A0A5K4FCY4_SCHMA Loading...

Tudor domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FCY4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 120 aa.

						>A0A5K4FCY4_SCHMA|A0A5K4FCY4
MSDDPQLDLLNHKLQLQQVEAALELDPENEELLQLKRDLEEVIKLSLELLGRTSDTPEVSWNVGDQCMAMCSRDKLYYRATILEFLGDVSCVVNFDMYDTTDVCQVCYCYIFTSLYLSTW
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.9	Very low	72.6	Confident	223 Å²	223	99.8 Å²	99.8	100%	1.099	54%	0.536	S	S	*	.				0	109.1	0	-70.7	173.3	163.9	0	0	103.6	D3	M1-D3 PolarHBondContact O-N 3.43Å; M1-D3 VanDerWaalsContact O-N 3.15Å
2	S	46.3	Very low	73.9	Confident	89 Å²	89	95.5 Å²	95.5	62%	0.622	51%	0.51	S	S	*	.			trans	-77.1	102.3	-173.2	-58.4	0	0	0	0	107.3	D4	S2-D4 PolarHBondContact O-N 3.11Å
3	D	63.4	Low	75.2	Confident	152 Å²	152	95.2 Å²	95.2	81%	0.813	50%	0.501	S	S	*	.			trans	-71.9	43.8	176.6	-58.8	-53.8	0	0	0	111.4	M1 P5	M1-D3 PolarHBondContact O-N 3.43Å; M1-D3 VanDerWaalsContact O-N 3.15Å; D3-P5 WeakPolarHBondContact O-CD 3.44Å
4	D	70.7	Confident	76.4	Confident	75 Å²	75	94.6 Å²	94.6	40%	0.401	50%	0.497	S	S	.	.			trans	-100.5	98.6	178.8	-165.8	-49.4	0	0	0	108.8	S2 Q6 L7 D8	S2-D4 PolarHBondContact O-N 3.11Å; D4-Q6 PolarHBondContact O-N 2.97Å; D4-Q6 VanDerWaalsContact O-N 3.1Å; D4-Q6 WeakPolarHBondContact OD1-CA 3.42Å; D4-Q6 WeakPolarHBondContact OD1-CB 3.46Å; D4-Q6 PolarHBondContact OD1-N 3.47Å; D4-L7 HydrophobicContact CB-CB 3.87Å; D4-L7 WeakPolarHBondContact O-CB 3.46Å; D4-L7 PolarHBondContact O-N 2.95Å; D4-L7 PolarHBondContact OD1-N 3.22Å; D4-L7 VanDerWaalsContact OD1-N 3.12Å; D4-D8 PolarHBondContact O-N 3.04Å; D4-D8 VanDerWaalsContact O-N 3.09Å
5	P	73	Confident	77.3	Confident	70 Å²	70	94.5 Å²	94.5	46%	0.455	49%	0.494	S	S	.	.	H	α-helix	trans	-61.9	-21.1	-178.1	24.7	-34.1	0	0	0	112.4	D3 L9 L50	D3-P5 WeakPolarHBondContact O-CD 3.44Å; P5-L9 WeakPolarHBondContact O-CB 3.38Å; P5-L9 PolarHBondContact O-N 3.49Å; P5-L50 HydrophobicContact CB-CD2 4.4Å; P5-L50 HydrophobicContact CB-CG 4.43Å; P5-L50 HydrophobicContact CG-CD2 4.33Å
6	Q	77.3	Confident	78.3	Confident	133 Å²	133	90.2 Å²	90.2	62%	0.621	47%	0.471	S	S	*	.	H	α-helix	trans	-75.9	-38.4	175.4	-49.6	-177.1	3.9	0	0	110.9	D4 L9 L10 L50	D4-Q6 PolarHBondContact O-N 2.97Å; D4-Q6 VanDerWaalsContact O-N 3.1Å; D4-Q6 WeakPolarHBondContact OD1-CA 3.42Å; D4-Q6 WeakPolarHBondContact OD1-CB 3.46Å; D4-Q6 PolarHBondContact OD1-N 3.47Å; Q6-L9 PolarHBondContact O-N 3.21Å; Q6-L10 WeakPolarHBondContact O-CB 3.47Å; Q6-L10 PolarHBondContact O-N 3.2Å; Q6-L50 HydrophobicContact CG-CD2 3.95Å
7	L	81.1	Confident	79.1	Confident	75 Å²	75	92.4 Å²	92.4	39%	0.393	48%	0.478	S	S	.	.	H	α-helix	trans	-64.4	-42.9	174.5	-176.2	62.8	0	0	0	111.1	D4 L10 N11	D4-L7 HydrophobicContact CB-CB 3.87Å; D4-L7 WeakPolarHBondContact O-CB 3.46Å; D4-L7 PolarHBondContact O-N 2.95Å; D4-L7 PolarHBondContact OD1-N 3.22Å; D4-L7 VanDerWaalsContact OD1-N 3.12Å; L7-L10 PolarHBondContact O-N 2.99Å; L7-N11 PolarHBondContact O-N 3.16Å; L7-N11 PolarHBondContact O-ND2 2.98Å
8	D	83	Confident	79.8	Confident	80 Å²	80	94.1 Å²	94.1	43%	0.428	48%	0.484	S	S	.	.	H	α-helix	trans	-61	-48.3	174.7	-73.2	-32.3	0	0	0	110.8	D4 L10 N11 H12	D4-D8 PolarHBondContact O-N 3.04Å; D4-D8 VanDerWaalsContact O-N 3.09Å; D8-L10 VanDerWaalsContact C-N 3.28Å; D8-L10 PolarHBondContact O-N 3.44Å; D8-N11 PolarHBondContact O-N 3Å; D8-N11 VanDerWaalsContact O-N 3.13Å; D8-H12 PolarHBondContact O-N 3.39Å; D8-H12 PolarHBondContact O-ND1 3.2Å
9	L	86.3	Confident	80.4	Confident	17 Å²	17	89.7 Å²	89.7	9%	0.089	46%	0.462	C	S	.	.	H	α-helix	trans	-57	-41.2	175.7	177.3	64.1	0	0	0	112.4	P5 Q6 H12 K13 I43 L47 L50	P5-L9 WeakPolarHBondContact O-CB 3.38Å; P5-L9 PolarHBondContact O-N 3.49Å; Q6-L9 PolarHBondContact O-N 3.21Å; L9-H12 PolarHBondContact O-N 2.87Å; L9-K13 WeakPolarHBondContact O-CG 3.42Å; L9-K13 PolarHBondContact O-N 3.17Å; L9-I43 HydrophobicContact CD1-CB 4.36Å; L9-I43 HydrophobicContact CD1-CG1 4.32Å; L9-I43 HydrophobicContact CD1-CG2 3.95Å; L9-L47 HydrophobicContact CD1-CG 4.27Å; L9-L47 HydrophobicContact CD2-CD2 3.68Å; L9-L47 HydrophobicContact CD2-CG 4.3Å; L9-L50 HydrophobicContact CB-CD1 4.13Å; L9-L50 HydrophobicContact CD2-CD1 3.6Å; L9-L50 HydrophobicContact CG-CD1 4.43Å
10	L	86.8	Confident	81	Confident	110 Å²	110	88.8 Å²	88.8	58%	0.576	46%	0.455	S	S	*	.	H	α-helix	trans	-62.9	-42.7	177.1	-177.7	65	0	0	0	111.5	Q6 L7 D8 K13 L14	Q6-L10 WeakPolarHBondContact O-CB 3.47Å; Q6-L10 PolarHBondContact O-N 3.2Å; L7-L10 PolarHBondContact O-N 2.99Å; D8-L10 VanDerWaalsContact C-N 3.28Å; D8-L10 PolarHBondContact O-N 3.44Å; L10-K13 PolarHBondContact O-N 3.34Å; L10-L14 PolarHBondContact O-N 3.12Å
11	N	88.9	Confident	81.6	Confident	74 Å²	74	87 Å²	87	40%	0.396	45%	0.453	S	S	.	.	H	α-helix	trans	-62.9	-44.7	176.8	-78.4	-59.3	0	0	0	112	L7 D8 K13 L14 Q15	L7-N11 PolarHBondContact O-N 3.16Å; L7-N11 PolarHBondContact O-ND2 2.98Å; D8-N11 PolarHBondContact O-N 3Å; D8-N11 VanDerWaalsContact O-N 3.13Å; N11-K13 VanDerWaalsContact C-N 3.33Å; N11-K13 PolarHBondContact O-N 2.87Å; N11-L14 WeakPolarHBondContact O-CB 3.48Å; N11-L14 PolarHBondContact O-N 3.17Å; N11-Q15 WeakPolarHBondContact O-CG 3.18Å; N11-Q15 PolarHBondContact O-N 2.98Å
12	H	88.5	Confident	84	Confident	48 Å²	48	78 Å²	78	22%	0.222	41%	0.414	C	S	.	.	H	α-helix	trans	-61.9	-40.7	177.3	-64.5	107	0	0	0	112	D8 L9 L14 Q15 L16 I43	D8-H12 PolarHBondContact O-N 3.39Å; D8-H12 PolarHBondContact O-ND1 3.2Å; L9-H12 PolarHBondContact O-N 2.87Å; H12-L14 VanDerWaalsContact C-N 3.35Å; H12-L14 PolarHBondContact O-N 3.28Å; H12-Q15 PolarHBondContact O-N 2.93Å; H12-L16 PolarHBondContact O-N 3.27Å; H12-I43 HydrophobicContact CB-CD1 4.25Å; H12-I43 HydrophobicContact CB-CG1 3.72Å
13	K	90.1	Very high	86.1	Confident	92 Å²	92	74.6 Å²	74.6	40%	0.4	39%	0.389	S	S	.	.	H	α-helix	trans	-62.3	-42.2	174.5	-76.4	-179.7	176.4	-176.6	0	112.2	L9 L10 N11 Q15 L16 Q17 I43	L9-K13 WeakPolarHBondContact O-CG 3.42Å; L9-K13 PolarHBondContact O-N 3.17Å; L10-K13 PolarHBondContact O-N 3.34Å; N11-K13 VanDerWaalsContact C-N 3.33Å; N11-K13 PolarHBondContact O-N 2.87Å; K13-Q15 VanDerWaalsContact C-N 3.34Å; K13-L16 WeakPolarHBondContact O-CB 3.31Å; K13-L16 PolarHBondContact O-N 3.05Å; K13-Q17 WeakPolarHBondContact O-CG 3.45Å; K13-Q17 PolarHBondContact O-N 3.13Å; K13-I43 HydrophobicContact CG-CD1 3.94Å; K13-I43 HydrophobicContact CG-CG1 4.34Å
14	L	92.5	Very high	87.5	Confident	86 Å²	86	75.4 Å²	75.4	45%	0.45	39%	0.388	S	S	.	.	H	α-helix	trans	-62.2	-43.1	177	179.3	63.7	0	0	0	111.4	L10 N11 H12 L16 Q17 Q18	L10-L14 PolarHBondContact O-N 3.12Å; N11-L14 WeakPolarHBondContact O-CB 3.48Å; N11-L14 PolarHBondContact O-N 3.17Å; H12-L14 VanDerWaalsContact C-N 3.35Å; H12-L14 PolarHBondContact O-N 3.28Å; L14-L16 VanDerWaalsContact C-N 3.34Å; L14-Q17 PolarHBondContact O-N 2.99Å; L14-Q18 WeakPolarHBondContact O-CG 3.37Å; L14-Q18 PolarHBondContact O-N 3.33Å; L14-Q18 VanDerWaalsContact O-N 3.16Å
15	Q	90.3	Very high	88.5	Confident	94 Å²	94	79.3 Å²	79.3	44%	0.439	41%	0.408	S	S	.	.	H	α-helix	trans	-61.7	-42.8	175.5	-72	176.2	-12.4	0	0	111.5	N11 H12 K13 Q17 Q18 V19 L39	N11-Q15 WeakPolarHBondContact O-CG 3.18Å; N11-Q15 PolarHBondContact O-N 2.98Å; H12-Q15 PolarHBondContact O-N 2.93Å; K13-Q15 VanDerWaalsContact C-N 3.34Å; Q15-Q17 VanDerWaalsContact C-N 3.32Å; Q15-Q17 PolarHBondContact O-N 3.38Å; Q15-Q18 WeakPolarHBondContact O-CB 3.36Å; Q15-Q18 PolarHBondContact O-N 2.97Å; Q15-Q18 VanDerWaalsContact O-N 3.12Å; Q15-V19 WeakPolarHBondContact O-CG2 3.37Å; Q15-V19 PolarHBondContact O-N 3.43Å; Q15-L39 HydrophobicContact CB-CD1 3.92Å; Q15-L39 HydrophobicContact CB-CD2 4.09Å
