobicContact CB-CE1 4.3Å; F80-F140 AromaticContact CD1-CE1 3.95Å; F80-F140 HydrophobicContact CD1-CE1 3.95Å; F80-F140 HydrophobicContact CD2-CE1 4.18Å; F80-F140 HydrophobicContact CD2-CZ 4.33Å; F80-F140 HydrophobicContact CE1-CE1 4.31Å; F80-F140 HydrophobicContact CE2-CE1 4.49Å; F80-F140 AromaticContact CG-CE1 3.87Å; F80-F140 HydrophobicContact CG-CE1 3.87Å; F80-F140 HydrophobicContact CG-CZ 4.32Å; R96-F140 WeakPolarHBondContact CA-O 3.35Å; F97-F140 HydrophobicContact CB-CD1 3.76Å; F97-F140 HydrophobicContact CB-CD2 4.39Å; F97-F140 HydrophobicContact CB-CE1 3.34Å; F97-F140 HydrophobicContact CB-CE2 4Å; F97-F140 HydrophobicContact CB-CG 4.29Å; F97-F140 HydrophobicContact CB-CZ 3.47Å; F97-F140 VanDerWaalsContact CB-CZ 3.47Å; F97-F140 HydrophobicContact CD1-CZ 4.33Å; F97-F140 HydrophobicContact CD2-CD2 4.06Å; F97-F140 HydrophobicContact CD2-CE1 4.44Å; F97-F140 AromaticContact CD2-CE2 3.52Å; F97-F140 HydrophobicContact CD2-CE2 3.52Å; F97-F140 AromaticContact CD2-CZ 3.75Å; F97-F140 HydrophobicContact CD2-CZ 3.75Å; F97-F140 HydrophobicContact CE2-CE2 4.28Å; F97-F140 HydrophobicContact CG-CE1 4Å; F97-F140 AromaticContact CG-CE2 3.87Å; F97-F140 HydrophobicContact CG-CE2 3.87Å; F97-F140 AromaticContact CG-CZ 3.57Å; F97-F140 HydrophobicContact CG-CZ 3.57Å; F97-F140 PolarHBondContact N-O 3.22Å; F97-F140 PolarHBondContact O-N 3.02Å; L99-F140 HydrophobicContact CD2-CD1 3.92Å; L99-F140 HydrophobicContact CD2-CE1 4.24Å; L99-F140 HydrophobicContact CG-CD1 4.26Å; L105-F140 HydrophobicContact CB-CB 4.43Å; L105-F140 HydrophobicContact CD1-CB 4.29Å; L105-F140 HydrophobicContact CD1-CD1 3.47Å; L105-F140 VanDerWaalsContact CD1-CD1 3.47Å; L105-F140 HydrophobicContact CD1-CE1 3.82Å; L105-F140 HydrophobicContact CD1-CG 3.91Å; L105-F140 HydrophobicContact CD2-CB 3.74Å; L105-F140 HydrophobicContact CD2-CD1 4.31Å; L105-F140 HydrophobicContact CD2-CD2 4.21Å; L105-F140 HydrophobicContact CD2-CG 3.85Å; L105-F140 HydrophobicContact CG-CB 4.38Å; L105-F140 HydrophobicContact CG-CD1 4.42Å; L105-F140 HydrophobicContact CG-CG 4.42Å; L113-F140 HydrophobicContact CD1-CE2 4.13Å; L113-F140 HydrophobicContact CD1-CZ 4.33Å; P130-F140 HydrophobicContact CG-CD2 4.36Å; S132-F140 WeakPolarHBondContact OG-CA 3.19Å; F140-V142 HydrophobicContact CD2-CG1 4.4Å; F140-V142 HydrophobicContact CE2-CG1 4.41Å; F140-W167 HydrophobicContact CE2-CD2 4.46Å; F140-W167 HydrophobicContact CE2-CZ2 4.41Å; F140-W167 HydrophobicContact CZ-CD2 4.31Å; F140-W167 HydrophobicContact CZ-CG 4.24Å; F140-W167 AromaticContact CZ-NE1 3.95Å
141	E	97.3	Very high	93.2	Very high	13 Å²	13	50.3 Å²	50.3	6%	0.061	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	143.5	179.9	-68.7	-178.7	154.6	0	0	111.1	R94 V95 R96 P130 I131 S132 Y139	R94-E141 HydrophobicContact CG-CB 4.45Å; V95-E141 VanDerWaalsContact O-CA 3.28Å; V95-E141 WeakPolarHBondContact O-CA 3.08Å; R96-E141 HydrophobicContact CB-CG 3.9Å; R96-E141 HydrophobicContact CG-CG 3.87Å; R96-E141 IonicContact CZ-OE1 3.16Å; R96-E141 IonicContact NE-OE1 2.76Å; R96-E141 PolarHBondContact NE-OE1 3.28Å; R96-E141 IonicContact NH2-OE1 2.71Å; R96-E141 PolarHBondContact NH2-OE1 2.75Å; P130-E141 CarbonylContact C-O 3.53Å; P130-E141 WeakPolarHBondContact CA-O 3.33Å; I131-E141 HydrophobicContact CD1-CB 4.32Å; I131-E141 HydrophobicContact CG1-CB 3.91Å; I131-E141 WeakPolarHBondContact CG1-O 3.29Å; I131-E141 PolarHBondContact N-O 2.76Å; S132-E141 PolarHBondContact OG-N 3.35Å; Y139-E141 HydrophobicContact CD2-CG 3.87Å; Y139-E141 HydrophobicContact CE2-CG 3.87Å
142	V	97.6	Very high	93.2	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	152.2	169.4	-66.5	0	0	0	0	111	R94 V95 F97 P130 F140 I144 W167	R94-V142 WeakPolarHBondContact CA-O 3.32Å; V95-V142 HydrophobicContact CB-CG2 4.47Å; V95-V142 PolarHBondContact N-O 3.4Å; V95-V142 PolarHBondContact O-N 3.08Å; F97-V142 HydrophobicContact CE2-CG2 3.73Å; P130-V142 HydrophobicContact CG-CG1 4.33Å; F140-V142 HydrophobicContact CD2-CG1 4.4Å; F140-V142 HydrophobicContact CE2-CG1 4.41Å; V142-I144 HydrophobicContact CG2-CD1 3.93Å; V142-I144 HydrophobicContact CG2-CG1 3.88Å; V142-W167 HydrophobicContact CG1-CH2 4.11Å; V142-W167 HydrophobicContact CG2-CH2 3.96Å; V142-W167 HydrophobicContact CG2-CZ2 4.17Å
143	L	96.8	Very high	93.4	Very high	5 Å²	5	50.3 Å²	50.3	3%	0.026	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	125.4	167.4	-66.9	176.9	0	0	0	109.9	L88 Y93 R94 I131 T191 Y226 L227	L88-L143 HydrophobicContact CD1-CD2 3.68Å; Y93-L143 WeakPolarHBondContact O-CA 3.48Å; R94-L143 HydrophobicContact CB-CD2 4.04Å; R94-L143 HydrophobicContact CG-CD2 4.48Å; I131-L143 HydrophobicContact CD1-CD1 4.27Å; I131-L143 HydrophobicContact CD1-CD2 3.85Å; I131-L143 HydrophobicContact CD1-CG 3.69Å; I131-L143 HydrophobicContact CG1-CG 4.23Å; I131-L143 HydrophobicContact CG2-CD1 4.1Å; I131-L143 HydrophobicContact CG2-CG 4.05Å; L143-T191 HydrophobicContact CB-CG2 4.42Å; L143-Y226 HydrophobicContact CD1-CD2 3.58Å; L143-Y226 HydrophobicContact CD1-CE2 3.52Å; L143-Y226 HydrophobicContact CD1-CG 4.47Å; L143-L227 HydrophobicContact CD1-CD1 3.84Å; L143-L227 HydrophobicContact CD1-CG 4.26Å
144	I	97.1	Very high	93.8	Very high	1 Å²	1	54.5 Å²	54.5	1%	0.005	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	118.8	179.2	-53.3	-178.1	0	0	0	109.4	T92 Y93 V95 Y128 V142 V156 W159	T92-I144 CarbonylContact C-O 3.58Å; T92-I144 WeakPolarHBondContact CA-O 3.36Å; Y93-I144 PolarHBondContact N-O 3.47Å; Y93-I144 PolarHBondContact O-N 3.15Å; V95-I144 HydrophobicContact CG2-CD1 4.18Å; Y128-I144 HydrophobicContact CD1-CG1 3.9Å; Y128-I144 HydrophobicContact CE1-CB 4.08Å; Y128-I144 HydrophobicContact CE1-CD1 4.34Å; Y128-I144 HydrophobicContact CE1-CG1 3.7Å; Y128-I144 HydrophobicContact CE1-CG2 3.76Å; V142-I144 HydrophobicContact CG2-CD1 3.93Å; V142-I144 HydrophobicContact CG2-CG1 3.88Å; I144-V156 HydrophobicContact CB-CG1 4.26Å; I144-V156 HydrophobicContact CD1-CG1 4.03Å; I144-V156 HydrophobicContact CD1-CG2 3.88Å; I144-V156 HydrophobicContact CG2-CB 4.34Å; I144-V156 HydrophobicContact CG2-CG1 3.93Å; I144-V156 HydrophobicContact CG2-CG2 4.05Å; I144-W159 HydrophobicContact CD1-CH2 4.12Å; I144-W159 HydrophobicContact CD1-CZ3 3.65Å
145	K	95.6	Very high	94.4	Very high	41 Å²	41	53.5 Å²	53.5	18%	0.178	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	125.1	169.9	-177.2	171.7	-174.5	171.7	0	110.6	D91 Y147 T191	D91-K145 CarbonylContact O-C 3.57Å; D91-K145 WeakPolarHBondContact O-CA 3.33Å; D91-K145 WeakPolarHBondContact OD2-CE 3.39Å; D91-K145 IonicContact OD2-NZ 3.28Å; K145-Y147 HydrophobicContact CB-CE2 4.17Å; K145-Y147 HydrophobicContact CD-CE1 4.34Å; K145-Y147 HydrophobicContact CD-CE2 4.35Å; K145-Y147 HydrophobicContact CG-CE2 4.03Å; K145-Y147 WeakPolarHBondContact O-CD2 3.14Å; K145-Y147 WeakPolarHBondContact O-CE2 3.47Å; K145-T191 HydrophobicContact CB-CG2 3.6Å
146	C	95.4	Very high	94.9	Very high	7 Å²	7	48.7 Å²	48.7	5%	0.047	23%	0.232	C	C	.	.			trans	-89.8	125.8	177.1	-69.4	0	0	0	0	110.3	D91 Y93 E157	D91-C146 PolarHBondContact O-N 3.02Å; Y93-C146 HydrophobicContact CE2-CB 4.29Å; C146-E157 HydrophobicContact CB-CG 4.3Å
147	Y	93.2	Very high	95.1	Very high	138 Å²	138	53.3 Å²	53.3	54%	0.541	25%	0.251	S	S	.	.			trans	-104	141.5	174.5	-61.5	-94.2	0	0	0	110.1	K145 M149 G150 S153	K145-Y147 HydrophobicContact CB-CE2 4.17Å; K145-Y147 HydrophobicContact CD-CE1 4.34Å; K145-Y147 HydrophobicContact CD-CE2 4.35Å; K145-Y147 HydrophobicContact CG-CE2 4.03Å; K145-Y147 WeakPolarHBondContact O-CD2 3.14Å; K145-Y147 WeakPolarHBondContact O-CE2 3.47Å; Y147-M149 PolarHBondContact O-N 2.92Å; Y147-G150 PolarHBondContact O-N 3.48Å; Y147-S153 PolarHBondContact N-OG 3.16Å; Y147-S153 WeakPolarHBondContact O-CB 3.49Å; Y147-S153 PolarHBondContact O-OG 2.9Å
148	Q	91.1	Very high	95.1	Very high	186 Å²	186	51.5 Å²	51.5	87%	0.869	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	133.2	176.6	-169.2	176.8	-1	0	0	110.3	G150	Q148-G150 PolarHBondContact O-N 2.84Å; Q148-G150 VanDerWaalsContact O-N 3.09Å
149	M	89.6	Confident	95.2	Very high	170 Å²	170	51.3 Å²	51.3	84%	0.837	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.1	5.7	-176.8	-58.4	173.2	66.6	0	0	115.8	Y147 L151	Y147-M149 PolarHBondContact O-N 2.92Å; M149-L151 PolarHBondContact O-N 3.34Å
150	G	92.9	Very high	95.2	Very high	22 Å²	22	57.1 Å²	57.1	23%	0.227	27%	0.266	C	S	.	.			trans	-71	128.6	173.8	0	0	0	0	0	111.2	Y147 Q148 M152 S153 R154	Y147-G150 PolarHBondContact O-N 3.48Å; Q148-G150 PolarHBondContact O-N 2.84Å; Q148-G150 VanDerWaalsContact O-N 3.09Å; G150-M152 PolarHBondContact O-N 3.39Å; G150-S153 WeakPolarHBondContact O-CA 3.32Å; G150-S153 VanDerWaalsContact O-CB 3.24Å; G150-S153 WeakPolarHBondContact O-CB 3.3Å; G150-S153 PolarHBondContact O-N 3.01Å; G150-S153 VanDerWaalsContact O-N 3.13Å; G150-R154 PolarHBondContact O-N 2.97Å
151	L	94.4	Very high	95.2	Very high	62 Å²	62	60.4 Å²	60.4	33%	0.325	29%	0.293	S	S	.	.	H	α-helix	trans	-61.5	-44.6	178.3	-63.5	175.5	0	0	0	111.6	V119 L122 I124 M149 S153 R154 Y155	V119-L151 HydrophobicContact CG1-CD2 4.2Å; L122-L151 HydrophobicContact CD2-CD1 3.79Å; I124-L151 VanDerWaalsContact CD1-C 3.48Å; I124-L151 HydrophobicContact CD1-CB 3.66Å; I124-L151 HydrophobicContact CG2-CB 4.3Å; I124-L151 HydrophobicContact CG2-CD1 3.93Å; M149-L151 PolarHBondContact O-N 3.34Å; L151-S153 VanDerWaalsContact C-N 3.26Å; L151-S153 PolarHBondContact O-N 3.32Å; L151-R154 PolarHBondContact O-N 3.41Å; L151-Y155 PolarHBondContact O-N 3.32Å
152	M	96	Very high	95.2	Very high	11 Å²	11	62.3 Å²	62.3	5%	0.054	32%	0.317	C	S	.	.	H	α-helix	trans	-64.5	-33.5	175.5	-170.6	58.3	79.1	0	0	111.7	L115 I124 R126 Y128 G150 Y155 V156	L115-M152 HydrophobicContact CD2-CE 4.11Å; L115-M152 HydrophobicContact CD2-SD 3.59Å; L115-M152 VanDerWaalsContact CD2-SD 3.59Å; L115-M152 HydrophobicContact CG-CE 4.1Å; L115-M152 HydrophobicContact CG-SD 4.18Å; I124-M152 HydrophobicContact CD1-CB 3.91Å; I124-M152 HydrophobicContact CD1-CE 3.95Å; I124-M152 VanDerWaalsContact CD1-N 3.27Å; I124-M152 HydrophobicContact CD1-SD 4.19Å; I124-M152 HydrophobicContact CG1-CE 3.9Å; R126-M152 HydrophobicContact CB-CE 4Å; R126-M152 HydrophobicContact CB-CG 4.32Å; R126-M152 HydrophobicContact CG-CB 4.03Å; R126-M152 HydrophobicContact CG-CE 3.92Å; R126-M152 HydrophobicContact CG-CG 3.96Å; Y128-M152 HydrophobicContact CE2-CG 4.42Å; Y128-M152 WeakPolarHBondContact OH-CG 3.34Å; G150-M152 PolarHBondContact O-N 3.39Å; M152-Y155 PolarHBondContact O-N 2.95Å; M152-Y155 HydrophobicContact SD-CD1 3.74Å; M152-V156 HydrophobicContact CG-CG2 4.41Å; M152-V156 VanDerWaalsContact O-CG2 3.27Å; M152-V156 WeakPolarHBondContact O-CG2 3.21Å; M152-V156 PolarHBondContact O-N 2.84Å; M152-V156 HydrophobicContact SD-CG2 4.35Å
153	S	96.1	Very high	95.2	Very high	8 Å²	8	65.5 Å²	65.5	6%	0.056	33%	0.334	C	S	.	.	H	α-helix	trans	-61.6	-48.2	173	-40.8	0	0	0	0	111.3	Y147 G150 L151 Y155 V156 E157	Y147-S153 PolarHBondContact N-OG 3.16Å; Y147-S153 WeakPolarHBondContact O-CB 3.49Å; Y147-S153 PolarHBondContact O-OG 2.9Å; G150-S153 WeakPolarHBondContact O-CA 3.32Å; G150-S153 VanDerWaalsContact O-CB 3.24Å; G150-S153 WeakPolarHBondContact O-CB 3.3Å; G150-S153 PolarHBondContact O-N 3.01Å; G150-S153 VanDerWaalsContact O-N 3.13Å; L151-S153 VanDerWaalsContact C-N 3.26Å; L151-S153 PolarHBondContact O-N 3.32Å; S153-Y155 VanDerWaalsContact C-N 3.27Å; S153-Y155 PolarHBondContact O-N 3.01Å; S153-V156 PolarHBondContact O-N 2.87Å; S153-E157 WeakPolarHBondContact O-CB 3.33Å; S153-E157 VanDerWaalsContact O-CG 3.25Å; S153-E157 WeakPolarHBondContact O-CG 3.36Å; S153-E157 PolarHBondContact O-N 2.89Å
154	R	95.6	Very high	95.2	Very high	119 Å²	119	68.5 Å²	68.5	45%	0.449	35%	0.352	S	S	.	.	H	α-helix	trans	-59	-40.4	177	-74.2	177.2	62.1	-157.3	-6.5	111.6	D120 G150 L151 S158	D120-R154 IonicContact OD1-NH2 3.49Å; D120-R154 PolarHBondContact OD1-NH2 2.93Å; D120-R154 IonicContact OD2-CZ 3.74Å; D120-R154 IonicContact OD2-NH1 2.72Å; D120-R154 PolarHBondContact OD2-NH1 2.85Å; D120-R154 IonicContact OD2-NH2 3.91Å; D120-R154 PolarHBondContact OD2-NH2 2.84Å; G150-R154 PolarHBondContact O-N 2.97Å; L151-R154 PolarHBondContact O-N 3.41Å; R154-S158 PolarHBondContact O-N 3.03Å
155	Y	95.8	Very high	95.2	Very high	37 Å²	37	68.4 Å²	68.4	15%	0.145	35%	0.352	C	S	.	.	H	α-helix	trans	-64.1	-42.7	176.9	-176.3	-120.8	0	0	0	112.3	V119 L151 M152 S153 S158 W159	V119-Y155 HydrophobicContact CG2-CD2 4.34Å; V119-Y155 HydrophobicContact CG2-CG 4.37Å; L151-Y155 PolarHBondContact O-N 3.32Å; M152-Y155 PolarHBondContact O-N 2.95Å; M152-Y155 HydrophobicContact SD-CD1 3.74Å; S153-Y155 VanDerWaalsContact C-N 3.27Å; S153-Y155 PolarHBondContact O-N 3.01Å; Y155-S158 PolarHBondContact O-OG 3.28Å; Y155-W159 AromaticContact CD1-CZ2 3.79Å; Y155-W159 HydrophobicContact CD1-CZ2 3.79Å; Y155-W159 AromaticContact CD1-NE1 3.85Å; Y155-W159 AromaticContact CE1-CE2 3.77Å; Y155-W159 AromaticContact CE1-CZ2 3.43Å; Y155-W159 HydrophobicContact CE1-CZ2 3.43Å; Y155-W159 VanDerWaalsContact CE1-CZ2 3.43Å; Y155-W159 AromaticContact CE1-NE1 3.56Å; Y155-W159 AromaticContact CE2-NE1 3.89Å; Y155-W159 AromaticContact CZ-NE1 3.54Å; Y155-W159 PolarHBondContact O-NE1 3.42Å
156	V	95.5	Very high	95.3	Very high	2 Å²	2	69.9 Å²	69.9	1%	0.012	36%	0.359	C	S	.	.	H	α-helix	trans	-76.1	-35.3	-178.9	170.9	0	0	0	0	111.8	I144 M152 S153 S158 W159	I144-V156 HydrophobicContact CB-CG1 4.26Å; I144-V156 HydrophobicContact CD1-CG1 4.03Å; I144-V156 HydrophobicContact CD1-CG2 3.88Å; I144-V156 HydrophobicContact CG2-CB 4.34Å; I144-V156 HydrophobicContact CG2-CG1 3.93Å; I144-V156 HydrophobicContact CG2-CG2 4.05Å; M152-V156 HydrophobicContact CG-CG2 4.41Å; M152-V156 VanDerWaalsContact O-CG2 3.27Å; M152-V156 WeakPolarHBondContact O-CG2 3.21Å; M152-V156 PolarHBondContact O-N 2.84Å; M152-V156 HydrophobicContact SD-CG2 4.35Å; S153-V156 PolarHBondContact O-N 2.87Å; V156-S158 PolarHBondContact O-N 3.02Å; V156-W159 HydrophobicContact CB-CD2 4.44Å; V156-W159 HydrophobicContact CB-CE3 4.22Å; V156-W159 HydrophobicContact CB-CZ3 4.4Å; V156-W159 HydrophobicContact CG1-CD2 4.49Å; V156-W159 HydrophobicContact CG1-CE3 3.87Å; V156-W159 HydrophobicContact CG1-CZ3 4.11Å; V156-W159 HydrophobicContact CG2-CD2 4.39Å; V156-W159 HydrophobicContact CG2-CE3 4.11Å; V156-W159 HydrophobicContact CG2-CH2 3.86Å; V156-W159 HydrophobicContact CG2-CZ2 4.12Å; V156-W159 HydrophobicContact CG2-CZ3 3.83Å; V156-W159 WeakPolarHBondContact O-CB 3.4Å; V156-W159 PolarHBondContact O-N 3.03Å; V156-W159 VanDerWaalsContact O-N 3.15Å
157	E	94.9	Very high	95.4	Very high	107 Å²	107	69.6 Å²	69.6	50%	0.5	36%	0.356	S	S	.	.	H	α-helix	trans	-67.2	-19.9	177.7	-74.4	176.1	152.6	0	0	113.2	Y93 C146 S153	Y93-E157 HydrophobicContact CE2-CG 4.35Å; C146-E157 HydrophobicContact CB-CG 4.3Å; S153-E157 WeakPolarHBondContact O-CB 3.33Å; S153-E157 VanDerWaalsContact O-CG 3.25Å; S153-E157 WeakPolarHBondContact O-CG 3.36Å; S153-E157 PolarHBondContact O-N 2.89Å
158	S	94.4	Very high	95.6	Very high	74 Å²	74	63 Å²	63	52%	0.517	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-14.1	174.4	69.8	0	0	0	0	113.6	R154 Y155 V156	R154-S158 PolarHBondContact O-N 3.03Å; Y155-S158 PolarHBondContact O-OG 3.28Å; V156-S158 PolarHBondContact O-N 3.02Å
159	W	96.7	Very high	95.7	Very high	13 Å²	13	54.2 Å²	54.2	5%	0.049	29%	0.289	C	S	.	.			trans	-67	144.1	-174.2	-70.7	-13.1	0	0	0	114	I82 V85 V95 F97 L115 I144 Y155 V156 D163 A165	I82-W159 HydrophobicContact CD1-CB 3.92Å; I82-W159 HydrophobicContact CD1-CD2 3.41Å; I82-W159 VanDerWaalsContact CD1-CD2 3.41Å; I82-W159 HydrophobicContact CD1-CE3 3.66Å; I82-W159 HydrophobicContact CD1-CG 3.56Å; I82-W159 HydrophobicContact CD1-CZ2 4.4Å; I82-W159 HydrophobicContact CD1-CZ3 4.26Å; V85-W159 HydrophobicContact CG2-CB 4.4Å; V95-W159 HydrophobicContact CB-CZ3 4.37Å; V95-W159 HydrophobicContact CG1-CE3 3.99Å; V95-W159 HydrophobicContact CG1-CZ3 3.96Å; V95-W159 HydrophobicContact CG2-CE3 4.14Å; V95-W159 HydrophobicContact CG2-CZ3 4.12Å; F97-W159 HydrophobicContact CE1-CH2 4.44Å; F97-W159 AromaticContact CZ-CH2 3.93Å; F97-W159 HydrophobicContact CZ-CH2 3.93Å; F97-W159 AromaticContact CZ-CZ3 3.77Å; F97-W159 HydrophobicContact CZ-CZ3 3.77Å; L115-W159 HydrophobicContact CD1-CH2 4.05Å; L115-W159 HydrophobicContact CD1-CZ2 4.09Å; L115-W159 HydrophobicContact CD2-CH2 3.54Å; L115-W159 HydrophobicContact CD2-CZ2 3.93Å; L115-W159 HydrophobicContact CG-CH2 4.47Å; I144-W159 HydrophobicContact CD1-CH2 4.12Å; I144-W159 HydrophobicContact CD1-CZ3 3.65Å; Y155-W159 AromaticContact CD1-CZ2 3.79Å; Y155-W159 HydrophobicContact CD1-CZ2 3.79Å; Y155-W159 AromaticContact CD1-NE1 3.85Å; Y155-W159 AromaticContact CE1-CE2 3.77Å; Y155-W159 AromaticContact CE1-CZ2 3.43Å; Y155-W159 HydrophobicContact CE1-CZ2 3.43Å; Y155-W159 VanDerWaalsContact CE1-CZ2 3.43Å; Y155-W159 AromaticContact CE1-NE1 3.56Å; Y155-W159 AromaticContact CE2-NE1 3.89Å; Y155-W159 AromaticContact CZ-NE1 3.54Å; Y155-W159 PolarHBondContact O-NE1 3.42Å; V156-W159 HydrophobicContact CB-CD2 4.44Å; V156-W159 HydrophobicContact CB-CE3 4.22Å; V156-W159 HydrophobicContact CB-CZ3 4.4Å; V156-W159 HydrophobicContact CG1-CD2 4.49Å; V156-W159 HydrophobicContact CG1-CE3 3.87Å; V156-W159 HydrophobicContact CG1-CZ3 4.11Å; V156-W159 HydrophobicContact CG2-CD2 4.39Å; V156-W159 HydrophobicContact CG2-CE3 4.11Å; V156-W159 HydrophobicContact CG2-CH2 3.86Å; V156-W159 HydrophobicContact CG2-CZ2 4.12Å; V156-W159 HydrophobicContact CG2-CZ3 3.83Å; V156-W159 WeakPolarHBondContact O-CB 3.4Å; V156-W159 PolarHBondContact O-N 3.03Å; V156-W159 VanDerWaalsContact O-N 3.15Å; W159-D163 WeakPolarHBondContact CA-OD2 3.44Å; W159-A165 HydrophobicContact CH2-CB 4.19Å; W159-A165 HydrophobicContact CZ2-CB 3.85Å
