A0A3Q0KKU7_SCHMA Loading...

Barh homeobox protein, putative

AlphaFold DB , UniProt , Accession A0A3Q0KKU7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 240 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	53.4	Low	81.8	Confident	184 Å²	184	83.8 Å²	83.8	91%	0.906	44%	0.444	S	S	*	.				0	120.2	0	-72	-175.9	163.7	0	0	107.5	E5	M1-E5 WeakPolarHBondContact CA-OE2 3.21Å; M1-E5 VanDerWaalsContact CB-OE2 3.24Å; M1-E5 WeakPolarHBondContact CB-OE2 3.3Å; M1-E5 WeakPolarHBondContact CG-OE2 3.39Å
2	T	76	Confident	82.7	Confident	84 Å²	84	85.8 Å²	85.8	52%	0.515	45%	0.449	S	S	.	.			trans	-80.2	151.5	-177.5	50.2	0	0	0	0	109.5	T4 E5	T2-T4 PolarHBondContact O-N 2.76Å; T2-E5 PolarHBondContact N-OE2 3.26Å; T2-E5 WeakPolarHBondContact O-CB 3.45Å; T2-E5 PolarHBondContact O-N 3Å
3	E	76.3	Confident	83.4	Confident	90 Å²	90	83.9 Å²	83.9	42%	0.421	44%	0.439	S	S	.	.	H	α-helix	trans	-52.3	-30	179.4	-173.8	175	175.3	0	0	112.9	N6 F7 I33 I36	E3-N6 PolarHBondContact O-N 3.21Å; E3-F7 PolarHBondContact O-N 3.14Å; E3-I33 HydrophobicContact CG-CG1 4.44Å; E3-I36 VanDerWaalsContact CD-CD1 3.42Å; E3-I36 VanDerWaalsContact OE1-CD1 3.3Å; E3-I36 WeakPolarHBondContact OE1-CD1 3.31Å; E3-I36 WeakPolarHBondContact OE2-CD1 3.46Å
4	T	78.7	Confident	84.1	Confident	97 Å²	97	80.6 Å²	80.6	60%	0.595	42%	0.421	S	S	*	.	H	α-helix	trans	-61.2	-40.5	174.3	-47	0	0	0	0	113.5	T2 N6 F7 I8	T2-T4 PolarHBondContact O-N 2.76Å; T4-N6 VanDerWaalsContact C-N 3.29Å; T4-N6 PolarHBondContact O-N 2.89Å; T4-F7 PolarHBondContact O-N 3.39Å; T4-I8 HydrophobicContact CG2-CD1 4.5Å; T4-I8 PolarHBondContact O-N 2.91Å
5	E	83.1	Confident	84.8	Confident	98 Å²	98	82.3 Å²	82.3	46%	0.458	43%	0.426	S	S	.	.	H	α-helix	trans	-64.8	-37.1	178.9	-69	168.7	174	0	0	111	M1 T2 F7 I8 A9	M1-E5 WeakPolarHBondContact CA-OE2 3.21Å; M1-E5 VanDerWaalsContact CB-OE2 3.24Å; M1-E5 WeakPolarHBondContact CB-OE2 3.3Å; M1-E5 WeakPolarHBondContact CG-OE2 3.39Å; T2-E5 PolarHBondContact N-OE2 3.26Å; T2-E5 WeakPolarHBondContact O-CB 3.45Å; T2-E5 PolarHBondContact O-N 3Å; E5-F7 VanDerWaalsContact C-N 3.34Å; E5-F7 PolarHBondContact O-N 2.95Å; E5-I8 PolarHBondContact O-N 3.23Å; E5-A9 PolarHBondContact O-N 2.98Å
6	N	84.1	Confident	85.4	Confident	49 Å²	49	86.8 Å²	86.8	26%	0.262	44%	0.444	S	S	.	.	H	α-helix	trans	-65.2	-37.6	177.1	-73.7	-11.1	0	0	0	112.1	E3 T4 A9 I10 W187	E3-N6 PolarHBondContact O-N 3.21Å; T4-N6 VanDerWaalsContact C-N 3.29Å; T4-N6 PolarHBondContact O-N 2.89Å; N6-A9 PolarHBondContact O-N 2.95Å; N6-I10 WeakPolarHBondContact O-CD1 3.47Å; N6-I10 VanDerWaalsContact O-CG1 3.26Å; N6-I10 WeakPolarHBondContact O-CG1 3.36Å; N6-I10 PolarHBondContact O-N 2.86Å; N6-W187 WeakPolarHBondContact OD1-CH2 3.45Å; N6-W187 WeakPolarHBondContact OD1-CZ2 3.42Å
7	F	88.1	Confident	85.8	Confident	76 Å²	76	85.2 Å²	85.2	33%	0.333	44%	0.437	S	S	.	.	H	α-helix	trans	-62.4	-48.6	176.5	-179.1	-103.7	0	0	0	111.5	E3 T4 E5 A9 I10 Q11 L30 I33	E3-F7 PolarHBondContact O-N 3.14Å; T4-F7 PolarHBondContact O-N 3.39Å; E5-F7 VanDerWaalsContact C-N 3.34Å; E5-F7 PolarHBondContact O-N 2.95Å; F7-A9 VanDerWaalsContact C-N 3.31Å; F7-A9 PolarHBondContact O-N 3.46Å; F7-I10 PolarHBondContact O-N 3.05Å; F7-Q11 VanDerWaalsContact CE1-OE1 3.3Å; F7-Q11 WeakPolarHBondContact O-CB 2.86Å; F7-Q11 PolarHBondContact O-N 2.88Å; F7-L30 HydrophobicContact CD2-CD2 4.13Å; F7-L30 HydrophobicContact CE2-CD2 3.84Å; F7-I33 HydrophobicContact CB-CD1 4Å; F7-I33 HydrophobicContact CD2-CD1 3.84Å; F7-I33 HydrophobicContact CD2-CG2 4.01Å; F7-I33 HydrophobicContact CG-CD1 4.41Å; F7-I33 HydrophobicContact CG-CG2 4.46Å
8	I	89	Confident	86.2	Confident	95 Å²	95	85.4 Å²	85.4	49%	0.487	45%	0.445	S	S	.	.	H	α-helix	trans	-61.2	-43.3	-179.4	-63.1	169.6	0	0	0	110.2	T4 E5 I10 Q11 H12	T4-I8 HydrophobicContact CG2-CD1 4.5Å; T4-I8 PolarHBondContact O-N 2.91Å; E5-I8 PolarHBondContact O-N 3.23Å; I8-I10 PolarHBondContact O-N 3.42Å; I8-Q11 PolarHBondContact O-N 2.77Å; I8-H12 PolarHBondContact O-N 2.88Å
9	A	90.7	Very high	86.6	Confident	56 Å²	56	89.8 Å²	89.8	46%	0.463	46%	0.46	S	S	.	.	H	α-helix	trans	-61.7	-43	177.7	0	0	0	0	0	112.4	E5 N6 F7 H12 L13	E5-A9 PolarHBondContact O-N 2.98Å; N6-A9 PolarHBondContact O-N 2.95Å; F7-A9 VanDerWaalsContact C-N 3.31Å; F7-A9 PolarHBondContact O-N 3.46Å; A9-H12 PolarHBondContact O-N 3.45Å; A9-L13 WeakPolarHBondContact O-CB 3.31Å; A9-L13 PolarHBondContact O-N 3.11Å
10	I	89.5	Confident	86.9	Confident	17 Å²	17	90.3 Å²	90.3	9%	0.087	46%	0.456	C	S	.	.	H	α-helix	trans	-68.2	-39.2	177.9	-70.1	167.3	0	0	0	111.1	N6 F7 I8 L13 I14 V26 I29 L30	N6-I10 WeakPolarHBondContact O-CD1 3.47Å; N6-I10 VanDerWaalsContact O-CG1 3.26Å; N6-I10 WeakPolarHBondContact O-CG1 3.36Å; N6-I10 PolarHBondContact O-N 2.86Å; F7-I10 PolarHBondContact O-N 3.05Å; I8-I10 PolarHBondContact O-N 3.42Å; I10-L13 WeakPolarHBondContact O-CB 3.47Å; I10-L13 PolarHBondContact O-N 3.37Å; I10-I14 HydrophobicContact CG2-CD1 3.85Å; I10-I14 HydrophobicContact CG2-CG1 4.47Å; I10-I14 VanDerWaalsContact O-CG1 3.29Å; I10-I14 WeakPolarHBondContact O-CG1 3.38Å; I10-I14 PolarHBondContact O-N 3.25Å; I10-V26 HydrophobicContact CG2-CG1 3.78Å; I10-I29 HydrophobicContact CD1-CB 3.73Å; I10-I29 HydrophobicContact CD1-CD1 3.66Å; I10-I29 HydrophobicContact CD1-CG1 4.27Å; I10-I29 HydrophobicContact CD1-CG2 3.19Å; I10-L30 HydrophobicContact CG2-CD2 4.07Å; I10-L30 HydrophobicContact CG2-CG 4.26Å
11	Q	91.1	Very high	87.2	Confident	76 Å²	76	87.9 Å²	87.9	36%	0.355	45%	0.451	S	S	.	.	H	α-helix	trans	-61	-48.8	175.7	-177	169.6	3	0	0	110.8	F7 I8 L13 I14 E15	F7-Q11 VanDerWaalsContact CE1-OE1 3.3Å; F7-Q11 WeakPolarHBondContact O-CB 2.86Å; F7-Q11 PolarHBondContact O-N 2.88Å; I8-Q11 PolarHBondContact O-N 2.77Å; Q11-L13 VanDerWaalsContact C-N 3.28Å; Q11-L13 PolarHBondContact O-N 3.26Å; Q11-I14 PolarHBondContact O-N 3.48Å; Q11-E15 WeakPolarHBondContact CG-OE1 3.43Å; Q11-E15 PolarHBondContact NE2-OE1 2.87Å; Q11-E15 WeakPolarHBondContact O-CG 3.24Å; Q11-E15 PolarHBondContact O-N 3.49Å
12	H	92.1	Very high	89.1	Confident	108 Å²	108	88.5 Å²	88.5	50%	0.5	44%	0.444	S	S	.	.	H	α-helix	trans	-57.9	-40.2	174.3	-109.3	-116.9	0	0	0	112.4	I8 A9 I14 E15 Q16	I8-H12 PolarHBondContact O-N 2.88Å; A9-H12 PolarHBondContact O-N 3.45Å; H12-I14 PolarHBondContact O-N 2.69Å; H12-E15 PolarHBondContact O-N 3.25Å; H12-Q16 WeakPolarHBondContact O-CB 3.31Å; H12-Q16 WeakPolarHBondContact O-CG 3.49Å; H12-Q16 PolarHBondContact O-N 3.22Å
13	L	92.6	Very high	89.9	Confident	61 Å²	61	88.1 Å²	88.1	32%	0.319	44%	0.436	S	S	.	.	H	α-helix	trans	-63.1	-41.5	178.2	-176.9	66.6	0	0	0	112	A9 I10 Q11 N17 W20	A9-L13 WeakPolarHBondContact O-CB 3.31Å; A9-L13 PolarHBondContact O-N 3.11Å; I10-L13 WeakPolarHBondContact O-CB 3.47Å; I10-L13 PolarHBondContact O-N 3.37Å; Q11-L13 VanDerWaalsContact C-N 3.28Å; Q11-L13 PolarHBondContact O-N 3.26Å; L13-N17 PolarHBondContact O-N 3.33Å; L13-W20 HydrophobicContact CD1-CG 4.32Å; L13-W20 HydrophobicContact CD2-CB 4.34Å; L13-W20 HydrophobicContact CD2-CD2 4Å; L13-W20 HydrophobicContact CD2-CE3 4.38Å; L13-W20 HydrophobicContact CD2-CG 3.97Å; L13-W20 HydrophobicContact CG-CB 4.2Å; L13-W20 HydrophobicContact CG-CD2 4.28Å; L13-W20 HydrophobicContact CG-CG 3.82Å