16	L	92.5	Very high	89.4	Confident	25 Å²	25	79.4 Å²	79.4	13%	0.131	41%	0.405	C	S	.	.	H	α-helix	trans	-57.8	-46.1	177.1	-175.2	67.9	0	0	0	111	H12 K13 L14 Q18 V19 E20 K36 L39 E40 I43	H12-L16 PolarHBondContact O-N 3.27Å; K13-L16 WeakPolarHBondContact O-CB 3.31Å; K13-L16 PolarHBondContact O-N 3.05Å; L14-L16 VanDerWaalsContact C-N 3.34Å; L16-Q18 VanDerWaalsContact C-N 3.3Å; L16-Q18 PolarHBondContact O-N 3.5Å; L16-V19 PolarHBondContact O-N 3.2Å; L16-V19 VanDerWaalsContact O-N 3.17Å; L16-E20 WeakPolarHBondContact O-CG 3.48Å; L16-E20 PolarHBondContact O-N 3.4Å; L16-K36 HydrophobicContact CD1-CB 4.44Å; L16-K36 HydrophobicContact CD1-CG 3.79Å; L16-L39 HydrophobicContact CB-CB 4.45Å; L16-L39 HydrophobicContact CB-CD1 4.42Å; L16-L39 HydrophobicContact CD1-CB 3.97Å; L16-E40 HydrophobicContact CD1-CG 3.91Å; L16-E40 HydrophobicContact CD2-CG 4.03Å; L16-I43 HydrophobicContact CB-CD1 4.17Å; L16-I43 HydrophobicContact CD2-CD1 3.84Å
17	Q	91.9	Very high	89.9	Confident	127 Å²	127	77.1 Å²	77.1	59%	0.593	40%	0.402	S	S	*	.	H	α-helix	trans	-60.6	-37.7	177.1	-68.6	-175.3	-80.6	0	0	113	K13 L14 Q15 E20 A21	K13-Q17 WeakPolarHBondContact O-CG 3.45Å; K13-Q17 PolarHBondContact O-N 3.13Å; L14-Q17 PolarHBondContact O-N 2.99Å; Q15-Q17 VanDerWaalsContact C-N 3.32Å; Q15-Q17 PolarHBondContact O-N 3.38Å; Q17-E20 PolarHBondContact O-N 2.9Å; Q17-A21 WeakPolarHBondContact O-CB 3.48Å; Q17-A21 PolarHBondContact O-N 2.99Å
18	Q	91.7	Very high	90.4	Very high	124 Å²	124	81.8 Å²	81.8	58%	0.579	42%	0.422	S	S	*	.	H	α-helix	trans	-66.7	-40.9	176.5	-69.6	175.3	-5.7	0	0	111.7	L14 Q15 L16 A21 A22	L14-Q18 WeakPolarHBondContact O-CG 3.37Å; L14-Q18 PolarHBondContact O-N 3.33Å; L14-Q18 VanDerWaalsContact O-N 3.16Å; Q15-Q18 WeakPolarHBondContact O-CB 3.36Å; Q15-Q18 PolarHBondContact O-N 2.97Å; Q15-Q18 VanDerWaalsContact O-N 3.12Å; L16-Q18 VanDerWaalsContact C-N 3.3Å; L16-Q18 PolarHBondContact O-N 3.5Å; Q18-A21 PolarHBondContact O-N 2.96Å; Q18-A22 PolarHBondContact O-N 2.9Å
19	V	92.3	Very high	90.8	Very high	11 Å²	11	80 Å²	80	7%	0.067	41%	0.412	C	S	.	.	H	α-helix	trans	-66.1	-41.6	176.8	175.2	0	0	0	0	110.7	Q15 L16 A22 L23 L32 L35 K36 L39	Q15-V19 WeakPolarHBondContact O-CG2 3.37Å; Q15-V19 PolarHBondContact O-N 3.43Å; L16-V19 PolarHBondContact O-N 3.2Å; L16-V19 VanDerWaalsContact O-N 3.17Å; V19-A22 PolarHBondContact O-N 3.25Å; V19-L23 HydrophobicContact CG1-CD1 4.06Å; V19-L23 HydrophobicContact CG1-CG 4.5Å; V19-L23 WeakPolarHBondContact O-CG 3.32Å; V19-L23 PolarHBondContact O-N 3.28Å; V19-L32 HydrophobicContact CG1-CB 4.25Å; V19-L32 HydrophobicContact CG1-CD2 4.24Å; V19-L32 VanDerWaalsContact CG1-O 3.3Å; V19-L32 WeakPolarHBondContact CG1-O 3.3Å; V19-L35 HydrophobicContact CG2-CD2 3.53Å; V19-L35 HydrophobicContact CG2-CG 3.91Å; V19-K36 HydrophobicContact CG1-CB 3.96Å; V19-L39 HydrophobicContact CG2-CD1 3.98Å
20	E	92	Very high	91	Very high	71 Å²	71	86.9 Å²	86.9	33%	0.332	44%	0.444	S	S	.	.	H	α-helix	trans	-62.6	-43	175.7	-70.9	-175	137.8	0	0	112.1	L16 Q17 A22 L23 E24 K36	L16-E20 WeakPolarHBondContact O-CG 3.48Å; L16-E20 PolarHBondContact O-N 3.4Å; Q17-E20 PolarHBondContact O-N 2.9Å; E20-A22 VanDerWaalsContact C-N 3.28Å; E20-A22 PolarHBondContact O-N 3.45Å; E20-L23 WeakPolarHBondContact O-CB 3.45Å; E20-L23 PolarHBondContact O-N 2.87Å; E20-L23 VanDerWaalsContact O-N 3.17Å; E20-E24 PolarHBondContact O-N 2.78Å; E20-K36 HydrophobicContact CG-CD 4.35Å; E20-K36 IonicContact OE1-NZ 3.65Å; E20-K36 PolarHBondContact OE1-NZ 3.35Å
21	A	92.7	Very high	91.3	Very high	50 Å²	50	89.1 Å²	89.1	41%	0.413	45%	0.451	S	S	.	.	H	α-helix	trans	-63.3	-34.2	174.7	0	0	0	0	0	112.7	Q17 Q18	Q17-A21 WeakPolarHBondContact O-CB 3.48Å; Q17-A21 PolarHBondContact O-N 2.99Å; Q18-A21 PolarHBondContact O-N 2.96Å
22	A	92.2	Very high	91.4	Very high	34 Å²	34	87.2 Å²	87.2	28%	0.281	44%	0.441	S	S	.	.	H	α-helix	trans	-71.1	-37.3	173.7	0	0	0	0	0	112	Q18 V19 E20 E24 L25 D26 L32	Q18-A22 PolarHBondContact O-N 2.9Å; V19-A22 PolarHBondContact O-N 3.25Å; E20-A22 VanDerWaalsContact C-N 3.28Å; E20-A22 PolarHBondContact O-N 3.45Å; A22-E24 VanDerWaalsContact C-N 3.28Å; A22-E24 PolarHBondContact O-N 3.33Å; A22-L25 PolarHBondContact O-N 3.07Å; A22-L25 VanDerWaalsContact O-N 3.11Å; A22-D26 PolarHBondContact O-N 3.39Å; A22-L32 HydrophobicContact CB-CD1 3.56Å; A22-L32 HydrophobicContact CB-CD2 4.02Å; A22-L32 HydrophobicContact CB-CG 4.47Å
23	L	91.9	Very high	91.5	Very high	18 Å²	18	88.2 Å²	88.2	9%	0.094	45%	0.448	C	S	.	.	H	α-helix	trans	-67.2	-25.5	174.6	-76.1	168	0	0	0	113.1	V19 E20 L25 D26 P27 L32 L33 K36	V19-L23 HydrophobicContact CG1-CD1 4.06Å; V19-L23 HydrophobicContact CG1-CG 4.5Å; V19-L23 WeakPolarHBondContact O-CG 3.32Å; V19-L23 PolarHBondContact O-N 3.28Å; E20-L23 WeakPolarHBondContact O-CB 3.45Å; E20-L23 PolarHBondContact O-N 2.87Å; E20-L23 VanDerWaalsContact O-N 3.17Å; L23-L25 PolarHBondContact O-N 3.15Å; L23-D26 CarbonylContact O-C 3.39Å; L23-P27 WeakPolarHBondContact O-CA 3.48Å; L23-P27 WeakPolarHBondContact O-CB 3.34Å; L23-P27 VanDerWaalsContact O-N 3.11Å; L23-L32 HydrophobicContact CD1-CB 4.35Å; L23-L32 HydrophobicContact CD2-CB 3.39Å; L23-L32 HydrophobicContact CD2-CD1 4.17Å; L23-L32 HydrophobicContact CD2-CG 4.44Å; L23-L32 HydrophobicContact CG-CB 3.68Å; L23-L32 HydrophobicContact CG-CD1 4.24Å; L23-L33 HydrophobicContact CD1-CD2 4.21Å; L23-L33 HydrophobicContact CD2-CD2 3.81Å; L23-L33 HydrophobicContact CD2-CG 3.84Å; L23-K36 HydrophobicContact CD1-CB 4.1Å; L23-K36 HydrophobicContact CD1-CD 3.8Å; L23-K36 HydrophobicContact CD1-CG 4.49Å
24	E	91.6	Very high	91.7	Very high	169 Å²	169	89.1 Å²	89.1	79%	0.79	45%	0.453	S	S	*	.	H	α-helix	trans	-65.1	-31.7	170.9	-73.3	-175.2	173.1	0	0	112.2	E20 A22	E20-E24 PolarHBondContact O-N 2.78Å; A22-E24 VanDerWaalsContact C-N 3.28Å; A22-E24 PolarHBondContact O-N 3.33Å
25	L	91.5	Very high	91.6	Very high	157 Å²	157	89 Å²	89	82%	0.822	45%	0.452	S	S	*	.	H	α-helix	trans	-85.4	-34.5	177.6	-63.4	171.9	0	0	0	112.3	A22 L23	A22-L25 PolarHBondContact O-N 3.07Å; A22-L25 VanDerWaalsContact O-N 3.11Å; L23-L25 PolarHBondContact O-N 3.15Å
26	D	91.5	Very high	91.7	Very high	72 Å²	72	87 Å²	87	39%	0.385	44%	0.442	S	S	.	.			trans	-137.5	78.1	-177.6	-169.4	8.6	0	0	0	111.2	A22 L23 E28 N29	A22-D26 PolarHBondContact O-N 3.39Å; L23-D26 CarbonylContact O-C 3.39Å; D26-E28 PolarHBondContact O-N 2.85Å; D26-N29 HydrophobicContact CB-CB 4.2Å; D26-N29 VanDerWaalsContact O-CB 3.31Å; D26-N29 WeakPolarHBondContact O-CB 3.41Å; D26-N29 PolarHBondContact O-N 2.91Å; D26-N29 WeakPolarHBondContact OD2-CB 3.3Å; D26-N29 PolarHBondContact OD2-ND2 3.09Å
27	P	89.6	Confident	91.7	Very high	86 Å²	86	93 Å²	93	56%	0.558	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-15.5	-173.1	27.4	-35.4	0	0	0	113.9	L23	L23-P27 WeakPolarHBondContact O-CA 3.48Å; L23-P27 WeakPolarHBondContact O-CB 3.34Å; L23-P27 VanDerWaalsContact O-N 3.11Å
28	E	90.3	Very high	91.7	Very high	173 Å²	173	90.6 Å²	90.6	81%	0.808	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	3.9	179.5	-61.4	-171.5	114.5	0	0	112.5	D26 E30	D26-E28 PolarHBondContact O-N 2.85Å; E28-E30 PolarHBondContact O-N 3.28Å
29	N	91.2	Very high	91.7	Very high	42 Å²	42	85.2 Å²	85.2	23%	0.225	43%	0.43	C	S	.	.			trans	-72.6	101	-179.3	-162.4	-50.9	0	0	0	111.5	D26 E31 L32 L33	D26-N29 HydrophobicContact CB-CB 4.2Å; D26-N29 VanDerWaalsContact O-CB 3.31Å; D26-N29 WeakPolarHBondContact O-CB 3.41Å; D26-N29 PolarHBondContact O-N 2.91Å; D26-N29 WeakPolarHBondContact OD2-CB 3.3Å; D26-N29 PolarHBondContact OD2-ND2 3.09Å; N29-E31 PolarHBondContact O-N 3.43Å; N29-E31 WeakPolarHBondContact OD1-CB 3.44Å; N29-E31 PolarHBondContact OD1-N 3.31Å; N29-L32 HydrophobicContact CB-CB 4.04Å; N29-L32 HydrophobicContact CB-CD1 3.8Å; N29-L32 HydrophobicContact CB-CG 3.98Å; N29-L32 PolarHBondContact O-N 3.07Å; N29-L32 PolarHBondContact OD1-N 2.73Å; N29-L33 WeakPolarHBondContact O-CG 3.41Å; N29-L33 PolarHBondContact O-N 3.42Å