160	R	96.6	Very high	96	Very high	184 Å²	184	48.1 Å²	48.1	69%	0.694	26%	0.263	S	S	*	.			trans	-132.9	162.3	168.8	-56.2	-156.2	-176.4	-73.1	-1.2	110.5	G162 D163	R160-G162 PolarHBondContact O-N 3.06Å; R160-D163 PolarHBondContact N-OD2 3.31Å; R160-D163 VanDerWaalsContact O-CB 3.29Å; R160-D163 WeakPolarHBondContact O-CB 3.24Å; R160-D163 PolarHBondContact O-N 2.97Å; R160-D163 VanDerWaalsContact O-N 3.12Å
161	A	97.4	Very high	96	Very high	68 Å²	68	47.5 Å²	47.5	56%	0.562	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	135.4	170.2	0	0	0	0	0	110	I82	I82-A161 CarbonylContact O-C 3.57Å; I82-A161 WeakPolarHBondContact O-CA 3.46Å
162	G	97.4	Very high	95.9	Very high	54 Å²	54	45.4 Å²	45.4	56%	0.557	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	97.6	-18.5	-172.3	0	0	0	0	0	114.3	I82 R160	I82-G162 PolarHBondContact O-N 2.95Å; R160-G162 PolarHBondContact O-N 3.06Å
163	D	97.7	Very high	95.5	Very high	66 Å²	66	51.5 Å²	51.5	35%	0.353	28%	0.28	S	S	.	.			trans	-68.7	164.7	175.1	-69.1	-17.2	0	0	0	111.4	C81 I82 W159 R160	C81-D163 CarbonylContact C-O 3.56Å; C81-D163 WeakPolarHBondContact CA-O 3.24Å; I82-D163 HydrophobicContact CD1-CB 4.06Å; I82-D163 PolarHBondContact N-O 2.74Å; W159-D163 WeakPolarHBondContact CA-OD2 3.44Å; R160-D163 PolarHBondContact N-OD2 3.31Å; R160-D163 VanDerWaalsContact O-CB 3.29Å; R160-D163 WeakPolarHBondContact O-CB 3.24Å; R160-D163 PolarHBondContact O-N 2.97Å; R160-D163 VanDerWaalsContact O-N 3.12Å
164	T	96.7	Very high	95.3	Very high	68 Å²	68	51.5 Å²	51.5	42%	0.417	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	135.8	179.8	-62.7	0	0	0	0	110.8	A79 F80 F166	A79-T164 HydrophobicContact CB-CG2 3.69Å; F80-T164 WeakPolarHBondContact O-CA 3.41Å; T164-F166 HydrophobicContact CG2-CE2 4.35Å; T164-F166 HydrophobicContact CG2-CZ 4.37Å
165	A	97.3	Very high	95	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	154.3	172.7	0	0	0	0	0	111.1	A79 F80 I82 F97 L115 W159	A79-A165 WeakPolarHBondContact CA-O 3.19Å; F80-A165 PolarHBondContact N-O 2.91Å; F80-A165 PolarHBondContact O-N 2.65Å; I82-A165 HydrophobicContact CD1-CB 4.47Å; F97-A165 HydrophobicContact CD1-CB 4.36Å; F97-A165 HydrophobicContact CE1-CB 3.56Å; F97-A165 HydrophobicContact CZ-CB 4.39Å; L115-A165 HydrophobicContact CD1-CB 3.89Å; W159-A165 HydrophobicContact CH2-CB 4.19Å; W159-A165 HydrophobicContact CZ2-CB 3.85Å
166	F	97.1	Very high	94.8	Very high	72 Å²	72	49.8 Å²	49.8	32%	0.316	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	125.5	-174.1	-67.9	-90.2	0	0	0	110.9	F77 V78 A79 R116 T164	F77-F166 HydrophobicContact CB-CB 4.19Å; F77-F166 HydrophobicContact CD1-CB 4.14Å; F77-F166 HydrophobicContact CG-CB 4.46Å; V78-F166 WeakPolarHBondContact O-CA 3.49Å; A79-F166 HydrophobicContact CB-CD1 4.06Å; A79-F166 HydrophobicContact CB-CE1 3.78Å; A79-F166 HydrophobicContact CB-CZ 4.39Å; R116-F166 HydrophobicContact CB-CB 4.27Å; R116-F166 PolarHBondContact N-O 3.47Å; R116-F166 VanDerWaalsContact NH2-CD1 3.29Å; T164-F166 HydrophobicContact CG2-CE2 4.35Å; T164-F166 HydrophobicContact CG2-CZ 4.37Å
167	W	97.4	Very high	94.7	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	141.5	-174	-64.1	89.2	0	0	0	111.4	F77 V78 F80 F97 L113 I114 L115 Y128 F140 V142	F77-W167 CarbonylContact C-O 3.5Å; F77-W167 WeakPolarHBondContact CA-O 3.39Å; V78-W167 PolarHBondContact N-O 3.45Å; V78-W167 PolarHBondContact O-N 2.76Å; F80-W167 HydrophobicContact CD2-CB 3.98Å; F80-W167 AromaticContact CD2-CD1 3.69Å; F80-W167 HydrophobicContact CD2-CG 4.13Å; F80-W167 HydrophobicContact CE2-CB 4.03Å; F97-W167 AromaticContact CD1-NE1 3.63Å; F97-W167 HydrophobicContact CD2-CZ2 4.4Å; F97-W167 HydrophobicContact CE1-CZ2 4.14Å; F97-W167 AromaticContact CE1-NE1 3.4Å; F97-W167 AromaticContact CE2-CZ2 3.7Å; F97-W167 HydrophobicContact CE2-CZ2 3.7Å; F97-W167 AromaticContact CZ-CE2 3.95Å; F97-W167 AromaticContact CZ-CZ2 3.54Å; F97-W167 HydrophobicContact CZ-CZ2 3.54Å; F97-W167 AromaticContact CZ-NE1 3.75Å; L113-W167 HydrophobicContact CB-CE3 3.56Å; L113-W167 HydrophobicContact CB-CZ3 3.97Å; L113-W167 HydrophobicContact CD1-CE3 4.22Å; I114-W167 WeakPolarHBondContact O-CA 3.43Å; L115-W167 HydrophobicContact CB-CD2 4.29Å; L115-W167 HydrophobicContact CB-CE3 3.84Å; L115-W167 HydrophobicContact CB-CH2 3.73Å; L115-W167 HydrophobicContact CB-CZ2 4.16Å; L115-W167 HydrophobicContact CB-CZ3 3.56Å; L115-W167 HydrophobicContact CD1-CD2 4.1Å; L115-W167 HydrophobicContact CD1-CH2 4.26Å; L115-W167 HydrophobicContact CD1-CZ2 3.79Å; L115-W167 HydrophobicContact CD2-CH2 4.24Å; L115-W167 HydrophobicContact CD2-CZ2 4.29Å; L115-W167 HydrophobicContact CG-CH2 4.29Å; L115-W167 HydrophobicContact CG-CZ2 4.29Å; Y128-W167 AromaticContact CD2-CH2 3.83Å; Y128-W167 HydrophobicContact CD2-CH2 3.83Å; Y128-W167 AromaticContact CD2-CZ3 3.94Å; Y128-W167 HydrophobicContact CD2-CZ3 3.94Å; Y128-W167 HydrophobicContact CG-CH2 4.15Å; Y128-W167 HydrophobicContact CG-CZ3 4.35Å; F140-W167 HydrophobicContact CE2-CD2 4.46Å; F140-W167 HydrophobicContact CE2-CZ2 4.41Å; F140-W167 HydrophobicContact CZ-CD2 4.31Å; F140-W167 HydrophobicContact CZ-CG 4.24Å; F140-W167 AromaticContact CZ-NE1 3.95Å; V142-W167 HydrophobicContact CG1-CH2 4.11Å; V142-W167 HydrophobicContact CG2-CH2 3.96Å; V142-W167 HydrophobicContact CG2-CZ2 4.17Å
168	R	96.1	Very high	94.8	Very high	1 Å²	1	54.8 Å²	54.8	0%	0.004	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	158.9	168.5	70.6	176.3	-178.6	105	3.7	110.7	P35 N73 P74 T76 F77 I114 F171	P35-R168 PolarHBondContact O-NH1 3.01Å; N73-R168 WeakPolarHBondContact O-CB 3.45Å; P74-R168 WeakPolarHBondContact O-CD 3.38Å; P74-R168 PolarHBondContact O-NH1 3.32Å; T76-R168 WeakPolarHBondContact O-CB 3.29Å; F77-R168 HydrophobicContact CD1-CB 3.89Å; F77-R168 HydrophobicContact CD1-CG 4.04Å; F77-R168 HydrophobicContact CE1-CB 3.95Å; F77-R168 HydrophobicContact CE1-CG 3.56Å; F77-R168 HydrophobicContact CE2-CG 4.27Å; F77-R168 HydrophobicContact CG-CB 4.23Å; F77-R168 HydrophobicContact CZ-CB 4.37Å; F77-R168 VanDerWaalsContact CZ-CD 3.41Å; F77-R168 HydrophobicContact CZ-CG 3.7Å; I114-R168 HydrophobicContact CB-CG 3.9Å; I114-R168 HydrophobicContact CG2-CG 4.34Å; I114-R168 PolarHBondContact N-O 2.87Å; I114-R168 PolarHBondContact O-N 3Å; R168-F171 HydrophobicContact CG-CE2 4.01Å; R168-F171 HydrophobicContact CG-CZ 4.2Å; R168-F171 WeakPolarHBondContact O-CE2 3.22Å
169	G	94.9	Very high	94.9	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	149.4	-165.6	-179.2	0	0	0	0	0	113	L72 N73 P74	L72-G169 CarbonylContact C-O 3.59Å; L72-G169 WeakPolarHBondContact CB-O 3.14Å; N73-G169 CarbonylContact C-O 3.54Å; N73-G169 WeakPolarHBondContact CA-O 3.39Å; N73-G169 PolarHBondContact N-O 3.08Å; N73-G169 PolarHBondContact O-N 3.01Å; N73-G169 VanDerWaalsContact O-N 3.11Å; P74-G169 WeakPolarHBondContact CD-O 3.44Å
170	P	94.3	Very high	94.8	Very high	43 Å²	43	58.5 Å²	58.5	28%	0.279	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	cis	-77.2	161.2	2.6	33.1	-36.6	0	0	0	113.6	L107 Q111	L107-P170 HydrophobicContact CD1-CB 4.09Å; L107-P170 HydrophobicContact CG-CB 3.94Å; Q111-P170 HydrophobicContact CB-CB 4.35Å
171	F	94.7	Very high	94.8	Very high	8 Å²	8	52 Å²	52	4%	0.035	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	164.4	170.3	-59	-81.7	0	0	0	110.5	C33 P74 Q111 H112 I114 R168	C33-F171 HydrophobicContact CB-CD1 3.63Å; C33-F171 HydrophobicContact CB-CE1 3.95Å; C33-F171 HydrophobicContact CB-CG 4.08Å; P74-F171 HydrophobicContact CB-CE1 3.88Å; P74-F171 HydrophobicContact CB-CZ 3.88Å; Q111-F171 CarbonylContact C-O 3.54Å; Q111-F171 WeakPolarHBondContact CA-O 3.5Å; Q111-F171 VanDerWaalsContact CB-O 3.29Å; Q111-F171 WeakPolarHBondContact CB-O 3.48Å; H112-F171 PolarHBondContact N-O 2.93Å; H112-F171 PolarHBondContact ND1-O 2.85Å; H112-F171 WeakPolarHBondContact NE2-CB 3.26Å; H112-F171 PolarHBondContact O-N 2.52Å; I114-F171 HydrophobicContact CB-CE2 4.1Å; I114-F171 HydrophobicContact CD1-CD2 3.72Å; I114-F171 HydrophobicContact CD1-CE1 4.34Å; I114-F171 HydrophobicContact CD1-CE2 3.43Å; I114-F171 VanDerWaalsContact CD1-CE2 3.43Å; I114-F171 HydrophobicContact CD1-CG 4.32Å; I114-F171 HydrophobicContact CD1-CZ 3.8Å; I114-F171 HydrophobicContact CG1-CD2 3.75Å; I114-F171 HydrophobicContact CG1-CE2 3.66Å; R168-F171 HydrophobicContact CG-CE2 4.01Å; R168-F171 HydrophobicContact CG-CZ 4.2Å; R168-F171 WeakPolarHBondContact O-CE2 3.22Å
172	G	91.2	Very high	94.8	Very high	19 Å²	19	49.9 Å²	49.9	20%	0.196	28%	0.276	C	S	.	.			trans	109.3	140.8	176.8	0	0	0	0	0	112
173	D	88.2	Confident	94.9	Very high	138 Å²	138	47.4 Å²	47.4	74%	0.738	25%	0.25	S	C	*	.			trans	-110.1	-0.4	-170.3	-56.9	-39.6	0	0	0	113.1	F175	D173-F175 VanDerWaalsContact O-CD2 3.23Å; D173-F175 WeakPolarHBondContact O-CD2 3.4Å; D173-F175 WeakPolarHBondContact O-CE2 3.48Å
174	F	91.4	Very high	94.9	Very high	8 Å²	8	44.2 Å²	44.2	4%	0.035	23%	0.233	C	C	.	.			trans	-85.2	118.3	174.7	-171.5	-97.6	0	0	0	110.3	Y181 I199 F285 L287 F313 F315	F174-Y181 HydrophobicContact CZ-CE2 4.2Å; F174-I199 HydrophobicContact CD1-CD1 3.96Å; F174-I199 HydrophobicContact CE1-CD1 3.76Å; F174-F285 HydrophobicContact CE2-CD1 4.48Å; F174-F285 AromaticContact CE2-CE1 3.71Å; F174-F285 HydrophobicContact CE2-CE1 3.71Å; F174-F285 HydrophobicContact CE2-CZ 4.33Å; F174-F285 HydrophobicContact CZ-CE1 4.42Å; F174-L287 HydrophobicContact CD2-CD2 4.19Å; F174-L287 HydrophobicContact CE1-CD1 4.13Å; F174-L287 HydrophobicContact CE1-CD2 4.02Å; F174-L287 HydrophobicContact CE2-CD2 3.52Å; F174-L287 HydrophobicContact CZ-CD1 4.11Å; F174-L287 HydrophobicContact CZ-CD2 3.42Å; F174-L287 VanDerWaalsContact CZ-CD2 3.42Å; F174-L287 HydrophobicContact CZ-CG 4.38Å; F174-F313 HydrophobicContact CB-CD1 3.85Å; F174-F313 HydrophobicContact CB-CD2 4.31Å; F174-F313 HydrophobicContact CB-CE1 3.61Å; F174-F313 HydrophobicContact CB-CE2 4.07Å; F174-F313 HydrophobicContact CB-CG 4.21Å; F174-F313 HydrophobicContact CB-CZ 3.72Å; F174-F313 HydrophobicContact CD2-CB 3.82Å; F174-F313 AromaticContact CD2-CD1 3.9Å; F174-F313 HydrophobicContact CD2-CD1 3.9Å; F174-F313 AromaticContact CD2-CD2 3.87Å; F174-F313 HydrophobicContact CD2-CD2 3.87Å; F174-F313 HydrophobicContact CD2-CE1 4.48Å; F174-F313 HydrophobicContact CD2-CE2 4.44Å; F174-F313 AromaticContact CD2-CG 3.57Å; F174-F313 HydrophobicContact CD2-CG 3.57Å; F174-F313 HydrophobicContact CE2-CB 4.13Å; F174-F313 HydrophobicContact CE2-CG 4.36Å; F174-F313 HydrophobicContact CG-CD1 4.06Å; F174-F313 HydrophobicContact CG-CE1 4.32Å; F174-F313 HydrophobicContact CG-CG 4.19Å; F174-F315 HydrophobicContact CB-CE1 3.92Å; F174-F315 HydrophobicContact CB-CZ 4.2Å; F174-F315 HydrophobicContact CD1-CE1 4.23Å; F174-F315 AromaticContact CD1-CZ 3.84Å; F174-F315 HydrophobicContact CD1-CZ 3.84Å; F174-F315 HydrophobicContact CE1-CZ 4.47Å; F174-F315 HydrophobicContact CG-CE1 4.24Å; F174-F315 HydrophobicContact CG-CZ 4.01Å
175	F	88.7	Confident	95	Very high	101 Å²	101	41 Å²	41	44%	0.443	21%	0.213	S	C	.	.			trans	-122.3	114.7	176	-58.6	-81.5	0	0	0	108.9	Q108 Q111 D173 Q180	Q108-F175 HydrophobicContact CB-CD1 4.1Å; Q108-F175 HydrophobicContact CB-CE1 4.36Å; Q108-F175 HydrophobicContact CG-CD1 4.31Å; Q108-F175 HydrophobicContact CG-CE1 4.44Å; Q111-F175 HydrophobicContact CG-CE1 4.32Å; D173-F175 VanDerWaalsContact O-CD2 3.23Å; D173-F175 WeakPolarHBondContact O-CD2 3.4Å; D173-F175 WeakPolarHBondContact O-CE2 3.48Å; F175-Q180 PolarHBondContact O-OE1 2.83Å
176	Y	92.7	Very high	95.1	Very high	19 Å²	19	41 Å²	41	8%	0.075	21%	0.213	C	C	.	.			trans	-84.7	137.8	173.7	-180	-107.7	0	0	0	110.8	Y181 L184 I199 I203 D209 T211	Y176-Y181 HydrophobicContact CD2-CD2 4.2Å; Y176-Y181 HydrophobicContact CD2-CE2 4.37Å; Y176-Y181 HydrophobicContact CE2-CD2 4.1Å; Y176-L184 HydrophobicContact CD2-CD1 4.23Å; Y176-L184 HydrophobicContact CE2-CD1 3.96Å; Y176-I199 HydrophobicContact CD1-CG2 4.49Å; Y176-I199 HydrophobicContact CG-CG2 4.23Å; Y176-I203 HydrophobicContact CD1-CG1 4.4Å; Y176-I203 HydrophobicContact CE1-CD1 4.04Å; Y176-I203 HydrophobicContact CE1-CG1 3.47Å; Y176-I203 VanDerWaalsContact CE1-CG1 3.47Å; Y176-I203 HydrophobicContact CE2-CD1 4.35Å; Y176-I203 WeakPolarHBondContact OH-CG1 3.47Å; Y176-D209 WeakPolarHBondContact CE1-OD2 3.48Å; Y176-D209 PolarHBondContact OH-OD1 2.89Å; Y176-D209 VanDerWaalsContact OH-OD1 3.07Å; Y176-D209 PolarHBondContact OH-OD2 3.07Å; Y176-T211 VanDerWaalsContact OH-CB 3.3Å; Y176-T211 WeakPolarHBondContact OH-CB 3.38Å; Y176-T211 PolarHBondContact OH-OG1 2.86Å
177	K	93.6	Very high	95.1	Very high	143 Å²	143	37.6 Å²	37.6	62%	0.622	20%	0.198	S	C	*	.			trans	-120.8	144.9	168.3	-63.9	178.2	-178.3	176.8	0	109.6	N179 Q180	K177-N179 PolarHBondContact O-N 2.98Å; K177-Q180 HydrophobicContact CB-CB 4.18Å; K177-Q180 WeakPolarHBondContact O-CB 3.45Å; K177-Q180 PolarHBondContact O-N 3.35Å
178	P	95.6	Very high	95.2	Very high	71 Å²	71	37.7 Å²	37.7	46%	0.461	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	137.8	177.8	-27.9	35.6	0	0	0	112.6	Q180 N206 D209	P178-Q180 PolarHBondContact O-N 3.1Å; P178-N206 WeakPolarHBondContact CG-ND2 3.34Å; P178-D209 WeakPolarHBondContact CA-OD2 3.44Å; P178-D209 HydrophobicContact CB-CB 4.21Å; P178-D209 WeakPolarHBondContact CB-OD2 3.43Å
179	N	96.5	Very high	95.3	Very high	83 Å²	83	38.7 Å²	38.7	44%	0.444	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	14.8	-177.9	-57.2	-65.9	0	0	0	115.6	K177 Y181 D208 D209 E210	K177-N179 PolarHBondContact O-N 2.98Å; N179-Y181 PolarHBondContact O-N 2.88Å; N179-D208 PolarHBondContact ND2-O 2.83Å; N179-D209 PolarHBondContact N-OD1 3.4Å; N179-E210 PolarHBondContact OD1-N 3.26Å
180	Q	95.6	Very high	95.3	Very high	83 Å²	83	39.4 Å²	39.4	39%	0.388	22%	0.215	S	C	.	.	S	Bend	trans	-62.1	-32.5	178	177.7	176.7	-7	0	0	112.3	F175 K177 P178	F175-Q180 PolarHBondContact O-OE1 2.83Å; K177-Q180 HydrophobicContact CB-CB 4.18Å; K177-Q180 WeakPolarHBondContact O-CB 3.45Å; K177-Q180 PolarHBondContact O-N 3.35Å; P178-Q180 PolarHBondContact O-N 3.1Å
181	Y	96.9	Very high	95.3	Very high	46 Å²	46	39 Å²	39	18%	0.18	21%	0.211	C	C	.	.	S	Bend	trans	-125.2	143.5	-178.7	-56.2	-69.1	0	0	0	109.9	F174 Y176 N179 E183 L184 T211 F285	F174-Y181 HydrophobicContact CZ-CE2 4.2Å; Y176-Y181 HydrophobicContact CD2-CD2 4.2Å; Y176-Y181 HydrophobicContact CD2-CE2 4.37Å; Y176-Y181 HydrophobicContact CE2-CD2 4.1Å; N179-Y181 PolarHBondContact O-N 2.88Å; Y181-E183 VanDerWaalsContact C-N 3.32Å; Y181-L184 HydrophobicContact CD2-CD2 3.53Å; Y181-L184 HydrophobicContact CD2-CG 4.47Å; Y181-L184 HydrophobicContact CE2-CD2 4.21Å; Y181-L184 HydrophobicContact CG-CD2 3.97Å; Y181-T211 WeakPolarHBondContact O-CG2 3.39Å; Y181-T211 PolarHBondContact O-OG1 2.95Å; Y181-F285 HydrophobicContact CD1-CB 3.44Å; Y181-F285 VanDerWaalsContact CD1-CB 3.44Å; Y181-F285 AromaticContact CD1-CD2 3.91Å; Y181-F285 HydrophobicContact CD1-CD2 3.91Å; Y181-F285 AromaticContact CD1-CG 3.73Å; Y181-F285 HydrophobicContact CD1-CG 3.73Å; Y181-F285 HydrophobicContact CD2-CB 4.34Å; Y181-F285 HydrophobicContact CD2-CG 4.49Å; Y181-F285 HydrophobicContact CE1-CB 3.74Å; Y181-F285 HydrophobicContact CE1-CD1 4.11Å; Y181-F285 AromaticContact CE1-CD2 3.31Å; Y181-F285 HydrophobicContact CE1-CD2 3.31Å; Y181-F285 AromaticContact CE1-CE2 3.87Å; Y181-F285 HydrophobicContact CE1-CE2 3.87Å; Y181-F285 AromaticContact CE1-CG 3.44Å; Y181-F285 HydrophobicContact CE1-CG 3.44Å; Y181-F285 VanDerWaalsContact CE1-CG 3.44Å; Y181-F285 HydrophobicContact CE1-CZ 4.49Å; Y181-F285 HydrophobicContact CE2-CD1 4.15Å; Y181-F285 HydrophobicContact CE2-CG 4.24Å; Y181-F285 HydrophobicContact CG-CB 3.76Å; Y181-F285 HydrophobicContact CG-CG 4.23Å; Y181-F285 AromaticContact CZ-CD1 3.87Å; Y181-F285 AromaticContact CZ-CD2 3.78Å; Y181-F285 AromaticContact CZ-CG 3.7Å