14	I	93.3	Very high	90.6	Very high	38 Å²	38	88.5 Å²	88.5	20%	0.195	45%	0.446	C	S	.	.	H	α-helix	trans	-69.9	-39.2	177.3	-65.5	164.6	0	0	0	110.9	I10 Q11 H12 N17 P18 W20 A21 V26 L30	I10-I14 HydrophobicContact CG2-CD1 3.85Å; I10-I14 HydrophobicContact CG2-CG1 4.47Å; I10-I14 VanDerWaalsContact O-CG1 3.29Å; I10-I14 WeakPolarHBondContact O-CG1 3.38Å; I10-I14 PolarHBondContact O-N 3.25Å; Q11-I14 PolarHBondContact O-N 3.48Å; H12-I14 PolarHBondContact O-N 2.69Å; I14-N17 CarbonylContact O-C 3.1Å; I14-N17 PolarHBondContact O-N 3.13Å; I14-P18 WeakPolarHBondContact O-CA 3.29Å; I14-W20 HydrophobicContact CG1-CB 4.37Å; I14-A21 HydrophobicContact CG2-CB 3.94Å; I14-V26 HydrophobicContact CD1-CG1 3.66Å; I14-V26 HydrophobicContact CG1-CG1 4.12Å; I14-L30 HydrophobicContact CD1-CD1 3.87Å
15	E	93.5	Very high	91.2	Very high	106 Å²	106	87 Å²	87	50%	0.495	44%	0.437	S	S	.	.	H	α-helix	trans	-64.2	-41	177.1	-75	174	-171.1	0	0	111.8	Q11 H12	Q11-E15 WeakPolarHBondContact CG-OE1 3.43Å; Q11-E15 PolarHBondContact NE2-OE1 2.87Å; Q11-E15 WeakPolarHBondContact O-CG 3.24Å; Q11-E15 PolarHBondContact O-N 3.49Å; H12-E15 PolarHBondContact O-N 3.25Å
16	Q	94.7	Very high	91.5	Very high	153 Å²	153	82.7 Å²	82.7	72%	0.715	42%	0.418	S	S	*	.	H	α-helix	trans	-70.1	-35.4	175.3	-73.6	-176	-17.9	0	0	112.5	H12	H12-Q16 WeakPolarHBondContact O-CB 3.31Å; H12-Q16 WeakPolarHBondContact O-CG 3.49Å; H12-Q16 PolarHBondContact O-N 3.22Å
17	N	92.1	Very high	91.8	Very high	60 Å²	60	87.5 Å²	87.5	32%	0.321	44%	0.436	S	S	.	.			trans	-147.1	104.3	179.9	-179.2	-15.9	0	0	0	111.5	L13 I14 F19 W20	L13-N17 PolarHBondContact O-N 3.33Å; I14-N17 CarbonylContact O-C 3.1Å; I14-N17 PolarHBondContact O-N 3.13Å; N17-F19 PolarHBondContact O-N 3.27Å; N17-F19 VanDerWaalsContact OD1-CB 3.31Å; N17-F19 WeakPolarHBondContact OD1-CB 3.41Å; N17-F19 VanDerWaalsContact OD1-CD2 3.24Å; N17-F19 WeakPolarHBondContact OD1-CD2 3.43Å; N17-F19 PolarHBondContact OD1-N 3.02Å; N17-W20 PolarHBondContact O-N 3.31Å; N17-W20 VanDerWaalsContact O-N 3.12Å
18	P	93.7	Very high	91.9	Very high	89 Å²	89	91.2 Å²	91.2	58%	0.578	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-59.2	-20.4	-177.9	-27.5	35.2	0	0	0	115.1	I14 W20 A21	I14-P18 WeakPolarHBondContact O-CA 3.29Å; P18-W20 PolarHBondContact O-N 3.34Å; P18-A21 VanDerWaalsContact O-CB 3.31Å; P18-A21 WeakPolarHBondContact O-CB 3.35Å; P18-A21 PolarHBondContact O-N 3.15Å; P18-A21 VanDerWaalsContact O-N 3.16Å
19	F	93.6	Very high	91.8	Very high	169 Å²	169	89.2 Å²	89.2	74%	0.741	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-64.1	-26.3	178.5	-68.6	-73.2	0	0	0	112.4	N17 A21 Y22	N17-F19 PolarHBondContact O-N 3.27Å; N17-F19 VanDerWaalsContact OD1-CB 3.31Å; N17-F19 WeakPolarHBondContact OD1-CB 3.41Å; N17-F19 VanDerWaalsContact OD1-CD2 3.24Å; N17-F19 WeakPolarHBondContact OD1-CD2 3.43Å; N17-F19 PolarHBondContact OD1-N 3.02Å; F19-A21 PolarHBondContact O-N 2.93Å; F19-Y22 PolarHBondContact O-N 3.23Å
20	W	93.4	Very high	91.6	Very high	99 Å²	99	89.3 Å²	89.3	38%	0.375	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-66.5	-24.2	176.6	-72.3	111.1	0	0	0	113.5	L13 I14 N17 P18 Y22 H23 V26	L13-W20 HydrophobicContact CD1-CG 4.32Å; L13-W20 HydrophobicContact CD2-CB 4.34Å; L13-W20 HydrophobicContact CD2-CD2 4Å; L13-W20 HydrophobicContact CD2-CE3 4.38Å; L13-W20 HydrophobicContact CD2-CG 3.97Å; L13-W20 HydrophobicContact CG-CB 4.2Å; L13-W20 HydrophobicContact CG-CD2 4.28Å; L13-W20 HydrophobicContact CG-CG 3.82Å; I14-W20 HydrophobicContact CG1-CB 4.37Å; N17-W20 PolarHBondContact O-N 3.31Å; N17-W20 VanDerWaalsContact O-N 3.12Å; P18-W20 PolarHBondContact O-N 3.34Å; W20-Y22 PolarHBondContact O-N 3.35Å; W20-Y22 VanDerWaalsContact O-N 3.12Å; W20-H23 HydrophobicContact CE3-CB 3.91Å; W20-H23 AromaticContact CE3-CG 3.98Å; W20-H23 HydrophobicContact CZ3-CB 4.44Å; W20-H23 AromaticContact CZ3-CD2 3.83Å; W20-H23 WeakPolarHBondContact O-CB 3.43Å; W20-H23 PolarHBondContact O-N 3.49Å; W20-V26 HydrophobicContact CB-CG2 4.48Å; W20-V26 WeakPolarHBondContact O-CB 3.33Å; W20-V26 WeakPolarHBondContact O-CG1 3.4Å; W20-V26 WeakPolarHBondContact O-CG2 3.49Å
21	A	91.6	Very high	91.4	Very high	41 Å²	41	91.5 Å²	91.5	34%	0.339	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-58.9	-26.3	176.1	0	0	0	0	0	112.7	I14 P18 F19	I14-A21 HydrophobicContact CG2-CB 3.94Å; P18-A21 VanDerWaalsContact O-CB 3.31Å; P18-A21 WeakPolarHBondContact O-CB 3.35Å; P18-A21 PolarHBondContact O-N 3.15Å; P18-A21 VanDerWaalsContact O-N 3.16Å; F19-A21 PolarHBondContact O-N 2.93Å
22	Y	93.7	Very high	91	Very high	197 Å²	197	91.3 Å²	91.3	77%	0.773	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-94.1	-4.1	179.7	-58.1	-80.1	0	0	0	113.3	F19 W20	F19-Y22 PolarHBondContact O-N 3.23Å; W20-Y22 PolarHBondContact O-N 3.35Å; W20-Y22 VanDerWaalsContact O-N 3.12Å
23	H	92.7	Very high	90.2	Very high	76 Å²	76	87.2 Å²	87.2	35%	0.352	43%	0.431	S	S	.	.			trans	-70.7	131.1	-179.5	-165.7	-86.9	0	0	0	110.4	W20 T25 V26 K27	W20-H23 HydrophobicContact CE3-CB 3.91Å; W20-H23 AromaticContact CE3-CG 3.98Å; W20-H23 HydrophobicContact CZ3-CB 4.44Å; W20-H23 AromaticContact CZ3-CD2 3.83Å; W20-H23 WeakPolarHBondContact O-CB 3.43Å; W20-H23 PolarHBondContact O-N 3.49Å; H23-T25 VanDerWaalsContact C-N 3.26Å; H23-T25 PolarHBondContact CE1-OG1 3.28Å; H23-T25 VanDerWaalsContact CE1-OG1 3.22Å; H23-T25 WeakPolarHBondContact ND1-CB 3.32Å; H23-T25 PolarHBondContact ND1-N 2.8Å; H23-T25 PolarHBondContact ND1-OG1 3.43Å; H23-T25 PolarHBondContact O-N 2.81Å; H23-T25 VanDerWaalsContact O-N 3.17Å; H23-V26 HydrophobicContact CB-CB 4.31Å; H23-V26 HydrophobicContact CB-CG2 4.17Å; H23-V26 PolarHBondContact O-N 3.37Å; H23-V26 VanDerWaalsContact O-N 3.09Å; H23-K27 PolarHBondContact O-N 3.12Å
24	P	92.2	Very high	88.8	Confident	97 Å²	97	90.3 Å²	90.3	63%	0.63	45%	0.448	S	S	*	.	H	α-helix	trans	-53.4	-40.3	-177	-28.6	34.7	0	0	0	114.1	K27 Y28	P24-K27 PolarHBondContact O-N 3.04Å; P24-Y28 WeakPolarHBondContact O-CB 3.34Å; P24-Y28 PolarHBondContact O-N 3.16Å
25	T	90.7	Very high	87	Confident	65 Å²	65	92.1 Å²	92.1	40%	0.399	46%	0.462	S	S	.	.	H	α-helix	trans	-64.8	-45.1	178.5	-47.3	0	0	0	0	112.4	H23 K27 Y28 I29	H23-T25 VanDerWaalsContact C-N 3.26Å; H23-T25 PolarHBondContact CE1-OG1 3.28Å; H23-T25 VanDerWaalsContact CE1-OG1 3.22Å; H23-T25 WeakPolarHBondContact ND1-CB 3.32Å; H23-T25 PolarHBondContact ND1-N 2.8Å; H23-T25 PolarHBondContact ND1-OG1 3.43Å; H23-T25 PolarHBondContact O-N 2.81Å; H23-T25 VanDerWaalsContact O-N 3.17Å; T25-K27 VanDerWaalsContact C-N 3.32Å; T25-K27 PolarHBondContact O-N 3.15Å; T25-Y28 PolarHBondContact O-N 3.22Å; T25-I29 HydrophobicContact CG2-CD1 3.98Å; T25-I29 VanDerWaalsContact O-CG1 3.28Å; T25-I29 WeakPolarHBondContact O-CG1 3.26Å; T25-I29 PolarHBondContact O-N 2.68Å
26	V	90	Very high	85.1	Confident	8 Å²	8	91.6 Å²	91.6	5%	0.048	46%	0.462	C	S	.	.	H	α-helix	trans	-62.7	-44.5	177.9	169	0	0	0	0	109.6	I10 I14 W20 H23 Y28 I29 L30	I10-V26 HydrophobicContact CG2-CG1 3.78Å; I14-V26 HydrophobicContact CD1-CG1 3.66Å; I14-V26 HydrophobicContact CG1-CG1 4.12Å; W20-V26 HydrophobicContact CB-CG2 4.48Å; W20-V26 WeakPolarHBondContact O-CB 3.33Å; W20-V26 WeakPolarHBondContact O-CG1 3.4Å; W20-V26 WeakPolarHBondContact O-CG2 3.49Å; H23-V26 HydrophobicContact CB-CB 4.31Å; H23-V26 HydrophobicContact CB-CG2 4.17Å; H23-V26 PolarHBondContact O-N 3.37Å; H23-V26 VanDerWaalsContact O-N 3.09Å; V26-Y28 VanDerWaalsContact C-N 3.34Å; V26-Y28 PolarHBondContact O-N 3.49Å; V26-I29 PolarHBondContact O-N 2.96Å; V26-L30 HydrophobicContact CG1-CD1 3.8Å; V26-L30 HydrophobicContact CG1-CG 4.25Å; V26-L30 WeakPolarHBondContact O-CB 3.47Å; V26-L30 VanDerWaalsContact O-CG 3.3Å; V26-L30 WeakPolarHBondContact O-CG 3.43Å; V26-L30 PolarHBondContact O-N 3.32Å