30	E	91.6	Very high	91.7	Very high	162 Å²	162	88.7 Å²	88.7	76%	0.757	45%	0.445	S	S	*	.	H	α-helix	trans	-58.4	-33.7	-179.4	-65.7	-169.1	141.9	0	0	112.9	E28 L33 Q34	E28-E30 PolarHBondContact O-N 3.28Å; E30-L33 PolarHBondContact O-N 3.07Å; E30-Q34 WeakPolarHBondContact O-CB 3.42Å; E30-Q34 PolarHBondContact O-N 3Å
31	E	91.9	Very high	91.6	Very high	157 Å²	157	91.1 Å²	91.1	73%	0.734	46%	0.456	S	S	*	.	H	α-helix	trans	-67.1	-45	178.6	-58.6	-174.5	164.8	0	0	111.1	N29 Q34 L35	N29-E31 PolarHBondContact O-N 3.43Å; N29-E31 WeakPolarHBondContact OD1-CB 3.44Å; N29-E31 PolarHBondContact OD1-N 3.31Å; E31-Q34 PolarHBondContact O-N 2.91Å; E31-L35 WeakPolarHBondContact O-CB 3.23Å; E31-L35 PolarHBondContact O-N 3.45Å
32	L	92.1	Very high	91.5	Very high	33 Å²	33	91.4 Å²	91.4	17%	0.173	45%	0.453	C	S	.	.	H	α-helix	trans	-66.9	-38.6	176.6	-66.5	177.9	0	0	0	111.6	V19 A22 L23 N29 Q34 L35 K36	V19-L32 HydrophobicContact CG1-CB 4.25Å; V19-L32 HydrophobicContact CG1-CD2 4.24Å; V19-L32 VanDerWaalsContact CG1-O 3.3Å; V19-L32 WeakPolarHBondContact CG1-O 3.3Å; A22-L32 HydrophobicContact CB-CD1 3.56Å; A22-L32 HydrophobicContact CB-CD2 4.02Å; A22-L32 HydrophobicContact CB-CG 4.47Å; L23-L32 HydrophobicContact CD1-CB 4.35Å; L23-L32 HydrophobicContact CD2-CB 3.39Å; L23-L32 HydrophobicContact CD2-CD1 4.17Å; L23-L32 HydrophobicContact CD2-CG 4.44Å; L23-L32 HydrophobicContact CG-CB 3.68Å; L23-L32 HydrophobicContact CG-CD1 4.24Å; N29-L32 HydrophobicContact CB-CB 4.04Å; N29-L32 HydrophobicContact CB-CD1 3.8Å; N29-L32 HydrophobicContact CB-CG 3.98Å; N29-L32 PolarHBondContact O-N 3.07Å; N29-L32 PolarHBondContact OD1-N 2.73Å; L32-Q34 VanDerWaalsContact C-N 3.33Å; L32-L35 PolarHBondContact O-N 3.36Å; L32-K36 WeakPolarHBondContact O-CB 3.41Å; L32-K36 PolarHBondContact O-N 2.99Å
33	L	90.9	Very high	91.3	Very high	70 Å²	70	90.5 Å²	90.5	37%	0.366	44%	0.443	S	S	.	.	H	α-helix	trans	-65.8	-35.8	175.6	-72.2	173.3	0	0	0	112.3	L23 N29 E30 R37	L23-L33 HydrophobicContact CD1-CD2 4.21Å; L23-L33 HydrophobicContact CD2-CD2 3.81Å; L23-L33 HydrophobicContact CD2-CG 3.84Å; N29-L33 WeakPolarHBondContact O-CG 3.41Å; N29-L33 PolarHBondContact O-N 3.42Å; E30-L33 PolarHBondContact O-N 3.07Å; L33-R37 WeakPolarHBondContact O-CG 3.49Å; L33-R37 PolarHBondContact O-N 3.04Å; L33-R37 PolarHBondContact O-NE 3.44Å; L33-R37 VanDerWaalsContact O-NE 3.07Å
34	Q	92.9	Very high	91.1	Very high	111 Å²	111	95.8 Å²	95.8	52%	0.519	47%	0.466	S	S	.	.	H	α-helix	trans	-68.4	-49.2	173.1	-173.7	175.8	-30	0	0	110.8	E30 E31 L32 K36 R37 D38	E30-Q34 WeakPolarHBondContact O-CB 3.42Å; E30-Q34 PolarHBondContact O-N 3Å; E31-Q34 PolarHBondContact O-N 2.91Å; L32-Q34 VanDerWaalsContact C-N 3.33Å; Q34-K36 VanDerWaalsContact C-N 3.3Å; Q34-K36 PolarHBondContact O-N 3.36Å; Q34-R37 WeakPolarHBondContact O-CB 3.46Å; Q34-R37 PolarHBondContact O-N 3.46Å; Q34-R37 VanDerWaalsContact O-N 3.09Å; Q34-D38 PolarHBondContact O-N 3Å
35	L	91.7	Very high	90.7	Very high	82 Å²	82	91.6 Å²	91.6	43%	0.429	45%	0.448	S	S	.	.	H	α-helix	trans	-60.5	-38.8	179.8	-174.7	60.3	0	0	0	112.4	V19 E31 L32 D38 L39	V19-L35 HydrophobicContact CG2-CD2 3.53Å; V19-L35 HydrophobicContact CG2-CG 3.91Å; E31-L35 WeakPolarHBondContact O-CB 3.23Å; E31-L35 PolarHBondContact O-N 3.45Å; L32-L35 PolarHBondContact O-N 3.36Å; L35-D38 PolarHBondContact O-N 3.09Å; L35-L39 HydrophobicContact CD1-CD1 4.35Å; L35-L39 HydrophobicContact CD1-CG 4.4Å; L35-L39 HydrophobicContact CG-CD1 4.06Å; L35-L39 WeakPolarHBondContact O-CB 3.37Å; L35-L39 VanDerWaalsContact O-CG 3.3Å; L35-L39 WeakPolarHBondContact O-CG 3.2Å; L35-L39 PolarHBondContact O-N 3.36Å
36	K	91.3	Very high	90.3	Very high	53 Å²	53	85.3 Å²	85.3	23%	0.23	42%	0.417	C	S	.	.	H	α-helix	trans	-56.2	-50.6	173	178.8	175.5	171.2	148.9	0	111.5	L16 V19 E20 L23 L32 Q34 L39 E40	L16-K36 HydrophobicContact CD1-CB 4.44Å; L16-K36 HydrophobicContact CD1-CG 3.79Å; V19-K36 HydrophobicContact CG1-CB 3.96Å; E20-K36 HydrophobicContact CG-CD 4.35Å; E20-K36 IonicContact OE1-NZ 3.65Å; E20-K36 PolarHBondContact OE1-NZ 3.35Å; L23-K36 HydrophobicContact CD1-CB 4.1Å; L23-K36 HydrophobicContact CD1-CD 3.8Å; L23-K36 HydrophobicContact CD1-CG 4.49Å; L32-K36 WeakPolarHBondContact O-CB 3.41Å; L32-K36 PolarHBondContact O-N 2.99Å; Q34-K36 VanDerWaalsContact C-N 3.3Å; Q34-K36 PolarHBondContact O-N 3.36Å; K36-L39 PolarHBondContact O-N 3.07Å; K36-E40 WeakPolarHBondContact CE-OE1 3.42Å; K36-E40 IonicContact NZ-OE1 2.78Å; K36-E40 WeakPolarHBondContact O-CG 3.35Å; K36-E40 PolarHBondContact O-N 2.71Å
37	R	92.4	Very high	89.8	Confident	151 Å²	151	85.9 Å²	85.9	57%	0.57	42%	0.42	S	S	*	.	H	α-helix	trans	-61.9	-45.4	-179.3	-74.6	178.9	-74.3	174.9	-0.7	111.6	L33 Q34 L39 E40 E41	L33-R37 WeakPolarHBondContact O-CG 3.49Å; L33-R37 PolarHBondContact O-N 3.04Å; L33-R37 PolarHBondContact O-NE 3.44Å; L33-R37 VanDerWaalsContact O-NE 3.07Å; Q34-R37 WeakPolarHBondContact O-CB 3.46Å; Q34-R37 PolarHBondContact O-N 3.46Å; Q34-R37 VanDerWaalsContact O-N 3.09Å; R37-L39 VanDerWaalsContact C-N 3.34Å; R37-L39 PolarHBondContact O-N 2.94Å; R37-E40 PolarHBondContact O-N 3.38Å; R37-E41 PolarHBondContact O-N 2.83Å
38	D	92.2	Very high	89.2	Confident	77 Å²	77	85.6 Å²	85.6	41%	0.412	41%	0.411	S	S	.	.	H	α-helix	trans	-62	-42.6	179.4	-65	-15.3	0	0	0	111	Q34 L35 E41 V42	Q34-D38 PolarHBondContact O-N 3Å; L35-D38 PolarHBondContact O-N 3.09Å; D38-E41 PolarHBondContact O-N 3.32Å; D38-V42 WeakPolarHBondContact O-CG2 3.32Å; D38-V42 PolarHBondContact O-N 2.98Å
39	L	92	Very high	88.5	Confident	11 Å²	11	82.5 Å²	82.5	6%	0.058	40%	0.399	C	S	.	.	H	α-helix	trans	-66.1	-41.7	176.9	-74.7	169.5	0	0	0	112.8	Q15 L16 V19 L35 K36 R37 E41 V42 I43	Q15-L39 HydrophobicContact CB-CD1 3.92Å; Q15-L39 HydrophobicContact CB-CD2 4.09Å; L16-L39 HydrophobicContact CB-CB 4.45Å; L16-L39 HydrophobicContact CB-CD1 4.42Å; L16-L39 HydrophobicContact CD1-CB 3.97Å; V19-L39 HydrophobicContact CG2-CD1 3.98Å; L35-L39 HydrophobicContact CD1-CD1 4.35Å; L35-L39 HydrophobicContact CD1-CG 4.4Å; L35-L39 HydrophobicContact CG-CD1 4.06Å; L35-L39 WeakPolarHBondContact O-CB 3.37Å; L35-L39 VanDerWaalsContact O-CG 3.3Å; L35-L39 WeakPolarHBondContact O-CG 3.2Å; L35-L39 PolarHBondContact O-N 3.36Å; K36-L39 PolarHBondContact O-N 3.07Å; R37-L39 VanDerWaalsContact C-N 3.34Å; R37-L39 PolarHBondContact O-N 2.94Å; L39-E41 VanDerWaalsContact C-N 3.31Å; L39-E41 PolarHBondContact O-N 3.12Å; L39-V42 PolarHBondContact O-N 3.1Å; L39-I43 WeakPolarHBondContact O-CB 3.4Å; L39-I43 WeakPolarHBondContact O-CD1 3.2Å; L39-I43 VanDerWaalsContact O-CG1 3.23Å; L39-I43 WeakPolarHBondContact O-CG1 3Å; L39-I43 PolarHBondContact O-N 3Å
40	E	91.4	Very high	87.5	Confident	83 Å²	83	82.6 Å²	82.6	39%	0.388	40%	0.4	S	S	.	.	H	α-helix	trans	-60.8	-40	175.5	-75.1	176.2	160.4	0	0	111.7	L16 K36 R37 I43 K44	L16-E40 HydrophobicContact CD1-CG 3.91Å; L16-E40 HydrophobicContact CD2-CG 4.03Å; K36-E40 WeakPolarHBondContact CE-OE1 3.42Å; K36-E40 IonicContact NZ-OE1 2.78Å; K36-E40 WeakPolarHBondContact O-CG 3.35Å; K36-E40 PolarHBondContact O-N 2.71Å; R37-E40 PolarHBondContact O-N 3.38Å; E40-I43 PolarHBondContact O-N 3.26Å; E40-K44 WeakPolarHBondContact O-CB 3.41Å; E40-K44 PolarHBondContact O-N 3.33Å
41	E	91.5	Very high	86	Confident	122 Å²	122	77.3 Å²	77.3	57%	0.57	39%	0.389	S	S	*	.	H	α-helix	trans	-65.8	-45.7	176.5	-171.4	170.5	-174.1	0	0	111.5	R37 D38 L39 I43 K44 L45	R37-E41 PolarHBondContact O-N 2.83Å; D38-E41 PolarHBondContact O-N 3.32Å; L39-E41 VanDerWaalsContact C-N 3.31Å; L39-E41 PolarHBondContact O-N 3.12Å; E41-I43 PolarHBondContact O-N 3.04Å; E41-K44 PolarHBondContact O-N 3.47Å; E41-L45 HydrophobicContact CG-CD1 4.15Å; E41-L45 WeakPolarHBondContact O-CB 3.36Å; E41-L45 WeakPolarHBondContact O-CG 3.23Å; E41-L45 PolarHBondContact O-N 3.45Å