182	G	97.3	Very high	95.4	Very high	25 Å²	25	38.9 Å²	38.9	26%	0.258	21%	0.213	S	C	.	.	S	Bend	trans	-67.8	-34.9	175	0	0	0	0	0	112.6	F212	G182-F212 WeakPolarHBondContact O-CD2 3.38Å; G182-F212 PolarHBondContact O-N 3.39Å
183	E	98.4	Very high	95.6	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	139.6	174.9	-176.5	160.4	-177.8	0	0	110.7	Y181 F212 T214 C280 R281 R282 P284 F285	Y181-E183 VanDerWaalsContact C-N 3.32Å; E183-F212 CarbonylContact C-O 3.47Å; E183-F212 WeakPolarHBondContact CA-O 3.24Å; E183-F212 HydrophobicContact CB-CB 3.88Å; E183-F212 HydrophobicContact CG-CB 3.7Å; E183-T214 PolarHBondContact OE1-OG1 3.06Å; E183-C280 WeakPolarHBondContact OE2-CB 3.38Å; E183-R281 WeakPolarHBondContact OE2-CA 3.38Å; E183-R281 WeakPolarHBondContact OE2-CB 3.38Å; E183-R281 PolarHBondContact OE2-N 2.97Å; E183-R282 HydrophobicContact CB-CB 4.17Å; E183-R282 PolarHBondContact OE2-N 3.05Å; E183-P284 CarbonylContact O-C 3.59Å; E183-P284 WeakPolarHBondContact O-CA 3.44Å; E183-F285 PolarHBondContact O-N 2.89Å
184	L	98.6	Very high	96	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	126.1	169.8	-69	-179.7	0	0	0	110.3	Y176 Y181 M186 I199 I203 T211 F212 V213 T214 F285 L287	Y176-L184 HydrophobicContact CD2-CD1 4.23Å; Y176-L184 HydrophobicContact CE2-CD1 3.96Å; Y181-L184 HydrophobicContact CD2-CD2 3.53Å; Y181-L184 HydrophobicContact CD2-CG 4.47Å; Y181-L184 HydrophobicContact CE2-CD2 4.21Å; Y181-L184 HydrophobicContact CG-CD2 3.97Å; L184-M186 HydrophobicContact CB-CE 4.24Å; L184-M186 HydrophobicContact CB-CG 4.47Å; L184-M186 HydrophobicContact CD1-CE 3.68Å; L184-I199 HydrophobicContact CD1-CG2 3.94Å; L184-I203 HydrophobicContact CD1-CD1 3.68Å; L184-T211 HydrophobicContact CD1-CG2 4.32Å; L184-T211 HydrophobicContact CG-CG2 4Å; L184-F212 PolarHBondContact N-O 2.77Å; L184-V213 WeakPolarHBondContact O-CA 3.19Å; L184-T214 PolarHBondContact O-N 3.27Å; L184-F285 WeakPolarHBondContact CA-O 3.38Å; L184-F285 HydrophobicContact CD2-CB 4.17Å; L184-F285 HydrophobicContact CD2-CD1 4.27Å; L184-L287 HydrophobicContact CD1-CD1 4.16Å; L184-L287 HydrophobicContact CD2-CD1 4.25Å; L184-L287 HydrophobicContact CD2-CG 4.32Å
185	L	98.8	Very high	96.2	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	98.6	168.4	176.5	60.6	0	0	0	109.1	L187 T214 V216 V277 P284 F285 A286 L287 L302	L185-L187 HydrophobicContact CD1-CD2 3.9Å; L185-L187 HydrophobicContact CD2-CD1 4.44Å; L185-L187 HydrophobicContact CD2-CD2 4.43Å; L185-L187 HydrophobicContact CG-CD1 4.48Å; L185-L187 HydrophobicContact CG-CD2 3.98Å; L185-L187 HydrophobicContact CG-CG 4.1Å; L185-T214 CarbonylContact C-O 3.58Å; L185-T214 WeakPolarHBondContact CA-O 3.44Å; L185-T214 HydrophobicContact CD1-CG2 3.76Å; L185-V216 HydrophobicContact CD1-CG2 4.19Å; L185-V277 HydrophobicContact CD2-CG2 3.77Å; L185-P284 HydrophobicContact CB-CB 3.77Å; L185-P284 HydrophobicContact CB-CG 4.28Å; L185-P284 HydrophobicContact CD2-CG 4.47Å; L185-F285 PolarHBondContact N-O 3.48Å; L185-A286 HydrophobicContact CB-CB 4.28Å; L185-A286 CarbonylContact O-C 2.89Å; L185-A286 VanDerWaalsContact O-CA 3.24Å; L185-A286 WeakPolarHBondContact O-CA 3.49Å; L185-L287 PolarHBondContact O-N 3.34Å; L185-L302 HydrophobicContact CD2-CD2 4.47Å
186	M	98.6	Very high	96.7	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	115	-178.8	-63.3	178.3	-177.5	0	0	110.4	L184 M196 I199 L200 V213 T214 L215 V216 L287	L184-M186 HydrophobicContact CB-CE 4.24Å; L184-M186 HydrophobicContact CB-CG 4.47Å; L184-M186 HydrophobicContact CD1-CE 3.68Å; M186-M196 HydrophobicContact CB-CG 4.11Å; M186-M196 HydrophobicContact CB-SD 3.73Å; M186-M196 HydrophobicContact CG-CG 4.45Å; M186-M196 HydrophobicContact CG-SD 3.75Å; M186-M196 HydrophobicContact SD-CB 3.81Å; M186-M196 HydrophobicContact SD-CG 4.3Å; M186-M196 HydrophobicContact SD-SD 4.08Å; M186-I199 HydrophobicContact CE-CB 4.08Å; M186-I199 HydrophobicContact CE-CG2 3.57Å; M186-L200 HydrophobicContact CE-CB 4.38Å; M186-L200 HydrophobicContact SD-CB 4.47Å; M186-V213 HydrophobicContact CE-CG1 3.83Å; M186-V213 HydrophobicContact CE-CG2 4.46Å; M186-V213 HydrophobicContact CG-CG1 4.25Å; M186-V213 HydrophobicContact SD-CG1 3.74Å; M186-T214 PolarHBondContact N-O 2.85Å; M186-L215 HydrophobicContact CB-CB 4.38Å; M186-L215 HydrophobicContact CB-CD1 3.5Å; M186-L215 VanDerWaalsContact CB-CD1 3.5Å; M186-L215 HydrophobicContact CG-CD1 4.49Å; M186-L215 CarbonylContact O-C 3.58Å; M186-L215 HydrophobicContact SD-CD1 4.25Å; M186-V216 PolarHBondContact O-N 2.75Å; M186-L287 CarbonylContact C-O 3.58Å; M186-L287 WeakPolarHBondContact CA-O 3.35Å; M186-L287 HydrophobicContact CE-CD1 4.22Å; M186-L287 HydrophobicContact CG-CB 4.23Å; M186-L287 HydrophobicContact CG-CD1 4.19Å
187	L	98.7	Very high	96.9	Very high	1 Å²	1	26 Å²	26	1%	0.005	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	103.1	-179.5	-57.3	178.5	0	0	0	109.5	L185 V216 L268 L276 L287 V288 C289 I298 L302	L185-L187 HydrophobicContact CD1-CD2 3.9Å; L185-L187 HydrophobicContact CD2-CD1 4.44Å; L185-L187 HydrophobicContact CD2-CD2 4.43Å; L185-L187 HydrophobicContact CG-CD1 4.48Å; L185-L187 HydrophobicContact CG-CD2 3.98Å; L185-L187 HydrophobicContact CG-CG 4.1Å; L187-V216 HydrophobicContact CD2-CB 3.68Å; L187-V216 HydrophobicContact CD2-CG1 4.4Å; L187-V216 HydrophobicContact CD2-CG2 3.69Å; L187-L268 HydrophobicContact CD2-CD2 4.19Å; L187-L276 HydrophobicContact CD2-CD1 4.49Å; L187-L287 PolarHBondContact N-O 3.48Å; L187-V288 HydrophobicContact CB-CG1 4.48Å; L187-V288 HydrophobicContact CB-CG2 4.4Å; L187-V288 HydrophobicContact CD1-CG2 4.37Å; L187-V288 WeakPolarHBondContact O-CA 3.25Å; L187-C289 PolarHBondContact O-N 2.89Å; L187-I298 HydrophobicContact CB-CG2 4.5Å; L187-I298 HydrophobicContact CD1-CG2 3.44Å; L187-I298 VanDerWaalsContact CD1-CG2 3.44Å; L187-L302 HydrophobicContact CD1-CD2 4.03Å
188	A	98.1	Very high	96.9	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.008	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	125.7	-171.9	0	0	0	0	0	111.9	L193 M196 V216 G217 C218 C289	A188-L193 HydrophobicContact CB-CB 4.2Å; A188-L193 HydrophobicContact CB-CD1 4.1Å; A188-M196 HydrophobicContact CB-CG 4.1Å; A188-V216 PolarHBondContact N-O 2.83Å; A188-G217 CarbonylContact O-C 3.43Å; A188-C218 PolarHBondContact O-N 2.79Å; A188-C289 CarbonylContact C-O 3.6Å; A188-C289 WeakPolarHBondContact CA-O 3.34Å
189	A	97.6	Very high	97	Very high	22 Å²	22	16.4 Å²	16.4	18%	0.182	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	121.3	174.8	0	0	0	0	0	112.5	T191 G192 C218 C289 F294	A189-T191 PolarHBondContact O-N 3.26Å; A189-G192 PolarHBondContact O-N 3.39Å; A189-C218 HydrophobicContact CB-CB 4.12Å; A189-C289 PolarHBondContact N-O 2.86Å; A189-F294 HydrophobicContact CB-CB 4.5Å; A189-F294 HydrophobicContact CB-CD1 3.74Å; A189-F294 HydrophobicContact CB-CD2 3.61Å; A189-F294 HydrophobicContact CB-CE1 3.71Å; A189-F294 HydrophobicContact CB-CE2 3.6Å; A189-F294 HydrophobicContact CB-CG 3.68Å; A189-F294 HydrophobicContact CB-CZ 3.63Å
190	G	95.5	Very high	97	Very high	15 Å²	15	12.5 Å²	12.5	16%	0.155	8%	0.078	C	C	.	.	G	3₁₀ helix	trans	46.3	-144.5	-169.3	0	0	0	0	0	109.7	G192 L193 C218 Y226	G190-G192 PolarHBondContact O-N 3.18Å; G190-L193 PolarHBondContact O-N 3.18Å; G190-C218 PolarHBondContact N-O 3.41Å; G190-Y226 PolarHBondContact O-OH 3.16Å
191	T	94.9	Very high	97	Very high	34 Å²	34	9.8 Å²	9.8	21%	0.209	7%	0.065	C	C	.	.	G	3₁₀ helix	trans	-55.8	-5.7	-172.9	46.4	0	0	0	0	115.9	T92 L143 K145 A189 L193 A194 Y226	T92-T191 HydrophobicContact CG2-CG2 4.19Å; L143-T191 HydrophobicContact CB-CG2 4.42Å; K145-T191 HydrophobicContact CB-CG2 3.6Å; A189-T191 PolarHBondContact O-N 3.26Å; T191-L193 PolarHBondContact O-N 2.67Å; T191-A194 VanDerWaalsContact O-CB 3.25Å; T191-A194 WeakPolarHBondContact O-CB 3.27Å; T191-A194 PolarHBondContact O-N 3.01Å; T191-Y226 WeakPolarHBondContact CA-OH 3.32Å; T191-Y226 HydrophobicContact CG2-CE1 4.29Å; T191-Y226 PolarHBondContact N-OH 3.49Å; T191-Y226 VanDerWaalsContact N-OH 3.08Å
192	G	95.8	Very high	96.9	Very high	6 Å²	6	9.2 Å²	9.2	6%	0.062	7%	0.068	C	C	.	.	G	3₁₀ helix	trans	-58.6	-6.4	161.1	0	0	0	0	0	114.9	A189 G190 A194 P195 C289	A189-G192 PolarHBondContact O-N 3.39Å; G190-G192 PolarHBondContact O-N 3.18Å; G192-A194 PolarHBondContact O-N 3.14Å; G192-P195 VanDerWaalsContact O-CD 3.27Å; G192-P195 WeakPolarHBondContact O-CD 3.38Å; G192-P195 WeakPolarHBondContact O-CG 3.25Å; G192-C289 WeakPolarHBondContact CA-SG 3.35Å; G192-C289 WeakPolarHBondContact O-CB 3.44Å
193	L	97	Very high	96.8	Very high	3 Å²	3	8.1 Å²	8.1	2%	0.016	6%	0.056	C	C	.	.	G	3₁₀ helix	trans	-64.1	-26.5	165.2	-171.1	67.5	0	0	0	112.4	A188 G190 T191 M196 V197 L215 F219 Y226 L231	A188-L193 HydrophobicContact CB-CB 4.2Å; A188-L193 HydrophobicContact CB-CD1 4.1Å; G190-L193 PolarHBondContact O-N 3.18Å; T191-L193 PolarHBondContact O-N 2.67Å; L193-M196 HydrophobicContact CD1-CB 4.28Å; L193-M196 WeakPolarHBondContact O-CA 3.34Å; L193-M196 VanDerWaalsContact O-CB 3.32Å; L193-M196 WeakPolarHBondContact O-CB 3.46Å; L193-M196 PolarHBondContact O-N 3.29Å; L193-V197 HydrophobicContact CG-CG2 4.23Å; L193-V197 PolarHBondContact O-N 3.38Å; L193-L215 HydrophobicContact CD1-CD1 3.9Å; L193-L215 HydrophobicContact CD1-CD2 4.02Å; L193-L215 HydrophobicContact CD1-CG 4.45Å; L193-F219 HydrophobicContact CD2-CZ 4.49Å; L193-Y226 HydrophobicContact CB-CE2 3.74Å; L193-Y226 WeakPolarHBondContact CB-OH 3.21Å; L193-Y226 HydrophobicContact CD2-CD2 4.04Å; L193-Y226 HydrophobicContact CD2-CE2 3.44Å; L193-Y226 VanDerWaalsContact CD2-CE2 3.44Å; L193-Y226 HydrophobicContact CG-CE2 4.16Å; L193-L231 HydrophobicContact CD1-CD2 4.46Å; L193-L231 HydrophobicContact CD2-CD1 4.19Å; L193-L231 HydrophobicContact CD2-CD2 4.3Å
194	A	96.5	Very high	96.8	Very high	6 Å²	6	8.8 Å²	8.8	5%	0.05	6%	0.06	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-49.6	-173.9	0	0	0	0	0	114.4	I131 T191 G192 M196 V197 P198	I131-A194 HydrophobicContact CG2-CB 3.75Å; T191-A194 VanDerWaalsContact O-CB 3.25Å; T191-A194 WeakPolarHBondContact O-CB 3.27Å; T191-A194 PolarHBondContact O-N 3.01Å; G192-A194 PolarHBondContact O-N 3.14Å; A194-M196 PolarHBondContact O-N 3.4Å; A194-V197 PolarHBondContact O-N 2.9Å; A194-P198 WeakPolarHBondContact O-CD 3.37Å
195	P	95.9	Very high	96.6	Very high	3 Å²	3	13.7 Å²	13.7	2%	0.019	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-24.5	174.9	24.9	-36	0	0	0	114.4	T129 G192 I199 C289 F315	T129-P195 HydrophobicContact CG2-CB 4.08Å; G192-P195 VanDerWaalsContact O-CD 3.27Å; G192-P195 WeakPolarHBondContact O-CD 3.38Å; G192-P195 WeakPolarHBondContact O-CG 3.25Å; P195-I199 VanDerWaalsContact O-CD1 3.29Å; P195-I199 WeakPolarHBondContact O-CD1 3.27Å; P195-I199 WeakPolarHBondContact O-CG1 3.49Å; P195-C289 HydrophobicContact CG-CB 3.76Å; P195-F315 HydrophobicContact CB-CD1 3.79Å; P195-F315 HydrophobicContact CB-CD2 4.22Å; P195-F315 HydrophobicContact CB-CE1 3.82Å; P195-F315 HydrophobicContact CB-CE2 4.24Å; P195-F315 HydrophobicContact CB-CG 4.01Å; P195-F315 HydrophobicContact CB-CZ 4.05Å; P195-F315 HydrophobicContact CG-CB 4.39Å; P195-F315 HydrophobicContact CG-CD1 4.31Å; P195-F315 HydrophobicContact CG-CD2 4.15Å; P195-F315 HydrophobicContact CG-CG 4.03Å
196	M	97.4	Very high	96.4	Very high	1 Å²	1	15.9 Å²	15.9	1%	0.005	10%	0.099	C	C	.	.	H	α-helix	trans	-74	-32.4	-179.5	-51.4	-52.4	169.4	0	0	112	M186 A188 L193 A194 I199 L200 L215 L287 C289 F315	M186-M196 HydrophobicContact CB-CG 4.11Å; M186-M196 HydrophobicContact CB-SD 3.73Å; M186-M196 HydrophobicContact CG-CG 4.45Å; M186-M196 HydrophobicContact CG-SD 3.75Å; M186-M196 HydrophobicContact SD-CB 3.81Å; M186-M196 HydrophobicContact SD-CG 4.3Å; M186-M196 HydrophobicContact SD-SD 4.08Å; A188-M196 HydrophobicContact CB-CG 4.1Å; L193-M196 HydrophobicContact CD1-CB 4.28Å; L193-M196 WeakPolarHBondContact O-CA 3.34Å; L193-M196 VanDerWaalsContact O-CB 3.32Å; L193-M196 WeakPolarHBondContact O-CB 3.46Å; L193-M196 PolarHBondContact O-N 3.29Å; A194-M196 PolarHBondContact O-N 3.4Å; M196-I199 PolarHBondContact O-N 3.21Å; M196-L200 WeakPolarHBondContact O-CB 3.47Å; M196-L200 PolarHBondContact O-N 2.81Å; M196-L215 HydrophobicContact CB-CD1 4.12Å; M196-L215 HydrophobicContact CG-CD1 4.22Å; M196-L287 HydrophobicContact CE-CB 3.87Å; M196-L287 WeakPolarHBondContact CE-O 3.28Å; M196-L287 HydrophobicContact SD-CB 3.83Å; M196-L287 HydrophobicContact SD-CD1 4.38Å; M196-C289 HydrophobicContact CE-CB 3.93Å; M196-F315 HydrophobicContact CE-CD2 4.16Å; M196-F315 HydrophobicContact CE-CE2 4.1Å; M196-F315 HydrophobicContact SD-CE2 4.46Å
197	V	96.9	Very high	96.3	Very high	3 Å²	3	24.8 Å²	24.8	2%	0.018	14%	0.14	C	C	.	.	H	α-helix	trans	-57.1	-58.5	-176.8	173.3	0	0	0	0	112.7	I131 L193 A194 I199 L200 Q201 L227 F230	I131-V197 HydrophobicContact CB-CB 4.35Å; I131-V197 HydrophobicContact CB-CG1 4.13Å; I131-V197 HydrophobicContact CG2-CB 4.36Å; I131-V197 HydrophobicContact CG2-CG2 4.4Å; I131-V197 WeakPolarHBondContact O-CG1 3.2Å; L193-V197 HydrophobicContact CG-CG2 4.23Å; L193-V197 PolarHBondContact O-N 3.38Å; A194-V197 PolarHBondContact O-N 2.9Å; V197-I199 VanDerWaalsContact C-N 3.31Å; V197-I199 PolarHBondContact O-N 3.26Å; V197-L200 PolarHBondContact O-N 3.45Å; V197-Q201 WeakPolarHBondContact O-CG 3.43Å; V197-Q201 PolarHBondContact O-N 2.73Å; V197-L227 HydrophobicContact CG2-CD1 3.74Å; V197-F230 HydrophobicContact CB-CE1 4.27Å; V197-F230 HydrophobicContact CB-CZ 4.42Å; V197-F230 HydrophobicContact CG1-CE1 3.9Å; V197-F230 HydrophobicContact CG1-CE2 4.36Å; V197-F230 HydrophobicContact CG1-CZ 3.77Å; V197-F230 HydrophobicContact CG2-CD1 4.5Å; V197-F230 HydrophobicContact CG2-CE1 3.94Å
198	P	95.1	Very high	96.2	Very high	12 Å²	12	30.5 Å²	30.5	8%	0.078	17%	0.171	C	C	.	.	H	α-helix	trans	-68.6	-29.3	-177.6	27.4	-35.3	0	0	0	112.7	P109 A194 S202	P109-P198 HydrophobicContact CB-CB 4.36Å; A194-P198 WeakPolarHBondContact O-CD 3.37Å; P198-S202 WeakPolarHBondContact O-CB 3.42Å; P198-S202 PolarHBondContact O-N 3.01Å; P198-S202 PolarHBondContact O-OG 2.8Å
199	I	96.2	Very high	96.2	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-67.4	-49.5	175.5	-62.2	169.6	0	0	0	109.5	P109 F174 Y176 L184 M186 P195 M196 V197 Q201 S202 I203 L287 F315	P109-I199 HydrophobicContact CB-CB 4.47Å; P109-I199 HydrophobicContact CB-CG1 3.73Å; F174-I199 HydrophobicContact CD1-CD1 3.96Å; F174-I199 HydrophobicContact CE1-CD1 3.76Å; Y176-I199 HydrophobicContact CD1-CG2 4.49Å; Y176-I199 HydrophobicContact CG-CG2 4.23Å; L184-I199 HydrophobicContact CD1-CG2 3.94Å; M186-I199 HydrophobicContact CE-CB 4.08Å; M186-I199 HydrophobicContact CE-CG2 3.57Å; P195-I199 VanDerWaalsContact O-CD1 3.29Å; P195-I199 WeakPolarHBondContact O-CD1 3.27Å; P195-I199 WeakPolarHBondContact O-CG1 3.49Å; M196-I199 PolarHBondContact O-N 3.21Å; V197-I199 VanDerWaalsContact C-N 3.31Å; V197-I199 PolarHBondContact O-N 3.26Å; I199-Q201 PolarHBondContact O-N 3.37Å; I199-S202 PolarHBondContact O-N 2.76Å; I199-S202 PolarHBondContact O-OG 3.2Å; I199-I203 HydrophobicContact CG2-CD1 4.27Å; I199-I203 WeakPolarHBondContact O-CG1 3.29Å; I199-I203 PolarHBondContact O-N 3.1Å; I199-L287 HydrophobicContact CD1-CD1 3.82Å; I199-L287 HydrophobicContact CG2-CD1 4.36Å; I199-F315 HydrophobicContact CD1-CZ 3.84Å
200	L	97.1	Very high	96.2	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-59.6	-46.1	178.1	176.3	57	0	0	0	111.4	M186 M196 V197 S202 I203 T204 V213 L215 F230 Q234 V240	M186-L200 HydrophobicContact CE-CB 4.38Å; M186-L200 HydrophobicContact SD-CB 4.47Å; M196-L200 WeakPolarHBondContact O-CB 3.47Å; M196-L200 PolarHBondContact O-N 2.81Å; V197-L200 PolarHBondContact O-N 3.45Å; L200-S202 VanDerWaalsContact C-N 3.35Å; L200-S202 PolarHBondContact O-N 2.72Å; L200-I203 WeakPolarHBondContact O-CB 3.13Å; L200-I203 PolarHBondContact O-N 2.83Å; L200-T204 HydrophobicContact CD1-CG2 4.19Å; L200-T204 PolarHBondContact O-N 3.02Å; L200-T204 PolarHBondContact O-OG1 3.36Å; L200-V213 HydrophobicContact CD1-CB 4.21Å; L200-V213 HydrophobicContact CD1-CG1 4.06Å; L200-V213 HydrophobicContact CD1-CG2 4.16Å; L200-L215 HydrophobicContact CD2-CD2 4.16Å; L200-F230 HydrophobicContact CD2-CE1 4.33Å; L200-F230 HydrophobicContact CD2-CZ 4.33Å; L200-Q234 HydrophobicContact CD2-CB 3.86Å; L200-Q234 HydrophobicContact CD2-CG 3.91Å; L200-Q234 HydrophobicContact CG-CB 4.34Å; L200-Q234 HydrophobicContact CG-CG 4.19Å; L200-V240 HydrophobicContact CD1-CG1 4.1Å; L200-V240 HydrophobicContact CD1-CG2 3.81Å