27	K	90.6	Very high	83	Confident	150 Å²	150	91.7 Å²	91.7	65%	0.652	46%	0.462	S	S	*	.	H	α-helix	trans	-59.5	-43.1	175.9	-171.2	175.3	-177.7	176.3	0	112.5	H23 P24 T25 S31	H23-K27 PolarHBondContact O-N 3.12Å; P24-K27 PolarHBondContact O-N 3.04Å; T25-K27 VanDerWaalsContact C-N 3.32Å; T25-K27 PolarHBondContact O-N 3.15Å; K27-S31 VanDerWaalsContact O-CB 3.3Å; K27-S31 WeakPolarHBondContact O-CB 3.45Å; K27-S31 PolarHBondContact O-N 3.27Å; K27-S31 PolarHBondContact O-OG 3.01Å
28	Y	89.5	Confident	81	Confident	155 Å²	155	98 Å²	98	61%	0.608	49%	0.486	S	S	*	.	H	α-helix	trans	-61.7	-48.3	176.5	179.2	-105.6	0	0	0	111.4	P24 T25 V26 S31 N32	P24-Y28 WeakPolarHBondContact O-CB 3.34Å; P24-Y28 PolarHBondContact O-N 3.16Å; T25-Y28 PolarHBondContact O-N 3.22Å; V26-Y28 VanDerWaalsContact C-N 3.34Å; V26-Y28 PolarHBondContact O-N 3.49Å; Y28-S31 WeakPolarHBondContact CA-OG 3.32Å; Y28-S31 PolarHBondContact O-N 3.05Å; Y28-S31 PolarHBondContact O-OG 3.41Å; Y28-N32 WeakPolarHBondContact CD1-ND2 3.35Å; Y28-N32 WeakPolarHBondContact CE1-ND2 3Å; Y28-N32 WeakPolarHBondContact CE2-ND2 3.24Å; Y28-N32 VanDerWaalsContact O-CG 3.3Å; Y28-N32 PolarHBondContact O-N 2.86Å; Y28-N32 PolarHBondContact O-ND2 2.99Å; Y28-N32 PolarHBondContact OH-ND2 3.25Å
29	I	86.7	Confident	78.7	Confident	53 Å²	53	99.2 Å²	99.2	27%	0.272	50%	0.497	S	S	.	.	H	α-helix	trans	-63.5	-48.4	-179.7	-61.7	164.1	0	0	0	110.8	I10 T25 V26 S31 N32 I33	I10-I29 HydrophobicContact CD1-CB 3.73Å; I10-I29 HydrophobicContact CD1-CD1 3.66Å; I10-I29 HydrophobicContact CD1-CG1 4.27Å; I10-I29 HydrophobicContact CD1-CG2 3.19Å; T25-I29 HydrophobicContact CG2-CD1 3.98Å; T25-I29 VanDerWaalsContact O-CG1 3.28Å; T25-I29 WeakPolarHBondContact O-CG1 3.26Å; T25-I29 PolarHBondContact O-N 2.68Å; V26-I29 PolarHBondContact O-N 2.96Å; I29-S31 VanDerWaalsContact C-N 3.25Å; I29-S31 PolarHBondContact O-N 3.34Å; I29-N32 PolarHBondContact O-N 3.46Å; I29-N32 VanDerWaalsContact O-N 3.07Å; I29-I33 HydrophobicContact CG2-CD1 3.56Å; I29-I33 HydrophobicContact CG2-CG1 4.33Å; I29-I33 WeakPolarHBondContact O-CG1 3.46Å; I29-I33 PolarHBondContact O-N 2.93Å; I29-I33 VanDerWaalsContact O-N 3.1Å
30	L	85.9	Confident	76.2	Confident	58 Å²	58	95.8 Å²	95.8	30%	0.304	49%	0.494	S	S	.	.	H	α-helix	trans	-59.3	-35.9	176.4	-69.6	176	0	0	0	112.5	F7 I10 I14 V26 N32	F7-L30 HydrophobicContact CD2-CD2 4.13Å; F7-L30 HydrophobicContact CE2-CD2 3.84Å; I10-L30 HydrophobicContact CG2-CD2 4.07Å; I10-L30 HydrophobicContact CG2-CG 4.26Å; I14-L30 HydrophobicContact CD1-CD1 3.87Å; V26-L30 HydrophobicContact CG1-CD1 3.8Å; V26-L30 HydrophobicContact CG1-CG 4.25Å; V26-L30 WeakPolarHBondContact O-CB 3.47Å; V26-L30 VanDerWaalsContact O-CG 3.3Å; V26-L30 WeakPolarHBondContact O-CG 3.43Å; V26-L30 PolarHBondContact O-N 3.32Å; L30-N32 VanDerWaalsContact C-N 3.33Å
31	S	86.1	Confident	73.5	Confident	63 Å²	63	96.4 Å²	96.4	44%	0.441	51%	0.513	S	S	.	.	H	α-helix	trans	-69.6	-30	177	69.8	0	0	0	0	113.5	K27 Y28 I29	K27-S31 VanDerWaalsContact O-CB 3.3Å; K27-S31 WeakPolarHBondContact O-CB 3.45Å; K27-S31 PolarHBondContact O-N 3.27Å; K27-S31 PolarHBondContact O-OG 3.01Å; Y28-S31 WeakPolarHBondContact CA-OG 3.32Å; Y28-S31 PolarHBondContact O-N 3.05Å; Y28-S31 PolarHBondContact O-OG 3.41Å; I29-S31 VanDerWaalsContact C-N 3.25Å; I29-S31 PolarHBondContact O-N 3.34Å
32	N	81.4	Confident	70.9	Confident	71 Å²	71	99.7 Å²	99.7	38%	0.38	53%	0.534	S	S	.	.	H	α-helix	trans	-85.9	-19.8	-179.1	-68.8	-24	0	0	0	113.9	Y28 I29 L30 N34 P35	Y28-N32 WeakPolarHBondContact CD1-ND2 3.35Å; Y28-N32 WeakPolarHBondContact CE1-ND2 3Å; Y28-N32 WeakPolarHBondContact CE2-ND2 3.24Å; Y28-N32 VanDerWaalsContact O-CG 3.3Å; Y28-N32 PolarHBondContact O-N 2.86Å; Y28-N32 PolarHBondContact O-ND2 2.99Å; Y28-N32 PolarHBondContact OH-ND2 3.25Å; I29-N32 PolarHBondContact O-N 3.46Å; I29-N32 VanDerWaalsContact O-N 3.07Å; L30-N32 VanDerWaalsContact C-N 3.33Å; N32-N34 VanDerWaalsContact C-N 3.35Å; N32-P35 VanDerWaalsContact C-CD 3.42Å; N32-P35 WeakPolarHBondContact O-CD 3.25Å
33	I	76.7	Confident	68.1	Low	23 Å²	23	95.5 Å²	95.5	12%	0.118	53%	0.534	C	S	.	.	H	α-helix	trans	-79.9	-25.4	175.4	-64.8	162.5	0	0	0	110.6	E3 F7 I29 I36	E3-I33 HydrophobicContact CG-CG1 4.44Å; F7-I33 HydrophobicContact CB-CD1 4Å; F7-I33 HydrophobicContact CD2-CD1 3.84Å; F7-I33 HydrophobicContact CD2-CG2 4.01Å; F7-I33 HydrophobicContact CG-CD1 4.41Å; F7-I33 HydrophobicContact CG-CG2 4.46Å; I29-I33 HydrophobicContact CG2-CD1 3.56Å; I29-I33 HydrophobicContact CG2-CG1 4.33Å; I29-I33 WeakPolarHBondContact O-CG1 3.46Å; I29-I33 PolarHBondContact O-N 2.93Å; I29-I33 VanDerWaalsContact O-N 3.1Å; I33-I36 PolarHBondContact O-N 3.47Å
34	N	63	Low	65.3	Low	126 Å²	126	97.3 Å²	97.3	67%	0.674	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.1	-27.5	-177.9	-125.5	-3.2	0	0	0	116.2	N32	N32-N34 VanDerWaalsContact C-N 3.35Å
35	P	55.1	Low	62.6	Low	75 Å²	75	97.7 Å²	97.7	49%	0.487	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.9	-18.4	-179.3	-13.6	30.3	0	0	0	115.4	N32 H37 K38	N32-P35 VanDerWaalsContact C-CD 3.42Å; N32-P35 WeakPolarHBondContact O-CD 3.25Å; P35-H37 VanDerWaalsContact C-N 3.25Å; P35-H37 PolarHBondContact O-N 3.04Å; P35-K38 PolarHBondContact O-N 3.22Å
36	I	52.8	Low	59.9	Low	95 Å²	95	100 Å²	100	49%	0.487	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.9	-19.7	-173.7	-58	-178.3	0	0	0	112.3	E3 I33	E3-I36 VanDerWaalsContact CD-CD1 3.42Å; E3-I36 VanDerWaalsContact OE1-CD1 3.3Å; E3-I36 WeakPolarHBondContact OE1-CD1 3.31Å; E3-I36 WeakPolarHBondContact OE2-CD1 3.46Å; I33-I36 PolarHBondContact O-N 3.47Å
37	H	51.3	Low	57.4	Low	155 Å²	155	106.6 Å²	106.6	72%	0.718	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.9	-3	177.7	-72.2	-84.2	0	0	0	115	P35	P35-H37 VanDerWaalsContact C-N 3.25Å; P35-H37 PolarHBondContact O-N 3.04Å
38	K	49.9	Very low	54.7	Low	193 Å²	193	104.2 Å²	104.2	84%	0.839	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	-16.8	176.9	-92.1	-178.5	177.4	178.6	0	114.8	P35	P35-K38 PolarHBondContact O-N 3.22Å
39	S	46.1	Very low	52.3	Low	115 Å²	115	102 Å²	102	80%	0.804	61%	0.605	S	S	*	*	S	Bend	trans	-93	-7.9	178.2	-62	0	0	0	0	114.1
40	S	41.4	Very low	49.7	Very low	96 Å²	96	104.4 Å²	104.4	67%	0.671	62%	0.622	S	S	*	*			trans	-107.2	81.8	173.3	-61.2	0	0	0	0	109.9
41	S	35.4	Very low	47.3	Very low	112 Å²	112	106.6 Å²	106.6	78%	0.783	64%	0.638	S	S	*	*			trans	-53.6	137.3	162.8	-150.8	0	0	0	0	109.8
42	S	37.5	Very low	44.7	Very low	110 Å²	110	108 Å²	108	77%	0.769	64%	0.644	S	S	*	*			trans	73.7	72.7	168.1	-53.9	0	0	0	0	117.9
43	S	35.8	Very low	42.7	Very low	110 Å²	110	110.1 Å²	110.1	77%	0.769	66%	0.661	S	S	*	*			trans	-159.5	95.7	136.2	-82.7	0	0	0	0	109.6	T45	S43-T45 PolarHBondContact O-N 2.91Å
44	S	33.8	Very low	40.7	Very low	113 Å²	113	114 Å²	114	79%	0.79	69%	0.686	S	S	*	*			trans	-52.3	96.4	164.7	158.1	0	0	0	0	109.6
45	T	34.7	Very low	39.4	Very low	106 Å²	106	114.2 Å²	114.2	65%	0.65	69%	0.693	S	S	*	*			trans	-123.8	84.9	155.9	-34.3	0	0	0	0	106.4	S43 L47	S43-T45 PolarHBondContact O-N 2.91Å; T45-L47 HydrophobicContact CG2-CD2 4.31Å; T45-L47 HydrophobicContact CG2-CG 4.22Å; T45-L47 PolarHBondContact O-N 3.18Å
46	T	34.6	Very low	38.2	Very low	114 Å²	114	118.5 Å²	118.5	70%	0.699	70%	0.704	S	S	*	*			trans	-61	87.3	161.8	-34.7	0	0	0	0	106	T48	T46-T48 WeakPolarHBondContact CG2-OG1 3.45Å; T46-T48 PolarHBondContact O-N 2.81Å