42	V	89.7	Confident	84.2	Confident	56 Å²	56	78.2 Å²	78.2	34%	0.339	39%	0.385	S	S	.	.	H	α-helix	trans	-62.2	-42.1	176.4	173.9	0	0	0	0	111.4	D38 L39 L45 S46	D38-V42 WeakPolarHBondContact O-CG2 3.32Å; D38-V42 PolarHBondContact O-N 2.98Å; L39-V42 PolarHBondContact O-N 3.1Å; V42-L45 PolarHBondContact O-N 3.49Å; V42-S46 VanDerWaalsContact O-CB 3.23Å; V42-S46 WeakPolarHBondContact O-CB 3.33Å; V42-S46 PolarHBondContact O-N 2.89Å; V42-S46 PolarHBondContact O-OG 3.31Å
43	I	88.6	Confident	82.1	Confident	16 Å²	16	80.7 Å²	80.7	8%	0.082	40%	0.402	C	S	.	.	H	α-helix	trans	-62.8	-45	176.2	-72.8	164.6	0	0	0	110.6	L9 H12 K13 L16 L39 E40 E41 S46 L47	L9-I43 HydrophobicContact CD1-CB 4.36Å; L9-I43 HydrophobicContact CD1-CG1 4.32Å; L9-I43 HydrophobicContact CD1-CG2 3.95Å; H12-I43 HydrophobicContact CB-CD1 4.25Å; H12-I43 HydrophobicContact CB-CG1 3.72Å; K13-I43 HydrophobicContact CG-CD1 3.94Å; K13-I43 HydrophobicContact CG-CG1 4.34Å; L16-I43 HydrophobicContact CB-CD1 4.17Å; L16-I43 HydrophobicContact CD2-CD1 3.84Å; L39-I43 WeakPolarHBondContact O-CB 3.4Å; L39-I43 WeakPolarHBondContact O-CD1 3.2Å; L39-I43 VanDerWaalsContact O-CG1 3.23Å; L39-I43 WeakPolarHBondContact O-CG1 3Å; L39-I43 PolarHBondContact O-N 3Å; E40-I43 PolarHBondContact O-N 3.26Å; E41-I43 PolarHBondContact O-N 3.04Å; I43-S46 PolarHBondContact O-N 2.93Å; I43-L47 HydrophobicContact CG2-CD1 3.94Å; I43-L47 HydrophobicContact CG2-CG 4.44Å; I43-L47 WeakPolarHBondContact O-CB 3.47Å; I43-L47 VanDerWaalsContact O-CG 3.3Å; I43-L47 WeakPolarHBondContact O-CG 3.22Å; I43-L47 PolarHBondContact O-N 2.79Å
44	K	87.4	Confident	80	Confident	129 Å²	129	80 Å²	80	56%	0.561	40%	0.403	S	S	*	.	H	α-helix	trans	-61.5	-48.8	178.2	-178.9	-176.5	172.9	-169.1	0	111.2	E40 E41 S46 L47 E48	E40-K44 WeakPolarHBondContact O-CB 3.41Å; E40-K44 PolarHBondContact O-N 3.33Å; E41-K44 PolarHBondContact O-N 3.47Å; K44-S46 VanDerWaalsContact C-N 3.3Å; K44-S46 PolarHBondContact O-N 2.92Å; K44-L47 PolarHBondContact O-N 2.76Å; K44-E48 WeakPolarHBondContact CE-OE1 3.43Å; K44-E48 WeakPolarHBondContact O-CG 3.3Å; K44-E48 PolarHBondContact O-N 3.5Å
45	L	83.8	Confident	77.7	Confident	81 Å²	81	81.3 Å²	81.3	42%	0.424	41%	0.414	S	S	.	.	H	α-helix	trans	-62.1	-39.8	176.8	-70	172.4	0	0	0	111.4	E41 V42 E48 L49	E41-L45 HydrophobicContact CG-CD1 4.15Å; E41-L45 WeakPolarHBondContact O-CB 3.36Å; E41-L45 WeakPolarHBondContact O-CG 3.23Å; E41-L45 PolarHBondContact O-N 3.45Å; V42-L45 PolarHBondContact O-N 3.49Å; L45-E48 PolarHBondContact O-N 3.44Å; L45-L49 WeakPolarHBondContact O-CB 3.26Å; L45-L49 WeakPolarHBondContact O-CG 3.26Å; L45-L49 PolarHBondContact O-N 2.81Å
46	S	82.6	Confident	75.6	Confident	24 Å²	24	79.2 Å²	79.2	17%	0.168	40%	0.404	C	S	.	.	H	α-helix	trans	-65.2	-39	176.2	-60.6	0	0	0	0	111.8	V42 I43 K44 L49 L50	V42-S46 VanDerWaalsContact O-CB 3.23Å; V42-S46 WeakPolarHBondContact O-CB 3.33Å; V42-S46 PolarHBondContact O-N 2.89Å; V42-S46 PolarHBondContact O-OG 3.31Å; I43-S46 PolarHBondContact O-N 2.93Å; K44-S46 VanDerWaalsContact C-N 3.3Å; K44-S46 PolarHBondContact O-N 2.92Å; S46-L49 PolarHBondContact O-N 3.02Å; S46-L50 VanDerWaalsContact O-CB 3.26Å; S46-L50 WeakPolarHBondContact O-CB 3.33Å; S46-L50 WeakPolarHBondContact O-CD1 3.4Å; S46-L50 PolarHBondContact O-N 3.35Å
47	L	80.1	Confident	73.6	Confident	84 Å²	84	80.6 Å²	80.6	44%	0.44	42%	0.419	S	S	.	.	H	α-helix	trans	-68.7	-39.5	174.4	-75.1	170.3	0	0	0	112.1	L9 I43 K44 L49 L50 G51	L9-L47 HydrophobicContact CD1-CG 4.27Å; L9-L47 HydrophobicContact CD2-CD2 3.68Å; L9-L47 HydrophobicContact CD2-CG 4.3Å; I43-L47 HydrophobicContact CG2-CD1 3.94Å; I43-L47 HydrophobicContact CG2-CG 4.44Å; I43-L47 WeakPolarHBondContact O-CB 3.47Å; I43-L47 VanDerWaalsContact O-CG 3.3Å; I43-L47 WeakPolarHBondContact O-CG 3.22Å; I43-L47 PolarHBondContact O-N 2.79Å; K44-L47 PolarHBondContact O-N 2.76Å; L47-L49 VanDerWaalsContact C-N 3.33Å; L47-L50 PolarHBondContact O-N 2.86Å; L47-G51 PolarHBondContact O-N 3.22Å
48	E	78.6	Confident	71.8	Confident	80 Å²	80	83 Å²	83	37%	0.374	44%	0.436	S	S	.	.	H	α-helix	trans	-64.6	-40.1	173.5	-74	-179.4	-168.3	0	0	111.1	K44 L45 R52	K44-E48 WeakPolarHBondContact CE-OE1 3.43Å; K44-E48 WeakPolarHBondContact O-CG 3.3Å; K44-E48 PolarHBondContact O-N 3.5Å; L45-E48 PolarHBondContact O-N 3.44Å; E48-R52 VanDerWaalsContact O-CB 3.23Å; E48-R52 WeakPolarHBondContact O-CB 3.31Å; E48-R52 VanDerWaalsContact O-CG 3.24Å; E48-R52 WeakPolarHBondContact O-CG 3.4Å; E48-R52 PolarHBondContact O-N 3.43Å
49	L	74.3	Confident	70.4	Confident	108 Å²	108	81.2 Å²	81.2	57%	0.565	43%	0.428	S	S	*	.	H	α-helix	trans	-66.4	-50.6	173.9	-74.1	165.4	0	0	0	110.6	L45 S46 L47 G51 R52 T53	L45-L49 WeakPolarHBondContact O-CB 3.26Å; L45-L49 WeakPolarHBondContact O-CG 3.26Å; L45-L49 PolarHBondContact O-N 2.81Å; S46-L49 PolarHBondContact O-N 3.02Å; L47-L49 VanDerWaalsContact C-N 3.33Å; L49-G51 VanDerWaalsContact C-N 3.27Å; L49-G51 PolarHBondContact O-N 2.84Å; L49-R52 CarbonylContact O-C 3.58Å; L49-R52 PolarHBondContact O-N 3.31Å; L49-T53 WeakPolarHBondContact O-CB 3.15Å; L49-T53 WeakPolarHBondContact O-CG2 3.46Å; L49-T53 PolarHBondContact O-N 2.89Å; L49-T53 PolarHBondContact O-OG1 3.16Å
50	L	71.1	Confident	69.5	Low	45 Å²	45	85.5 Å²	85.5	24%	0.236	46%	0.459	C	S	.	.	H	α-helix	trans	-57.4	-40.9	176.1	-89.7	147.9	0	0	0	111.7	P5 Q6 L9 S46 L47 T53	P5-L50 HydrophobicContact CB-CD2 4.4Å; P5-L50 HydrophobicContact CB-CG 4.43Å; P5-L50 HydrophobicContact CG-CD2 4.33Å; Q6-L50 HydrophobicContact CG-CD2 3.95Å; L9-L50 HydrophobicContact CB-CD1 4.13Å; L9-L50 HydrophobicContact CD2-CD1 3.6Å; L9-L50 HydrophobicContact CG-CD1 4.43Å; S46-L50 VanDerWaalsContact O-CB 3.26Å; S46-L50 WeakPolarHBondContact O-CB 3.33Å; S46-L50 WeakPolarHBondContact O-CD1 3.4Å; S46-L50 PolarHBondContact O-N 3.35Å; L47-L50 PolarHBondContact O-N 2.86Å; L50-T53 VanDerWaalsContact CA-OG1 3.26Å; L50-T53 WeakPolarHBondContact CA-OG1 3.37Å; L50-T53 PolarHBondContact O-OG1 2.93Å
51	G	60.3	Low	69.1	Low	51 Å²	51	82.8 Å²	82.8	53%	0.526	45%	0.445	S	S	.	.	H	α-helix	trans	-73.2	-24.9	176.1	0	0	0	0	0	114.4	L47 L49 S54	L47-G51 PolarHBondContact O-N 3.22Å; L49-G51 VanDerWaalsContact C-N 3.27Å; L49-G51 PolarHBondContact O-N 2.84Å; G51-S54 PolarHBondContact O-OG 3.11Å; G51-S54 VanDerWaalsContact O-OG 3.07Å
52	R	53.3	Low	68.9	Low	175 Å²	175	81.6 Å²	81.6	66%	0.66	44%	0.443	S	S	*	.	H	α-helix	trans	-86.3	-29.4	172	-78.7	176.3	170.4	160.8	1.2	112.7	E48 L49 S54 D55	E48-R52 VanDerWaalsContact O-CB 3.23Å; E48-R52 WeakPolarHBondContact O-CB 3.31Å; E48-R52 VanDerWaalsContact O-CG 3.24Å; E48-R52 WeakPolarHBondContact O-CG 3.4Å; E48-R52 PolarHBondContact O-N 3.43Å; L49-R52 CarbonylContact O-C 3.58Å; L49-R52 PolarHBondContact O-N 3.31Å; R52-S54 CarbonylContact O-C 3.23Å; R52-S54 VanDerWaalsContact O-C 3.23Å; R52-S54 PolarHBondContact O-N 2.72Å; R52-S54 VanDerWaalsContact O-N 3.16Å; R52-D55 PolarHBondContact O-N 3.25Å; R52-D55 VanDerWaalsContact O-N 3.11Å
53	T	48.2	Very low	68.9	Low	86 Å²	86	83.4 Å²	83.4	53%	0.528	45%	0.454	S	S	.	.			trans	-73.7	2.3	177.8	56.8	0	0	0	0	113.6	L49 L50 D55	L49-T53 WeakPolarHBondContact O-CB 3.15Å; L49-T53 WeakPolarHBondContact O-CG2 3.46Å; L49-T53 PolarHBondContact O-N 2.89Å; L49-T53 PolarHBondContact O-OG1 3.16Å; L50-T53 VanDerWaalsContact CA-OG1 3.26Å; L50-T53 WeakPolarHBondContact CA-OG1 3.37Å; L50-T53 PolarHBondContact O-OG1 2.93Å; T53-D55 PolarHBondContact O-N 2.98Å
54	S	47.1	Very low	69	Low	55 Å²	55	84.9 Å²	84.9	39%	0.385	47%	0.472	S	S	.	.			trans	-70.6	57.9	141.7	60.8	0	0	0	0	109.4	G51 R52 T56	G51-S54 PolarHBondContact O-OG 3.11Å; G51-S54 VanDerWaalsContact O-OG 3.07Å; R52-S54 CarbonylContact O-C 3.23Å; R52-S54 VanDerWaalsContact O-C 3.23Å; R52-S54 PolarHBondContact O-N 2.72Å; R52-S54 VanDerWaalsContact O-N 3.16Å; S54-T56 PolarHBondContact O-N 3.06Å
55	D	44.4	Very low	69.1	Low	139 Å²	139	81.4 Å²	81.4	74%	0.743	46%	0.46	S	S	*	.			trans	-70.6	58.6	161	-86.4	-65.4	0	0	0	106.9	R52 T53	R52-D55 PolarHBondContact O-N 3.25Å; R52-D55 VanDerWaalsContact O-N 3.11Å; T53-D55 PolarHBondContact O-N 2.98Å