201	Q	95.4	Very high	96.3	Very high	25 Å²	25	34.4 Å²	34.4	12%	0.117	18%	0.181	C	C	.	.	H	α-helix	trans	-58.6	-44.3	174.1	-76.2	177.6	-43.7	0	0	112.3	V197 I199 I203 T204 D205 F230	V197-Q201 WeakPolarHBondContact O-CG 3.43Å; V197-Q201 PolarHBondContact O-N 2.73Å; I199-Q201 PolarHBondContact O-N 3.37Å; Q201-I203 PolarHBondContact O-N 3.41Å; Q201-T204 PolarHBondContact O-N 3.31Å; Q201-T204 PolarHBondContact O-OG1 3.21Å; Q201-D205 VanDerWaalsContact O-CB 3.23Å; Q201-D205 WeakPolarHBondContact O-CB 3.48Å; Q201-D205 PolarHBondContact O-N 2.81Å; Q201-F230 HydrophobicContact CG-CE2 3.41Å; Q201-F230 VanDerWaalsContact CG-CE2 3.41Å; Q201-F230 HydrophobicContact CG-CZ 3.69Å
202	S	94.6	Very high	96.5	Very high	35 Å²	35	33.9 Å²	33.9	25%	0.245	18%	0.176	C	C	.	.	H	α-helix	trans	-60.8	-28.3	179.9	71.4	0	0	0	0	113.5	P198 I199 L200 N206	P198-S202 WeakPolarHBondContact O-CB 3.42Å; P198-S202 PolarHBondContact O-N 3.01Å; P198-S202 PolarHBondContact O-OG 2.8Å; I199-S202 PolarHBondContact O-N 2.76Å; I199-S202 PolarHBondContact O-OG 3.2Å; L200-S202 VanDerWaalsContact C-N 3.35Å; L200-S202 PolarHBondContact O-N 2.72Å; S202-N206 WeakPolarHBondContact O-CB 3.48Å
203	I	96.6	Very high	96.6	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-78	-49	175.3	-64.8	166.5	0	0	0	109.8	Y176 L184 I199 L200 Q201 D205 N206 D209 T211 V213	Y176-I203 HydrophobicContact CD1-CG1 4.4Å; Y176-I203 HydrophobicContact CE1-CD1 4.04Å; Y176-I203 HydrophobicContact CE1-CG1 3.47Å; Y176-I203 VanDerWaalsContact CE1-CG1 3.47Å; Y176-I203 HydrophobicContact CE2-CD1 4.35Å; Y176-I203 WeakPolarHBondContact OH-CG1 3.47Å; L184-I203 HydrophobicContact CD1-CD1 3.68Å; I199-I203 HydrophobicContact CG2-CD1 4.27Å; I199-I203 WeakPolarHBondContact O-CG1 3.29Å; I199-I203 PolarHBondContact O-N 3.1Å; L200-I203 WeakPolarHBondContact O-CB 3.13Å; L200-I203 PolarHBondContact O-N 2.83Å; Q201-I203 PolarHBondContact O-N 3.41Å; I203-D205 VanDerWaalsContact C-N 3.34Å; I203-D205 PolarHBondContact O-N 3.11Å; I203-N206 PolarHBondContact O-N 2.98Å; I203-D209 HydrophobicContact CG2-CB 4.43Å; I203-T211 HydrophobicContact CD1-CG2 4.12Å; I203-V213 HydrophobicContact CD1-CG2 3.64Å; I203-V213 HydrophobicContact CG2-CG2 4.41Å
204	T	96.7	Very high	96.7	Very high	15 Å²	15	33.7 Å²	33.7	9%	0.092	17%	0.174	C	C	.	.	H	α-helix	trans	-73.5	-25.5	-175.2	58.3	0	0	0	0	114	L200 Q201 N206 Q234 F237 V240	L200-T204 HydrophobicContact CD1-CG2 4.19Å; L200-T204 PolarHBondContact O-N 3.02Å; L200-T204 PolarHBondContact O-OG1 3.36Å; Q201-T204 PolarHBondContact O-N 3.31Å; Q201-T204 PolarHBondContact O-OG1 3.21Å; T204-N206 VanDerWaalsContact C-N 3.29Å; T204-Q234 PolarHBondContact OG1-NE2 2.89Å; T204-Q234 PolarHBondContact OG1-OE1 2.83Å; T204-F237 HydrophobicContact CG2-CB 4.16Å; T204-F237 HydrophobicContact CG2-CD1 3.99Å; T204-F237 HydrophobicContact CG2-CD2 3.8Å; T204-F237 HydrophobicContact CG2-CE1 4.32Å; T204-F237 HydrophobicContact CG2-CE2 4.15Å; T204-F237 HydrophobicContact CG2-CG 3.72Å; T204-F237 HydrophobicContact CG2-CZ 4.39Å; T204-F237 VanDerWaalsContact O-CE1 3.3Å; T204-F237 WeakPolarHBondContact O-CE1 3.48Å; T204-V240 HydrophobicContact CG2-CG2 3.9Å
205	D	94.7	Very high	96.8	Very high	104 Å²	104	33.7 Å²	33.7	56%	0.556	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-7.2	178.3	-65.3	-7.3	0	0	0	112.1	Q201 I203	Q201-D205 VanDerWaalsContact O-CB 3.23Å; Q201-D205 WeakPolarHBondContact O-CB 3.48Å; Q201-D205 PolarHBondContact O-N 2.81Å; I203-D205 VanDerWaalsContact C-N 3.34Å; I203-D205 PolarHBondContact O-N 3.11Å
206	N	95.3	Very high	96.9	Very high	46 Å²	46	33.6 Å²	33.6	25%	0.246	17%	0.172	C	C	.	.			trans	-110.2	107.1	178.2	-177.1	6.8	0	0	0	110.7	P178 S202 I203 T204 D208 D209	P178-N206 WeakPolarHBondContact CG-ND2 3.34Å; S202-N206 WeakPolarHBondContact O-CB 3.48Å; I203-N206 PolarHBondContact O-N 2.98Å; T204-N206 VanDerWaalsContact C-N 3.29Å; N206-D208 PolarHBondContact O-N 2.9Å; N206-D208 PolarHBondContact OD1-N 2.83Å; N206-D208 VanDerWaalsContact OD1-N 3.13Å; N206-D209 HydrophobicContact CB-CB 3.96Å; N206-D209 PolarHBondContact O-N 2.85Å
207	E	95.4	Very high	96.9	Very high	187 Å²	187	33.7 Å²	33.7	87%	0.874	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-22.4	-179.4	63.7	-176.6	178.6	0	0	114	D209	E207-D209 VanDerWaalsContact C-N 3.33Å
208	D	97.5	Very high	97	Very high	120 Å²	120	34.3 Å²	34.3	64%	0.642	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-4.3	177.2	-66.8	-40.6	0	0	0	112.9	N179 N206	N179-D208 PolarHBondContact ND2-O 2.83Å; N206-D208 PolarHBondContact O-N 2.9Å; N206-D208 PolarHBondContact OD1-N 2.83Å; N206-D208 VanDerWaalsContact OD1-N 3.13Å
209	D	97.7	Very high	97.1	Very high	5 Å²	5	34.2 Å²	34.2	3%	0.027	18%	0.176	C	C	.	.			trans	-95.5	103.7	-179.9	-158.8	-19.2	0	0	0	112.1	Y176 P178 N179 I203 N206 E207 T211	Y176-D209 WeakPolarHBondContact CE1-OD2 3.48Å; Y176-D209 PolarHBondContact OH-OD1 2.89Å; Y176-D209 VanDerWaalsContact OH-OD1 3.07Å; Y176-D209 PolarHBondContact OH-OD2 3.07Å; P178-D209 WeakPolarHBondContact CA-OD2 3.44Å; P178-D209 HydrophobicContact CB-CB 4.21Å; P178-D209 WeakPolarHBondContact CB-OD2 3.43Å; N179-D209 PolarHBondContact N-OD1 3.4Å; I203-D209 HydrophobicContact CG2-CB 4.43Å; N206-D209 HydrophobicContact CB-CB 3.96Å; N206-D209 PolarHBondContact O-N 2.85Å; E207-D209 VanDerWaalsContact C-N 3.33Å; D209-T211 VanDerWaalsContact C-N 3.3Å; D209-T211 PolarHBondContact O-N 2.79Å; D209-T211 VanDerWaalsContact OD1-CB 3.22Å; D209-T211 WeakPolarHBondContact OD1-CB 3.3Å; D209-T211 PolarHBondContact OD1-N 3.27Å; D209-T211 VanDerWaalsContact OD1-N 3.16Å; D209-T211 PolarHBondContact OD1-OG1 2.87Å
210	E	97.3	Very high	97	Very high	115 Å²	115	39.2 Å²	39.2	54%	0.537	20%	0.198	S	C	.	.			trans	-91.7	12.5	-178.6	-60	-168.9	152.9	0	0	113	N179 F212 W238	N179-E210 PolarHBondContact OD1-N 3.26Å; E210-F212 PolarHBondContact O-N 3.21Å; E210-W238 HydrophobicContact CB-CH2 4.19Å
211	T	98.4	Very high	96.9	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.006	21%	0.207	C	C	.	.			trans	-59.9	125.7	-179.6	-60.4	0	0	0	0	110.7	Y176 Y181 L184 I203 D209 N239	Y176-T211 VanDerWaalsContact OH-CB 3.3Å; Y176-T211 WeakPolarHBondContact OH-CB 3.38Å; Y176-T211 PolarHBondContact OH-OG1 2.86Å; Y181-T211 WeakPolarHBondContact O-CG2 3.39Å; Y181-T211 PolarHBondContact O-OG1 2.95Å; L184-T211 HydrophobicContact CD1-CG2 4.32Å; L184-T211 HydrophobicContact CG-CG2 4Å; I203-T211 HydrophobicContact CD1-CG2 4.12Å; D209-T211 VanDerWaalsContact C-N 3.3Å; D209-T211 PolarHBondContact O-N 2.79Å; D209-T211 VanDerWaalsContact OD1-CB 3.22Å; D209-T211 WeakPolarHBondContact OD1-CB 3.3Å; D209-T211 PolarHBondContact OD1-N 3.27Å; D209-T211 VanDerWaalsContact OD1-N 3.16Å; D209-T211 PolarHBondContact OD1-OG1 2.87Å; T211-N239 PolarHBondContact O-ND2 2.87Å
212	F	98.6	Very high	96.9	Very high	23 Å²	23	40.9 Å²	40.9	10%	0.101	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	144.6	169.9	-69.4	-69.4	0	0	0	110.6	G182 E183 L184 E210 W238 N239 R281	G182-F212 WeakPolarHBondContact O-CD2 3.38Å; G182-F212 PolarHBondContact O-N 3.39Å; E183-F212 CarbonylContact C-O 3.47Å; E183-F212 WeakPolarHBondContact CA-O 3.24Å; E183-F212 HydrophobicContact CB-CB 3.88Å; E183-F212 HydrophobicContact CG-CB 3.7Å; L184-F212 PolarHBondContact N-O 2.77Å; E210-F212 PolarHBondContact O-N 3.21Å; F212-W238 HydrophobicContact CD1-CZ3 4.38Å; F212-W238 AromaticContact CE1-CE3 3.98Å; F212-W238 HydrophobicContact CE1-CE3 3.98Å; F212-W238 HydrophobicContact CE1-CH2 4.38Å; F212-W238 AromaticContact CE1-CZ3 3.45Å; F212-W238 HydrophobicContact CE1-CZ3 3.45Å; F212-W238 VanDerWaalsContact CE1-CZ3 3.45Å; F212-W238 HydrophobicContact CZ-CH2 4.5Å; F212-W238 AromaticContact CZ-CZ3 3.72Å; F212-W238 HydrophobicContact CZ-CZ3 3.72Å; F212-N239 CarbonylContact C-O 3.58Å; F212-N239 WeakPolarHBondContact CA-O 3.21Å; F212-N239 HydrophobicContact CD1-CB 3.87Å; F212-N239 HydrophobicContact CE1-CB 4.22Å; F212-R281 HydrophobicContact CD2-CB 4.46Å; F212-R281 VanDerWaalsContact CE1-CZ 3.47Å
213	V	98.6	Very high	96.8	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.006	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	125.2	174.8	-174.8	0	0	0	0	110.2	L184 M186 L200 I203 N239 V240 R241	L184-V213 WeakPolarHBondContact O-CA 3.19Å; M186-V213 HydrophobicContact CE-CG1 3.83Å; M186-V213 HydrophobicContact CE-CG2 4.46Å; M186-V213 HydrophobicContact CG-CG1 4.25Å; M186-V213 HydrophobicContact SD-CG1 3.74Å; L200-V213 HydrophobicContact CD1-CB 4.21Å; L200-V213 HydrophobicContact CD1-CG1 4.06Å; L200-V213 HydrophobicContact CD1-CG2 4.16Å; I203-V213 HydrophobicContact CD1-CG2 3.64Å; I203-V213 HydrophobicContact CG2-CG2 4.41Å; V213-N239 PolarHBondContact N-O 2.83Å; V213-V240 HydrophobicContact CB-CG2 4.4Å; V213-V240 CarbonylContact O-C 3.6Å; V213-V240 WeakPolarHBondContact O-CA 3.42Å; V213-R241 PolarHBondContact O-N 3.27Å
214	T	98.5	Very high	96.7	Very high	4 Å²	4	46 Å²	46	3%	0.025	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	105.7	165.6	-67.2	0	0	0	0	108.1	E183 L184 L185 M186 V216 R241 F243	E183-T214 PolarHBondContact OE1-OG1 3.06Å; L184-T214 PolarHBondContact O-N 3.27Å; L185-T214 CarbonylContact C-O 3.58Å; L185-T214 WeakPolarHBondContact CA-O 3.44Å; L185-T214 HydrophobicContact CD1-CG2 3.76Å; M186-T214 PolarHBondContact N-O 2.85Å; T214-V216 HydrophobicContact CG2-CG2 4.39Å; T214-R241 WeakPolarHBondContact CA-O 3.1Å; T214-F243 HydrophobicContact CG2-CD2 3.9Å; T214-F243 HydrophobicContact CG2-CE2 3.87Å
215	L	98.4	Very high	96.6	Very high	5 Å²	5	45.5 Å²	45.5	3%	0.026	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	126.7	178.3	174.6	68.2	0	0	0	110.9	M186 L193 M196 L200 L231 R241 T242 F243	M186-L215 HydrophobicContact CB-CB 4.38Å; M186-L215 HydrophobicContact CB-CD1 3.5Å; M186-L215 VanDerWaalsContact CB-CD1 3.5Å; M186-L215 HydrophobicContact CG-CD1 4.49Å; M186-L215 CarbonylContact O-C 3.58Å; M186-L215 HydrophobicContact SD-CD1 4.25Å; L193-L215 HydrophobicContact CD1-CD1 3.9Å; L193-L215 HydrophobicContact CD1-CD2 4.02Å; L193-L215 HydrophobicContact CD1-CG 4.45Å; M196-L215 HydrophobicContact CB-CD1 4.12Å; M196-L215 HydrophobicContact CG-CD1 4.22Å; L200-L215 HydrophobicContact CD2-CD2 4.16Å; L215-L231 HydrophobicContact CD2-CD2 3.51Å; L215-R241 PolarHBondContact N-O 3.07Å; L215-T242 HydrophobicContact CB-CG2 4.34Å; L215-T242 HydrophobicContact CD2-CG2 4.26Å; L215-T242 CarbonylContact O-C 3.46Å; L215-T242 WeakPolarHBondContact O-CA 3.38Å; L215-F243 PolarHBondContact O-N 3.14Å
216	V	98.4	Very high	96.5	Very high	1 Å²	1	41 Å²	41	1%	0.006	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	109.5	176.9	-170.7	0	0	0	0	109	L185 M186 L187 A188 T214 F243 V245 L276	L185-V216 HydrophobicContact CD1-CG2 4.19Å; M186-V216 PolarHBondContact O-N 2.75Å; L187-V216 HydrophobicContact CD2-CB 3.68Å; L187-V216 HydrophobicContact CD2-CG1 4.4Å; L187-V216 HydrophobicContact CD2-CG2 3.69Å; A188-V216 PolarHBondContact N-O 2.83Å; T214-V216 HydrophobicContact CG2-CG2 4.39Å; V216-F243 WeakPolarHBondContact CA-O 3.33Å; V216-F243 HydrophobicContact CG1-CB 4.45Å; V216-F243 HydrophobicContact CG2-CB 4.32Å; V216-V245 HydrophobicContact CG1-CG2 3.91Å; V216-L276 HydrophobicContact CG1-CD1 4.26Å; V216-L276 HydrophobicContact CG2-CD1 3.88Å; V216-L276 HydrophobicContact CG2-CD2 3.88Å; V216-L276 HydrophobicContact CG2-CG 4.49Å
217	G	98.1	Very high	96.4	Very high	3 Å²	3	40.1 Å²	40.1	3%	0.031	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	119.5	177	0	0	0	0	0	112.2	A188 F219 F243 F244 V245	A188-G217 CarbonylContact O-C 3.43Å; G217-F219 WeakPolarHBondContact O-CD2 3.4Å; G217-F243 PolarHBondContact N-O 3.12Å; G217-F244 CarbonylContact O-C 3.57Å; G217-F244 WeakPolarHBondContact O-CA 3.34Å; G217-V245 PolarHBondContact O-N 3.06Å
218	C	98.1	Very high	96.4	Very high	16 Å²	16	33.7 Å²	33.7	11%	0.108	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	120.1	177.7	-55.5	0	0	0	0	111.3	A188 A189 G190 V245	A188-C218 PolarHBondContact O-N 2.79Å; A189-C218 HydrophobicContact CB-CB 4.12Å; G190-C218 PolarHBondContact N-O 3.41Å; C218-V245 CarbonylContact C-O 3.52Å; C218-V245 WeakPolarHBondContact CA-O 3.5Å; C218-V245 HydrophobicContact CB-CB 4.44Å
219	F	97	Very high	96.2	Very high	11 Å²	11	32.3 Å²	32.3	5%	0.048	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	170.7	-175.3	-61.4	-82.5	0	0	0	111.6	L193 G217 S224 I225 Y226 F244 V245 L246 S247	L193-F219 HydrophobicContact CD2-CZ 4.49Å; G217-F219 WeakPolarHBondContact O-CD2 3.4Å; F219-S224 WeakPolarHBondContact CB-OG 3.48Å; F219-S224 VanDerWaalsContact CD1-O 3.3Å; F219-S224 WeakPolarHBondContact CD1-O 3.46Å; F219-I225 HydrophobicContact CB-CG1 4.2Å; F219-I225 HydrophobicContact CD1-CG1 4.49Å; F219-I225 HydrophobicContact CD2-CB 4.34Å; F219-I225 HydrophobicContact CD2-CG1 3.65Å; F219-I225 HydrophobicContact CD2-CG2 4.43Å; F219-I225 HydrophobicContact CE2-CB 4.35Å; F219-I225 HydrophobicContact CE2-CG1 4.08Å; F219-I225 HydrophobicContact CE2-CG2 3.99Å; F219-I225 HydrophobicContact CG-CB 4.49Å; F219-I225 HydrophobicContact CG-CG1 3.86Å; F219-I225 HydrophobicContact CZ-CG2 4.17Å; F219-Y226 HydrophobicContact CD1-CE1 4.32Å; F219-Y226 HydrophobicContact CE1-CD1 4.11Å; F219-Y226 AromaticContact CE1-CE1 3.53Å; F219-Y226 HydrophobicContact CE1-CE1 3.53Å; F219-Y226 HydrophobicContact CE1-CE2 4.36Å; F219-Y226 AromaticContact CE1-CZ 3.63Å; F219-Y226 HydrophobicContact CZ-CE1 4.47Å; F219-F244 HydrophobicContact CD2-CD1 4.34Å; F219-F244 HydrophobicContact CE2-CD1 4.14Å; F219-F244 HydrophobicContact CE2-CE1 4.42Å; F219-V245 PolarHBondContact N-O 3.43Å; F219-L246 HydrophobicContact CB-CD2 3.77Å; F219-L246 WeakPolarHBondContact O-CA 3.4Å; F219-S247 PolarHBondContact O-N 2.8Å; F219-S247 PolarHBondContact O-OG 3.35Å; F219-S247 VanDerWaalsContact O-OG 3.1Å
220	K	95	Very high	96.1	Very high	104 Å²	104	33.2 Å²	33.2	45%	0.452	17%	0.167	S	C	.	.	S	Bend	trans	-79.1	-58.8	175.6	-72.6	-177.2	178.2	179.6	0	109.9	S224 S247 Q248	K220-S224 PolarHBondContact N-OG 3.48Å; K220-S247 PolarHBondContact O-N 3.35Å; K220-Q248 HydrophobicContact CB-CG 4.21Å; K220-Q248 HydrophobicContact CG-CG 4.49Å; K220-Q248 WeakPolarHBondContact O-CA 3.22Å; K220-Q248 WeakPolarHBondContact O-CB 3.44Å; K220-Q248 PolarHBondContact O-N 3.23Å
221	T	95.3	Very high	96.1	Very high	33 Å²	33	27.9 Å²	27.9	20%	0.202	14%	0.142	C	C	.	.	S	Bend	trans	-129.8	170.6	-178.8	71.9	0	0	0	0	110.7	E223 S224 Q248 E249	T221-E223 VanDerWaalsContact C-N 3.29Å; T221-E223 WeakPolarHBondContact CB-OE2 3.5Å; T221-E223 PolarHBondContact O-N 3.3Å; T221-E223 PolarHBondContact OG1-OE2 3.07Å; T221-S224 PolarHBondContact N-OG 2.92Å; T221-S224 PolarHBondContact O-N 3.19Å; T221-S224 VanDerWaalsContact O-N 3.14Å; T221-S224 PolarHBondContact O-OG 2.79Å; T221-Q248 HydrophobicContact CG2-CB 4.17Å; T221-E249 WeakPolarHBondContact CA-OE1 3.32Å; T221-E249 WeakPolarHBondContact CB-OE1 3.41Å
222	F	94.8	Very high	95.9	Very high	28 Å²	28	32 Å²	32	12%	0.123	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-61.5	-37.5	176.9	179.7	-106	0	0	0	112.8	S224 I225 K228 L246 E249 L255 P256 Y259	F222-S224 PolarHBondContact O-N 2.72Å; F222-I225 HydrophobicContact CD2-CD1 3.67Å; F222-I225 HydrophobicContact CE2-CD1 4.04Å; F222-I225 WeakPolarHBondContact O-CB 3.48Å; F222-I225 WeakPolarHBondContact O-CG1 3.35Å; F222-I225 PolarHBondContact O-N 2.99Å; F222-K228 HydrophobicContact CZ-CD 4.09Å; F222-K228 VanDerWaalsContact CZ-CE 3.43Å; F222-K228 VanDerWaalsContact O-CE 3.24Å; F222-K228 WeakPolarHBondContact O-CE 3.38Å; F222-K228 PolarHBondContact O-NZ 3.46Å; F222-L246 HydrophobicContact CB-CD1 4.22Å; F222-E249 PolarHBondContact N-OE1 3.41Å; F222-L255 HydrophobicContact CB-CD2 3.57Å; F222-L255 HydrophobicContact CD2-CD2 3.83Å; F222-L255 HydrophobicContact CG-CD2 3.77Å; F222-P256 HydrophobicContact CE1-CG 3.73Å; F222-P256 HydrophobicContact CE2-CG 4.32Å; F222-P256 VanDerWaalsContact CZ-CD 3.48Å; F222-P256 HydrophobicContact CZ-CG 3.52Å; F222-Y259 HydrophobicContact CD2-CD1 4.42Å; F222-Y259 HydrophobicContact CD2-CG 4.49Å; F222-Y259 AromaticContact CE2-CD1 3.69Å; F222-Y259 HydrophobicContact CE2-CD1 3.69Å; F222-Y259 AromaticContact CE2-CD2 3.76Å; F222-Y259 HydrophobicContact CE2-CD2 3.76Å; F222-Y259 AromaticContact CE2-CE1 3.9Å; F222-Y259 HydrophobicContact CE2-CE1 3.9Å; F222-Y259 AromaticContact CE2-CE2 3.98Å; F222-Y259 HydrophobicContact CE2-CE2 3.98Å; F222-Y259 AromaticContact CE2-CG 3.61Å; F222-Y259 HydrophobicContact CE2-CG 3.61Å; F222-Y259 HydrophobicContact CZ-CD2 4.07Å; F222-Y259 HydrophobicContact CZ-CE2 4.09Å; F222-Y259 HydrophobicContact CZ-CG 4.37Å
223	E	93	Very high	95.8	Very high	120 Å²	120	36.1 Å²	36.1	56%	0.561	18%	0.18	S	C	*	.	G	3₁₀ helix	trans	-63.2	-29.8	177.8	-59.1	70.6	-151.9	0	0	111.3	T221 I225	T221-E223 VanDerWaalsContact C-N 3.29Å; T221-E223 WeakPolarHBondContact CB-OE2 3.5Å; T221-E223 PolarHBondContact O-N 3.3Å; T221-E223 PolarHBondContact OG1-OE2 3.07Å; E223-I225 VanDerWaalsContact C-N 3.27Å; E223-I225 PolarHBondContact O-N 3.19Å