47	L	37.9	Very low	37.6	Very low	145 Å²	145	119.3 Å²	119.3	76%	0.759	72%	0.715	S	S	*	*			trans	-72.3	76	161.3	-71.2	170.4	0	0	0	105.5	T45 T49	T45-L47 HydrophobicContact CG2-CD2 4.31Å; T45-L47 HydrophobicContact CG2-CG 4.22Å; T45-L47 PolarHBondContact O-N 3.18Å; L47-T49 PolarHBondContact O-N 2.87Å
48	T	33.6	Very low	37.1	Very low	101 Å²	101	119.3 Å²	119.3	62%	0.62	72%	0.718	S	S	*	*			trans	-67.9	83.8	160.4	-27.7	0	0	0	0	104.6	T46 T50	T46-T48 WeakPolarHBondContact CG2-OG1 3.45Å; T46-T48 PolarHBondContact O-N 2.81Å; T48-T50 PolarHBondContact O-N 2.87Å
49	T	38.4	Very low	36.6	Very low	108 Å²	108	115 Å²	115	66%	0.663	71%	0.709	S	S	*	*			trans	-69.2	82.1	164.2	-32.2	0	0	0	0	104.9	L47 T51	L47-T49 PolarHBondContact O-N 2.87Å; T49-T51 HydrophobicContact CG2-CG2 4.2Å; T49-T51 PolarHBondContact O-N 3.47Å
50	T	31.6	Very low	36.4	Very low	104 Å²	104	114.7 Å²	114.7	64%	0.638	70%	0.701	S	S	*	*			trans	-68.6	79.1	167.5	-48.3	0	0	0	0	105.8	T48 T52	T48-T50 PolarHBondContact O-N 2.87Å; T50-T52 HydrophobicContact CG2-CG2 4.34Å; T50-T52 PolarHBondContact O-N 2.77Å
51	T	37.2	Very low	36.2	Very low	103 Å²	103	116.4 Å²	116.4	63%	0.632	70%	0.703	S	S	*	*			trans	-66.8	87.1	160.1	45.9	0	0	0	0	105.3	T49 P53	T49-T51 HydrophobicContact CG2-CG2 4.2Å; T49-T51 PolarHBondContact O-N 3.47Å; T51-P53 VanDerWaalsContact O-CD 3.3Å; T51-P53 WeakPolarHBondContact O-CD 3.28Å; T51-P53 VanDerWaalsContact O-N 3.16Å
52	T	30.7	Very low	36.7	Very low	93 Å²	93	117.3 Å²	117.3	57%	0.571	70%	0.698	S	S	*	*			trans	-51.6	120.7	161	34.8	0	0	0	0	106	T50 T54	T50-T52 HydrophobicContact CG2-CG2 4.34Å; T50-T52 PolarHBondContact O-N 2.77Å; T52-T54 PolarHBondContact O-N 3.08Å; T52-T54 PolarHBondContact O-OG1 2.91Å
53	P	38.9	Very low	36.5	Very low	115 Å²	115	117.2 Å²	117.2	75%	0.747	70%	0.697	S	S	*	*			trans	-66.4	85.7	170.1	27.7	-31.7	0	0	0	105.7	T51 T55	T51-P53 VanDerWaalsContact O-CD 3.3Å; T51-P53 WeakPolarHBondContact O-CD 3.28Å; T51-P53 VanDerWaalsContact O-N 3.16Å; P53-T55 PolarHBondContact O-N 3.44Å
54	T	34.2	Very low	36.8	Very low	105 Å²	105	119.1 Å²	119.1	64%	0.644	70%	0.698	S	S	*	*			trans	-73.5	83.6	163.9	21.3	0	0	0	0	104.5	T52 K56	T52-T54 PolarHBondContact O-N 3.08Å; T52-T54 PolarHBondContact O-OG1 2.91Å; T54-K56 PolarHBondContact O-N 3.41Å
55	T	36.1	Very low	36.8	Very low	131 Å²	131	121.3 Å²	121.3	80%	0.804	70%	0.701	S	S	*	*			trans	-63	55.8	155.9	31.7	0	0	0	0	108.8	P53 P57	P53-T55 PolarHBondContact O-N 3.44Å; T55-P57 WeakPolarHBondContact O-CD 3.46Å
56	K	30.4	Very low	36.8	Very low	165 Å²	165	122.5 Å²	122.5	72%	0.717	70%	0.703	S	S	*	*			trans	-87.3	112.4	156.8	-76	-171.6	177.5	-177.9	0	104.6	T54 I58	T54-K56 PolarHBondContact O-N 3.41Å; K56-I58 PolarHBondContact O-N 3.27Å
57	P	41.1	Very low	36.9	Very low	111 Å²	111	125.1 Å²	125.1	72%	0.721	71%	0.707	S	S	*	*			trans	-53.2	122.8	170.1	22.5	-30.9	0	0	0	106.8	T55 T59	T55-P57 WeakPolarHBondContact O-CD 3.46Å; P57-T59 PolarHBondContact O-N 3.15Å
58	I	39.6	Very low	36.9	Very low	155 Å²	155	125.9 Å²	125.9	80%	0.795	71%	0.712	S	S	*	*			trans	-69.4	91.3	168.8	-60	175.6	0	0	0	104.6	K56 V60	K56-I58 PolarHBondContact O-N 3.27Å; I58-V60 HydrophobicContact CG2-CG2 3.69Å; I58-V60 PolarHBondContact O-N 3.27Å
59	T	39.3	Very low	37.1	Very low	104 Å²	104	126 Å²	126	64%	0.638	72%	0.718	S	S	*	*			trans	-69.6	91.8	165.5	-56.5	0	0	0	0	106.4	P57 N61	P57-T59 PolarHBondContact O-N 3.15Å; T59-N61 VanDerWaalsContact C-N 3.26Å; T59-N61 WeakPolarHBondContact CG2-OD1 3.33Å; T59-N61 PolarHBondContact O-N 3.37Å
60	V	43.5	Very low	37	Very low	107 Å²	107	126.5 Å²	126.5	65%	0.648	73%	0.725	S	S	*	*			trans	-71.3	91.9	166.8	-168.6	0	0	0	0	105.8	I58 I62	I58-V60 HydrophobicContact CG2-CG2 3.69Å; I58-V60 PolarHBondContact O-N 3.27Å; V60-I62 HydrophobicContact CG1-CG1 3.99Å; V60-I62 PolarHBondContact O-N 3.04Å
61	N	36.5	Very low	37.3	Very low	132 Å²	132	128.2 Å²	128.2	71%	0.706	73%	0.73	S	S	*	*			trans	-70.4	89.9	169.4	-90.7	-9.1	0	0	0	107.8	T59 S63	T59-N61 VanDerWaalsContact C-N 3.26Å; T59-N61 WeakPolarHBondContact CG2-OD1 3.33Å; T59-N61 PolarHBondContact O-N 3.37Å; N61-S63 VanDerWaalsContact C-N 3.25Å; N61-S63 PolarHBondContact O-N 3.38Å
62	I	45.6	Very low	37.4	Very low	131 Å²	131	129 Å²	129	67%	0.672	73%	0.734	S	S	*	*			trans	-71	91.6	166.4	-48.7	172.7	0	0	0	105.5	V60 L64	V60-I62 HydrophobicContact CG1-CG1 3.99Å; V60-I62 PolarHBondContact O-N 3.04Å; I62-L64 HydrophobicContact CG2-CD2 4.07Å; I62-L64 HydrophobicContact CG2-CG 4.06Å; I62-L64 PolarHBondContact O-N 3.21Å
63	S	32.4	Very low	37.8	Very low	108 Å²	108	128.5 Å²	128.5	76%	0.755	73%	0.731	S	S	*	*			trans	-70.9	86.8	169.8	-75.1	0	0	0	0	107.9	N61 N65	N61-S63 VanDerWaalsContact C-N 3.25Å; N61-S63 PolarHBondContact O-N 3.38Å; S63-N65 VanDerWaalsContact C-N 3.29Å; S63-N65 PolarHBondContact O-N 2.99Å
64	L	42.4	Very low	37.5	Very low	150 Å²	150	129 Å²	129	79%	0.785	73%	0.733	S	S	*	*			trans	-67.3	98	162.3	-65.3	171.5	0	0	0	105.9	I62 N66	I62-L64 HydrophobicContact CG2-CD2 4.07Å; I62-L64 HydrophobicContact CG2-CG 4.06Å; I62-L64 PolarHBondContact O-N 3.21Å; L64-N66 PolarHBondContact O-N 3.12Å
65	N	33.5	Very low	37.6	Very low	160 Å²	160	132.3 Å²	132.3	86%	0.856	74%	0.741	S	S	*	*			trans	-64.2	76.1	169	179.6	26.2	0	0	0	109	S63	S63-N65 VanDerWaalsContact C-N 3.29Å; S63-N65 PolarHBondContact O-N 2.99Å
66	N	36.5	Very low	37.2	Very low	131 Å²	131	131.9 Å²	131.9	70%	0.701	74%	0.738	S	S	*	*	S	Bend	trans	-165.6	108	149.7	-130.4	-5.9	0	0	0	109.6	L64	L64-N66 PolarHBondContact O-N 3.12Å
67	Q	36.1	Very low	37.2	Very low	168 Å²	168	130.9 Å²	130.9	79%	0.785	74%	0.74	S	S	*	*	S	Bend	trans	25.6	113.4	154	-51.5	-162.8	9.9	0	0	118.5
68	N	38	Very low	36.8	Very low	161 Å²	161	134.8 Å²	134.8	86%	0.861	75%	0.749	S	S	*	*	S	Bend	trans	59.1	72.7	149.9	-64.5	-3.5	0	0	0	118.3
69	S	37.8	Very low	36.4	Very low	105 Å²	105	134.9 Å²	134.9	73%	0.734	75%	0.75	S	S	*	*			trans	-172.1	115.9	132.7	57.8	0	0	0	0	111	L71	S69-L71 PolarHBondContact O-N 3.24Å
70	S	35	Very low	36.2	Very low	117 Å²	117	134.5 Å²	134.5	82%	0.818	76%	0.758	S	S	*	*			trans	-72.9	103	164.4	178.5	0	0	0	0	107.8
71	L	39	Very low	35.7	Very low	140 Å²	140	134.9 Å²	134.9	73%	0.733	76%	0.76	S	S	*	*			trans	-104.2	104.1	167.6	-150	83.9	0	0	0	107.6	S69 T73	S69-L71 PolarHBondContact O-N 3.24Å; L71-T73 PolarHBondContact O-N 3.32Å; L71-T73 VanDerWaalsContact O-N 3.14Å
72	V	39.2	Very low	35.7	Very low	121 Å²	121	134.9 Å²	134.9	73%	0.733	77%	0.765	S	S	*	*			trans	-74.9	93.1	168.2	176.5	0	0	0	0	106.5	T74	V72-T74 PolarHBondContact O-N 3.25Å
73	T	38.8	Very low	35.3	Very low	82 Å²	82	134.7 Å²	134.7	50%	0.503	77%	0.771	S	S	.	*			trans	-91.5	93.5	177.4	-38	0	0	0	0	109.6	L71 E75	L71-T73 PolarHBondContact O-N 3.32Å; L71-T73 VanDerWaalsContact O-N 3.14Å; T73-E75 HydrophobicContact CG2-CB 4.17Å; T73-E75 HydrophobicContact CG2-CG 3.67Å
74	T	32.5	Very low	35.4	Very low	126 Å²	126	135.5 Å²	135.5	77%	0.773	77%	0.771	S	S	*	*			trans	-87.2	90.8	157.8	42.7	0	0	0	0	107.9	V72	V72-T74 PolarHBondContact O-N 3.25Å
75	E	37	Very low	35.2	Very low	174 Å²	174	133.6 Å²	133.6	81%	0.813	77%	0.768	S	S	*	*			trans	-106.3	104.6	172.4	-85.9	178.4	-176	0	0	110.2	T73	T73-E75 HydrophobicContact CG2-CB 4.17Å; T73-E75 HydrophobicContact CG2-CG 3.67Å
76	T	28.1	Very low	35.2	Very low	121 Å²	121	132.2 Å²	132.2	74%	0.742	77%	0.765	S	S	*	*			trans	-97.6	136.2	160.3	-55.2	0	0	0	0	106.4
77	N	29.4	Very low	35.3	Very low	144 Å²	144	133.7 Å²	133.7	77%	0.77	77%	0.771	S	S	*	*			trans	68.6	117.9	176.4	-61.9	-19.1	0	0	0	115.5