56	T	48.2	Very low	69.4	Low	37 Å²	37	81.1 Å²	81.1	23%	0.227	46%	0.457	C	S	.	.			trans	-64	126.8	140.5	46.6	0	0	0	0	104	S54 E58 C107 Y110	S54-T56 PolarHBondContact O-N 3.06Å; T56-E58 PolarHBondContact O-N 2.84Å; T56-C107 WeakPolarHBondContact CG2-O 3.17Å; T56-Y110 HydrophobicContact CG2-CD1 4.37Å; T56-Y110 HydrophobicContact CG2-CE1 4.09Å
57	P	48.1	Very low	69.6	Low	83 Å²	83	80 Å²	80	54%	0.539	45%	0.449	S	S	.	.			trans	-43.6	142.5	170.5	15.5	-26.7	0	0	0	107.8	V59 I111	P57-V59 HydrophobicContact CB-CG2 4.18Å; P57-V59 HydrophobicContact CG-CG2 3.86Å; P57-V59 WeakPolarHBondContact O-CG2 3.05Å; P57-V59 PolarHBondContact O-N 2.84Å; P57-I111 HydrophobicContact CG-CD1 4.14Å
58	E	54.9	Low	70	Confident	201 Å²	201	79.1 Å²	79.1	94%	0.939	44%	0.443	S	S	*	.			trans	-59.5	75.6	171.8	-81.7	178.1	86.8	0	0	108.7	T56 S60	T56-E58 PolarHBondContact O-N 2.84Å; E58-S60 PolarHBondContact O-N 2.59Å
59	V	63.9	Low	70.5	Confident	40 Å²	40	75.3 Å²	75.3	24%	0.242	43%	0.425	C	S	.	.			trans	-78.1	107	174.7	179.7	0	0	0	0	102.5	P57 W61 I111	P57-V59 HydrophobicContact CB-CG2 4.18Å; P57-V59 HydrophobicContact CG-CG2 3.86Å; P57-V59 WeakPolarHBondContact O-CG2 3.05Å; P57-V59 PolarHBondContact O-N 2.84Å; V59-W61 HydrophobicContact CB-CD2 4.29Å; V59-W61 HydrophobicContact CB-CG 4.42Å; V59-W61 HydrophobicContact CB-CZ2 4.37Å; V59-W61 HydrophobicContact CG1-CD2 3.51Å; V59-W61 VanDerWaalsContact CG1-CE2 3.48Å; V59-W61 HydrophobicContact CG1-CE3 3.86Å; V59-W61 HydrophobicContact CG1-CG 3.93Å; V59-W61 HydrophobicContact CG1-CH2 4.22Å; V59-W61 HydrophobicContact CG1-CZ2 3.87Å; V59-W61 HydrophobicContact CG1-CZ3 4.2Å; V59-W61 PolarHBondContact O-N 3.07Å; V59-I111 HydrophobicContact CB-CG1 4.45Å; V59-I111 HydrophobicContact CG1-CG1 4.23Å; V59-I111 HydrophobicContact CG2-CD1 3.43Å; V59-I111 VanDerWaalsContact CG2-CD1 3.43Å; V59-I111 HydrophobicContact CG2-CG1 3.38Å
60	S	72.2	Confident	71.1	Confident	100 Å²	100	72.1 Å²	72.1	70%	0.699	41%	0.408	S	S	*	.			trans	-68.9	79.3	168.6	-55.2	0	0	0	0	107.7	E58 N62	E58-S60 PolarHBondContact O-N 2.59Å; S60-N62 PolarHBondContact O-ND2 3.04Å
61	W	83.7	Confident	71.7	Confident	27 Å²	27	70.7 Å²	70.7	10%	0.102	40%	0.402	C	S	.	.			trans	-61.9	133.7	175.3	-69.7	113.1	0	0	0	109.6	V59 D65 Q66 C67 I82 F85 C109 Y110 I111	V59-W61 HydrophobicContact CB-CD2 4.29Å; V59-W61 HydrophobicContact CB-CG 4.42Å; V59-W61 HydrophobicContact CB-CZ2 4.37Å; V59-W61 HydrophobicContact CG1-CD2 3.51Å; V59-W61 VanDerWaalsContact CG1-CE2 3.48Å; V59-W61 HydrophobicContact CG1-CE3 3.86Å; V59-W61 HydrophobicContact CG1-CG 3.93Å; V59-W61 HydrophobicContact CG1-CH2 4.22Å; V59-W61 HydrophobicContact CG1-CZ2 3.87Å; V59-W61 HydrophobicContact CG1-CZ3 4.2Å; V59-W61 PolarHBondContact O-N 3.07Å; W61-D65 HydrophobicContact CE3-CB 3.71Å; W61-D65 HydrophobicContact CZ3-CB 4.07Å; W61-Q66 WeakPolarHBondContact CZ3-O 3.23Å; W61-C67 HydrophobicContact CE3-CB 4.32Å; W61-C67 HydrophobicContact CH2-CB 3.22Å; W61-C67 HydrophobicContact CZ2-CB 3.81Å; W61-C67 HydrophobicContact CZ3-CB 3.54Å; W61-I82 HydrophobicContact CB-CD1 3.62Å; W61-I82 HydrophobicContact CD2-CD1 3.62Å; W61-I82 HydrophobicContact CE3-CD1 3.5Å; W61-I82 VanDerWaalsContact CE3-CD1 3.5Å; W61-I82 HydrophobicContact CG-CD1 3.72Å; W61-I82 HydrophobicContact CZ3-CD1 4.32Å; W61-F85 HydrophobicContact CB-CE1 4.05Å; W61-F85 HydrophobicContact CB-CZ 3.66Å; W61-F85 VanDerWaalsContact O-CZ 3.23Å; W61-F85 WeakPolarHBondContact O-CZ 3.32Å; W61-C109 HydrophobicContact CZ2-CB 3.88Å; W61-C109 WeakPolarHBondContact CZ2-O 3.34Å; W61-Y110 WeakPolarHBondContact CH2-O 3.23Å; W61-I111 HydrophobicContact CH2-CG1 4.49Å; W61-I111 HydrophobicContact CZ2-CG1 4.5Å
62	N	85.9	Confident	72.8	Confident	96 Å²	96	70.8 Å²	70.8	51%	0.513	39%	0.394	S	S	.	.			trans	-115.5	157.7	173.5	-59.5	-80.1	0	0	0	110.1	S60 G64 D65	S60-N62 PolarHBondContact O-ND2 3.04Å; N62-G64 PolarHBondContact O-N 3.25Å; N62-D65 PolarHBondContact N-OD2 3.3Å; N62-D65 PolarHBondContact ND2-OD2 2.94Å; N62-D65 WeakPolarHBondContact O-CB 3.24Å; N62-D65 PolarHBondContact O-N 2.94Å
63	V	90.9	Very high	74.2	Confident	95 Å²	95	72.4 Å²	72.4	58%	0.576	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	124.8	167.9	172.3	0	0	0	0	108.7	L83 F85	V63-L83 WeakPolarHBondContact CG1-O 3.43Å; V63-F85 HydrophobicContact CG2-CD2 4.09Å; V63-F85 HydrophobicContact CG2-CE2 4.08Å
64	G	90.6	Very high	76	Confident	46 Å²	46	71.6 Å²	71.6	47%	0.474	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.1	-9.9	-174.4	0	0	0	0	0	114.7	N62 I82	N62-G64 PolarHBondContact O-N 3.25Å; G64-I82 PolarHBondContact N-O 2.78Å
65	D	89.6	Confident	77.7	Confident	56 Å²	56	75.2 Å²	75.2	30%	0.299	40%	0.402	S	S	.	.			trans	-71.8	145.6	177.8	-74.8	-13.9	0	0	0	111.8	W61 N62 T81 I82	W61-D65 HydrophobicContact CE3-CB 3.71Å; W61-D65 HydrophobicContact CZ3-CB 4.07Å; N62-D65 PolarHBondContact N-OD2 3.3Å; N62-D65 PolarHBondContact ND2-OD2 2.94Å; N62-D65 WeakPolarHBondContact O-CB 3.24Å; N62-D65 PolarHBondContact O-N 2.94Å; D65-T81 WeakPolarHBondContact O-CA 3.23Å; D65-I82 HydrophobicContact CB-CD1 4.47Å; D65-I82 PolarHBondContact O-N 2.59Å
66	Q	88.6	Confident	79.6	Confident	76 Å²	76	73 Å²	73	36%	0.355	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	125.2	177.3	-57.9	-161.1	-71	0	0	111.1	W61 A80 D96	W61-Q66 WeakPolarHBondContact CZ3-O 3.23Å; Q66-A80 WeakPolarHBondContact CA-O 3.47Å; Q66-D96 PolarHBondContact NE2-OD2 3.06Å; Q66-D96 VanDerWaalsContact NE2-OD2 3.09Å
67	C	88.6	Confident	81.4	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	164.9	179.1	66.3	0	0	0	0	111.5	W61 A80 C109 Y110	W61-C67 HydrophobicContact CE3-CB 4.32Å; W61-C67 HydrophobicContact CH2-CB 3.22Å; W61-C67 HydrophobicContact CZ2-CB 3.81Å; W61-C67 HydrophobicContact CZ3-CB 3.54Å; C67-A80 PolarHBondContact N-O 2.99Å; C67-A80 PolarHBondContact O-N 2.95Å; C67-C109 HydrophobicContact CB-CB 4Å; C67-Y110 CarbonylContact C-O 3.55Å; C67-Y110 WeakPolarHBondContact CA-O 3.05Å
68	M	88.5	Confident	83.4	Confident	65 Å²	65	74 Å²	74	32%	0.32	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	110.7	156.6	-72.9	-168.7	-70.5	0	0	108.1	Y78 C109 Y110 F112	M68-Y78 CarbonylContact C-O 3.6Å; M68-Y78 WeakPolarHBondContact CA-O 3.44Å; M68-C109 WeakPolarHBondContact O-CA 3.48Å; M68-Y110 PolarHBondContact N-O 3.4Å; M68-Y110 PolarHBondContact O-N 2.89Å; M68-F112 HydrophobicContact CG-CD2 4.34Å
69	A	88	Confident	85	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	146.7	179	0	0	0	0	0	110.5	Y77 Y78 A80 V93 F95 C104	A69-Y77 WeakPolarHBondContact O-CA 3.46Å; A69-Y78 PolarHBondContact N-O 3.23Å; A69-Y78 PolarHBondContact O-N 2.91Å; A69-A80 HydrophobicContact CB-CB 3.87Å; A69-V93 HydrophobicContact CB-CB 4.33Å; A69-V93 HydrophobicContact CB-CG1 4.19Å; A69-V93 HydrophobicContact CB-CG2 3.76Å; A69-F95 HydrophobicContact CB-CE1 4.1Å; A69-F95 HydrophobicContact CB-CZ 4.5Å; A69-C104 HydrophobicContact CB-CB 4.26Å
70	M	87.2	Confident	86.3	Confident	41 Å²	41	67.2 Å²	67.2	20%	0.202	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	124.3	175.5	-170.7	-170.9	-66.7	0	0	110.1	K75 L76 Y77	M70-K75 HydrophobicContact CG-CB 4.49Å; M70-K75 HydrophobicContact SD-CB 4.01Å; M70-K75 HydrophobicContact SD-CD 3.87Å; M70-L76 CarbonylContact C-O 3.53Å; M70-L76 WeakPolarHBondContact CA-O 3.36Å; M70-Y77 HydrophobicContact CB-CD1 4.02Å; M70-Y77 HydrophobicContact CB-CE1 3.79Å; M70-Y77 HydrophobicContact CE-CE1 4.12Å; M70-Y77 HydrophobicContact CE-CE2 3.68Å; M70-Y77 WeakPolarHBondContact CE-OH 3.48Å
71	C	83.8	Confident	87.3	Confident	15 Å²	15	63.8 Å²	63.8	10%	0.101	32%	0.316	C	S	.	.			trans	-70.8	131.5	172.1	172.9	0	0	0	0	110.4	R73 D74 K75 L76 Y78 F95	C71-R73 PolarHBondContact O-N 2.83Å; C71-D74 WeakPolarHBondContact CB-OD1 3.36Å; C71-K75 VanDerWaalsContact O-CA 3.31Å; C71-K75 WeakPolarHBondContact O-CA 3.43Å; C71-K75 PolarHBondContact O-N 2.92Å; C71-L76 PolarHBondContact N-O 3.14Å; C71-Y78 HydrophobicContact CB-CD2 3.75Å; C71-Y78 HydrophobicContact CB-CE2 3.83Å; C71-F95 HydrophobicContact CB-CE1 4.37Å; C71-F95 HydrophobicContact CB-CE2 4.09Å; C71-F95 HydrophobicContact CB-CZ 3.76Å