224	S	93.8	Very high	95.7	Very high	25 Å²	25	36.7 Å²	36.7	18%	0.175	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-77.9	-6.8	-179.6	70.5	0	0	0	0	114.6	F219 K220 T221 F222 Y226	F219-S224 WeakPolarHBondContact CB-OG 3.48Å; F219-S224 VanDerWaalsContact CD1-O 3.3Å; F219-S224 WeakPolarHBondContact CD1-O 3.46Å; K220-S224 PolarHBondContact N-OG 3.48Å; T221-S224 PolarHBondContact N-OG 2.92Å; T221-S224 PolarHBondContact O-N 3.19Å; T221-S224 VanDerWaalsContact O-N 3.14Å; T221-S224 PolarHBondContact O-OG 2.79Å; F222-S224 PolarHBondContact O-N 2.72Å; S224-Y226 PolarHBondContact O-N 3.05Å
225	I	94.4	Very high	95.5	Very high	3 Å²	3	37.7 Å²	37.7	2%	0.015	19%	0.191	C	C	.	.			trans	-71.1	111.7	168.6	-51.2	173.5	0	0	0	108.2	F219 F222 E223 K228 L231 F244 L246 Y259	F219-I225 HydrophobicContact CB-CG1 4.2Å; F219-I225 HydrophobicContact CD1-CG1 4.49Å; F219-I225 HydrophobicContact CD2-CB 4.34Å; F219-I225 HydrophobicContact CD2-CG1 3.65Å; F219-I225 HydrophobicContact CD2-CG2 4.43Å; F219-I225 HydrophobicContact CE2-CB 4.35Å; F219-I225 HydrophobicContact CE2-CG1 4.08Å; F219-I225 HydrophobicContact CE2-CG2 3.99Å; F219-I225 HydrophobicContact CG-CB 4.49Å; F219-I225 HydrophobicContact CG-CG1 3.86Å; F219-I225 HydrophobicContact CZ-CG2 4.17Å; F222-I225 HydrophobicContact CD2-CD1 3.67Å; F222-I225 HydrophobicContact CE2-CD1 4.04Å; F222-I225 WeakPolarHBondContact O-CB 3.48Å; F222-I225 WeakPolarHBondContact O-CG1 3.35Å; F222-I225 PolarHBondContact O-N 2.99Å; E223-I225 VanDerWaalsContact C-N 3.27Å; E223-I225 PolarHBondContact O-N 3.19Å; I225-K228 HydrophobicContact CB-CG 4.18Å; I225-K228 HydrophobicContact CG2-CG 3.89Å; I225-K228 WeakPolarHBondContact O-CG 3.44Å; I225-K228 PolarHBondContact O-NZ 3.42Å; I225-L231 HydrophobicContact CG2-CD1 4.02Å; I225-F244 HydrophobicContact CD1-CD1 3.82Å; I225-F244 HydrophobicContact CD1-CE1 4.21Å; I225-F244 HydrophobicContact CD1-CG 4.23Å; I225-F244 HydrophobicContact CG1-CD1 4.44Å; I225-F244 HydrophobicContact CG2-CD1 4.41Å; I225-F244 HydrophobicContact CG2-CE1 3.95Å; I225-L246 HydrophobicContact CD1-CD2 4.23Å; I225-L246 HydrophobicContact CG1-CD2 4.32Å; I225-Y259 HydrophobicContact CD1-CD1 4.43Å; I225-Y259 HydrophobicContact CD1-CE1 4.24Å
226	Y	92.3	Very high	95.4	Very high	9 Å²	9	42.7 Å²	42.7	4%	0.035	23%	0.226	C	C	.	.			trans	-92.9	167.3	171.3	47.2	-100.6	0	0	0	110.7	T92 L143 G190 T191 L193 F219 S224 K228	T92-Y226 HydrophobicContact CG2-CD1 4.1Å; L143-Y226 HydrophobicContact CD1-CD2 3.58Å; L143-Y226 HydrophobicContact CD1-CE2 3.52Å; L143-Y226 HydrophobicContact CD1-CG 4.47Å; G190-Y226 PolarHBondContact O-OH 3.16Å; T191-Y226 WeakPolarHBondContact CA-OH 3.32Å; T191-Y226 HydrophobicContact CG2-CE1 4.29Å; T191-Y226 PolarHBondContact N-OH 3.49Å; T191-Y226 VanDerWaalsContact N-OH 3.08Å; L193-Y226 HydrophobicContact CB-CE2 3.74Å; L193-Y226 WeakPolarHBondContact CB-OH 3.21Å; L193-Y226 HydrophobicContact CD2-CD2 4.04Å; L193-Y226 HydrophobicContact CD2-CE2 3.44Å; L193-Y226 VanDerWaalsContact CD2-CE2 3.44Å; L193-Y226 HydrophobicContact CG-CE2 4.16Å; F219-Y226 HydrophobicContact CD1-CE1 4.32Å; F219-Y226 HydrophobicContact CE1-CD1 4.11Å; F219-Y226 AromaticContact CE1-CE1 3.53Å; F219-Y226 HydrophobicContact CE1-CE1 3.53Å; F219-Y226 HydrophobicContact CE1-CE2 4.36Å; F219-Y226 AromaticContact CE1-CZ 3.63Å; F219-Y226 HydrophobicContact CZ-CE1 4.47Å; S224-Y226 PolarHBondContact O-N 3.05Å; Y226-K228 PolarHBondContact O-N 3.4Å
227	L	94.3	Very high	95.4	Very high	28 Å²	28	46.3 Å²	46.3	15%	0.147	24%	0.241	C	C	.	.			trans	55.7	31.3	-176.9	-58.6	-178.3	0	0	0	114.2	L88 I131 L143 V197 T229 F230 L231	L88-L227 HydrophobicContact CD1-CD2 4.43Å; I131-L227 HydrophobicContact CD1-CD1 4.17Å; I131-L227 HydrophobicContact CD1-CD2 4.26Å; L143-L227 HydrophobicContact CD1-CD1 3.84Å; L143-L227 HydrophobicContact CD1-CG 4.26Å; V197-L227 HydrophobicContact CG2-CD1 3.74Å; L227-T229 VanDerWaalsContact C-N 3.31Å; L227-T229 PolarHBondContact O-N 3.01Å; L227-F230 HydrophobicContact CB-CB 4.21Å; L227-F230 HydrophobicContact CB-CD1 4.36Å; L227-F230 HydrophobicContact CD1-CD1 4.49Å; L227-F230 WeakPolarHBondContact O-CB 3.33Å; L227-F230 PolarHBondContact O-N 2.8Å; L227-L231 WeakPolarHBondContact O-CG 3.43Å; L227-L231 PolarHBondContact O-N 2.9Å
228	K	94.4	Very high	95.3	Very high	53 Å²	53	53.6 Å²	53.6	23%	0.23	27%	0.268	C	S	.	.	H	α-helix	trans	-51.9	-45.7	-178.3	-70.3	-174.6	173	81.1	0	113.2	F222 I225 Y226 L231 Q232	F222-K228 HydrophobicContact CZ-CD 4.09Å; F222-K228 VanDerWaalsContact CZ-CE 3.43Å; F222-K228 VanDerWaalsContact O-CE 3.24Å; F222-K228 WeakPolarHBondContact O-CE 3.38Å; F222-K228 PolarHBondContact O-NZ 3.46Å; I225-K228 HydrophobicContact CB-CG 4.18Å; I225-K228 HydrophobicContact CG2-CG 3.89Å; I225-K228 WeakPolarHBondContact O-CG 3.44Å; I225-K228 PolarHBondContact O-NZ 3.42Å; Y226-K228 PolarHBondContact O-N 3.4Å; K228-L231 PolarHBondContact O-N 2.99Å; K228-Q232 VanDerWaalsContact O-CG 3.3Å; K228-Q232 WeakPolarHBondContact O-CG 3.47Å; K228-Q232 PolarHBondContact O-N 2.85Å
229	T	94.2	Very high	95.3	Very high	90 Å²	90	53 Å²	53	55%	0.552	26%	0.264	S	S	*	.	H	α-helix	trans	-60.2	-51.1	179.3	-51.3	0	0	0	0	111.3	L227 L231 Q232 E233	L227-T229 VanDerWaalsContact C-N 3.31Å; L227-T229 PolarHBondContact O-N 3.01Å; T229-L231 VanDerWaalsContact C-N 3.35Å; T229-L231 PolarHBondContact O-N 3.29Å; T229-Q232 WeakPolarHBondContact O-CB 3.49Å; T229-Q232 PolarHBondContact O-N 3.39Å; T229-Q232 VanDerWaalsContact O-N 3.1Å; T229-E233 WeakPolarHBondContact O-CG 3.46Å; T229-E233 PolarHBondContact O-N 3.3Å
230	F	95.4	Very high	95.3	Very high	25 Å²	25	53 Å²	53	11%	0.11	27%	0.265	C	S	.	.	H	α-helix	trans	-55.7	-48.7	175.3	167.5	-99.3	0	0	0	111.4	V197 L200 Q201 L227 Q232 E233 Q234	V197-F230 HydrophobicContact CB-CE1 4.27Å; V197-F230 HydrophobicContact CB-CZ 4.42Å; V197-F230 HydrophobicContact CG1-CE1 3.9Å; V197-F230 HydrophobicContact CG1-CE2 4.36Å; V197-F230 HydrophobicContact CG1-CZ 3.77Å; V197-F230 HydrophobicContact CG2-CD1 4.5Å; V197-F230 HydrophobicContact CG2-CE1 3.94Å; L200-F230 HydrophobicContact CD2-CE1 4.33Å; L200-F230 HydrophobicContact CD2-CZ 4.33Å; Q201-F230 HydrophobicContact CG-CE2 3.41Å; Q201-F230 VanDerWaalsContact CG-CE2 3.41Å; Q201-F230 HydrophobicContact CG-CZ 3.69Å; L227-F230 HydrophobicContact CB-CB 4.21Å; L227-F230 HydrophobicContact CB-CD1 4.36Å; L227-F230 HydrophobicContact CD1-CD1 4.49Å; L227-F230 WeakPolarHBondContact O-CB 3.33Å; L227-F230 PolarHBondContact O-N 2.8Å; F230-Q232 PolarHBondContact O-N 3.47Å; F230-E233 PolarHBondContact O-N 2.84Å; F230-Q234 HydrophobicContact CD1-CG 4.29Å; F230-Q234 HydrophobicContact CD2-CG 3.91Å; F230-Q234 HydrophobicContact CE1-CG 3.88Å; F230-Q234 HydrophobicContact CE2-CG 3.44Å; F230-Q234 VanDerWaalsContact CE2-CG 3.44Å; F230-Q234 HydrophobicContact CG-CG 4.3Å; F230-Q234 HydrophobicContact CZ-CG 3.43Å; F230-Q234 VanDerWaalsContact CZ-CG 3.43Å; F230-Q234 WeakPolarHBondContact O-CB 3.39Å; F230-Q234 WeakPolarHBondContact O-CG 3.39Å; F230-Q234 PolarHBondContact O-N 3.3Å
231	L	96.2	Very high	95.4	Very high	3 Å²	3	52.7 Å²	52.7	2%	0.016	26%	0.261	C	S	.	.	H	α-helix	trans	-61.9	-31.7	179.1	-67.8	172.4	0	0	0	113.2	L193 L215 I225 L227 K228 T229 A235 F244	L193-L231 HydrophobicContact CD1-CD2 4.46Å; L193-L231 HydrophobicContact CD2-CD1 4.19Å; L193-L231 HydrophobicContact CD2-CD2 4.3Å; L215-L231 HydrophobicContact CD2-CD2 3.51Å; I225-L231 HydrophobicContact CG2-CD1 4.02Å; L227-L231 WeakPolarHBondContact O-CG 3.43Å; L227-L231 PolarHBondContact O-N 2.9Å; K228-L231 PolarHBondContact O-N 2.99Å; T229-L231 VanDerWaalsContact C-N 3.35Å; T229-L231 PolarHBondContact O-N 3.29Å; L231-A235 VanDerWaalsContact O-CB 3.31Å; L231-A235 WeakPolarHBondContact O-CB 3.28Å; L231-A235 PolarHBondContact O-N 3.15Å; L231-A235 VanDerWaalsContact O-N 3.16Å; L231-F244 HydrophobicContact CD1-CE1 3.94Å; L231-F244 HydrophobicContact CD1-CZ 4.19Å
232	Q	94.6	Very high	95.5	Very high	87 Å²	87	51.5 Å²	51.5	41%	0.407	25%	0.253	S	S	.	.	H	α-helix	trans	-72.5	-44.6	175.1	-74.2	173.9	-41.5	0	0	111.8	K228 T229 F230 A235 C236	K228-Q232 VanDerWaalsContact O-CG 3.3Å; K228-Q232 WeakPolarHBondContact O-CG 3.47Å; K228-Q232 PolarHBondContact O-N 2.85Å; T229-Q232 WeakPolarHBondContact O-CB 3.49Å; T229-Q232 PolarHBondContact O-N 3.39Å; T229-Q232 VanDerWaalsContact O-N 3.1Å; F230-Q232 PolarHBondContact O-N 3.47Å; Q232-A235 PolarHBondContact O-N 3.19Å; Q232-C236 PolarHBondContact O-N 2.69Å; Q232-C236 PolarHBondContact O-SG 3.36Å
233	E	95.9	Very high	95.6	Very high	110 Å²	110	52.7 Å²	52.7	51%	0.514	26%	0.259	S	S	.	.	H	α-helix	trans	-59.7	-46.7	176	-70.3	165.9	172.9	0	0	110.9	T229 F230 A235 C236	T229-E233 WeakPolarHBondContact O-CG 3.46Å; T229-E233 PolarHBondContact O-N 3.3Å; F230-E233 PolarHBondContact O-N 2.84Å; E233-A235 VanDerWaalsContact C-N 3.28Å; E233-A235 PolarHBondContact O-N 2.76Å; E233-C236 VanDerWaalsContact O-CB 3.3Å; E233-C236 WeakPolarHBondContact O-CB 3.06Å; E233-C236 PolarHBondContact O-N 3.07Å; E233-C236 VanDerWaalsContact O-N 3.08Å
234	Q	96.8	Very high	95.8	Very high	12 Å²	12	47.3 Å²	47.3	6%	0.056	23%	0.233	C	C	.	.	H	α-helix	trans	-63.2	-35.3	177.6	-65.1	-62.2	-52.9	0	0	112.2	L200 T204 F230 C236 F237 V240	L200-Q234 HydrophobicContact CD2-CB 3.86Å; L200-Q234 HydrophobicContact CD2-CG 3.91Å; L200-Q234 HydrophobicContact CG-CB 4.34Å; L200-Q234 HydrophobicContact CG-CG 4.19Å; T204-Q234 PolarHBondContact OG1-NE2 2.89Å; T204-Q234 PolarHBondContact OG1-OE1 2.83Å; F230-Q234 HydrophobicContact CD1-CG 4.29Å; F230-Q234 HydrophobicContact CD2-CG 3.91Å; F230-Q234 HydrophobicContact CE1-CG 3.88Å; F230-Q234 HydrophobicContact CE2-CG 3.44Å; F230-Q234 VanDerWaalsContact CE2-CG 3.44Å; F230-Q234 HydrophobicContact CG-CG 4.3Å; F230-Q234 HydrophobicContact CZ-CG 3.43Å; F230-Q234 VanDerWaalsContact CZ-CG 3.43Å; F230-Q234 WeakPolarHBondContact O-CB 3.39Å; F230-Q234 WeakPolarHBondContact O-CG 3.39Å; F230-Q234 PolarHBondContact O-N 3.3Å; Q234-C236 PolarHBondContact O-N 3.23Å; Q234-F237 WeakPolarHBondContact O-CD2 3.24Å; Q234-F237 PolarHBondContact O-N 2.62Å; Q234-V240 VanDerWaalsContact O-CB 3.26Å; Q234-V240 WeakPolarHBondContact O-CB 3.45Å; Q234-V240 WeakPolarHBondContact O-CG1 3.34Å
235	A	95.3	Very high	96	Very high	25 Å²	25	46.4 Å²	46.4	21%	0.207	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-5.6	177.1	0	0	0	0	0	114.2	L231 Q232 E233 T242	L231-A235 VanDerWaalsContact O-CB 3.31Å; L231-A235 WeakPolarHBondContact O-CB 3.28Å; L231-A235 PolarHBondContact O-N 3.15Å; L231-A235 VanDerWaalsContact O-N 3.16Å; Q232-A235 PolarHBondContact O-N 3.19Å; E233-A235 VanDerWaalsContact C-N 3.28Å; E233-A235 PolarHBondContact O-N 2.76Å; A235-T242 HydrophobicContact CB-CG2 4.1Å
236	C	95.9	Very high	96.1	Very high	110 Å²	110	46.2 Å²	46.2	74%	0.743	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-16.6	172.3	-66.5	0	0	0	0	113	Q232 E233 Q234	Q232-C236 PolarHBondContact O-N 2.69Å; Q232-C236 PolarHBondContact O-SG 3.36Å; E233-C236 VanDerWaalsContact O-CB 3.3Å; E233-C236 WeakPolarHBondContact O-CB 3.06Å; E233-C236 PolarHBondContact O-N 3.07Å; E233-C236 VanDerWaalsContact O-N 3.08Å; Q234-C236 PolarHBondContact O-N 3.23Å
237	F	97.9	Very high	96.4	Very high	77 Å²	77	48.2 Å²	48.2	34%	0.338	24%	0.241	S	C	.	.	S	Bend	trans	-73.8	139.5	177.7	-71.1	-98.4	0	0	0	111.1	T204 Q234 N239 V240	T204-F237 HydrophobicContact CG2-CB 4.16Å; T204-F237 HydrophobicContact CG2-CD1 3.99Å; T204-F237 HydrophobicContact CG2-CD2 3.8Å; T204-F237 HydrophobicContact CG2-CE1 4.32Å; T204-F237 HydrophobicContact CG2-CE2 4.15Å; T204-F237 HydrophobicContact CG2-CG 3.72Å; T204-F237 HydrophobicContact CG2-CZ 4.39Å; T204-F237 VanDerWaalsContact O-CE1 3.3Å; T204-F237 WeakPolarHBondContact O-CE1 3.48Å; Q234-F237 WeakPolarHBondContact O-CD2 3.24Å; Q234-F237 PolarHBondContact O-N 2.62Å; F237-N239 PolarHBondContact O-N 3.27Å; F237-N239 VanDerWaalsContact O-N 3.16Å; F237-V240 HydrophobicContact CB-CB 4.3Å; F237-V240 HydrophobicContact CB-CG2 3.88Å; F237-V240 PolarHBondContact O-N 2.9Å; F237-V240 VanDerWaalsContact O-N 3.09Å
238	W	97.1	Very high	96.4	Very high	156 Å²	156	53 Å²	53	59%	0.591	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-25.7	-172.6	64.3	-90.5	0	0	0	113.9	E210 F212 R281	E210-W238 HydrophobicContact CB-CH2 4.19Å; F212-W238 HydrophobicContact CD1-CZ3 4.38Å; F212-W238 AromaticContact CE1-CE3 3.98Å; F212-W238 HydrophobicContact CE1-CE3 3.98Å; F212-W238 HydrophobicContact CE1-CH2 4.38Å; F212-W238 AromaticContact CE1-CZ3 3.45Å; F212-W238 HydrophobicContact CE1-CZ3 3.45Å; F212-W238 VanDerWaalsContact CE1-CZ3 3.45Å; F212-W238 HydrophobicContact CZ-CH2 4.5Å; F212-W238 AromaticContact CZ-CZ3 3.72Å; F212-W238 HydrophobicContact CZ-CZ3 3.72Å; W238-R281 PolarHBondContact O-NH2 3.13Å
239	N	97.5	Very high	96.3	Very high	5 Å²	5	52 Å²	52	3%	0.027	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-2	-179.3	59.8	-26.7	0	0	0	113.7	T211 F212 V213 F237	T211-N239 PolarHBondContact O-ND2 2.87Å; F212-N239 CarbonylContact C-O 3.58Å; F212-N239 WeakPolarHBondContact CA-O 3.21Å; F212-N239 HydrophobicContact CD1-CB 3.87Å; F212-N239 HydrophobicContact CE1-CB 4.22Å; V213-N239 PolarHBondContact N-O 2.83Å; F237-N239 PolarHBondContact O-N 3.27Å; F237-N239 VanDerWaalsContact O-N 3.16Å
240	V	98.2	Very high	95.9	Very high	9 Å²	9	53.1 Å²	53.1	6%	0.055	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	135	-175.8	-178.9	0	0	0	0	112	L200 T204 V213 Q234 F237 T242	L200-V240 HydrophobicContact CD1-CG1 4.1Å; L200-V240 HydrophobicContact CD1-CG2 3.81Å; T204-V240 HydrophobicContact CG2-CG2 3.9Å; V213-V240 HydrophobicContact CB-CG2 4.4Å; V213-V240 CarbonylContact O-C 3.6Å; V213-V240 WeakPolarHBondContact O-CA 3.42Å; Q234-V240 VanDerWaalsContact O-CB 3.26Å; Q234-V240 WeakPolarHBondContact O-CB 3.45Å; Q234-V240 WeakPolarHBondContact O-CG1 3.34Å; F237-V240 HydrophobicContact CB-CB 4.3Å; F237-V240 HydrophobicContact CB-CG2 3.88Å; F237-V240 PolarHBondContact O-N 2.9Å; F237-V240 VanDerWaalsContact O-N 3.09Å; V240-T242 HydrophobicContact CG1-CG2 4.35Å
241	R	96.8	Very high	95.6	Very high	98 Å²	98	53.6 Å²	53.6	37%	0.37	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	137.2	170.2	-68.7	179.3	177	169.7	-1.7	109.8	V213 T214 L215 F243	V213-R241 PolarHBondContact O-N 3.27Å; T214-R241 WeakPolarHBondContact CA-O 3.1Å; L215-R241 PolarHBondContact N-O 3.07Å; R241-F243 HydrophobicContact CB-CE2 4.13Å
242	T	97.1	Very high	95.2	Very high	8 Å²	8	55.7 Å²	55.7	5%	0.049	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	133	178	54.7	0	0	0	0	110.9	L215 A235 V240	L215-T242 HydrophobicContact CB-CG2 4.34Å; L215-T242 HydrophobicContact CD2-CG2 4.26Å; L215-T242 CarbonylContact O-C 3.46Å; L215-T242 WeakPolarHBondContact O-CA 3.38Å; A235-T242 HydrophobicContact CB-CG2 4.1Å; V240-T242 HydrophobicContact CG1-CG2 4.35Å
243	F	96.6	Very high	94.8	Very high	54 Å²	54	59.6 Å²	59.6	24%	0.237	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	151.1	174.2	-63.1	-81.9	0	0	0	109.9	T214 L215 V216 G217 R241 K262 L276	T214-F243 HydrophobicContact CG2-CD2 3.9Å; T214-F243 HydrophobicContact CG2-CE2 3.87Å; L215-F243 PolarHBondContact O-N 3.14Å; V216-F243 WeakPolarHBondContact CA-O 3.33Å; V216-F243 HydrophobicContact CG1-CB 4.45Å; V216-F243 HydrophobicContact CG2-CB 4.32Å; G217-F243 PolarHBondContact N-O 3.12Å; R241-F243 HydrophobicContact CB-CE2 4.13Å; F243-K262 CarbonylContact C-O 3.45Å; F243-K262 WeakPolarHBondContact CA-O 3.46Å; F243-L276 HydrophobicContact CD2-CD2 4.21Å; F243-L276 HydrophobicContact CG-CD2 4.49Å
244	F	97.6	Very high	94.2	Very high	7 Å²	7	61.8 Å²	61.8	3%	0.031	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	139.2	-179.8	-60.3	-81.2	0	0	0	110.6	G217 F219 I225 L231 Y259 K262 T263 R264	G217-F244 CarbonylContact O-C 3.57Å; G217-F244 WeakPolarHBondContact O-CA 3.34Å; F219-F244 HydrophobicContact CD2-CD1 4.34Å; F219-F244 HydrophobicContact CE2-CD1 4.14Å; F219-F244 HydrophobicContact CE2-CE1 4.42Å; I225-F244 HydrophobicContact CD1-CD1 3.82Å; I225-F244 HydrophobicContact CD1-CE1 4.21Å; I225-F244 HydrophobicContact CD1-CG 4.23Å; I225-F244 HydrophobicContact CG1-CD1 4.44Å; I225-F244 HydrophobicContact CG2-CD1 4.41Å; I225-F244 HydrophobicContact CG2-CE1 3.95Å; L231-F244 HydrophobicContact CD1-CE1 3.94Å; L231-F244 HydrophobicContact CD1-CZ 4.19Å; F244-Y259 AromaticContact CD2-CD1 3.64Å; F244-Y259 HydrophobicContact CD2-CD1 3.64Å; F244-Y259 AromaticContact CD2-CE1 3.94Å; F244-Y259 HydrophobicContact CD2-CE1 3.94Å; F244-Y259 HydrophobicContact CE1-CE1 4.23Å; F244-Y259 AromaticContact CE2-CD1 3.54Å; F244-Y259 HydrophobicContact CE2-CD1 3.54Å; F244-Y259 AromaticContact CE2-CE1 3.41Å; F244-Y259 HydrophobicContact CE2-CE1 3.41Å; F244-Y259 VanDerWaalsContact CE2-CE1 3.41Å; F244-Y259 HydrophobicContact CG-CD1 4.33Å; F244-Y259 HydrophobicContact CZ-CD1 4.16Å; F244-Y259 AromaticContact CZ-CE1 3.58Å; F244-Y259 HydrophobicContact CZ-CE1 3.58Å; F244-K262 HydrophobicContact CD2-CB 4.4Å; F244-K262 PolarHBondContact N-O 3.24Å; F244-T263 HydrophobicContact CB-CG2 4.49Å; F244-T263 CarbonylContact O-C 3.53Å; F244-T263 WeakPolarHBondContact O-CA 3.4Å; F244-R264 PolarHBondContact O-N 2.87Å