78	E	32.8	Very low	35.1	Very low	193 Å²	193	130.3 Å²	130.3	90%	0.902	77%	0.766	S	S	*	*				-167.4	143.3	94.8	-96.7	177.2	-168.7	0	0	112.1	A80	E78-A80 PolarHBondContact O-N 3.27Å
79	L	31.3	Very low	34.7	Very low	157 Å²	157	129.7 Å²	129.7	82%	0.822	76%	0.763	S	S	*	*			trans	-65.5	104.8	-172.2	-169.9	73.5	0	0	0	110.3	T81	L79-T81 PolarHBondContact O-N 3.47Å; L79-T81 PolarHBondContact O-OG1 3.29Å
80	A	35	Very low	34.6	Very low	97 Å²	97	130.8 Å²	130.8	80%	0.802	77%	0.765	S	S	*	*			trans	-63.6	99.1	169.9	0	0	0	0	0	109.4	E78 T82	E78-A80 PolarHBondContact O-N 3.27Å; A80-T82 PolarHBondContact O-N 3.43Å
81	T	32.6	Very low	34.7	Very low	114 Å²	114	128.7 Å²	128.7	70%	0.699	76%	0.762	S	S	*	*			trans	-81.1	104.4	177.1	-52.4	0	0	0	0	107.5	L79 T83	L79-T81 PolarHBondContact O-N 3.47Å; L79-T81 PolarHBondContact O-OG1 3.29Å; T81-T83 PolarHBondContact O-N 3.33Å; T81-T83 VanDerWaalsContact O-N 3.11Å
82	T	37.7	Very low	34.7	Very low	132 Å²	132	127.3 Å²	127.3	81%	0.81	76%	0.755	S	S	*	*			trans	-66.8	108.2	176.8	-49.3	0	0	0	0	109.8	A80	A80-T82 PolarHBondContact O-N 3.43Å
83	T	35.9	Very low	35.3	Very low	128 Å²	128	130.5 Å²	130.5	79%	0.785	76%	0.762	S	S	*	*			trans	-66	131.2	175.1	26.8	0	0	0	0	111.4	T81	T81-T83 PolarHBondContact O-N 3.33Å; T81-T83 VanDerWaalsContact O-N 3.11Å
84	T	34.8	Very low	35.5	Very low	124 Å²	124	133.1 Å²	133.1	76%	0.761	77%	0.768	S	S	*	*			trans	-78	125.2	-179.9	-33.1	0	0	0	0	110.3	T86	T84-T86 PolarHBondContact O-N 3.39Å
85	P	39.1	Very low	36.4	Very low	111 Å²	111	135.9 Å²	135.9	72%	0.721	77%	0.772	S	S	*	*			trans	-74.6	109.2	170.2	27.5	-30	0	0	0	109.9	I87	P85-I87 PolarHBondContact O-N 2.92Å
86	T	32.2	Very low	36.9	Very low	130 Å²	130	134.7 Å²	134.7	80%	0.798	77%	0.766	S	S	*	*			trans	-78.2	100	166.8	-44	0	0	0	0	108	T84	T84-T86 PolarHBondContact O-N 3.39Å
87	I	37.9	Very low	38.4	Very low	163 Å²	163	137.1 Å²	137.1	84%	0.836	77%	0.768	S	S	*	*			trans	-100.1	100.7	164.9	-59.7	177.1	0	0	0	106.8	P85	P85-I87 PolarHBondContact O-N 2.92Å
88	S	32	Very low	39.1	Very low	96 Å²	96	137.1 Å²	137.1	67%	0.671	76%	0.764	S	S	*	*			trans	-74.6	133.3	163.6	45.4	0	0	0	0	110.1
89	D	30.6	Very low	39.9	Very low	148 Å²	148	134.9 Å²	134.9	79%	0.791	75%	0.753	S	S	*	*				124.9	134.1	123.1	-141.8	11.8	0	0	0	118.5
90	V	36.3	Very low	40.9	Very low	129 Å²	129	136 Å²	136	78%	0.782	75%	0.754	S	S	*	*			trans	52.8	121.2	164.4	-150.1	0	0	0	0	121.1
91	G	36.2	Very low	41.7	Very low	73 Å²	73	138.6 Å²	138.6	75%	0.753	75%	0.749	S	S	*	*			trans	174.1	55.6	163.8	0	0	0	0	0	117.7	H93	G91-H93 PolarHBondContact O-N 3.03Å
92	N	38.7	Very low	42.6	Very low	110 Å²	110	141.5 Å²	141.5	59%	0.588	75%	0.754	S	S	*	*			trans	-48.8	121	173.4	-179.7	29.2	0	0	0	115.1
93	H	52.2	Low	43	Very low	189 Å²	189	141.8 Å²	141.8	88%	0.875	75%	0.746	S	S	*	*			trans	-150.3	110	146.2	-75.6	-55.4	0	0	0	110.9	G91	G91-H93 PolarHBondContact O-N 3.03Å
94	H	43.3	Very low	43.7	Very low	136 Å²	136	144.3 Å²	144.3	63%	0.63	75%	0.749	S	S	*	*			trans	-50.5	152.6	161	-55.7	-50.6	0	0	0	111.6
95	H	52	Low	44.2	Very low	184 Å²	184	144 Å²	144	85%	0.852	74%	0.743	S	S	*	*			trans	-168.2	122.3	132.1	-95.9	82.7	0	0	0	109.3
96	H	47.6	Very low	44.4	Very low	149 Å²	149	147.6 Å²	147.6	69%	0.69	75%	0.749	S	S	*	*			trans	-78.8	141.3	178.3	-67.5	-91.9	0	0	0	111.7
97	H	57.6	Low	44.8	Very low	172 Å²	172	150.2 Å²	150.2	80%	0.796	75%	0.75	S	S	*	*			trans	-159.8	96.5	147.3	-71.7	-56.2	0	0	0	108.3
98	H	46.1	Very low	45.2	Very low	145 Å²	145	151.2 Å²	151.2	67%	0.671	75%	0.751	S	S	*	*				69.5	108.8	92.1	-70	-53.8	0	0	0	116.7
99	H	49.4	Very low	45.5	Very low	146 Å²	146	153.4 Å²	153.4	68%	0.676	75%	0.75	S	S	*	*			trans	32.5	123.8	139.5	-50.9	-69.6	0	0	0	120.2
100	H	52.3	Low	46.1	Very low	181 Å²	181	154.2 Å²	154.2	84%	0.838	75%	0.753	S	S	*	*				-144.4	107.9	117.3	-92	-61.1	0	0	0	110.4
101	Q	52	Low	46	Very low	151 Å²	151	156 Å²	156	71%	0.706	75%	0.754	S	S	*	*			trans	-70	126.2	157.2	-76.3	177.9	-23.2	0	0	107.8
102	H	50.3	Low	46.1	Very low	175 Å²	175	157.4 Å²	157.4	81%	0.81	75%	0.751	S	S	*	*			trans	-128.7	102.1	150.7	-93.9	-77	0	0	0	108.4
103	H	46	Very low	45.8	Very low	137 Å²	137	158.3 Å²	158.3	63%	0.634	76%	0.761	S	S	*	*			trans	-45.8	149.3	151.2	-71.5	-83.9	0	0	0	110.3
104	Q	50.3	Low	45.1	Very low	181 Å²	181	159.6 Å²	159.6	85%	0.846	76%	0.76	S	S	*	*				-169.3	112.3	128	-88.8	-89.4	-18	0	0	107.8
105	D	46.7	Very low	45.1	Very low	118 Å²	118	158.1 Å²	158.1	63%	0.631	76%	0.762	S	S	*	*			trans	-62.8	126.6	175.9	-64.1	-80.3	0	0	0	112.1
106	H	43.2	Very low	44.4	Very low	187 Å²	187	160.4 Å²	160.4	87%	0.866	76%	0.763	S	S	*	*			trans	-123.9	80	154.3	-89.9	21.8	0	0	0	109.1
107	K	40	Very low	44	Very low	185 Å²	185	160.7 Å²	160.7	80%	0.804	77%	0.768	S	S	*	*			trans	-71.6	132.5	150.1	-71.1	-175.9	176.2	-178	0	107.6
108	Q	46.4	Very low	43.3	Very low	184 Å²	184	159.1 Å²	159.1	86%	0.86	77%	0.765	S	S	*	*			trans	172.8	100.1	137.2	-73.5	-130.1	13.5	0	0	106.1
109	H	38.2	Very low	42.9	Very low	142 Å²	142	159.5 Å²	159.5	66%	0.657	77%	0.772	S	S	*	*				72.3	85.4	100.5	-170.8	-85	0	0	0	113.3
110	L	43	Very low	42.3	Very low	164 Å²	164	156.8 Å²	156.8	86%	0.859	78%	0.775	S	S	*	*			trans	-142.5	93.8	146.5	-86.8	172.6	0	0	0	108.1	S112	L110-S112 PolarHBondContact O-N 3.27Å
111	Q	34.3	Very low	41.6	Very low	168 Å²	168	155.9 Å²	155.9	79%	0.785	78%	0.776	S	S	*	*			trans	-60.2	114.4	155.8	-71.4	174.3	-9.1	0	0	107.8
112	S	39.1	Very low	41.1	Very low	101 Å²	101	154.5 Å²	154.5	71%	0.706	78%	0.78	S	S	*	*			trans	-137.3	95.1	156.3	61.7	0	0	0	0	109.7	L110 Y114	L110-S112 PolarHBondContact O-N 3.27Å; S112-Y114 PolarHBondContact O-N 2.91Å
113	T	32.3	Very low	40.9	Very low	129 Å²	129	152 Å²	152	79%	0.791	78%	0.777	S	S	*	*			trans	-59.2	99.7	161.2	-61.3	0	0	0	0	109.3
114	Y	36.1	Very low	40.4	Very low	216 Å²	216	156.1 Å²	156.1	85%	0.847	79%	0.786	S	S	*	*			trans	-150.4	145.9	155	-80.4	-69.6	0	0	0	111.2	S112	S112-Y114 PolarHBondContact O-N 2.91Å
115	P	44.9	Very low	40	Very low	105 Å²	105	157.8 Å²	157.8	68%	0.682	79%	0.785	S	S	*	*			trans	-86.6	128.3	-153.1	32.9	-33	0	0	0	113	I117	P115-I117 PolarHBondContact O-N 2.81Å
116	R	37.3	Very low	39.4	Very low	232 Å²	232	159.2 Å²	159.2	88%	0.875	79%	0.792	S	S	*	*			trans	33	63.6	132.3	-156	-176.6	-112.3	167.3	-3.8	115.7	L118	R116-L118 HydrophobicContact CG-CG 4.49Å; R116-L118 PolarHBondContact O-N 2.92Å
117	I	38.7	Very low	39.2	Very low	155 Å²	155	155.4 Å²	155.4	80%	0.795	79%	0.787	S	S	*	*			trans	-84.4	93	159.1	-57.1	177.1	0	0	0	106.1	P115 N119	P115-I117 PolarHBondContact O-N 2.81Å; I117-N119 PolarHBondContact O-N 2.77Å
118	L	42.9	Very low	39.3	Very low	140 Å²	140	153.8 Å²	153.8	73%	0.733	79%	0.786	S	S	*	*			trans	-54.7	130.3	164.3	-73.8	165.8	0	0	0	107.5	R116 A120	R116-L118 HydrophobicContact CG-CG 4.49Å; R116-L118 PolarHBondContact O-N 2.92Å; L118-A120 PolarHBondContact O-N 3.47Å
119	N	36.9	Very low	39	Very low	153 Å²	153	151.5 Å²	151.5	82%	0.818	78%	0.78	S	S	*	*			trans	-57.7	79.8	178.1	-64.5	-34	0	0	0	111	I117	I117-N119 PolarHBondContact O-N 2.77Å
120	A	37.7	Very low	39.4	Very low	88 Å²	88	152 Å²	152	73%	0.727	79%	0.787	S	S	*	*			trans	-97.8	104.8	162.2	0	0	0	0	0	106.2	L118 P122	L118-A120 PolarHBondContact O-N 3.47Å; A120-P122 WeakPolarHBondContact O-CD 3.3Å
121	L	37.2	Very low	39.6	Very low	163 Å²	163	152 Å²	152	85%	0.853	78%	0.783	S	S	*	*			trans	-54.3	120.7	167.3	-78.9	153	0	0	0	107.6	V123	L121-V123 PolarHBondContact O-N 2.97Å