72	S	83.8	Confident	87.7	Confident	53 Å²	53	62.6 Å²	62.6	37%	0.371	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-26	-176.6	65.8	0	0	0	0	113	K75 D102	S72-K75 WeakPolarHBondContact O-CE 3.44Å; S72-K75 PolarHBondContact O-NZ 3.3Å; S72-D102 WeakPolarHBondContact CB-OD2 3.2Å; S72-D102 PolarHBondContact N-OD2 3.34Å; S72-D102 PolarHBondContact OG-OD1 3.18Å; S72-D102 PolarHBondContact OG-OD2 2.83Å
73	R	82.2	Confident	88.1	Confident	209 Å²	209	61.8 Å²	61.8	79%	0.789	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-46	-174.3	-61.8	-177.2	-173.8	175.4	4.8	113.8	C71	C71-R73 PolarHBondContact O-N 2.83Å
74	D	86.1	Confident	88.1	Confident	69 Å²	69	62.5 Å²	62.5	37%	0.369	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.3	-5.5	-172.8	62.9	2.6	0	0	0	113.6	C71 L76 Y78	C71-D74 WeakPolarHBondContact CB-OD1 3.36Å; D74-L76 HydrophobicContact CB-CD1 4.44Å; D74-L76 HydrophobicContact CB-CG 4.4Å; D74-L76 PolarHBondContact O-N 2.91Å; D74-L76 PolarHBondContact OD1-N 2.97Å; D74-Y78 VanDerWaalsContact OD2-CE2 3.23Å; D74-Y78 WeakPolarHBondContact OD2-CE2 3.38Å; D74-Y78 PolarHBondContact OD2-OH 2.86Å
75	K	83	Confident	88.1	Confident	131 Å²	131	64 Å²	64	57%	0.57	30%	0.297	S	S	*	.			trans	60.3	23.6	-177.9	-50.7	-53.9	-172.4	-161.5	0	113.5	M70 C71 S72	M70-K75 HydrophobicContact CG-CB 4.49Å; M70-K75 HydrophobicContact SD-CB 4.01Å; M70-K75 HydrophobicContact SD-CD 3.87Å; C71-K75 VanDerWaalsContact O-CA 3.31Å; C71-K75 WeakPolarHBondContact O-CA 3.43Å; C71-K75 PolarHBondContact O-N 2.92Å; S72-K75 WeakPolarHBondContact O-CE 3.44Å; S72-K75 PolarHBondContact O-NZ 3.3Å
76	L	85	Confident	88	Confident	93 Å²	93	65.5 Å²	65.5	49%	0.487	31%	0.305	S	S	.	.			trans	-97.2	149.7	174.2	-64.9	176	0	0	0	110.5	M70 C71 D74 Y78	M70-L76 CarbonylContact C-O 3.53Å; M70-L76 WeakPolarHBondContact CA-O 3.36Å; C71-L76 PolarHBondContact N-O 3.14Å; D74-L76 HydrophobicContact CB-CD1 4.44Å; D74-L76 HydrophobicContact CB-CG 4.4Å; D74-L76 PolarHBondContact O-N 2.91Å; D74-L76 PolarHBondContact OD1-N 2.97Å; L76-Y78 HydrophobicContact CB-CD2 4.39Å; L76-Y78 HydrophobicContact CB-CE2 3.59Å; L76-Y78 WeakPolarHBondContact CD1-OH 3.13Å; L76-Y78 WeakPolarHBondContact O-CD2 3.22Å
77	Y	86.1	Confident	87.6	Confident	86 Å²	86	64.3 Å²	64.3	34%	0.337	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	125.9	177.4	-67.9	-92	0	0	0	110.1	A69 M70 Y108 Y110	A69-Y77 WeakPolarHBondContact O-CA 3.46Å; M70-Y77 HydrophobicContact CB-CD1 4.02Å; M70-Y77 HydrophobicContact CB-CE1 3.79Å; M70-Y77 HydrophobicContact CE-CE1 4.12Å; M70-Y77 HydrophobicContact CE-CE2 3.68Å; M70-Y77 WeakPolarHBondContact CE-OH 3.48Å; Y77-Y108 WeakPolarHBondContact CE1-O 3.37Å; Y77-Y110 AromaticContact CD1-CD2 3.89Å; Y77-Y110 HydrophobicContact CD1-CD2 3.89Å; Y77-Y110 HydrophobicContact CD1-CE2 4.04Å; Y77-Y110 AromaticContact CE1-CD2 3.62Å; Y77-Y110 HydrophobicContact CE1-CD2 3.62Å; Y77-Y110 AromaticContact CE1-CE2 3.33Å; Y77-Y110 HydrophobicContact CE1-CE2 3.33Å; Y77-Y110 HydrophobicContact CE2-CE2 4.44Å; Y77-Y110 AromaticContact CZ-CE2 3.57Å
78	Y	88.2	Confident	86.9	Confident	54 Å²	54	72.2 Å²	72.2	21%	0.212	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	155.2	175	-60.4	-82.3	0	0	0	110	M68 A69 C71 D74 L76 A80 F95 Y98	M68-Y78 CarbonylContact C-O 3.6Å; M68-Y78 WeakPolarHBondContact CA-O 3.44Å; A69-Y78 PolarHBondContact N-O 3.23Å; A69-Y78 PolarHBondContact O-N 2.91Å; C71-Y78 HydrophobicContact CB-CD2 3.75Å; C71-Y78 HydrophobicContact CB-CE2 3.83Å; D74-Y78 VanDerWaalsContact OD2-CE2 3.23Å; D74-Y78 WeakPolarHBondContact OD2-CE2 3.38Å; D74-Y78 PolarHBondContact OD2-OH 2.86Å; L76-Y78 HydrophobicContact CB-CD2 4.39Å; L76-Y78 HydrophobicContact CB-CE2 3.59Å; L76-Y78 WeakPolarHBondContact CD1-OH 3.13Å; L76-Y78 WeakPolarHBondContact O-CD2 3.22Å; Y78-A80 PolarHBondContact O-N 2.82Å; Y78-F95 HydrophobicContact CD2-CE1 4.44Å; Y78-Y98 AromaticContact CD1-CE2 3.88Å; Y78-Y98 HydrophobicContact CD1-CE2 3.88Å; Y78-Y98 AromaticContact CE1-CE2 3.93Å; Y78-Y98 HydrophobicContact CE1-CE2 3.93Å; Y78-Y98 HydrophobicContact CG-CE2 4.28Å
79	R	90	Very high	86.5	Confident	99 Å²	99	73.2 Å²	73.2	37%	0.374	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	127.3	170.5	-173	-175.9	174.6	166.5	4.5	109.1	D96 F112	R79-D96 WeakPolarHBondContact CD-OD2 3.33Å; R79-D96 HydrophobicContact CG-CB 4.42Å; R79-D96 VanDerWaalsContact CG-OD2 3.31Å; R79-D96 WeakPolarHBondContact CG-OD2 3.37Å; R79-D96 IonicContact CZ-OD2 3.8Å; R79-D96 IonicContact NE-OD2 2.83Å; R79-D96 PolarHBondContact NE-OD2 3.35Å; R79-D96 PolarHBondContact O-N 3.04Å; R79-D96 VanDerWaalsContact O-N 3.11Å; R79-F112 HydrophobicContact CG-CD2 4.23Å; R79-F112 HydrophobicContact CG-CE2 4.18Å
80	A	91.6	Very high	86.3	Confident	0 Å²	0	74.4 Å²	74.4	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	157.6	179.4	0	0	0	0	0	111.1	Q66 C67 A69 Y78 V93 N94 F95	Q66-A80 WeakPolarHBondContact CA-O 3.47Å; C67-A80 PolarHBondContact N-O 2.99Å; C67-A80 PolarHBondContact O-N 2.95Å; A69-A80 HydrophobicContact CB-CB 3.87Å; Y78-A80 PolarHBondContact O-N 2.82Å; A80-V93 HydrophobicContact CB-CB 3.75Å; A80-V93 HydrophobicContact CB-CG2 3.93Å; A80-N94 CarbonylContact C-O 3.52Å; A80-N94 WeakPolarHBondContact CA-O 3.22Å; A80-N94 WeakPolarHBondContact CB-O 3.07Å; A80-F95 HydrophobicContact CB-CD1 3.68Å; A80-F95 HydrophobicContact CB-CE1 3.95Å; A80-F95 HydrophobicContact CB-CG 4.43Å
81	T	92.6	Very high	86.5	Confident	29 Å²	29	72.4 Å²	72.4	18%	0.178	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	129.1	177	-58	0	0	0	0	109.3	D65 L83 V93 N94 D96	D65-T81 WeakPolarHBondContact O-CA 3.23Å; T81-L83 PolarHBondContact O-N 2.87Å; T81-V93 CarbonylContact O-C 3.52Å; T81-V93 VanDerWaalsContact O-CA 3.31Å; T81-V93 WeakPolarHBondContact O-CA 3.48Å; T81-N94 PolarHBondContact N-O 2.82Å; T81-N94 PolarHBondContact O-N 3.11Å; T81-D96 PolarHBondContact OG1-OD1 3.02Å
82	I	91.9	Very high	86.9	Confident	2 Å²	2	72.5 Å²	72.5	1%	0.01	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	124	-179.4	-61.1	175.6	0	0	0	109.5	W61 G64 D65 F85 C91 V93	W61-I82 HydrophobicContact CB-CD1 3.62Å; W61-I82 HydrophobicContact CD2-CD1 3.62Å; W61-I82 HydrophobicContact CE3-CD1 3.5Å; W61-I82 VanDerWaalsContact CE3-CD1 3.5Å; W61-I82 HydrophobicContact CG-CD1 3.72Å; W61-I82 HydrophobicContact CZ3-CD1 4.32Å; G64-I82 PolarHBondContact N-O 2.78Å; D65-I82 HydrophobicContact CB-CD1 4.47Å; D65-I82 PolarHBondContact O-N 2.59Å; I82-F85 HydrophobicContact CD1-CZ 4.36Å; I82-F85 HydrophobicContact CG2-CE1 4.3Å; I82-F85 HydrophobicContact CG2-CE2 4.01Å; I82-F85 HydrophobicContact CG2-CZ 3.82Å; I82-C91 HydrophobicContact CG2-CB 4.24Å; I82-V93 HydrophobicContact CG1-CG1 4.18Å
83	L	93.3	Very high	87.4	Confident	79 Å²	79	70 Å²	70	41%	0.414	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	-44.3	-179.8	-63.1	-174.6	0	0	0	112.6	V63 T81 V92 N94 T101	V63-L83 WeakPolarHBondContact CG1-O 3.43Å; T81-L83 PolarHBondContact O-N 2.87Å; L83-V92 HydrophobicContact CB-CB 4.5Å; L83-V92 HydrophobicContact CB-CG1 4.44Å; L83-V92 HydrophobicContact CD1-CG1 4.28Å; L83-V92 PolarHBondContact N-O 2.56Å; L83-N94 HydrophobicContact CD1-CB 4.02Å; L83-N94 HydrophobicContact CD2-CB 4.2Å; L83-N94 HydrophobicContact CG-CB 4.13Å; L83-T101 HydrophobicContact CD1-CG2 3.55Å
84	E	92.2	Very high	88	Confident	110 Å²	110	61.4 Å²	61.4	51%	0.514	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	158.8	179.5	59.4	177.1	175.4	0	0	110.9	C91 V92	E84-C91 CarbonylContact O-C 3.44Å; E84-C91 VanDerWaalsContact O-CA 3.29Å; E84-C91 WeakPolarHBondContact O-CA 3.17Å; E84-C91 WeakPolarHBondContact O-CB 3.31Å; E84-V92 HydrophobicContact CG-CB 3.71Å; E84-V92 HydrophobicContact CG-CG2 3.6Å; E84-V92 PolarHBondContact O-N 2.83Å