245	V	97.7	Very high	94	Very high	5 Å²	5	61.6 Å²	61.6	3%	0.03	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	115	174	-178	0	0	0	0	108.6	V216 G217 C218 F219 R264 G266 L268 L272	V216-V245 HydrophobicContact CG1-CG2 3.91Å; G217-V245 PolarHBondContact O-N 3.06Å; C218-V245 CarbonylContact C-O 3.52Å; C218-V245 WeakPolarHBondContact CA-O 3.5Å; C218-V245 HydrophobicContact CB-CB 4.44Å; F219-V245 PolarHBondContact N-O 3.43Å; V245-R264 CarbonylContact C-O 3.54Å; V245-R264 VanDerWaalsContact CA-O 3.3Å; V245-R264 WeakPolarHBondContact CA-O 3.41Å; V245-R264 HydrophobicContact CG2-CB 4.46Å; V245-G266 VanDerWaalsContact CG1-O 3.27Å; V245-G266 WeakPolarHBondContact CG1-O 3.42Å; V245-L268 HydrophobicContact CG2-CD1 4.41Å; V245-L272 HydrophobicContact CG2-CD2 3.9Å
246	L	97.5	Very high	93.9	Very high	0 Å²	0	63 Å²	63	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	112.8	-175.5	-56.1	-175.9	0	0	0	110.7	F219 F222 I225 E249 L255 T263 R264 F265 G266	F219-L246 HydrophobicContact CB-CD2 3.77Å; F219-L246 WeakPolarHBondContact O-CA 3.4Å; F222-L246 HydrophobicContact CB-CD1 4.22Å; I225-L246 HydrophobicContact CD1-CD2 4.23Å; I225-L246 HydrophobicContact CG1-CD2 4.32Å; L246-E249 HydrophobicContact CB-CB 3.84Å; L246-E249 HydrophobicContact CB-CG 3.8Å; L246-E249 HydrophobicContact CD1-CB 4.33Å; L246-E249 HydrophobicContact CD1-CG 3.81Å; L246-E249 HydrophobicContact CG-CG 4.43Å; L246-L255 HydrophobicContact CD1-CD1 4.39Å; L246-L255 HydrophobicContact CD1-CD2 4.04Å; L246-T263 HydrophobicContact CB-CG2 4.44Å; L246-T263 HydrophobicContact CD1-CG2 3.73Å; L246-T263 HydrophobicContact CG-CG2 3.78Å; L246-R264 PolarHBondContact N-O 3.35Å; L246-F265 HydrophobicContact CB-CD1 4.36Å; L246-F265 WeakPolarHBondContact O-CA 3.21Å; L246-G266 CarbonylContact C-O 3.59Å; L246-G266 PolarHBondContact O-N 2.97Å
247	S	96.6	Very high	93.6	Very high	51 Å²	51	67.1 Å²	67.1	36%	0.357	33%	0.326	S	S	.	.	S	Bend	trans	-85.6	-13.2	-169.8	58	0	0	0	0	115.9	F219 K220 G266	F219-S247 PolarHBondContact O-N 2.8Å; F219-S247 PolarHBondContact O-OG 3.35Å; F219-S247 VanDerWaalsContact O-OG 3.1Å; K220-S247 PolarHBondContact O-N 3.35Å; S247-G266 WeakPolarHBondContact CA-O 3.38Å; S247-G266 WeakPolarHBondContact CB-O 3.29Å; S247-G266 PolarHBondContact N-O 3.48Å
248	Q	95.4	Very high	93.2	Very high	128 Å²	128	66.3 Å²	66.3	60%	0.598	33%	0.33	S	S	*	.	S	Bend	trans	-123.2	13.9	179.1	-59.5	-171.9	-12.9	0	0	112.4	K220 T221	K220-Q248 HydrophobicContact CB-CG 4.21Å; K220-Q248 HydrophobicContact CG-CG 4.49Å; K220-Q248 WeakPolarHBondContact O-CA 3.22Å; K220-Q248 WeakPolarHBondContact O-CB 3.44Å; K220-Q248 PolarHBondContact O-N 3.23Å; T221-Q248 HydrophobicContact CG2-CB 4.17Å
249	E	92.4	Very high	93	Very high	33 Å²	33	59.2 Å²	59.2	15%	0.154	30%	0.303	C	S	.	.			trans	-107.4	146.7	172.3	-64.1	-68.1	177.3	0	0	109.8	T221 F222 L246 F265	T221-E249 WeakPolarHBondContact CA-OE1 3.32Å; T221-E249 WeakPolarHBondContact CB-OE1 3.41Å; F222-E249 PolarHBondContact N-OE1 3.41Å; L246-E249 HydrophobicContact CB-CB 3.84Å; L246-E249 HydrophobicContact CB-CG 3.8Å; L246-E249 HydrophobicContact CD1-CB 4.33Å; L246-E249 HydrophobicContact CD1-CG 3.81Å; L246-E249 HydrophobicContact CG-CG 4.43Å; E249-F265 HydrophobicContact CB-CD1 3.58Å; E249-F265 HydrophobicContact CB-CE1 3.62Å; E249-F265 WeakPolarHBondContact O-CD1 3.27Å
250	S	86.5	Confident	92.8	Very high	113 Å²	113	62 Å²	62	79%	0.79	32%	0.316	S	S	*	.			trans	-121.6	-9.7	-177.1	56.7	0	0	0	0	114.1
251	S	87.8	Confident	92.4	Very high	34 Å²	34	69 Å²	69	24%	0.238	35%	0.348	C	S	.	.			trans	-148	150.7	-177.6	75.9	0	0	0	0	112.4	F265	S251-F265 VanDerWaalsContact O-CZ 3.24Å; S251-F265 WeakPolarHBondContact O-CZ 3.19Å
252	S	87.3	Confident	92.2	Very high	47 Å²	47	68.1 Å²	68.1	33%	0.329	35%	0.347	S	S	.	.	S	Bend	trans	-86.6	-10.9	176.6	54.6	0	0	0	0	113.7	Q254 L255 Q260 F265	S252-Q254 PolarHBondContact O-N 3.38Å; S252-L255 WeakPolarHBondContact O-CB 3.44Å; S252-L255 PolarHBondContact O-N 3.34Å; S252-Q260 WeakPolarHBondContact O-CG 3.49Å; S252-Q260 PolarHBondContact O-NE2 3.01Å; S252-F265 VanDerWaalsContact N-CZ 3.34Å
253	E	86.4	Confident	92.1	Very high	170 Å²	170	68 Å²	68	79%	0.794	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-31.8	-174.7	-63.9	-178.8	178.8	0	0	112.8
254	Q	84.9	Confident	92.1	Very high	156 Å²	156	70 Å²	70	73%	0.729	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-9.4	-180	-60.3	-179.6	5.3	0	0	113	S252	S252-Q254 PolarHBondContact O-N 3.38Å
255	L	92.1	Very high	92	Very high	7 Å²	7	73.2 Å²	73.2	4%	0.037	37%	0.366	C	S	.	.	S	Bend	trans	-82.3	144.2	179	-56.7	-178.9	0	0	0	110.2	F222 L246 S252 W257 Q260 T263 F265	F222-L255 HydrophobicContact CB-CD2 3.57Å; F222-L255 HydrophobicContact CD2-CD2 3.83Å; F222-L255 HydrophobicContact CG-CD2 3.77Å; L246-L255 HydrophobicContact CD1-CD1 4.39Å; L246-L255 HydrophobicContact CD1-CD2 4.04Å; S252-L255 WeakPolarHBondContact O-CB 3.44Å; S252-L255 PolarHBondContact O-N 3.34Å; L255-W257 PolarHBondContact O-N 3.01Å; L255-Q260 HydrophobicContact CB-CG 4.06Å; L255-Q260 PolarHBondContact O-NE2 3.33Å; L255-T263 HydrophobicContact CD1-CG2 3.74Å; L255-F265 HydrophobicContact CD1-CE1 4.09Å; L255-F265 HydrophobicContact CD1-CZ 3.86Å
256	P	92.9	Very high	91.8	Very high	54 Å²	54	74.4 Å²	74.4	35%	0.351	38%	0.379	S	S	.	.			trans	-55.3	141.9	167.8	-23.9	34.8	0	0	0	110.6	F222 S258 Y259 Q260	F222-P256 HydrophobicContact CE1-CG 3.73Å; F222-P256 HydrophobicContact CE2-CG 4.32Å; F222-P256 VanDerWaalsContact CZ-CD 3.48Å; F222-P256 HydrophobicContact CZ-CG 3.52Å; P256-S258 PolarHBondContact O-N 3.24Å; P256-Y259 HydrophobicContact CB-CD2 4.28Å; P256-Y259 PolarHBondContact O-N 3.5Å; P256-Q260 PolarHBondContact O-N 3.06Å
257	W	90	Very high	91.7	Very high	198 Å²	198	84.8 Å²	84.8	75%	0.75	42%	0.418	S	S	*	.	H	α-helix	trans	-49.7	-39.8	-175.1	-178.8	77.2	0	0	0	113.4	L255 Y259 Q260	L255-W257 PolarHBondContact O-N 3.01Å; W257-Y259 PolarHBondContact O-N 3.06Å; W257-Y259 VanDerWaalsContact O-N 3.09Å; W257-Q260 PolarHBondContact O-N 2.92Å
258	S	89.4	Confident	91.6	Very high	59 Å²	59	83.4 Å²	83.4	41%	0.413	41%	0.407	S	S	.	.	H	α-helix	trans	-63.4	-14.5	178.7	55.6	0	0	0	0	115.5	P256	P256-S258 PolarHBondContact O-N 3.24Å
259	Y	93.2	Very high	91.5	Very high	8 Å²	8	78.8 Å²	78.8	3%	0.031	39%	0.394	C	S	.	.	H	α-helix	trans	-105.9	-16.7	177.9	-75.7	-98.9	0	0	0	113.4	F222 I225 F244 P256 W257 E261 K262 T263	F222-Y259 HydrophobicContact CD2-CD1 4.42Å; F222-Y259 HydrophobicContact CD2-CG 4.49Å; F222-Y259 AromaticContact CE2-CD1 3.69Å; F222-Y259 HydrophobicContact CE2-CD1 3.69Å; F222-Y259 AromaticContact CE2-CD2 3.76Å; F222-Y259 HydrophobicContact CE2-CD2 3.76Å; F222-Y259 AromaticContact CE2-CE1 3.9Å; F222-Y259 HydrophobicContact CE2-CE1 3.9Å; F222-Y259 AromaticContact CE2-CE2 3.98Å; F222-Y259 HydrophobicContact CE2-CE2 3.98Å; F222-Y259 AromaticContact CE2-CG 3.61Å; F222-Y259 HydrophobicContact CE2-CG 3.61Å; F222-Y259 HydrophobicContact CZ-CD2 4.07Å; F222-Y259 HydrophobicContact CZ-CE2 4.09Å; F222-Y259 HydrophobicContact CZ-CG 4.37Å; I225-Y259 HydrophobicContact CD1-CD1 4.43Å; I225-Y259 HydrophobicContact CD1-CE1 4.24Å; F244-Y259 AromaticContact CD2-CD1 3.64Å; F244-Y259 HydrophobicContact CD2-CD1 3.64Å; F244-Y259 AromaticContact CD2-CE1 3.94Å; F244-Y259 HydrophobicContact CD2-CE1 3.94Å; F244-Y259 HydrophobicContact CE1-CE1 4.23Å; F244-Y259 AromaticContact CE2-CD1 3.54Å; F244-Y259 HydrophobicContact CE2-CD1 3.54Å; F244-Y259 AromaticContact CE2-CE1 3.41Å; F244-Y259 HydrophobicContact CE2-CE1 3.41Å; F244-Y259 VanDerWaalsContact CE2-CE1 3.41Å; F244-Y259 HydrophobicContact CG-CD1 4.33Å; F244-Y259 HydrophobicContact CZ-CD1 4.16Å; F244-Y259 AromaticContact CZ-CE1 3.58Å; F244-Y259 HydrophobicContact CZ-CE1 3.58Å; P256-Y259 HydrophobicContact CB-CD2 4.28Å; P256-Y259 PolarHBondContact O-N 3.5Å; W257-Y259 PolarHBondContact O-N 3.06Å; W257-Y259 VanDerWaalsContact O-N 3.09Å; Y259-E261 PolarHBondContact O-N 3.44Å; Y259-K262 PolarHBondContact O-N 3.35Å; Y259-T263 VanDerWaalsContact O-CB 3.29Å; Y259-T263 WeakPolarHBondContact O-CB 3.35Å; Y259-T263 PolarHBondContact O-N 3.33Å; Y259-T263 VanDerWaalsContact O-N 3.09Å; Y259-T263 PolarHBondContact O-OG1 2.89Å
260	Q	92.6	Very high	91.7	Very high	64 Å²	64	79.6 Å²	79.6	30%	0.299	40%	0.398	S	S	.	.	H	α-helix	trans	-60.1	-51	-170.5	-69.5	-179.3	-1.8	0	0	112.1	S252 L255 P256 W257 K262 T263	S252-Q260 WeakPolarHBondContact O-CG 3.49Å; S252-Q260 PolarHBondContact O-NE2 3.01Å; L255-Q260 HydrophobicContact CB-CG 4.06Å; L255-Q260 PolarHBondContact O-NE2 3.33Å; P256-Q260 PolarHBondContact O-N 3.06Å; W257-Q260 PolarHBondContact O-N 2.92Å; Q260-K262 VanDerWaalsContact C-N 3.31Å; Q260-K262 PolarHBondContact O-N 2.9Å; Q260-T263 PolarHBondContact O-N 2.87Å
261	E	90.1	Very high	92.1	Very high	154 Å²	154	80.2 Å²	80.2	72%	0.72	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-28.1	-178	-62.1	-175.8	168.1	0	0	113.4	Y259 T263 R264	Y259-E261 PolarHBondContact O-N 3.44Å; E261-T263 VanDerWaalsContact C-N 3.34Å; E261-R264 PolarHBondContact O-NH1 2.92Å; E261-R264 VanDerWaalsContact O-NH1 3.13Å
262	K	91.8	Very high	92.5	Very high	80 Å²	80	80 Å²	80	35%	0.348	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-6.3	-177.5	-61.8	-179.3	179.7	-175.8	0	113.2	F243 F244 Y259 Q260	F243-K262 CarbonylContact C-O 3.45Å; F243-K262 WeakPolarHBondContact CA-O 3.46Å; F244-K262 HydrophobicContact CD2-CB 4.4Å; F244-K262 PolarHBondContact N-O 3.24Å; Y259-K262 PolarHBondContact O-N 3.35Å; Q260-K262 VanDerWaalsContact C-N 3.31Å; Q260-K262 PolarHBondContact O-N 2.9Å
263	T	96.1	Very high	93	Very high	6 Å²	6	77.8 Å²	77.8	4%	0.037	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	142.2	-175.2	-58.8	0	0	0	0	111.4	F244 L246 L255 Y259 Q260 E261 F265	F244-T263 HydrophobicContact CB-CG2 4.49Å; F244-T263 CarbonylContact O-C 3.53Å; F244-T263 WeakPolarHBondContact O-CA 3.4Å; L246-T263 HydrophobicContact CB-CG2 4.44Å; L246-T263 HydrophobicContact CD1-CG2 3.73Å; L246-T263 HydrophobicContact CG-CG2 3.78Å; L255-T263 HydrophobicContact CD1-CG2 3.74Å; Y259-T263 VanDerWaalsContact O-CB 3.29Å; Y259-T263 WeakPolarHBondContact O-CB 3.35Å; Y259-T263 PolarHBondContact O-N 3.33Å; Y259-T263 VanDerWaalsContact O-N 3.09Å; Y259-T263 PolarHBondContact O-OG1 2.89Å; Q260-T263 PolarHBondContact O-N 2.87Å; E261-T263 VanDerWaalsContact C-N 3.34Å; T263-F265 HydrophobicContact CG2-CD1 4.43Å; T263-F265 HydrophobicContact CG2-CE1 3.94Å; T263-F265 HydrophobicContact CG2-CZ 4.17Å
264	R	95.4	Very high	93.5	Very high	95 Å²	95	74.1 Å²	74.1	36%	0.358	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	144.8	168	-61.2	-65.7	-176.9	-100.1	1.6	108.7	F244 V245 L246 E261 L272	F244-R264 PolarHBondContact O-N 2.87Å; V245-R264 CarbonylContact C-O 3.54Å; V245-R264 VanDerWaalsContact CA-O 3.3Å; V245-R264 WeakPolarHBondContact CA-O 3.41Å; V245-R264 HydrophobicContact CG2-CB 4.46Å; L246-R264 PolarHBondContact N-O 3.35Å; E261-R264 PolarHBondContact O-NH1 2.92Å; E261-R264 VanDerWaalsContact O-NH1 3.13Å; R264-L272 HydrophobicContact CB-CD2 4.23Å; R264-L272 HydrophobicContact CG-CD1 4.3Å; R264-L272 HydrophobicContact CG-CD2 4.39Å
265	F	95.3	Very high	94	Very high	76 Å²	76	70.7 Å²	70.7	33%	0.333	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	148.3	-179.3	-59.7	-65.4	0	0	0	111.2	L246 E249 S251 S252 L255 T263	L246-F265 HydrophobicContact CB-CD1 4.36Å; L246-F265 WeakPolarHBondContact O-CA 3.21Å; E249-F265 HydrophobicContact CB-CD1 3.58Å; E249-F265 HydrophobicContact CB-CE1 3.62Å; E249-F265 WeakPolarHBondContact O-CD1 3.27Å; S251-F265 VanDerWaalsContact O-CZ 3.24Å; S251-F265 WeakPolarHBondContact O-CZ 3.19Å; S252-F265 VanDerWaalsContact N-CZ 3.34Å; L255-F265 HydrophobicContact CD1-CE1 4.09Å; L255-F265 HydrophobicContact CD1-CZ 3.86Å; T263-F265 HydrophobicContact CG2-CD1 4.43Å; T263-F265 HydrophobicContact CG2-CE1 3.94Å; T263-F265 HydrophobicContact CG2-CZ 4.17Å
266	G	94.8	Very high	94.2	Very high	29 Å²	29	71 Å²	71	30%	0.299	34%	0.34	S	S	.	.	S	Bend	trans	98	-152.2	-177.2	0	0	0	0	0	112.9	V245 L246 S247	V245-G266 VanDerWaalsContact CG1-O 3.27Å; V245-G266 WeakPolarHBondContact CG1-O 3.42Å; L246-G266 CarbonylContact C-O 3.59Å; L246-G266 PolarHBondContact O-N 2.97Å; S247-G266 WeakPolarHBondContact CA-O 3.38Å; S247-G266 WeakPolarHBondContact CB-O 3.29Å; S247-G266 PolarHBondContact N-O 3.48Å
267	R	94.6	Very high	94.3	Very high	218 Å²	218	69.6 Å²	69.6	82%	0.823	33%	0.33	S	S	*	.			trans	-105.2	152.8	-178.4	-66.9	-174.7	176.5	-145.1	1.6	110.7	G269	R267-G269 PolarHBondContact O-N 3Å
268	L	94.9	Very high	94.6	Very high	22 Å²	22	64.4 Å²	64.4	12%	0.115	32%	0.324	C	S	.	.			trans	-68.4	101.6	172.9	-174.4	60.9	0	0	0	108.9	L187 V245 L272 I273 L276 F294 I298	L187-L268 HydrophobicContact CD2-CD2 4.19Å; V245-L268 HydrophobicContact CG2-CD1 4.41Å; L268-L272 HydrophobicContact CD1-CB 4.25Å; L268-L272 HydrophobicContact CD1-CD2 3.7Å; L268-L272 HydrophobicContact CD1-CG 3.84Å; L268-I273 HydrophobicContact CD1-CG1 3.8Å; L268-I273 HydrophobicContact CD2-CG1 4.32Å; L268-I273 HydrophobicContact CG-CD1 4.04Å; L268-I273 HydrophobicContact CG-CG1 3.82Å; L268-L276 HydrophobicContact CD1-CD1 3.84Å; L268-F294 HydrophobicContact CD2-CE2 4.27Å; L268-F294 HydrophobicContact CD2-CZ 4.13Å; L268-I298 HydrophobicContact CB-CD1 4.36Å; L268-I298 HydrophobicContact CD2-CD1 3.55Å; L268-I298 HydrophobicContact CG-CD1 3.84Å
269	G	94	Very high	94.7	Very high	32 Å²	32	64.7 Å²	64.7	33%	0.33	33%	0.326	S	S	.	.			trans	-109.5	176.5	-178.2	0	0	0	0	0	113	R267 D271 L272 I273	R267-G269 PolarHBondContact O-N 3Å; G269-D271 VanDerWaalsContact C-N 3.33Å; G269-D271 PolarHBondContact O-N 3.2Å; G269-L272 PolarHBondContact O-N 3.37Å; G269-I273 WeakPolarHBondContact O-CG1 3.41Å; G269-I273 PolarHBondContact O-N 2.77Å
270	Q	95.8	Very high	94.8	Very high	49 Å²	49	65.1 Å²	65.1	23%	0.229	33%	0.329	C	S	.	.	H	α-helix	trans	-52.6	-45.2	-176.1	-179.4	64.3	73.2	0	0	113.9	I273 K274 C301	Q270-I273 PolarHBondContact O-N 2.84Å; Q270-K274 HydrophobicContact CG-CD 4.36Å; Q270-K274 WeakPolarHBondContact O-CG 3.15Å; Q270-K274 PolarHBondContact O-N 3.48Å; Q270-C301 PolarHBondContact NE2-O 3.37Å; Q270-C301 VanDerWaalsContact OE1-CA 3.27Å
271	D	95.9	Very high	94.8	Very high	127 Å²	127	67.4 Å²	67.4	68%	0.679	34%	0.335	S	S	*	.	H	α-helix	trans	-69.5	-42.6	-175.3	-62.6	-29	0	0	0	111.4	G269 I273 K274 E275	G269-D271 VanDerWaalsContact C-N 3.33Å; G269-D271 PolarHBondContact O-N 3.2Å; D271-I273 VanDerWaalsContact C-N 3.33Å; D271-I273 PolarHBondContact O-N 3.13Å; D271-K274 WeakPolarHBondContact O-CB 3.44Å; D271-K274 PolarHBondContact O-N 2.94Å; D271-E275 PolarHBondContact O-N 3.09Å
272	L	95.4	Very high	95	Very high	30 Å²	30	66.2 Å²	66.2	16%	0.157	32%	0.324	C	S	.	.	H	α-helix	trans	-65.8	-36.7	176.1	-177.1	57.6	0	0	0	111.5	V245 R264 L268 G269 E275 L276	V245-L272 HydrophobicContact CG2-CD2 3.9Å; R264-L272 HydrophobicContact CB-CD2 4.23Å; R264-L272 HydrophobicContact CG-CD1 4.3Å; R264-L272 HydrophobicContact CG-CD2 4.39Å; L268-L272 HydrophobicContact CD1-CB 4.25Å; L268-L272 HydrophobicContact CD1-CD2 3.7Å; L268-L272 HydrophobicContact CD1-CG 3.84Å; G269-L272 PolarHBondContact O-N 3.37Å; L272-E275 PolarHBondContact O-N 3.01Å; L272-L276 HydrophobicContact CD1-CD1 4.44Å; L272-L276 HydrophobicContact CD1-CG 4.33Å; L272-L276 HydrophobicContact CG-CD1 4.04Å; L272-L276 HydrophobicContact CG-CG 4.43Å; L272-L276 WeakPolarHBondContact O-CB 3.34Å; L272-L276 WeakPolarHBondContact O-CD1 3.39Å; L272-L276 WeakPolarHBondContact O-CG 3.35Å; L272-L276 PolarHBondContact O-N 3.37Å
273	I	97.1	Very high	95.1	Very high	0 Å²	0	69.2 Å²	69.2	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-65.6	-42.3	175.1	-68.8	162.9	0	0	0	110.8	L268 G269 Q270 D271 E275 L276 V277 I298 C301 L302 A305	L268-I273 HydrophobicContact CD1-CG1 3.8Å; L268-I273 HydrophobicContact CD2-CG1 4.32Å; L268-I273 HydrophobicContact CG-CD1 4.04Å; L268-I273 HydrophobicContact CG-CG1 3.82Å; G269-I273 WeakPolarHBondContact O-CG1 3.41Å; G269-I273 PolarHBondContact O-N 2.77Å; Q270-I273 PolarHBondContact O-N 2.84Å; D271-I273 VanDerWaalsContact C-N 3.33Å; D271-I273 PolarHBondContact O-N 3.13Å; I273-E275 VanDerWaalsContact C-N 3.35Å; I273-L276 PolarHBondContact O-N 3.37Å; I273-V277 HydrophobicContact CG2-CG2 4.36Å; I273-V277 WeakPolarHBondContact O-CB 3.49Å; I273-V277 VanDerWaalsContact O-CG2 3.28Å; I273-V277 WeakPolarHBondContact O-CG2 3.46Å; I273-V277 PolarHBondContact O-N 3.38Å; I273-I298 HydrophobicContact CD1-CD1 3.45Å; I273-I298 VanDerWaalsContact CD1-CD1 3.45Å; I273-I298 HydrophobicContact CG1-CD1 4.45Å; I273-C301 HydrophobicContact CB-CB 4.28Å; I273-C301 HydrophobicContact CD1-CB 3.24Å; I273-C301 HydrophobicContact CG1-CB 4.35Å; I273-C301 HydrophobicContact CG2-CB 4.16Å; I273-L302 HydrophobicContact CG2-CD2 3.86Å; I273-L302 HydrophobicContact CG2-CG 4.46Å; I273-A305 HydrophobicContact CG2-CB 4.36Å