122	P	41.7	Very low	40.3	Very low	122 Å²	122	150.7 Å²	150.7	79%	0.792	78%	0.781	S	S	*	*			trans	-65.3	108	179	23.3	-29.9	0	0	0	108.7	A120 R124	A120-P122 WeakPolarHBondContact O-CD 3.3Å; P122-R124 VanDerWaalsContact C-N 3.3Å; P122-R124 PolarHBondContact O-N 3.24Å
123	V	47.3	Very low	40.5	Very low	123 Å²	123	154.3 Å²	154.3	75%	0.745	79%	0.787	S	S	*	*			trans	-66.9	97.1	165.9	177.1	0	0	0	0	106.2	L121 R125	L121-V123 PolarHBondContact O-N 2.97Å; V123-R125 VanDerWaalsContact C-N 3.31Å; V123-R125 HydrophobicContact CG1-CG 4.5Å; V123-R125 PolarHBondContact O-N 3.09Å
124	R	35.2	Very low	41.2	Very low	222 Å²	222	153.7 Å²	153.7	84%	0.838	78%	0.783	S	S	*	*			trans	-65.3	88.7	174.5	-167.3	-176.9	-173.1	161.8	4.3	108.5	P122	P122-R124 VanDerWaalsContact C-N 3.3Å; P122-R124 PolarHBondContact O-N 3.24Å
125	R	41.7	Very low	41.5	Very low	217 Å²	217	152 Å²	152	82%	0.819	78%	0.782	S	S	*	*			trans	-85.8	116.5	157.5	-78.5	-161.6	-165.3	108.2	0.6	107.4	V123 S127	V123-R125 VanDerWaalsContact C-N 3.31Å; V123-R125 HydrophobicContact CG1-CG 4.5Å; V123-R125 PolarHBondContact O-N 3.09Å; R125-S127 VanDerWaalsContact C-N 3.31Å; R125-S127 PolarHBondContact O-N 3.22Å
126	N	34.3	Very low	41.5	Very low	147 Å²	147	154.3 Å²	154.3	79%	0.786	79%	0.787	S	S	*	*			trans	-67.5	95.4	163.3	-60.6	-16.9	0	0	0	106.4
127	S	39.3	Very low	42	Very low	108 Å²	108	152.1 Å²	152.1	76%	0.755	78%	0.784	S	S	*	*			trans	-116	104	167.1	-162.5	0	0	0	0	107.2	R125	R125-S127 VanDerWaalsContact C-N 3.31Å; R125-S127 PolarHBondContact O-N 3.22Å
128	L	41	Very low	42.4	Very low	150 Å²	150	150.3 Å²	150.3	79%	0.785	78%	0.782	S	S	*	*			trans	-69	125.6	167.9	-169.5	85	0	0	0	107.1
129	N	40.4	Very low	42	Very low	136 Å²	136	149 Å²	149	73%	0.727	79%	0.785	S	S	*	*			trans	50.6	105	160.9	-54.3	-11.8	0	0	0	117.5
130	D	45.3	Very low	42.4	Very low	152 Å²	152	149.4 Å²	149.4	81%	0.813	79%	0.786	S	S	*	*				-165.2	126.2	113.5	-130	-19.8	0	0	0	109.5	D132	D130-D132 PolarHBondContact O-N 3.32Å; D130-D132 VanDerWaalsContact O-N 3.11Å
131	E	47.5	Very low	42.7	Very low	165 Å²	165	152.8 Å²	152.8	77%	0.771	79%	0.791	S	S	*	*			trans	-74.4	89.1	173.3	-77.3	-77.1	157.8	0	0	107.7
132	D	49.7	Very low	42.7	Very low	140 Å²	140	150.2 Å²	150.2	75%	0.749	79%	0.786	S	S	*	*			trans	-145.1	118.9	158.8	-102.9	-31.6	0	0	0	111	D130 V134	D130-D132 PolarHBondContact O-N 3.32Å; D130-D132 VanDerWaalsContact O-N 3.11Å; D132-V134 VanDerWaalsContact C-N 3.32Å; D132-V134 PolarHBondContact O-N 3.31Å
133	H	43	Very low	42.8	Very low	177 Å²	177	151.5 Å²	151.5	82%	0.819	79%	0.785	S	S	*	*			trans	-63.9	79	-173.9	-68.8	-45.7	0	0	0	112.7
134	V	47.5	Very low	42.3	Very low	117 Å²	117	151.4 Å²	151.4	71%	0.709	79%	0.786	S	S	*	*			trans	-94.8	111	165.3	-175.5	0	0	0	0	108.5	D132 I136	D132-V134 VanDerWaalsContact C-N 3.32Å; D132-V134 PolarHBondContact O-N 3.31Å; V134-I136 VanDerWaalsContact C-N 3.3Å; V134-I136 PolarHBondContact O-N 3.17Å
135	H	42.4	Very low	42.4	Very low	181 Å²	181	146.1 Å²	146.1	84%	0.838	78%	0.783	S	S	*	*			trans	-54.7	88.3	169	-99.5	-93.3	0	0	0	110.5	K137	H135-K137 PolarHBondContact O-N 3.27Å
136	I	45.4	Very low	42.8	Very low	152 Å²	152	140.9 Å²	140.9	78%	0.779	78%	0.78	S	S	*	*			trans	-74.6	93.1	172.9	-57.9	172.7	0	0	0	107.5	V134	V134-I136 VanDerWaalsContact C-N 3.3Å; V134-I136 PolarHBondContact O-N 3.17Å
137	K	46	Very low	43.2	Very low	186 Å²	186	140.4 Å²	140.4	81%	0.809	78%	0.778	S	S	*	*			trans	-62.7	128	165.2	-84.8	178	176.4	174.5	0	108.3	H135 S139	H135-K137 PolarHBondContact O-N 3.27Å; K137-S139 PolarHBondContact O-N 3.26Å; K137-S139 VanDerWaalsContact O-N 3.17Å
138	P	47.1	Very low	43.1	Very low	117 Å²	117	141.7 Å²	141.7	76%	0.76	78%	0.776	S	S	*	*			trans	-67.2	115	177	26.2	-32.2	0	0	0	109.6	L140	P138-L140 PolarHBondContact O-N 2.96Å
139	S	36	Very low	43.2	Very low	114 Å²	114	140 Å²	140	80%	0.797	77%	0.774	S	S	*	*			trans	-76.5	116.2	170.9	73.7	0	0	0	0	109	K137 L141	K137-S139 PolarHBondContact O-N 3.26Å; K137-S139 VanDerWaalsContact O-N 3.17Å; S139-L141 PolarHBondContact O-N 3.25Å
140	L	44.8	Very low	43.1	Very low	161 Å²	161	139.2 Å²	139.2	84%	0.843	77%	0.769	S	S	*	*			trans	-72.7	110.6	172.2	-68.5	167.6	0	0	0	108.6	P138 C142	P138-L140 PolarHBondContact O-N 2.96Å; L140-C142 PolarHBondContact O-N 3.47Å
141	L	43.9	Very low	43	Very low	158 Å²	158	141 Å²	141	83%	0.827	77%	0.77	S	S	*	*			trans	-78.6	101.8	172.6	-175.7	69.3	0	0	0	108.7	S139	S139-L141 PolarHBondContact O-N 3.25Å
142	C	38.1	Very low	42.3	Very low	110 Å²	110	142.7 Å²	142.7	74%	0.743	77%	0.771	S	S	*	*			trans	-85.2	117.3	170.9	-67.5	0	0	0	0	109.1	L140 P144	L140-C142 PolarHBondContact O-N 3.47Å; C142-P144 VanDerWaalsContact O-CD 3.32Å; C142-P144 WeakPolarHBondContact O-CD 3.41Å
143	I	43.7	Very low	41.9	Very low	149 Å²	149	142 Å²	142	76%	0.764	77%	0.772	S	S	*	*			trans	-80.7	117	171.1	-58.4	172.7	0	0	0	107.5	S145	I143-S145 PolarHBondContact O-N 2.92Å
144	P	36.7	Very low	41.9	Very low	120 Å²	120	142.4 Å²	142.4	78%	0.779	77%	0.771	S	S	*	*			trans	-71.9	114.8	173.8	26.8	-29.5	0	0	0	109.6	C142	C142-P144 VanDerWaalsContact O-CD 3.32Å; C142-P144 WeakPolarHBondContact O-CD 3.41Å
145	S	37.4	Very low	41.9	Very low	111 Å²	111	142.2 Å²	142.2	78%	0.776	78%	0.775	S	S	*	*			trans	-83	127	168.3	-176.2	0	0	0	0	108.8	I143 N147	I143-S145 PolarHBondContact O-N 2.92Å; S145-N147 VanDerWaalsContact C-N 3.34Å; S145-N147 PolarHBondContact O-N 3.41Å
146	S	48.5	Very low	42.5	Very low	108 Å²	108	138 Å²	138	76%	0.755	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	-1.8	-159.7	47.2	0	0	0	0	116.7
147	N	44.3	Very low	42.8	Very low	137 Å²	137	135.2 Å²	135.2	73%	0.733	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.5	26	-166.9	-71.7	-24	0	0	0	117.1	S145	S145-N147 VanDerWaalsContact C-N 3.34Å; S145-N147 PolarHBondContact O-N 3.41Å
148	N	36.7	Very low	43.8	Very low	134 Å²	134	132.5 Å²	132.5	72%	0.717	74%	0.738	S	S	*	*			trans	178.7	117.9	153.2	-112.2	-64	0	0	0	112.6	L150	N148-L150 VanDerWaalsContact C-N 3.3Å; N148-L150 PolarHBondContact O-N 3.42Å; N148-L150 VanDerWaalsContact O-N 3.15Å
149	P	42.8	Very low	44.6	Very low	115 Å²	115	133.7 Å²	133.7	75%	0.747	73%	0.733	S	S	*	*			trans	-87.7	64.8	172.5	36.5	-33	0	0	0	110.6
150	L	38.4	Very low	45.8	Very low	119 Å²	119	133.2 Å²	133.2	62%	0.623	72%	0.719	S	S	*	*			trans	-124.1	93.2	162.1	-106.9	115.4	0	0	0	108.3	N148 Y152	N148-L150 VanDerWaalsContact C-N 3.3Å; N148-L150 PolarHBondContact O-N 3.42Å; N148-L150 VanDerWaalsContact O-N 3.15Å; L150-Y152 HydrophobicContact CB-CD2 4.44Å; L150-Y152 HydrophobicContact CD2-CD2 3.89Å; L150-Y152 HydrophobicContact CD2-CE2 3.46Å; L150-Y152 VanDerWaalsContact CD2-CE2 3.46Å; L150-Y152 PolarHBondContact O-N 3.09Å
151	F	42.2	Very low	46.9	Very low	191 Å²	191	129.1 Å²	129.1	84%	0.838	70%	0.697	S	S	*	*			trans	-64.7	72.9	171.6	-68.2	-85.5	0	0	0	110.1	T153	F151-T153 PolarHBondContact O-N 3.01Å; F151-T153 VanDerWaalsContact O-N 3.08Å
152	Y	34.4	Very low	48	Very low	200 Å²	200	125.9 Å²	125.9	78%	0.784	68%	0.678	S	S	*	*			trans	-76.8	86.3	157.3	-88	-79.9	0	0	0	107.3	L150 K154	L150-Y152 HydrophobicContact CB-CD2 4.44Å; L150-Y152 HydrophobicContact CD2-CD2 3.89Å; L150-Y152 HydrophobicContact CD2-CE2 3.46Å; L150-Y152 VanDerWaalsContact CD2-CE2 3.46Å; L150-Y152 PolarHBondContact O-N 3.09Å; Y152-K154 PolarHBondContact O-N 3.07Å
153	T	40.6	Very low	49.2	Very low	125 Å²	125	126.4 Å²	126.4	77%	0.767	67%	0.672	S	S	*	*			trans	-67	78	160.4	45.3	0	0	0	0	107.7	F151 S155	F151-T153 PolarHBondContact O-N 3.01Å; F151-T153 VanDerWaalsContact O-N 3.08Å; T153-S155 VanDerWaalsContact C-N 3.33Å; T153-S155 PolarHBondContact O-N 2.88Å