85	F	89.7	Confident	88.2	Confident	78 Å²	78	58.4 Å²	58.4	34%	0.342	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	129.1	174.9	-67.9	-84.7	0	0	0	110.6	W61 V63 I82 G87 C91 V106	W61-F85 HydrophobicContact CB-CE1 4.05Å; W61-F85 HydrophobicContact CB-CZ 3.66Å; W61-F85 VanDerWaalsContact O-CZ 3.23Å; W61-F85 WeakPolarHBondContact O-CZ 3.32Å; V63-F85 HydrophobicContact CG2-CD2 4.09Å; V63-F85 HydrophobicContact CG2-CE2 4.08Å; I82-F85 HydrophobicContact CD1-CZ 4.36Å; I82-F85 HydrophobicContact CG2-CE1 4.3Å; I82-F85 HydrophobicContact CG2-CE2 4.01Å; I82-F85 HydrophobicContact CG2-CZ 3.82Å; F85-G87 PolarHBondContact O-N 2.74Å; F85-C91 HydrophobicContact CD1-CB 3.77Å; F85-C91 HydrophobicContact CE1-CB 4.02Å; F85-C91 HydrophobicContact CG-CB 4.5Å; F85-V106 HydrophobicContact CD1-CG2 4.14Å; F85-V106 HydrophobicContact CE1-CG2 4.12Å
86	L	87.5	Confident	88.5	Confident	87 Å²	87	55 Å²	55	46%	0.455	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	73.5	172.3	-74.8	162	0	0	0	108.1	S90 V92 V103	L86-S90 CarbonylContact C-O 3.5Å; L86-S90 WeakPolarHBondContact CA-O 3.36Å; L86-S90 PolarHBondContact N-O 3.24Å; L86-V92 HydrophobicContact CD1-CG2 3.41Å; L86-V92 VanDerWaalsContact CD1-CG2 3.41Å; L86-V92 HydrophobicContact CG-CG2 4.02Å; L86-V103 HydrophobicContact CD1-CG1 3.86Å; L86-V103 HydrophobicContact CD1-CG2 3.83Å
87	G	80.6	Confident	88.6	Confident	51 Å²	51	58.3 Å²	58.3	53%	0.526	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.7	-160.3	-173.8	0	0	0	0	0	113.1	F85	F85-G87 PolarHBondContact O-N 2.74Å
88	D	74.5	Confident	88.6	Confident	165 Å²	165	60.7 Å²	60.7	88%	0.882	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-16.9	-171.7	-58.7	-34.4	0	0	0	113.7
89	V	78.8	Confident	88.5	Confident	87 Å²	87	64.4 Å²	64.4	53%	0.527	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.5	-13.8	-169.8	-63.5	0	0	0	0	114.2	Q105 V106	V89-Q105 CarbonylContact O-C 3.53Å; V89-Q105 VanDerWaalsContact O-CA 3.22Å; V89-Q105 WeakPolarHBondContact O-CA 3.48Å; V89-V106 PolarHBondContact O-N 2.76Å
90	S	85.5	Confident	88.4	Confident	24 Å²	24	62.1 Å²	62.1	17%	0.168	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	147.8	-174.1	-58.5	0	0	0	0	111.3	L86 C104	L86-S90 CarbonylContact C-O 3.5Å; L86-S90 WeakPolarHBondContact CA-O 3.36Å; L86-S90 PolarHBondContact N-O 3.24Å; S90-C104 CarbonylContact C-O 3.58Å; S90-C104 WeakPolarHBondContact CA-O 3.29Å
91	C	90.3	Very high	88.4	Confident	0 Å²	0	66 Å²	66	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	152.1	174.3	60	0	0	0	0	110.8	I82 E84 F85 C104 V106	I82-C91 HydrophobicContact CG2-CB 4.24Å; E84-C91 CarbonylContact O-C 3.44Å; E84-C91 VanDerWaalsContact O-CA 3.29Å; E84-C91 WeakPolarHBondContact O-CA 3.17Å; E84-C91 WeakPolarHBondContact O-CB 3.31Å; F85-C91 HydrophobicContact CD1-CB 3.77Å; F85-C91 HydrophobicContact CE1-CB 4.02Å; F85-C91 HydrophobicContact CG-CB 4.5Å; C91-C104 PolarHBondContact N-O 3.4Å; C91-C104 PolarHBondContact O-N 3.09Å; C91-C104 VanDerWaalsContact O-O 3.13Å; C91-V106 HydrophobicContact CB-CG2 4.05Å
92	V	93.1	Very high	88.3	Confident	16 Å²	16	66.2 Å²	66.2	10%	0.097	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	128	168.3	-176.5	0	0	0	0	107.5	L83 E84 L86 D102 V103	L83-V92 HydrophobicContact CB-CB 4.5Å; L83-V92 HydrophobicContact CB-CG1 4.44Å; L83-V92 HydrophobicContact CD1-CG1 4.28Å; L83-V92 PolarHBondContact N-O 2.56Å; E84-V92 HydrophobicContact CG-CB 3.71Å; E84-V92 HydrophobicContact CG-CG2 3.6Å; E84-V92 PolarHBondContact O-N 2.83Å; L86-V92 HydrophobicContact CD1-CG2 3.41Å; L86-V92 VanDerWaalsContact CD1-CG2 3.41Å; L86-V92 HydrophobicContact CG-CG2 4.02Å; V92-D102 WeakPolarHBondContact CA-O 3.43Å; V92-V103 HydrophobicContact CG2-CG2 4.38Å
93	V	93	Very high	88.2	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	145.9	178.6	-59.5	0	0	0	0	109.9	A69 A80 T81 I82 F95 T101 D102 C104	A69-V93 HydrophobicContact CB-CB 4.33Å; A69-V93 HydrophobicContact CB-CG1 4.19Å; A69-V93 HydrophobicContact CB-CG2 3.76Å; A80-V93 HydrophobicContact CB-CB 3.75Å; A80-V93 HydrophobicContact CB-CG2 3.93Å; T81-V93 CarbonylContact O-C 3.52Å; T81-V93 VanDerWaalsContact O-CA 3.31Å; T81-V93 WeakPolarHBondContact O-CA 3.48Å; I82-V93 HydrophobicContact CG1-CG1 4.18Å; V93-F95 HydrophobicContact CG2-CE1 4.47Å; V93-F95 HydrophobicContact CG2-CZ 4.19Å; V93-T101 CarbonylContact O-C 3.43Å; V93-T101 WeakPolarHBondContact O-CA 3.31Å; V93-D102 PolarHBondContact N-O 3.49Å; V93-D102 PolarHBondContact O-N 2.79Å; V93-C104 HydrophobicContact CG2-CB 4.24Å
94	N	94.2	Very high	87.8	Confident	30 Å²	30	66.5 Å²	66.5	16%	0.16	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	123.7	168.2	-170.9	33.2	0	0	0	109.9	A80 T81 L83 D96 D99 T100 T101	A80-N94 CarbonylContact C-O 3.52Å; A80-N94 WeakPolarHBondContact CA-O 3.22Å; A80-N94 WeakPolarHBondContact CB-O 3.07Å; T81-N94 PolarHBondContact N-O 2.82Å; T81-N94 PolarHBondContact O-N 3.11Å; L83-N94 HydrophobicContact CD1-CB 4.02Å; L83-N94 HydrophobicContact CD2-CB 4.2Å; L83-N94 HydrophobicContact CG-CB 4.13Å; N94-D96 PolarHBondContact O-N 2.86Å; N94-D99 PolarHBondContact ND2-OD1 3.23Å; N94-T100 PolarHBondContact OD1-N 3.23Å; N94-T100 PolarHBondContact OD1-O 2.81Å; N94-T101 HydrophobicContact CB-CG2 4.18Å
95	F	92.2	Very high	87.4	Confident	6 Å²	6	65.7 Å²	65.7	3%	0.026	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	112.3	176.7	-69	-67	0	0	0	111.3	A69 C71 Y78 A80 V93 M97 Y98 D99 T100 D102	A69-F95 HydrophobicContact CB-CE1 4.1Å; A69-F95 HydrophobicContact CB-CZ 4.5Å; C71-F95 HydrophobicContact CB-CE1 4.37Å; C71-F95 HydrophobicContact CB-CE2 4.09Å; C71-F95 HydrophobicContact CB-CZ 3.76Å; Y78-F95 HydrophobicContact CD2-CE1 4.44Å; A80-F95 HydrophobicContact CB-CD1 3.68Å; A80-F95 HydrophobicContact CB-CE1 3.95Å; A80-F95 HydrophobicContact CB-CG 4.43Å; V93-F95 HydrophobicContact CG2-CE1 4.47Å; V93-F95 HydrophobicContact CG2-CZ 4.19Å; F95-M97 PolarHBondContact O-N 2.88Å; F95-Y98 HydrophobicContact CB-CD2 4.24Å; F95-Y98 PolarHBondContact O-N 2.83Å; F95-D99 PolarHBondContact O-N 3.12Å; F95-T100 WeakPolarHBondContact CD2-O 3.37Å; F95-T100 PolarHBondContact N-O 2.81Å; F95-D102 HydrophobicContact CD2-CB 4.41Å; F95-D102 HydrophobicContact CE2-CB 3.58Å; F95-D102 HydrophobicContact CZ-CB 4.36Å
96	D	89.1	Confident	86.9	Confident	58 Å²	58	63.2 Å²	63.2	31%	0.31	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-32.3	-172	-66.3	1.6	0	0	0	113.6	Q66 R79 T81 N94	Q66-D96 PolarHBondContact NE2-OD2 3.06Å; Q66-D96 VanDerWaalsContact NE2-OD2 3.09Å; R79-D96 WeakPolarHBondContact CD-OD2 3.33Å; R79-D96 HydrophobicContact CG-CB 4.42Å; R79-D96 VanDerWaalsContact CG-OD2 3.31Å; R79-D96 WeakPolarHBondContact CG-OD2 3.37Å; R79-D96 IonicContact CZ-OD2 3.8Å; R79-D96 IonicContact NE-OD2 2.83Å; R79-D96 PolarHBondContact NE-OD2 3.35Å; R79-D96 PolarHBondContact O-N 3.04Å; R79-D96 VanDerWaalsContact O-N 3.11Å; T81-D96 PolarHBondContact OG1-OD1 3.02Å; N94-D96 PolarHBondContact O-N 2.86Å
97	M	86.9	Confident	86.2	Confident	163 Å²	163	61.7 Å²	61.7	80%	0.803	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-21.6	-177.9	-67.2	-70.2	-86	0	0	113.9	F95	F95-M97 PolarHBondContact O-N 2.88Å
98	Y	85.7	Confident	86	Confident	136 Å²	136	64.2 Å²	64.2	53%	0.533	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.2	-8.7	-171.8	-60.9	-79.5	0	0	0	113.2	Y78 F95 T100	Y78-Y98 AromaticContact CD1-CE2 3.88Å; Y78-Y98 HydrophobicContact CD1-CE2 3.88Å; Y78-Y98 AromaticContact CE1-CE2 3.93Å; Y78-Y98 HydrophobicContact CE1-CE2 3.93Å; Y78-Y98 HydrophobicContact CG-CE2 4.28Å; F95-Y98 HydrophobicContact CB-CD2 4.24Å; F95-Y98 PolarHBondContact O-N 2.83Å; Y98-T100 PolarHBondContact O-N 2.83Å; Y98-T100 VanDerWaalsContact O-N 3.12Å; Y98-T100 PolarHBondContact O-OG1 2.8Å