274	K	96.6	Very high	95.2	Very high	92 Å²	92	69.2 Å²	69.2	40%	0.4	34%	0.337	S	S	.	.	H	α-helix	trans	-60.3	-45	174.2	-76.9	173.5	176	177.6	0	111.7	Q270 D271 S278 C304 A305	Q270-K274 HydrophobicContact CG-CD 4.36Å; Q270-K274 WeakPolarHBondContact O-CG 3.15Å; Q270-K274 PolarHBondContact O-N 3.48Å; D271-K274 WeakPolarHBondContact O-CB 3.44Å; D271-K274 PolarHBondContact O-N 2.94Å; K274-S278 WeakPolarHBondContact O-CB 3.45Å; K274-S278 PolarHBondContact O-N 3.21Å; K274-S278 PolarHBondContact O-OG 3.46Å; K274-C304 WeakPolarHBondContact CE-O 3.42Å; K274-A305 HydrophobicContact CG-CB 3.75Å
275	E	95.8	Very high	95.3	Very high	85 Å²	85	65.9 Å²	65.9	40%	0.397	33%	0.326	S	S	.	.	H	α-helix	trans	-56.8	-53.9	173.6	-176.3	-172.2	158.8	0	0	110.4	D271 L272 I273 V277 S278 C279	D271-E275 PolarHBondContact O-N 3.09Å; L272-E275 PolarHBondContact O-N 3.01Å; I273-E275 VanDerWaalsContact C-N 3.35Å; E275-V277 PolarHBondContact O-N 3.24Å; E275-S278 WeakPolarHBondContact CA-OG 3.39Å; E275-S278 CarbonylContact O-C 3.32Å; E275-S278 WeakPolarHBondContact O-CA 3.34Å; E275-S278 PolarHBondContact O-N 2.72Å; E275-S278 PolarHBondContact O-OG 2.86Å; E275-C279 WeakPolarHBondContact O-CB 3.3Å; E275-C279 PolarHBondContact O-N 3.04Å; E275-C279 PolarHBondContact O-SG 3.36Å
276	L	95.9	Very high	95.5	Very high	13 Å²	13	62.3 Å²	62.3	7%	0.068	31%	0.31	C	S	.	.	H	α-helix	trans	-57.6	-45.5	-179.1	-72.9	164.3	0	0	0	112.7	L187 V216 F243 L268 L272 I273 S278 C279 C280	L187-L276 HydrophobicContact CD2-CD1 4.49Å; V216-L276 HydrophobicContact CG1-CD1 4.26Å; V216-L276 HydrophobicContact CG2-CD1 3.88Å; V216-L276 HydrophobicContact CG2-CD2 3.88Å; V216-L276 HydrophobicContact CG2-CG 4.49Å; F243-L276 HydrophobicContact CD2-CD2 4.21Å; F243-L276 HydrophobicContact CG-CD2 4.49Å; L268-L276 HydrophobicContact CD1-CD1 3.84Å; L272-L276 HydrophobicContact CD1-CD1 4.44Å; L272-L276 HydrophobicContact CD1-CG 4.33Å; L272-L276 HydrophobicContact CG-CD1 4.04Å; L272-L276 HydrophobicContact CG-CG 4.43Å; L272-L276 WeakPolarHBondContact O-CB 3.34Å; L272-L276 WeakPolarHBondContact O-CD1 3.39Å; L272-L276 WeakPolarHBondContact O-CG 3.35Å; L272-L276 PolarHBondContact O-N 3.37Å; I273-L276 PolarHBondContact O-N 3.37Å; L276-S278 VanDerWaalsContact C-N 3.32Å; L276-S278 PolarHBondContact O-N 3.36Å; L276-C279 PolarHBondContact O-N 2.86Å; L276-C280 PolarHBondContact O-N 2.86Å; L276-C280 PolarHBondContact O-SG 3.4Å
277	V	96.6	Very high	95.7	Very high	24 Å²	24	60.9 Å²	60.9	15%	0.145	30%	0.295	C	S	.	.	H	α-helix	trans	-62.2	-40.9	176.2	171.7	0	0	0	0	110.8	L185 I273 E275 C279 C280 P284 L302 A305 L307	L185-V277 HydrophobicContact CD2-CG2 3.77Å; I273-V277 HydrophobicContact CG2-CG2 4.36Å; I273-V277 WeakPolarHBondContact O-CB 3.49Å; I273-V277 VanDerWaalsContact O-CG2 3.28Å; I273-V277 WeakPolarHBondContact O-CG2 3.46Å; I273-V277 PolarHBondContact O-N 3.38Å; E275-V277 PolarHBondContact O-N 3.24Å; V277-C279 VanDerWaalsContact C-N 3.34Å; V277-C280 WeakPolarHBondContact O-CB 3.44Å; V277-C280 PolarHBondContact O-N 3.06Å; V277-P284 HydrophobicContact CG1-CG 4.42Å; V277-L302 HydrophobicContact CG2-CD2 4.27Å; V277-A305 HydrophobicContact CB-CB 4.42Å; V277-A305 HydrophobicContact CG2-CB 4.18Å; V277-L307 HydrophobicContact CG1-CD1 4.39Å; V277-L307 HydrophobicContact CG2-CD1 3.82Å
278	S	94.6	Very high	95.9	Very high	90 Å²	90	50.5 Å²	50.5	63%	0.629	26%	0.256	S	S	*	.	H	α-helix	trans	-70.7	-27.1	177.4	75.3	0	0	0	0	113.9	K274 E275 L276 C280	K274-S278 WeakPolarHBondContact O-CB 3.45Å; K274-S278 PolarHBondContact O-N 3.21Å; K274-S278 PolarHBondContact O-OG 3.46Å; E275-S278 WeakPolarHBondContact CA-OG 3.39Å; E275-S278 CarbonylContact O-C 3.32Å; E275-S278 WeakPolarHBondContact O-CA 3.34Å; E275-S278 PolarHBondContact O-N 2.72Å; E275-S278 PolarHBondContact O-OG 2.86Å; L276-S278 VanDerWaalsContact C-N 3.32Å; L276-S278 PolarHBondContact O-N 3.36Å; S278-C280 VanDerWaalsContact C-N 3.33Å
279	C	92.5	Very high	96	Very high	65 Å²	65	50.3 Å²	50.3	44%	0.439	26%	0.257	S	S	.	.	H	α-helix	trans	-82.8	-11.2	178.6	-70.5	0	0	0	0	113.4	E275 L276 V277	E275-C279 WeakPolarHBondContact O-CB 3.3Å; E275-C279 PolarHBondContact O-N 3.04Å; E275-C279 PolarHBondContact O-SG 3.36Å; L276-C279 PolarHBondContact O-N 2.86Å; V277-C279 VanDerWaalsContact C-N 3.34Å
280	C	95	Very high	96	Very high	16 Å²	16	50.1 Å²	50.1	11%	0.108	25%	0.254	C	S	.	.	S	Bend	trans	-61.8	139.6	171.8	-67.2	0	0	0	0	109.5	E183 L276 V277 S278 R282 P284	E183-C280 WeakPolarHBondContact OE2-CB 3.38Å; L276-C280 PolarHBondContact O-N 2.86Å; L276-C280 PolarHBondContact O-SG 3.4Å; V277-C280 WeakPolarHBondContact O-CB 3.44Å; V277-C280 PolarHBondContact O-N 3.06Å; S278-C280 VanDerWaalsContact C-N 3.33Å; C280-R282 VanDerWaalsContact C-N 3.3Å; C280-R282 VanDerWaalsContact CB-O 3.26Å; C280-R282 WeakPolarHBondContact CB-O 3.44Å; C280-P284 HydrophobicContact CB-CB 4.33Å; C280-P284 HydrophobicContact CB-CG 4.17Å
281	R	93.1	Very high	95.9	Very high	112 Å²	112	50.7 Å²	50.7	42%	0.423	26%	0.264	S	S	.	.	S	Bend	trans	-69.1	-32.1	178.8	-52.7	-174.1	-168.5	-159.9	9.3	111.5	E183 F212 W238	E183-R281 WeakPolarHBondContact OE2-CA 3.38Å; E183-R281 WeakPolarHBondContact OE2-CB 3.38Å; E183-R281 PolarHBondContact OE2-N 2.97Å; F212-R281 HydrophobicContact CD2-CB 4.46Å; F212-R281 VanDerWaalsContact CE1-CZ 3.47Å; W238-R281 PolarHBondContact O-NH2 3.13Å
282	R	93.1	Very high	95.7	Very high	129 Å²	129	48.3 Å²	48.3	49%	0.487	26%	0.262	S	S	.	.	S	Bend	trans	-128.1	164.5	176	-64.3	-179.4	175.5	167.3	-3.3	109.2	E183 C280 P284	E183-R282 HydrophobicContact CB-CB 4.17Å; E183-R282 PolarHBondContact OE2-N 3.05Å; C280-R282 VanDerWaalsContact C-N 3.3Å; C280-R282 VanDerWaalsContact CB-O 3.26Å; C280-R282 WeakPolarHBondContact CB-O 3.44Å; R282-P284 VanDerWaalsContact O-CD 3.24Å; R282-P284 WeakPolarHBondContact O-CD 3.44Å; R282-P284 VanDerWaalsContact O-N 3.08Å
283	K	94.6	Very high	95.7	Very high	143 Å²	143	52.9 Å²	52.9	62%	0.622	28%	0.282	S	S	*	.	P	Polyproline II helix	trans	-58.3	116.3	170.6	-175.1	179	177.1	-173.1	0	107.9
284	P	97.9	Very high	95.7	Very high	6 Å²	6	54.4 Å²	54.4	4%	0.039	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-82.7	153.7	-170.5	32.8	-35.1	0	0	0	111.5	E183 L185 V277 C280 R282 L307	E183-P284 CarbonylContact O-C 3.59Å; E183-P284 WeakPolarHBondContact O-CA 3.44Å; L185-P284 HydrophobicContact CB-CB 3.77Å; L185-P284 HydrophobicContact CB-CG 4.28Å; L185-P284 HydrophobicContact CD2-CG 4.47Å; V277-P284 HydrophobicContact CG1-CG 4.42Å; C280-P284 HydrophobicContact CB-CB 4.33Å; C280-P284 HydrophobicContact CB-CG 4.17Å; R282-P284 VanDerWaalsContact O-CD 3.24Å; R282-P284 WeakPolarHBondContact O-CD 3.44Å; R282-P284 VanDerWaalsContact O-N 3.08Å; P284-L307 HydrophobicContact CG-CD2 4.41Å; P284-L307 WeakPolarHBondContact O-CD2 3.49Å
285	F	98.4	Very high	95.7	Very high	26 Å²	26	51 Å²	51	11%	0.114	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	122.1	155.4	-172	-84.5	0	0	0	108.2	F174 Y181 E183 L184 L185 L287 D310 S311 F313	F174-F285 HydrophobicContact CE2-CD1 4.48Å; F174-F285 AromaticContact CE2-CE1 3.71Å; F174-F285 HydrophobicContact CE2-CE1 3.71Å; F174-F285 HydrophobicContact CE2-CZ 4.33Å; F174-F285 HydrophobicContact CZ-CE1 4.42Å; Y181-F285 HydrophobicContact CD1-CB 3.44Å; Y181-F285 VanDerWaalsContact CD1-CB 3.44Å; Y181-F285 AromaticContact CD1-CD2 3.91Å; Y181-F285 HydrophobicContact CD1-CD2 3.91Å; Y181-F285 AromaticContact CD1-CG 3.73Å; Y181-F285 HydrophobicContact CD1-CG 3.73Å; Y181-F285 HydrophobicContact CD2-CB 4.34Å; Y181-F285 HydrophobicContact CD2-CG 4.49Å; Y181-F285 HydrophobicContact CE1-CB 3.74Å; Y181-F285 HydrophobicContact CE1-CD1 4.11Å; Y181-F285 AromaticContact CE1-CD2 3.31Å; Y181-F285 HydrophobicContact CE1-CD2 3.31Å; Y181-F285 AromaticContact CE1-CE2 3.87Å; Y181-F285 HydrophobicContact CE1-CE2 3.87Å; Y181-F285 AromaticContact CE1-CG 3.44Å; Y181-F285 HydrophobicContact CE1-CG 3.44Å; Y181-F285 VanDerWaalsContact CE1-CG 3.44Å; Y181-F285 HydrophobicContact CE1-CZ 4.49Å; Y181-F285 HydrophobicContact CE2-CD1 4.15Å; Y181-F285 HydrophobicContact CE2-CG 4.24Å; Y181-F285 HydrophobicContact CG-CB 3.76Å; Y181-F285 HydrophobicContact CG-CG 4.23Å; Y181-F285 AromaticContact CZ-CD1 3.87Å; Y181-F285 AromaticContact CZ-CD2 3.78Å; Y181-F285 AromaticContact CZ-CG 3.7Å; E183-F285 PolarHBondContact O-N 2.89Å; L184-F285 WeakPolarHBondContact CA-O 3.38Å; L184-F285 HydrophobicContact CD2-CB 4.17Å; L184-F285 HydrophobicContact CD2-CD1 4.27Å; L185-F285 PolarHBondContact N-O 3.48Å; F285-L287 HydrophobicContact CD1-CD2 3.84Å; F285-L287 HydrophobicContact CE1-CD2 3.66Å; F285-D310 VanDerWaalsContact CE2-O 3.31Å; F285-D310 WeakPolarHBondContact CE2-O 3.24Å; F285-S311 WeakPolarHBondContact CA-O 3.36Å; F285-F313 HydrophobicContact CE1-CB 3.82Å; F285-F313 HydrophobicContact CZ-CB 4.08Å
286	A	98.6	Very high	95.7	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	136	-173.8	0	0	0	0	0	112.3	L185 L302 S311 Y312 F313	L185-A286 HydrophobicContact CB-CB 4.28Å; L185-A286 CarbonylContact O-C 2.89Å; L185-A286 VanDerWaalsContact O-CA 3.24Å; L185-A286 WeakPolarHBondContact O-CA 3.49Å; A286-L302 HydrophobicContact CB-CD1 3.84Å; A286-L302 HydrophobicContact CB-CD2 4.07Å; A286-S311 PolarHBondContact N-O 3.05Å; A286-Y312 CarbonylContact O-C 3.53Å; A286-Y312 WeakPolarHBondContact O-CA 3.3Å; A286-Y312 WeakPolarHBondContact O-CB 3.35Å; A286-F313 PolarHBondContact O-N 3.23Å
287	L	98.5	Very high	95.8	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	120.4	175	-65.1	-172.2	0	0	0	108.2	F174 L184 L185 M186 L187 M196 I199 F285 F313 F315	F174-L287 HydrophobicContact CD2-CD2 4.19Å; F174-L287 HydrophobicContact CE1-CD1 4.13Å; F174-L287 HydrophobicContact CE1-CD2 4.02Å; F174-L287 HydrophobicContact CE2-CD2 3.52Å; F174-L287 HydrophobicContact CZ-CD1 4.11Å; F174-L287 HydrophobicContact CZ-CD2 3.42Å; F174-L287 VanDerWaalsContact CZ-CD2 3.42Å; F174-L287 HydrophobicContact CZ-CG 4.38Å; L184-L287 HydrophobicContact CD1-CD1 4.16Å; L184-L287 HydrophobicContact CD2-CD1 4.25Å; L184-L287 HydrophobicContact CD2-CG 4.32Å; L185-L287 PolarHBondContact O-N 3.34Å; M186-L287 CarbonylContact C-O 3.58Å; M186-L287 WeakPolarHBondContact CA-O 3.35Å; M186-L287 HydrophobicContact CE-CD1 4.22Å; M186-L287 HydrophobicContact CG-CB 4.23Å; M186-L287 HydrophobicContact CG-CD1 4.19Å; L187-L287 PolarHBondContact N-O 3.48Å; M196-L287 HydrophobicContact CE-CB 3.87Å; M196-L287 WeakPolarHBondContact CE-O 3.28Å; M196-L287 HydrophobicContact SD-CB 3.83Å; M196-L287 HydrophobicContact SD-CD1 4.38Å; I199-L287 HydrophobicContact CD1-CD1 3.82Å; I199-L287 HydrophobicContact CG2-CD1 4.36Å; F285-L287 HydrophobicContact CD1-CD2 3.84Å; F285-L287 HydrophobicContact CE1-CD2 3.66Å; L287-F313 HydrophobicContact CD2-CB 3.97Å; L287-F315 HydrophobicContact CB-CE2 4.05Å; L287-F315 HydrophobicContact CD2-CE2 4.19Å; L287-F315 HydrophobicContact CD2-CZ 4.5Å; L287-F315 HydrophobicContact CG-CE2 4.48Å
288	V	98.4	Very high	95.8	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	129.4	-173.4	-170.3	0	0	0	0	110.5	L187 F294 I298 L302 F313 L314 F315	L187-V288 HydrophobicContact CB-CG1 4.48Å; L187-V288 HydrophobicContact CB-CG2 4.4Å; L187-V288 HydrophobicContact CD1-CG2 4.37Å; L187-V288 WeakPolarHBondContact O-CA 3.25Å; V288-F294 HydrophobicContact CG1-CD1 4.19Å; V288-F294 HydrophobicContact CG1-CE1 3.84Å; V288-I298 HydrophobicContact CB-CG2 4.42Å; V288-I298 HydrophobicContact CG1-CB 3.85Å; V288-I298 HydrophobicContact CG1-CG1 4.29Å; V288-I298 HydrophobicContact CG1-CG2 3.69Å; V288-I298 HydrophobicContact CG2-CG2 3.78Å; V288-L302 HydrophobicContact CG2-CD1 3.79Å; V288-F313 PolarHBondContact N-O 3.07Å; V288-L314 HydrophobicContact CB-CD2 3.61Å; V288-L314 HydrophobicContact CG1-CD2 4.2Å; V288-L314 HydrophobicContact CG2-CD2 3.85Å; V288-F315 PolarHBondContact O-N 3.32Å
289	C	97.4	Very high	96	Very high	18 Å²	18	52 Å²	52	12%	0.122	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	134	172.8	-169.4	0	0	0	0	111.8	L187 A188 A189 G192 P195 M196 N295 F315	L187-C289 PolarHBondContact O-N 2.89Å; A188-C289 CarbonylContact C-O 3.6Å; A188-C289 WeakPolarHBondContact CA-O 3.34Å; A189-C289 PolarHBondContact N-O 2.86Å; G192-C289 WeakPolarHBondContact CA-SG 3.35Å; G192-C289 WeakPolarHBondContact O-CB 3.44Å; P195-C289 HydrophobicContact CG-CB 3.76Å; M196-C289 HydrophobicContact CE-CB 3.93Å; C289-N295 WeakPolarHBondContact CA-OD1 3.22Å; C289-F315 HydrophobicContact CB-CB 3.88Å; C289-F315 HydrophobicContact CB-CD2 4.1Å; C289-F315 HydrophobicContact CB-CG 4.35Å
290	G	95.4	Very high	96.2	Very high	27 Å²	27	54.6 Å²	54.6	28%	0.278	27%	0.27	S	S	.	.	S	Bend	trans	-178.6	-149.5	-180	0	0	0	0	0	111.2	N295	G290-N295 PolarHBondContact N-OD1 3.17Å
291	S	93.4	Very high	96.3	Very high	62 Å²	62	54.5 Å²	54.5	43%	0.434	27%	0.27	S	S	.	.			trans	-69.6	164.7	168.8	81	0	0	0	0	111	E293 F294 N295	S291-E293 WeakPolarHBondContact CB-OE2 3.47Å; S291-E293 PolarHBondContact O-N 2.88Å; S291-E293 PolarHBondContact OG-N 3.39Å; S291-E293 PolarHBondContact OG-OE2 2.91Å; S291-F294 WeakPolarHBondContact O-CB 3.29Å; S291-F294 PolarHBondContact O-N 2.78Å; S291-F294 VanDerWaalsContact O-N 3.07Å; S291-F294 PolarHBondContact OG-N 2.81Å; S291-N295 PolarHBondContact O-N 3.04Å
292	A	92.3	Very high	96.6	Very high	77 Å²	77	49.2 Å²	49.2	64%	0.636	25%	0.25	S	C	*	.	H	α-helix	trans	-56.5	-39.5	176.3	0	0	0	0	0	112.1	K296	A292-K296 WeakPolarHBondContact O-CB 3.36Å; A292-K296 PolarHBondContact O-N 3.03Å
293	E	94.9	Very high	96.8	Very high	125 Å²	125	46.5 Å²	46.5	58%	0.584	24%	0.244	S	C	*	.	H	α-helix	trans	-66.4	-43.3	175.6	-56.5	76.4	-166.7	0	0	111.5	S291 K296 D297	S291-E293 WeakPolarHBondContact CB-OE2 3.47Å; S291-E293 PolarHBondContact O-N 2.88Å; S291-E293 PolarHBondContact OG-N 3.39Å; S291-E293 PolarHBondContact OG-OE2 2.91Å; E293-K296 PolarHBondContact O-N 2.96Å; E293-D297 WeakPolarHBondContact O-CB 3.32Å; E293-D297 PolarHBondContact O-N 3.33Å
294	F	96.5	Very high	96.9	Very high	33 Å²	33	43.1 Å²	43.1	15%	0.145	24%	0.238	C	C	.	.	H	α-helix	trans	-59.4	-52.3	176	179.8	-96.2	0	0	0	110.8	A189 L268 V288 S291 K296 D297 I298	A189-F294 HydrophobicContact CB-CB 4.5Å; A189-F294 HydrophobicContact CB-CD1 3.74Å; A189-F294 HydrophobicContact CB-CD2 3.61Å; A189-F294 HydrophobicContact CB-CE1 3.71Å; A189-F294 HydrophobicContact CB-CE2 3.6Å; A189-F294 HydrophobicContact CB-CG 3.68Å; A189-F294 HydrophobicContact CB-CZ 3.63Å; L268-F294 HydrophobicContact CD2-CE2 4.27Å; L268-F294 HydrophobicContact CD2-CZ 4.13Å; V288-F294 HydrophobicContact CG1-CD1 4.19Å; V288-F294 HydrophobicContact CG1-CE1 3.84Å; S291-F294 WeakPolarHBondContact O-CB 3.29Å; S291-F294 PolarHBondContact O-N 2.78Å; S291-F294 VanDerWaalsContact O-N 3.07Å; S291-F294 PolarHBondContact OG-N 2.81Å; F294-K296 VanDerWaalsContact C-N 3.3Å; F294-K296 PolarHBondContact O-N 3.03Å; F294-D297 PolarHBondContact O-N 3.05Å; F294-I298 HydrophobicContact CD1-CG1 4.02Å; F294-I298 HydrophobicContact CD2-CD1 4.38Å; F294-I298 HydrophobicContact CD2-CG1 3.98Å; F294-I298 HydrophobicContact CE1-CG1 3.73Å; F294-I298 HydrophobicContact CE2-CD1 3.81Å; F294-I298 HydrophobicContact CE2-CG1 3.67Å; F294-I298 HydrophobicContact CG-CG1 4.15Å; F294-I298 HydrophobicContact CZ-CD1 3.96Å; F294-I298 HydrophobicContact CZ-CG1 3.55Å; F294-I298 WeakPolarHBondContact O-CB 3.31Å; F294-I298 VanDerWaalsContact O-CG1 3.24Å; F294-I298 WeakPolarHBondContact O-CG1 3.28Å; F294-I298 PolarHBondContact O-N 3.39Å
295	N	96.7	Very high	96.8	Very high	21 Å²	21	44 Å²	44	11%	0.112	25%	0.246	C	C	.	.	H	α-helix	trans	-56	-45.8	178.5	-76.1	4	0	0	0	111.3	C289 G290 S291 A299 F315	C289-N295 WeakPolarHBondContact CA-OD1 3.22Å; G290-N295 PolarHBondContact N-OD1 3.17Å; S291-N295 PolarHBondContact O-N 3.04Å; N295-A299 VanDerWaalsContact O-CB 3.26Å; N295-A299 WeakPolarHBondContact O-CB 3.49Å; N295-A299 PolarHBondContact O-N 2.87Å; N295-F315 PolarHBondContact ND2-O 3.03Å
296	K	96.4	Very high	96.6	Very high	147 Å²	147	45.5 Å²	45.5	64%	0.639	27%	0.269	S	S	*	.	H	α-helix	trans	-63.6	-42	179.1	-175.9	-179.8	178.9	178.5	0	113	A292 E293 F294 R300	A292-K296 WeakPolarHBondContact O-CB 3.36Å; A292-K296 PolarHBondContact O-N 3.03Å; E293-K296 PolarHBondContact O-N 2.96Å; F294-K296 VanDerWaalsContact C-N 3.3Å; F294-K296 PolarHBondContact O-N 3.03Å; K296-R300 PolarHBondContact O-N 2.62Å