154	K	42.7	Very low	50	Low	186 Å²	186	125.7 Å²	125.7	81%	0.809	66%	0.66	S	S	*	*			trans	-66	100.9	167.8	-166.7	171.4	-175.4	175.9	0	106.1	Y152 I156	Y152-K154 PolarHBondContact O-N 3.07Å; K154-I156 PolarHBondContact O-N 3.28Å
155	S	47.7	Very low	51.1	Low	113 Å²	113	124 Å²	124	79%	0.79	64%	0.64	S	S	*	*			trans	-56.6	104.8	172.2	38.8	0	0	0	0	107.9	T153 N157	T153-S155 VanDerWaalsContact C-N 3.33Å; T153-S155 PolarHBondContact O-N 2.88Å; S155-N157 PolarHBondContact O-N 3.1Å
156	I	54.5	Low	52.4	Low	93 Å²	93	126.4 Å²	126.4	48%	0.477	64%	0.637	S	S	.	*			trans	-69.1	118.9	173.2	-63.9	170.9	0	0	0	105.8	K154 L158 Q160	K154-I156 PolarHBondContact O-N 3.28Å; I156-L158 PolarHBondContact O-N 3.27Å; I156-Q160 HydrophobicContact CG2-CB 4.02Å
157	N	53.4	Low	52.6	Low	92 Å²	92	123.9 Å²	123.9	49%	0.492	62%	0.619	S	S	.	*			trans	-52.6	129.8	174	-179.5	-38.8	0	0	0	108.7	S155 E159 Q160 L161	S155-N157 PolarHBondContact O-N 3.1Å; N157-E159 PolarHBondContact O-N 3.24Å; N157-E159 VanDerWaalsContact O-N 3.08Å; N157-E159 WeakPolarHBondContact OD1-CB 3.42Å; N157-E159 PolarHBondContact OD1-N 2.94Å; N157-Q160 WeakPolarHBondContact O-CB 3.05Å; N157-Q160 PolarHBondContact O-N 2.94Å; N157-L161 PolarHBondContact O-N 3.39Å
158	L	66.8	Low	53.2	Low	129 Å²	129	122.4 Å²	122.4	68%	0.675	61%	0.61	S	S	*	*	H	α-helix	trans	-51.6	-33.5	-176.8	-172.1	69	0	0	0	112.6	I156 Q160 L161 E162	I156-L158 PolarHBondContact O-N 3.27Å; L158-Q160 PolarHBondContact O-N 2.88Å; L158-L161 WeakPolarHBondContact O-CB 3.3Å; L158-L161 PolarHBondContact O-N 3.17Å; L158-E162 PolarHBondContact O-N 3.24Å; L158-E162 VanDerWaalsContact O-N 3.11Å
159	E	63.6	Low	53.9	Low	142 Å²	142	120.9 Å²	120.9	66%	0.664	60%	0.602	S	S	*	*	H	α-helix	trans	-64.5	-38.9	176.6	-68.7	-177.2	157.5	0	0	112.5	N157 L161 E162 I163	N157-E159 PolarHBondContact O-N 3.24Å; N157-E159 VanDerWaalsContact O-N 3.08Å; N157-E159 WeakPolarHBondContact OD1-CB 3.42Å; N157-E159 PolarHBondContact OD1-N 2.94Å; E159-L161 VanDerWaalsContact C-N 3.27Å; E159-L161 PolarHBondContact O-N 3.27Å; E159-E162 PolarHBondContact O-N 2.84Å; E159-I163 WeakPolarHBondContact O-CG1 3.03Å; E159-I163 PolarHBondContact O-N 2.7Å
160	Q	61.2	Low	54.1	Low	105 Å²	105	118.8 Å²	118.8	49%	0.491	59%	0.59	S	S	.	*	H	α-helix	trans	-66.1	-32.9	175.4	-70.9	-170.1	4.2	0	0	111.8	I156 N157 L158 R164	I156-Q160 HydrophobicContact CG2-CB 4.02Å; N157-Q160 WeakPolarHBondContact O-CB 3.05Å; N157-Q160 PolarHBondContact O-N 2.94Å; L158-Q160 PolarHBondContact O-N 2.88Å; Q160-R164 WeakPolarHBondContact O-CB 3.43Å; Q160-R164 WeakPolarHBondContact O-CG 3.48Å; Q160-R164 PolarHBondContact O-N 3.04Å
161	L	68.2	Low	54.7	Low	75 Å²	75	118.1 Å²	118.1	39%	0.393	59%	0.586	S	S	.	*	H	α-helix	trans	-68.2	-42.3	176.9	-173.1	67.8	0	0	0	111.2	N157 L158 E159 R164 K165	N157-L161 PolarHBondContact O-N 3.39Å; L158-L161 WeakPolarHBondContact O-CB 3.3Å; L158-L161 PolarHBondContact O-N 3.17Å; E159-L161 VanDerWaalsContact C-N 3.27Å; E159-L161 PolarHBondContact O-N 3.27Å; L161-R164 PolarHBondContact O-N 3.3Å; L161-K165 WeakPolarHBondContact O-CG 3.01Å; L161-K165 PolarHBondContact O-N 3.4Å
162	E	66.7	Low	54.8	Low	89 Å²	89	115.9 Å²	115.9	42%	0.416	58%	0.576	S	S	.	*	H	α-helix	trans	-67	-39.4	177.5	-76.3	-58.3	135.1	0	0	112.5	L158 E159 R164 K165 K166	L158-E162 PolarHBondContact O-N 3.24Å; L158-E162 VanDerWaalsContact O-N 3.11Å; E159-E162 PolarHBondContact O-N 2.84Å; E162-R164 VanDerWaalsContact C-N 3.33Å; E162-R164 PolarHBondContact O-N 3.35Å; E162-K165 PolarHBondContact O-N 3.21Å; E162-K165 IonicContact OE1-NZ 2.79Å; E162-K165 PolarHBondContact OE1-NZ 3.06Å; E162-K166 PolarHBondContact O-N 3.03Å
163	I	61.9	Low	55.5	Low	121 Å²	121	113.2 Å²	113.2	62%	0.621	58%	0.575	S	S	*	*	H	α-helix	trans	-61.7	-43.1	173	-65	165.6	0	0	0	110.4	E159 K166 S167	E159-I163 WeakPolarHBondContact O-CG1 3.03Å; E159-I163 PolarHBondContact O-N 2.7Å; I163-K166 PolarHBondContact O-N 3.22Å; I163-S167 PolarHBondContact O-N 3.48Å
164	R	62.2	Low	55.7	Low	135 Å²	135	114.4 Å²	114.4	51%	0.509	57%	0.572	S	S	.	*	H	α-helix	trans	-63	-42.3	175.4	-78.8	-178.2	-177.2	173.6	2.1	112.2	Q160 L161 E162 K166 S167 I168	Q160-R164 WeakPolarHBondContact O-CB 3.43Å; Q160-R164 WeakPolarHBondContact O-CG 3.48Å; Q160-R164 PolarHBondContact O-N 3.04Å; L161-R164 PolarHBondContact O-N 3.3Å; E162-R164 VanDerWaalsContact C-N 3.33Å; E162-R164 PolarHBondContact O-N 3.35Å; R164-K166 PolarHBondContact O-N 3.08Å; R164-S167 WeakPolarHBondContact CA-OG 3.39Å; R164-S167 PolarHBondContact O-N 3.31Å; R164-S167 PolarHBondContact O-OG 3.48Å; R164-I168 WeakPolarHBondContact O-CG1 3.3Å; R164-I168 PolarHBondContact O-N 2.95Å
165	K	59.6	Low	55.7	Low	84 Å²	84	108.2 Å²	108.2	37%	0.365	55%	0.552	S	S	.	*	H	α-helix	trans	-60.6	-44.4	175.7	-74.8	179.9	-171.3	167.6	0	112.3	L161 E162 S167 I168 N169	L161-K165 WeakPolarHBondContact O-CG 3.01Å; L161-K165 PolarHBondContact O-N 3.4Å; E162-K165 PolarHBondContact O-N 3.21Å; E162-K165 IonicContact OE1-NZ 2.79Å; E162-K165 PolarHBondContact OE1-NZ 3.06Å; K165-S167 VanDerWaalsContact C-N 3.33Å; K165-S167 PolarHBondContact O-N 2.67Å; K165-I168 PolarHBondContact O-N 2.8Å; K165-N169 PolarHBondContact O-N 3.39Å
166	K	63.5	Low	55.6	Low	162 Å²	162	109.4 Å²	109.4	70%	0.704	55%	0.548	S	S	*	.	H	α-helix	trans	-61.7	-40.1	175.1	-83.2	-174.5	176.7	-179.4	0	112	E162 I163 R164 I168 N169 S170	E162-K166 PolarHBondContact O-N 3.03Å; I163-K166 PolarHBondContact O-N 3.22Å; R164-K166 PolarHBondContact O-N 3.08Å; K166-I168 PolarHBondContact O-N 2.95Å; K166-N169 PolarHBondContact O-N 2.91Å; K166-S170 PolarHBondContact O-N 3.36Å
167	S	54.3	Low	55.1	Low	55 Å²	55	110.3 Å²	110.3	39%	0.385	56%	0.558	S	S	.	*	H	α-helix	trans	-63.6	-40.8	176.6	73.5	0	0	0	0	112.6	I163 R164 K165 S170 I171	I163-S167 PolarHBondContact O-N 3.48Å; R164-S167 WeakPolarHBondContact CA-OG 3.39Å; R164-S167 PolarHBondContact O-N 3.31Å; R164-S167 PolarHBondContact O-OG 3.48Å; K165-S167 VanDerWaalsContact C-N 3.33Å; K165-S167 PolarHBondContact O-N 2.67Å; S167-S170 PolarHBondContact O-N 2.98Å; S167-I171 VanDerWaalsContact O-CG1 3.27Å; S167-I171 WeakPolarHBondContact O-CG1 3.46Å; S167-I171 PolarHBondContact O-N 3.05Å
168	I	55.3	Low	54.6	Low	105 Å²	105	113 Å²	113	54%	0.538	57%	0.572	S	S	.	*	H	α-helix	trans	-67	-40.6	178.9	-66.2	164.4	0	0	0	110.8	R164 K165 K166 I171 K172	R164-I168 WeakPolarHBondContact O-CG1 3.3Å; R164-I168 PolarHBondContact O-N 2.95Å; K165-I168 PolarHBondContact O-N 2.8Å; K166-I168 PolarHBondContact O-N 2.95Å; I168-I171 PolarHBondContact O-N 3.5Å; I168-K172 WeakPolarHBondContact O-CB 3.44Å; I168-K172 PolarHBondContact O-N 3.34Å
169	N	52	Low	53.6	Low	102 Å²	102	113.7 Å²	113.7	55%	0.545	57%	0.572	S	S	.	*	H	α-helix	trans	-69	-33.6	176.7	-74.4	-15.4	0	0	0	112.7	K165 K166 K172 N173	K165-N169 PolarHBondContact O-N 3.39Å; K166-N169 PolarHBondContact O-N 2.91Å; N169-K172 PolarHBondContact O-N 3.11Å; N169-N173 PolarHBondContact O-N 2.98Å
170	S	47.7	Very low	52.7	Low	72 Å²	72	116.1 Å²	116.1	50%	0.503	58%	0.581	S	S	.	*	H	α-helix	trans	-64.3	-44.2	171.9	-165.9	0	0	0	0	111.4	K166 S167 K172 N173 Q174	K166-S170 PolarHBondContact O-N 3.36Å; S167-S170 PolarHBondContact O-N 2.98Å; S170-K172 VanDerWaalsContact C-N 3.34Å; S170-K172 PolarHBondContact O-N 3.34Å; S170-N173 PolarHBondContact O-N 3.31Å; S170-Q174 PolarHBondContact O-N 3.5Å