99	D	85.3	Confident	86.1	Confident	132 Å²	132	56.4 Å²	56.4	71%	0.706	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.8	41.9	-172.5	-159	38.1	0	0	0	112.3	N94 F95	N94-D99 PolarHBondContact ND2-OD1 3.23Å; F95-D99 PolarHBondContact O-N 3.12Å
100	T	88.5	Confident	86.2	Confident	52 Å²	52	57.1 Å²	57.1	32%	0.319	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	134.3	-178.2	-60.7	0	0	0	0	108.2	N94 F95 Y98	N94-T100 PolarHBondContact OD1-N 3.23Å; N94-T100 PolarHBondContact OD1-O 2.81Å; F95-T100 WeakPolarHBondContact CD2-O 3.37Å; F95-T100 PolarHBondContact N-O 2.81Å; Y98-T100 PolarHBondContact O-N 2.83Å; Y98-T100 VanDerWaalsContact O-N 3.12Å; Y98-T100 PolarHBondContact O-OG1 2.8Å
101	T	91.9	Very high	85.6	Confident	81 Å²	81	59.5 Å²	59.5	50%	0.497	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	146.8	174.8	56.6	0	0	0	0	111.8	L83 V93 N94	L83-T101 HydrophobicContact CD1-CG2 3.55Å; V93-T101 CarbonylContact O-C 3.43Å; V93-T101 WeakPolarHBondContact O-CA 3.31Å; N94-T101 HydrophobicContact CB-CG2 4.18Å
102	D	90.6	Very high	84.6	Confident	34 Å²	34	63.8 Å²	63.8	18%	0.182	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	159.2	173.9	-157.3	-0.2	0	0	0	110.4	S72 V92 V93 F95	S72-D102 WeakPolarHBondContact CB-OD2 3.2Å; S72-D102 PolarHBondContact N-OD2 3.34Å; S72-D102 PolarHBondContact OG-OD1 3.18Å; S72-D102 PolarHBondContact OG-OD2 2.83Å; V92-D102 WeakPolarHBondContact CA-O 3.43Å; V93-D102 PolarHBondContact N-O 3.49Å; V93-D102 PolarHBondContact O-N 2.79Å; F95-D102 HydrophobicContact CD2-CB 4.41Å; F95-D102 HydrophobicContact CE2-CB 3.58Å; F95-D102 HydrophobicContact CZ-CB 4.36Å
103	V	89.8	Confident	83	Confident	79 Å²	79	66.4 Å²	66.4	48%	0.479	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	118.4	175.2	-179.3	0	0	0	0	108.3	L86 V92	L86-V103 HydrophobicContact CD1-CG1 3.86Å; L86-V103 HydrophobicContact CD1-CG2 3.83Å; V92-V103 HydrophobicContact CG2-CG2 4.38Å
104	C	85.2	Confident	81.1	Confident	8 Å²	8	71.2 Å²	71.2	5%	0.054	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	150.9	177.6	-169.7	0	0	0	0	110.3	A69 S90 C91 V93	A69-C104 HydrophobicContact CB-CB 4.26Å; S90-C104 CarbonylContact C-O 3.58Å; S90-C104 WeakPolarHBondContact CA-O 3.29Å; C91-C104 PolarHBondContact N-O 3.4Å; C91-C104 PolarHBondContact O-N 3.09Å; C91-C104 VanDerWaalsContact O-O 3.13Å; V93-C104 HydrophobicContact CG2-CB 4.24Å
105	Q	82.5	Confident	78.9	Confident	93 Å²	93	76 Å²	76	44%	0.435	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	136.9	168.2	-64.2	-175.3	-53.6	0	0	109.3	V89 C107 Y108	V89-Q105 CarbonylContact O-C 3.53Å; V89-Q105 VanDerWaalsContact O-CA 3.22Å; V89-Q105 WeakPolarHBondContact O-CA 3.48Å; Q105-C107 PolarHBondContact O-N 2.91Å; Q105-Y108 HydrophobicContact CB-CD2 3.8Å; Q105-Y108 HydrophobicContact CB-CE2 4.27Å; Q105-Y108 HydrophobicContact CG-CD2 4.46Å; Q105-Y108 PolarHBondContact O-N 3Å
106	V	80.9	Confident	76.8	Confident	26 Å²	26	86.1 Å²	86.1	16%	0.158	43%	0.434	C	S	.	.	G	3₁₀ helix	trans	-59.4	-33.6	-178.5	178.9	0	0	0	0	111.1	F85 V89 C91 Y108 C109	F85-V106 HydrophobicContact CD1-CG2 4.14Å; F85-V106 HydrophobicContact CE1-CG2 4.12Å; V89-V106 PolarHBondContact O-N 2.76Å; C91-V106 HydrophobicContact CB-CG2 4.05Å; V106-Y108 PolarHBondContact O-N 2.78Å; V106-Y108 VanDerWaalsContact O-N 3.14Å; V106-C109 WeakPolarHBondContact O-CB 3.43Å; V106-C109 PolarHBondContact O-N 2.98Å
107	C	72.8	Confident	74.6	Confident	55 Å²	55	90.9 Å²	90.9	37%	0.372	46%	0.459	S	S	.	.	G	3₁₀ helix	trans	-62.2	-18.7	175.1	-54.4	0	0	0	0	113.9	T56 Q105	T56-C107 WeakPolarHBondContact CG2-O 3.17Å; Q105-C107 PolarHBondContact O-N 2.91Å
108	Y	75.5	Confident	72.2	Confident	103 Å²	103	87.5 Å²	87.5	40%	0.404	45%	0.451	S	S	.	.	G	3₁₀ helix	trans	-103.2	9.5	175.1	-59.1	-51.7	0	0	0	113	Y77 Q105 V106	Y77-Y108 WeakPolarHBondContact CE1-O 3.37Å; Q105-Y108 HydrophobicContact CB-CD2 3.8Å; Q105-Y108 HydrophobicContact CB-CE2 4.27Å; Q105-Y108 HydrophobicContact CG-CD2 4.46Å; Q105-Y108 PolarHBondContact O-N 3Å; V106-Y108 PolarHBondContact O-N 2.78Å; V106-Y108 VanDerWaalsContact O-N 3.14Å
109	C	77.2	Confident	69.9	Low	2 Å²	2	87.2 Å²	87.2	1%	0.014	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-89.8	117.5	169	-70.6	0	0	0	0	109.1	W61 C67 M68 V106	W61-C109 HydrophobicContact CZ2-CB 3.88Å; W61-C109 WeakPolarHBondContact CZ2-O 3.34Å; C67-C109 HydrophobicContact CB-CB 4Å; M68-C109 WeakPolarHBondContact O-CA 3.48Å; V106-C109 WeakPolarHBondContact O-CB 3.43Å; V106-C109 PolarHBondContact O-N 2.98Å
110	Y	79.6	Confident	68	Low	101 Å²	101	96.4 Å²	96.4	40%	0.396	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	145.6	173.8	-63.8	-70	0	0	0	111.3	T56 W61 C67 M68 Y77 F112	T56-Y110 HydrophobicContact CG2-CD1 4.37Å; T56-Y110 HydrophobicContact CG2-CE1 4.09Å; W61-Y110 WeakPolarHBondContact CH2-O 3.23Å; C67-Y110 CarbonylContact C-O 3.55Å; C67-Y110 WeakPolarHBondContact CA-O 3.05Å; M68-Y110 PolarHBondContact N-O 3.4Å; M68-Y110 PolarHBondContact O-N 2.89Å; Y77-Y110 AromaticContact CD1-CD2 3.89Å; Y77-Y110 HydrophobicContact CD1-CD2 3.89Å; Y77-Y110 HydrophobicContact CD1-CE2 4.04Å; Y77-Y110 AromaticContact CE1-CD2 3.62Å; Y77-Y110 HydrophobicContact CE1-CD2 3.62Å; Y77-Y110 AromaticContact CE1-CE2 3.33Å; Y77-Y110 HydrophobicContact CE1-CE2 3.33Å; Y77-Y110 HydrophobicContact CE2-CE2 4.44Å; Y77-Y110 AromaticContact CZ-CE2 3.57Å; Y110-F112 PolarHBondContact O-N 2.78Å
111	I	72.9	Confident	66.9	Low	74 Å²	74	98.7 Å²	98.7	38%	0.379	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.7	128.8	170.9	-50.9	175.6	0	0	0	108.1	P57 V59 W61 T113	P57-I111 HydrophobicContact CG-CD1 4.14Å; V59-I111 HydrophobicContact CB-CG1 4.45Å; V59-I111 HydrophobicContact CG1-CG1 4.23Å; V59-I111 HydrophobicContact CG2-CD1 3.43Å; V59-I111 VanDerWaalsContact CG2-CD1 3.43Å; V59-I111 HydrophobicContact CG2-CG1 3.38Å; W61-I111 HydrophobicContact CH2-CG1 4.49Å; W61-I111 HydrophobicContact CZ2-CG1 4.5Å; I111-T113 HydrophobicContact CB-CG2 3.86Å; I111-T113 HydrophobicContact CG2-CG2 3.38Å; I111-T113 PolarHBondContact O-N 3.22Å
112	F	68.7	Low	65.6	Low	91 Å²	91	99.6 Å²	99.6	40%	0.399	50%	0.497	S	S	.	.			trans	-69	67.4	165.5	-173.7	-102.4	0	0	0	108.9	M68 R79 Y110	M68-F112 HydrophobicContact CG-CD2 4.34Å; R79-F112 HydrophobicContact CG-CD2 4.23Å; R79-F112 HydrophobicContact CG-CE2 4.18Å; Y110-F112 PolarHBondContact O-N 2.78Å
113	T	60.1	Low	64.2	Low	71 Å²	71	103.2 Å²	103.2	44%	0.436	52%	0.515	S	S	.	.			trans	-85.9	132.9	170.6	58.5	0	0	0	0	108.7	I111 L115	I111-T113 HydrophobicContact CB-CG2 3.86Å; I111-T113 HydrophobicContact CG2-CG2 3.38Å; I111-T113 PolarHBondContact O-N 3.22Å; T113-L115 PolarHBondContact O-N 3.04Å
114	S	53.6	Low	62.7	Low	100 Å²	100	104.6 Å²	104.6	70%	0.699	52%	0.517	S	S	*	.	S	Bend	trans	-69	42.5	177.9	-178.4	0	0	0	0	112.9
115	L	47.5	Very low	61.3	Low	130 Å²	130	110.7 Å²	110.7	68%	0.681	55%	0.546	S	S	*	.			trans	-103.2	2.5	-176.7	-80.3	164.4	0	0	0	114.4	T113	T113-L115 PolarHBondContact O-N 3.04Å
116	Y	48.7	Very low	59.9	Low	220 Å²	220	111.9 Å²	111.9	86%	0.863	55%	0.553	S	S	*	*	S	Bend	trans	-118	21.5	174.6	-79.7	-81.9	0	0	0	114.8
117	L	43.2	Very low	58.4	Low	158 Å²	158	118 Å²	118	83%	0.827	58%	0.581	S	S	*	*	S	Bend	trans	-113.5	26.6	174.9	-82.5	167.9	0	0	0	114
118	S	35.7	Very low	57.3	Low	92 Å²	92	122.8 Å²	122.8	64%	0.643	60%	0.597	S	S	*	*			trans	-133.9	69.4	176.1	59.3	0	0	0	0	112.2
119	T	36.9	Very low	55.8	Low	129 Å²	129	124.5 Å²	124.5	79%	0.791	61%	0.614	S	S	*	*			trans	-176.5	95.8	148.7	20.4	0	0	0	0	108.2
120	W	45.5	Very low	53.9	Low	326 Å²	326	135.6 Å²	135.6	100%	1.235	67%	0.668	S	S	*	*				177.4	0	123.6	-79.8	110.6	0	0	0	108.5

Retrieved 120 of 120 residues in 67.6 ms (Link to these results)

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