297	D	97	Very high	96.5	Very high	73 Å²	73	45.9 Å²	45.9	39%	0.39	27%	0.271	S	S	.	.	H	α-helix	trans	-73	-41.6	-178.9	-76.1	-20.9	0	0	0	111.9	E293 F294 R300 C301	E293-D297 WeakPolarHBondContact O-CB 3.32Å; E293-D297 PolarHBondContact O-N 3.33Å; F294-D297 PolarHBondContact O-N 3.05Å; D297-R300 PolarHBondContact O-N 2.61Å; D297-R300 IonicContact OD1-CZ 3.52Å; D297-R300 VanDerWaalsContact OD1-CZ 3.28Å; D297-R300 IonicContact OD1-NH1 2.73Å; D297-R300 PolarHBondContact OD1-NH1 3.43Å; D297-R300 IonicContact OD1-NH2 3.45Å; D297-R300 PolarHBondContact OD1-NH2 2.83Å; D297-C301 PolarHBondContact O-N 3.2Å; D297-C301 PolarHBondContact O-SG 3.47Å
298	I	97.9	Very high	96.5	Very high	3 Å²	3	49 Å²	49	2%	0.015	29%	0.29	C	S	.	.	H	α-helix	trans	-65.7	-43.3	176.5	-62	-56.3	0	0	0	111	L187 L268 I273 V288 F294 R300 C301 L302	L187-I298 HydrophobicContact CB-CG2 4.5Å; L187-I298 HydrophobicContact CD1-CG2 3.44Å; L187-I298 VanDerWaalsContact CD1-CG2 3.44Å; L268-I298 HydrophobicContact CB-CD1 4.36Å; L268-I298 HydrophobicContact CD2-CD1 3.55Å; L268-I298 HydrophobicContact CG-CD1 3.84Å; I273-I298 HydrophobicContact CD1-CD1 3.45Å; I273-I298 VanDerWaalsContact CD1-CD1 3.45Å; I273-I298 HydrophobicContact CG1-CD1 4.45Å; V288-I298 HydrophobicContact CB-CG2 4.42Å; V288-I298 HydrophobicContact CG1-CB 3.85Å; V288-I298 HydrophobicContact CG1-CG1 4.29Å; V288-I298 HydrophobicContact CG1-CG2 3.69Å; V288-I298 HydrophobicContact CG2-CG2 3.78Å; F294-I298 HydrophobicContact CD1-CG1 4.02Å; F294-I298 HydrophobicContact CD2-CD1 4.38Å; F294-I298 HydrophobicContact CD2-CG1 3.98Å; F294-I298 HydrophobicContact CE1-CG1 3.73Å; F294-I298 HydrophobicContact CE2-CD1 3.81Å; F294-I298 HydrophobicContact CE2-CG1 3.67Å; F294-I298 HydrophobicContact CG-CG1 4.15Å; F294-I298 HydrophobicContact CZ-CD1 3.96Å; F294-I298 HydrophobicContact CZ-CG1 3.55Å; F294-I298 WeakPolarHBondContact O-CB 3.31Å; F294-I298 VanDerWaalsContact O-CG1 3.24Å; F294-I298 WeakPolarHBondContact O-CG1 3.28Å; F294-I298 PolarHBondContact O-N 3.39Å; I298-R300 VanDerWaalsContact C-N 3.31Å; I298-R300 PolarHBondContact O-N 3.26Å; I298-C301 CarbonylContact O-C 3.52Å; I298-C301 WeakPolarHBondContact O-CA 3.42Å; I298-C301 WeakPolarHBondContact O-CB 3.37Å; I298-C301 PolarHBondContact O-N 2.78Å; I298-L302 HydrophobicContact CG2-CD1 3.91Å; I298-L302 HydrophobicContact CG2-CG 4.07Å; I298-L302 VanDerWaalsContact O-CG 3.32Å; I298-L302 WeakPolarHBondContact O-CG 3.29Å; I298-L302 PolarHBondContact O-N 3.44Å
299	A	97.6	Very high	96.3	Very high	10 Å²	10	55.9 Å²	55.9	8%	0.083	32%	0.322	C	S	.	.	H	α-helix	trans	-54.7	-47.2	176	0	0	0	0	0	111.8	N295 C301 L302 L303 Y312 L314	N295-A299 VanDerWaalsContact O-CB 3.26Å; N295-A299 WeakPolarHBondContact O-CB 3.49Å; N295-A299 PolarHBondContact O-N 2.87Å; A299-C301 VanDerWaalsContact C-N 3.31Å; A299-C301 PolarHBondContact O-N 2.73Å; A299-L302 PolarHBondContact O-N 2.83Å; A299-L303 WeakPolarHBondContact O-CG 3.42Å; A299-L303 PolarHBondContact O-N 3.22Å; A299-L303 VanDerWaalsContact O-N 3.15Å; A299-Y312 HydrophobicContact CB-CE2 3.98Å; A299-L314 HydrophobicContact CB-CD1 4.04Å; A299-L314 HydrophobicContact CB-CD2 4.25Å
300	R	97.7	Very high	96.2	Very high	119 Å²	119	61 Å²	61	45%	0.449	35%	0.348	S	S	.	.	H	α-helix	trans	-58.5	-44.3	174.4	-169.4	-170.3	-47.1	116.5	17.9	111.6	K296 D297 I298 L303 C304	K296-R300 PolarHBondContact O-N 2.62Å; D297-R300 PolarHBondContact O-N 2.61Å; D297-R300 IonicContact OD1-CZ 3.52Å; D297-R300 VanDerWaalsContact OD1-CZ 3.28Å; D297-R300 IonicContact OD1-NH1 2.73Å; D297-R300 PolarHBondContact OD1-NH1 3.43Å; D297-R300 IonicContact OD1-NH2 3.45Å; D297-R300 PolarHBondContact OD1-NH2 2.83Å; I298-R300 VanDerWaalsContact C-N 3.31Å; I298-R300 PolarHBondContact O-N 3.26Å; R300-L303 PolarHBondContact O-N 2.7Å; R300-C304 PolarHBondContact O-N 2.97Å; R300-C304 VanDerWaalsContact O-N 3.08Å; R300-C304 PolarHBondContact O-SG 2.84Å
301	C	97.6	Very high	96.3	Very high	14 Å²	14	60.4 Å²	60.4	10%	0.095	34%	0.34	C	S	.	.	H	α-helix	trans	-67.7	-36.2	-178.5	-66.4	0	0	0	0	113.3	Q270 I273 D297 I298 A299 C304 A305	Q270-C301 PolarHBondContact NE2-O 3.37Å; Q270-C301 VanDerWaalsContact OE1-CA 3.27Å; I273-C301 HydrophobicContact CB-CB 4.28Å; I273-C301 HydrophobicContact CD1-CB 3.24Å; I273-C301 HydrophobicContact CG1-CB 4.35Å; I273-C301 HydrophobicContact CG2-CB 4.16Å; D297-C301 PolarHBondContact O-N 3.2Å; D297-C301 PolarHBondContact O-SG 3.47Å; I298-C301 CarbonylContact O-C 3.52Å; I298-C301 WeakPolarHBondContact O-CA 3.42Å; I298-C301 WeakPolarHBondContact O-CB 3.37Å; I298-C301 PolarHBondContact O-N 2.78Å; A299-C301 VanDerWaalsContact C-N 3.31Å; A299-C301 PolarHBondContact O-N 2.73Å; C301-C304 CarbonylContact O-C 3.51Å; C301-C304 PolarHBondContact O-N 3.27Å; C301-A305 WeakPolarHBondContact O-CB 3.45Å; C301-A305 PolarHBondContact O-N 3.16Å
302	L	97.9	Very high	96.5	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-63.7	-43.6	175.7	-68.6	170.1	0	0	0	110.9	L185 L187 I273 V277 A286 V288 I298 A299 C304 A305 G306 L307 Y312	L185-L302 HydrophobicContact CD2-CD2 4.47Å; L187-L302 HydrophobicContact CD1-CD2 4.03Å; I273-L302 HydrophobicContact CG2-CD2 3.86Å; I273-L302 HydrophobicContact CG2-CG 4.46Å; V277-L302 HydrophobicContact CG2-CD2 4.27Å; A286-L302 HydrophobicContact CB-CD1 3.84Å; A286-L302 HydrophobicContact CB-CD2 4.07Å; V288-L302 HydrophobicContact CG2-CD1 3.79Å; I298-L302 HydrophobicContact CG2-CD1 3.91Å; I298-L302 HydrophobicContact CG2-CG 4.07Å; I298-L302 VanDerWaalsContact O-CG 3.32Å; I298-L302 WeakPolarHBondContact O-CG 3.29Å; I298-L302 PolarHBondContact O-N 3.44Å; A299-L302 PolarHBondContact O-N 2.83Å; L302-C304 PolarHBondContact O-N 3.44Å; L302-A305 CarbonylContact O-C 3.56Å; L302-A305 WeakPolarHBondContact O-CA 3.35Å; L302-A305 WeakPolarHBondContact O-CB 3.49Å; L302-A305 PolarHBondContact O-N 3.25Å; L302-G306 PolarHBondContact O-N 3.43Å; L302-L307 HydrophobicContact CB-CB 4.35Å; L302-L307 HydrophobicContact CB-CD1 3.91Å; L302-L307 HydrophobicContact CD2-CD1 3.44Å; L302-L307 VanDerWaalsContact CD2-CD1 3.44Å; L302-L307 HydrophobicContact CG-CD1 4.2Å; L302-L307 WeakPolarHBondContact O-CB 3.35Å; L302-L307 PolarHBondContact O-N 3.44Å; L302-L307 VanDerWaalsContact O-N 3.1Å; L302-Y312 HydrophobicContact CD1-CD1 4.35Å; L302-Y312 HydrophobicContact CD1-CG 4.05Å
303	L	97.3	Very high	96.7	Very high	72 Å²	72	58.1 Å²	58.1	38%	0.377	31%	0.307	S	S	.	.	H	α-helix	trans	-59.5	-46.1	173.9	-66.5	174.7	0	0	0	111.5	A299 R300 A305 G306 L307 E309 Y312	A299-L303 WeakPolarHBondContact O-CG 3.42Å; A299-L303 PolarHBondContact O-N 3.22Å; A299-L303 VanDerWaalsContact O-N 3.15Å; R300-L303 PolarHBondContact O-N 2.7Å; L303-A305 PolarHBondContact O-N 3.16Å; L303-G306 PolarHBondContact O-N 3.4Å; L303-L307 WeakPolarHBondContact CD2-O 3.31Å; L303-E309 HydrophobicContact CD2-CG 4.04Å; L303-Y312 HydrophobicContact CD2-CE1 4.05Å; L303-Y312 HydrophobicContact CG-CE1 4.37Å
304	C	96.7	Very high	96.8	Very high	72 Å²	72	55.2 Å²	55.2	49%	0.486	30%	0.295	S	S	.	.	H	α-helix	trans	-66.8	-17.7	175.1	-70.2	0	0	0	0	114	K274 R300 C301 L302 G306	K274-C304 WeakPolarHBondContact CE-O 3.42Å; R300-C304 PolarHBondContact O-N 2.97Å; R300-C304 VanDerWaalsContact O-N 3.08Å; R300-C304 PolarHBondContact O-SG 2.84Å; C301-C304 CarbonylContact O-C 3.51Å; C301-C304 PolarHBondContact O-N 3.27Å; L302-C304 PolarHBondContact O-N 3.44Å; C304-G306 VanDerWaalsContact C-N 3.33Å
305	A	96.3	Very high	96.6	Very high	25 Å²	25	56.6 Å²	56.6	21%	0.207	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	2	172.9	0	0	0	0	0	113.1	I273 K274 V277 C301 L302 L303	I273-A305 HydrophobicContact CG2-CB 4.36Å; K274-A305 HydrophobicContact CG-CB 3.75Å; V277-A305 HydrophobicContact CB-CB 4.42Å; V277-A305 HydrophobicContact CG2-CB 4.18Å; C301-A305 WeakPolarHBondContact O-CB 3.45Å; C301-A305 PolarHBondContact O-N 3.16Å; L302-A305 CarbonylContact O-C 3.56Å; L302-A305 WeakPolarHBondContact O-CA 3.35Å; L302-A305 WeakPolarHBondContact O-CB 3.49Å; L302-A305 PolarHBondContact O-N 3.25Å; L303-A305 PolarHBondContact O-N 3.16Å
306	G	95.1	Very high	96.6	Very high	58 Å²	58	58.4 Å²	58.4	60%	0.598	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	92	10.2	175.5	0	0	0	0	0	114.9	L302 L303 C304	L302-G306 PolarHBondContact O-N 3.43Å; L303-G306 PolarHBondContact O-N 3.4Å; C304-G306 VanDerWaalsContact C-N 3.33Å
307	L	96.5	Very high	96.6	Very high	8 Å²	8	53.7 Å²	53.7	4%	0.042	29%	0.294	C	S	.	.			trans	-79.5	156.2	166.7	-70.4	155.7	0	0	0	110.1	V277 P284 L302 L303	V277-L307 HydrophobicContact CG1-CD1 4.39Å; V277-L307 HydrophobicContact CG2-CD1 3.82Å; P284-L307 HydrophobicContact CG-CD2 4.41Å; P284-L307 WeakPolarHBondContact O-CD2 3.49Å; L302-L307 HydrophobicContact CB-CB 4.35Å; L302-L307 HydrophobicContact CB-CD1 3.91Å; L302-L307 HydrophobicContact CD2-CD1 3.44Å; L302-L307 VanDerWaalsContact CD2-CD1 3.44Å; L302-L307 HydrophobicContact CG-CD1 4.2Å; L302-L307 WeakPolarHBondContact O-CB 3.35Å; L302-L307 PolarHBondContact O-N 3.44Å; L302-L307 VanDerWaalsContact O-N 3.1Å; L303-L307 WeakPolarHBondContact CD2-O 3.31Å
308	T	96.6	Very high	96.6	Very high	64 Å²	64	52.7 Å²	52.7	39%	0.393	29%	0.288	S	S	.	.			trans	-106.5	164.7	177	43.8	0	0	0	0	110.1	D310 S311 Y312	T308-D310 WeakPolarHBondContact CB-OD1 3.32Å; T308-D310 PolarHBondContact O-N 3.31Å; T308-D310 PolarHBondContact OG1-OD1 3.13Å; T308-S311 WeakPolarHBondContact O-CB 3.31Å; T308-S311 PolarHBondContact O-N 3.22Å; T308-S311 PolarHBondContact OG1-OG 3.12Å; T308-Y312 WeakPolarHBondContact O-CD1 3.42Å
309	E	94.9	Very high	96.5	Very high	146 Å²	146	55.6 Å²	55.6	68%	0.682	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-61.8	-24.9	-177.1	-66.6	-176.1	169.5	0	0	113.7	L303 S311	L303-E309 HydrophobicContact CD2-CG 4.04Å; E309-S311 VanDerWaalsContact C-N 3.3Å
310	D	96.1	Very high	96.4	Very high	124 Å²	124	58.4 Å²	58.4	66%	0.663	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-84.1	-0.5	174	65.9	-22.1	0	0	0	113.7	F285 T308	F285-D310 VanDerWaalsContact CE2-O 3.31Å; F285-D310 WeakPolarHBondContact CE2-O 3.24Å; T308-D310 WeakPolarHBondContact CB-OD1 3.32Å; T308-D310 PolarHBondContact O-N 3.31Å; T308-D310 PolarHBondContact OG1-OD1 3.13Å
311	S	96.9	Very high	96.4	Very high	15 Å²	15	54.4 Å²	54.4	11%	0.105	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-107.1	11.1	-178.6	-59.3	0	0	0	0	113.3	F285 A286 T308 E309	F285-S311 WeakPolarHBondContact CA-O 3.36Å; A286-S311 PolarHBondContact N-O 3.05Å; T308-S311 WeakPolarHBondContact O-CB 3.31Å; T308-S311 PolarHBondContact O-N 3.22Å; T308-S311 PolarHBondContact OG1-OG 3.12Å; E309-S311 VanDerWaalsContact C-N 3.3Å
312	Y	97.8	Very high	96.3	Very high	36 Å²	36	57.3 Å²	57.3	14%	0.141	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	157	172.1	66.6	-93.7	0	0	0	112.8	A286 A299 L302 L303 T308 L314	A286-Y312 CarbonylContact O-C 3.53Å; A286-Y312 WeakPolarHBondContact O-CA 3.3Å; A286-Y312 WeakPolarHBondContact O-CB 3.35Å; A299-Y312 HydrophobicContact CB-CE2 3.98Å; L302-Y312 HydrophobicContact CD1-CD1 4.35Å; L302-Y312 HydrophobicContact CD1-CG 4.05Å; L303-Y312 HydrophobicContact CD2-CE1 4.05Å; L303-Y312 HydrophobicContact CG-CE1 4.37Å; T308-Y312 WeakPolarHBondContact O-CD1 3.42Å; Y312-L314 HydrophobicContact CD2-CD2 3.65Å; Y312-L314 HydrophobicContact CD2-CG 3.96Å; Y312-L314 HydrophobicContact CE2-CD1 4.13Å; Y312-L314 HydrophobicContact CE2-CD2 3.82Å; Y312-L314 HydrophobicContact CE2-CG 3.86Å
313	F	97.3	Very high	96.1	Very high	55 Å²	55	61.7 Å²	61.7	24%	0.241	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	134.8	173	-172.9	-90.9	0	0	0	110.1	F174 F285 A286 L287 V288 F315	F174-F313 HydrophobicContact CB-CD1 3.85Å; F174-F313 HydrophobicContact CB-CD2 4.31Å; F174-F313 HydrophobicContact CB-CE1 3.61Å; F174-F313 HydrophobicContact CB-CE2 4.07Å; F174-F313 HydrophobicContact CB-CG 4.21Å; F174-F313 HydrophobicContact CB-CZ 3.72Å; F174-F313 HydrophobicContact CD2-CB 3.82Å; F174-F313 AromaticContact CD2-CD1 3.9Å; F174-F313 HydrophobicContact CD2-CD1 3.9Å; F174-F313 AromaticContact CD2-CD2 3.87Å; F174-F313 HydrophobicContact CD2-CD2 3.87Å; F174-F313 HydrophobicContact CD2-CE1 4.48Å; F174-F313 HydrophobicContact CD2-CE2 4.44Å; F174-F313 AromaticContact CD2-CG 3.57Å; F174-F313 HydrophobicContact CD2-CG 3.57Å; F174-F313 HydrophobicContact CE2-CB 4.13Å; F174-F313 HydrophobicContact CE2-CG 4.36Å; F174-F313 HydrophobicContact CG-CD1 4.06Å; F174-F313 HydrophobicContact CG-CE1 4.32Å; F174-F313 HydrophobicContact CG-CG 4.19Å; F285-F313 HydrophobicContact CE1-CB 3.82Å; F285-F313 HydrophobicContact CZ-CB 4.08Å; A286-F313 PolarHBondContact O-N 3.23Å; L287-F313 HydrophobicContact CD2-CB 3.97Å; V288-F313 PolarHBondContact N-O 3.07Å; F313-F315 HydrophobicContact CD1-CD1 4.13Å; F313-F315 AromaticContact CD1-CD2 3.95Å; F313-F315 HydrophobicContact CD1-CD2 3.95Å; F313-F315 HydrophobicContact CD1-CE1 4.09Å; F313-F315 AromaticContact CD1-CE2 3.91Å; F313-F315 HydrophobicContact CD1-CE2 3.91Å; F313-F315 HydrophobicContact CD1-CG 4.06Å; F313-F315 AromaticContact CD1-CZ 3.98Å; F313-F315 HydrophobicContact CD1-CZ 3.98Å; F313-F315 HydrophobicContact CE1-CB 4.49Å; F313-F315 AromaticContact CE1-CD1 3.71Å; F313-F315 HydrophobicContact CE1-CD1 3.71Å; F313-F315 HydrophobicContact CE1-CD2 4.28Å; F313-F315 AromaticContact CE1-CE1 3.89Å; F313-F315 HydrophobicContact CE1-CE1 3.89Å; F313-F315 HydrophobicContact CE1-CE2 4.45Å; F313-F315 AromaticContact CE1-CG 3.91Å; F313-F315 HydrophobicContact CE1-CG 3.91Å; F313-F315 HydrophobicContact CE1-CZ 4.27Å
314	L	96	Very high	96	Very high	64 Å²	64	60.8 Å²	60.8	34%	0.335	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	119.8	174.4	-49.6	-177.9	0	0	0	108.3	V288 A299 Y312	V288-L314 HydrophobicContact CB-CD2 3.61Å; V288-L314 HydrophobicContact CG1-CD2 4.2Å; V288-L314 HydrophobicContact CG2-CD2 3.85Å; A299-L314 HydrophobicContact CB-CD1 4.04Å; A299-L314 HydrophobicContact CB-CD2 4.25Å; Y312-L314 HydrophobicContact CD2-CD2 3.65Å; Y312-L314 HydrophobicContact CD2-CG 3.96Å; Y312-L314 HydrophobicContact CE2-CD1 4.13Å; Y312-L314 HydrophobicContact CE2-CD2 3.82Å; Y312-L314 HydrophobicContact CE2-CG 3.86Å
315	F	92.3	Very high	96	Very high	63 Å²	63	59.8 Å²	59.8	28%	0.276	34%	0.335	S	S	.	.			trans	-79.7	0	173.3	-66.9	-89.3	0	0	0	112.1	F174 P195 M196 I199 L287 V288 C289 N295 F313	F174-F315 HydrophobicContact CB-CE1 3.92Å; F174-F315 HydrophobicContact CB-CZ 4.2Å; F174-F315 HydrophobicContact CD1-CE1 4.23Å; F174-F315 AromaticContact CD1-CZ 3.84Å; F174-F315 HydrophobicContact CD1-CZ 3.84Å; F174-F315 HydrophobicContact CE1-CZ 4.47Å; F174-F315 HydrophobicContact CG-CE1 4.24Å; F174-F315 HydrophobicContact CG-CZ 4.01Å; P195-F315 HydrophobicContact CB-CD1 3.79Å; P195-F315 HydrophobicContact CB-CD2 4.22Å; P195-F315 HydrophobicContact CB-CE1 3.82Å; P195-F315 HydrophobicContact CB-CE2 4.24Å; P195-F315 HydrophobicContact CB-CG 4.01Å; P195-F315 HydrophobicContact CB-CZ 4.05Å; P195-F315 HydrophobicContact CG-CB 4.39Å; P195-F315 HydrophobicContact CG-CD1 4.31Å; P195-F315 HydrophobicContact CG-CD2 4.15Å; P195-F315 HydrophobicContact CG-CG 4.03Å; M196-F315 HydrophobicContact CE-CD2 4.16Å; M196-F315 HydrophobicContact CE-CE2 4.1Å; M196-F315 HydrophobicContact SD-CE2 4.46Å; I199-F315 HydrophobicContact CD1-CZ 3.84Å; L287-F315 HydrophobicContact CB-CE2 4.05Å; L287-F315 HydrophobicContact CD2-CE2 4.19Å; L287-F315 HydrophobicContact CD2-CZ 4.5Å; L287-F315 HydrophobicContact CG-CE2 4.48Å; V288-F315 PolarHBondContact O-N 3.32Å; C289-F315 HydrophobicContact CB-CB 3.88Å; C289-F315 HydrophobicContact CB-CD2 4.1Å; C289-F315 HydrophobicContact CB-CG 4.35Å; N295-F315 PolarHBondContact ND2-O 3.03Å; F313-F315 HydrophobicContact CD1-CD1 4.13Å; F313-F315 AromaticContact CD1-CD2 3.95Å; F313-F315 HydrophobicContact CD1-CD2 3.95Å; F313-F315 HydrophobicContact CD1-CE1 4.09Å; F313-F315 AromaticContact CD1-CE2 3.91Å; F313-F315 HydrophobicContact CD1-CE2 3.91Å; F313-F315 HydrophobicContact CD1-CG 4.06Å; F313-F315 AromaticContact CD1-CZ 3.98Å; F313-F315 HydrophobicContact CD1-CZ 3.98Å; F313-F315 HydrophobicContact CE1-CB 4.49Å; F313-F315 AromaticContact CE1-CD1 3.71Å; F313-F315 HydrophobicContact CE1-CD1 3.71Å; F313-F315 HydrophobicContact CE1-CD2 4.28Å; F313-F315 AromaticContact CE1-CE1 3.89Å; F313-F315 HydrophobicContact CE1-CE1 3.89Å; F313-F315 HydrophobicContact CE1-CE2 4.45Å; F313-F315 AromaticContact CE1-CG 3.91Å; F313-F315 HydrophobicContact CE1-CG 3.91Å; F313-F315 HydrophobicContact CE1-CZ 4.27Å

Retrieved 315 of 315 residues in 190.5 ms (Link to these results)

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