171	I	50.2	Low	52.2	Low	105 Å²	105	116 Å²	116	54%	0.538	58%	0.582	S	S	.	*	H	α-helix	trans	-66.4	-37.3	177.7	-65.1	163.5	0	0	0	110.8	S167 I168 N173 Q174 S175	S167-I171 VanDerWaalsContact O-CG1 3.27Å; S167-I171 WeakPolarHBondContact O-CG1 3.46Å; S167-I171 PolarHBondContact O-N 3.05Å; I168-I171 PolarHBondContact O-N 3.5Å; I171-N173 PolarHBondContact O-N 2.99Å; I171-Q174 PolarHBondContact O-N 3.31Å; I171-S175 WeakPolarHBondContact O-CB 3.27Å; I171-S175 PolarHBondContact O-N 3Å
172	K	45.4	Very low	51.3	Low	144 Å²	144	116.5 Å²	116.5	63%	0.626	59%	0.586	S	S	*	*	H	α-helix	trans	-63.3	-30.3	179.4	-163.8	173.3	-177.6	-178.9	0	113.1	I168 N169 S170	I168-K172 WeakPolarHBondContact O-CB 3.44Å; I168-K172 PolarHBondContact O-N 3.34Å; N169-K172 PolarHBondContact O-N 3.11Å; S170-K172 VanDerWaalsContact C-N 3.34Å; S170-K172 PolarHBondContact O-N 3.34Å
173	N	47.6	Very low	50.8	Low	144 Å²	144	117.5 Å²	117.5	77%	0.77	59%	0.593	S	S	*	*	H	α-helix	trans	-89.8	-19.4	177.7	-68	-19.8	0	0	0	113.6	N169 S170 I171	N169-N173 PolarHBondContact O-N 2.98Å; S170-N173 PolarHBondContact O-N 3.31Å; I171-N173 PolarHBondContact O-N 2.99Å
174	Q	45.3	Very low	50.3	Low	150 Å²	150	117.9 Å²	117.9	70%	0.701	59%	0.592	S	S	*	*	H	α-helix	trans	-101.5	-17.3	179.8	-123.7	170.6	19.4	0	0	114.1	S170 I171	S170-Q174 PolarHBondContact O-N 3.5Å; I171-Q174 PolarHBondContact O-N 3.31Å
175	S	42.5	Very low	49.8	Very low	56 Å²	56	117.6 Å²	117.6	39%	0.392	60%	0.597	S	S	.	*	S	Bend	trans	-92.4	-7.2	-172.1	-167.5	0	0	0	0	114.9	I171 T177	I171-S175 WeakPolarHBondContact O-CB 3.27Å; I171-S175 PolarHBondContact O-N 3Å; S175-T177 VanDerWaalsContact C-N 3.31Å
176	I	45.2	Very low	49.6	Very low	138 Å²	138	117.9 Å²	117.9	71%	0.708	60%	0.602	S	S	*	*	S	Bend	trans	-77.6	-19.4	-179	-61.7	176.1	0	0	0	111.7
177	T	45.5	Very low	49.2	Very low	112 Å²	112	114.5 Å²	114.5	69%	0.687	58%	0.584	S	S	*	*	S	Bend	trans	-93.5	-16.6	-173.1	34.2	0	0	0	0	116.3	S175	S175-T177 VanDerWaalsContact C-N 3.31Å
178	N	42.6	Very low	49	Very low	147 Å²	147	115.8 Å²	115.8	79%	0.786	59%	0.593	S	S	*	*	S	Bend	trans	-129.5	12.9	-170.2	-71.5	-18.6	0	0	0	116.8
179	Q	44.1	Very low	48.9	Very low	145 Å²	145	116.3 Å²	116.3	68%	0.678	60%	0.596	S	S	*	*			trans	-128.9	44	173.1	-77.6	-170.9	10.7	0	0	112.9	I181	Q179-I181 PolarHBondContact O-N 3.46Å
180	F	44.7	Very low	48.8	Very low	192 Å²	192	115.5 Å²	115.5	84%	0.842	59%	0.591	S	S	*	*			trans	-64.7	88.4	139.3	-96.3	-92.1	0	0	0	105.6	D182	F180-D182 PolarHBondContact O-N 3.22Å
181	I	52.7	Low	48.9	Very low	102 Å²	102	116.1 Å²	116.1	52%	0.523	59%	0.593	S	S	.	*			trans	-55.4	102.4	154.6	-68.3	168.4	0	0	0	102.8	Q179 I183	Q179-I181 PolarHBondContact O-N 3.46Å; I181-I183 PolarHBondContact O-N 3.4Å
182	D	48.8	Very low	48.6	Very low	86 Å²	86	114.8 Å²	114.8	46%	0.46	59%	0.593	S	S	.	*			trans	-49.9	119.8	176	-177.6	-5.5	0	0	0	106	F180 Q184 Q185	F180-D182 PolarHBondContact O-N 3.22Å; D182-Q184 PolarHBondContact O-N 3.48Å; D182-Q184 VanDerWaalsContact OD1-CB 3.31Å; D182-Q184 WeakPolarHBondContact OD1-CB 3.08Å; D182-Q184 VanDerWaalsContact OD1-CG 3.25Å; D182-Q184 WeakPolarHBondContact OD1-CG 3.43Å; D182-Q184 PolarHBondContact OD1-N 2.98Å; D182-Q184 VanDerWaalsContact OD1-N 3.09Å; D182-Q185 HydrophobicContact CB-CG 4.38Å; D182-Q185 WeakPolarHBondContact O-CB 3.33Å; D182-Q185 PolarHBondContact O-N 3.07Å
183	I	55.7	Low	48.7	Very low	111 Å²	111	114.2 Å²	114.2	57%	0.569	60%	0.596	S	S	*	*	H	α-helix	trans	-54	-26.4	-177.8	-66.5	168.6	0	0	0	109.3	I181 Q185 L186 W187	I181-I183 PolarHBondContact O-N 3.4Å; I183-Q185 PolarHBondContact O-N 3.27Å; I183-L186 WeakPolarHBondContact O-CB 3.48Å; I183-L186 PolarHBondContact O-N 3.46Å; I183-W187 PolarHBondContact O-N 3.31Å
184	Q	50.6	Low	48.4	Very low	129 Å²	129	112.2 Å²	112.2	60%	0.603	59%	0.585	S	S	*	*	H	α-helix	trans	-60.9	-36.4	171.7	-61.7	-72	-16.9	0	0	113.9	D182 L186 W187 S188	D182-Q184 PolarHBondContact O-N 3.48Å; D182-Q184 VanDerWaalsContact OD1-CB 3.31Å; D182-Q184 WeakPolarHBondContact OD1-CB 3.08Å; D182-Q184 VanDerWaalsContact OD1-CG 3.25Å; D182-Q184 WeakPolarHBondContact OD1-CG 3.43Å; D182-Q184 PolarHBondContact OD1-N 2.98Å; D182-Q184 VanDerWaalsContact OD1-N 3.09Å; Q184-L186 VanDerWaalsContact C-N 3.34Å; Q184-W187 PolarHBondContact O-N 2.84Å; Q184-S188 PolarHBondContact O-N 3.22Å; Q184-S188 PolarHBondContact O-OG 3.27Å
185	Q	53.4	Low	48	Very low	129 Å²	129	113 Å²	113	60%	0.603	59%	0.587	S	S	*	*	H	α-helix	trans	-68.4	-34.5	175.6	-72.6	-167.2	4.5	0	0	111.8	D182 I183 W187 S188 I189	D182-Q185 HydrophobicContact CB-CG 4.38Å; D182-Q185 WeakPolarHBondContact O-CB 3.33Å; D182-Q185 PolarHBondContact O-N 3.07Å; I183-Q185 PolarHBondContact O-N 3.27Å; Q185-W187 VanDerWaalsContact C-N 3.34Å; Q185-S188 WeakPolarHBondContact O-CB 3.33Å; Q185-S188 PolarHBondContact O-N 2.89Å; Q185-S188 VanDerWaalsContact O-N 3.15Å; Q185-I189 PolarHBondContact O-N 3.35Å
186	L	54.3	Low	48	Very low	90 Å²	90	115.2 Å²	115.2	47%	0.471	60%	0.602	S	S	.	*	H	α-helix	trans	-64.4	-42.1	175.4	-155.4	80.7	0	0	0	110.9	I183 Q184 S188 I189	I183-L186 WeakPolarHBondContact O-CB 3.48Å; I183-L186 PolarHBondContact O-N 3.46Å; Q184-L186 VanDerWaalsContact C-N 3.34Å; L186-S188 VanDerWaalsContact C-N 3.25Å; L186-S188 PolarHBondContact O-N 3.18Å; L186-I189 PolarHBondContact O-N 3.34Å
187	W	54.6	Low	48.1	Very low	90 Å²	90	114 Å²	114	34%	0.341	60%	0.596	S	S	.	*	H	α-helix	trans	-66.3	-26.2	173.9	-70	112.8	0	0	0	113.2	N6 I183 Q184 Q185 I189 I190 P191	N6-W187 WeakPolarHBondContact OD1-CH2 3.45Å; N6-W187 WeakPolarHBondContact OD1-CZ2 3.42Å; I183-W187 PolarHBondContact O-N 3.31Å; Q184-W187 PolarHBondContact O-N 2.84Å; Q185-W187 VanDerWaalsContact C-N 3.34Å; W187-I189 VanDerWaalsContact C-N 3.27Å; W187-I189 PolarHBondContact O-N 3.48Å; W187-I190 HydrophobicContact CD2-CD1 4.43Å; W187-I190 HydrophobicContact CE3-CD1 3.59Å; W187-I190 HydrophobicContact CZ3-CD1 3.7Å; W187-I190 PolarHBondContact O-N 3.45Å; W187-P191 WeakPolarHBondContact O-CD 3.43Å
188	S	51	Low	47.9	Very low	82 Å²	82	113.9 Å²	113.9	57%	0.573	59%	0.591	S	S	*	*	H	α-helix	trans	-70.4	-23.3	177.1	-59.2	0	0	0	0	113.1	Q184 Q185 L186	Q184-S188 PolarHBondContact O-N 3.22Å; Q184-S188 PolarHBondContact O-OG 3.27Å; Q185-S188 WeakPolarHBondContact O-CB 3.33Å; Q185-S188 PolarHBondContact O-N 2.89Å; Q185-S188 VanDerWaalsContact O-N 3.15Å; L186-S188 VanDerWaalsContact C-N 3.25Å; L186-S188 PolarHBondContact O-N 3.18Å
189	I	53	Low	47.6	Very low	116 Å²	116	113.2 Å²	113.2	60%	0.595	59%	0.587	S	S	*	*	H	α-helix	trans	-79.6	-25.5	177.8	-60.5	169.2	0	0	0	111.3	Q185 L186 W187 S192	Q185-I189 PolarHBondContact O-N 3.35Å; L186-I189 PolarHBondContact O-N 3.34Å; W187-I189 VanDerWaalsContact C-N 3.27Å; W187-I189 PolarHBondContact O-N 3.48Å; I189-S192 PolarHBondContact O-N 2.89Å; I189-S192 PolarHBondContact O-OG 2.7Å
190	I	50.8	Low	47.4	Very low	86 Å²	86	115 Å²	115	44%	0.441	60%	0.596	S	S	.	*	H	α-helix	trans	-70.8	-38.7	-174.7	-65.5	173.8	0	0	0	113.3	W187 S192 L193	W187-I190 HydrophobicContact CD2-CD1 4.43Å; W187-I190 HydrophobicContact CE3-CD1 3.59Å; W187-I190 HydrophobicContact CZ3-CD1 3.7Å; W187-I190 PolarHBondContact O-N 3.45Å; I190-S192 VanDerWaalsContact C-N 3.27Å; I190-S192 PolarHBondContact O-N 3.36Å; I190-L193 PolarHBondContact O-N 3.25Å; I190-L193 VanDerWaalsContact O-N 3.13Å
191	P	48.7	Very low	47	Very low	84 Å²	84	116.2 Å²	116.2	55%	0.545	60%	0.596	S	S	.	*	H	α-helix	trans	-60.6	-31.9	174.9	-26.1	31.3	0	0	0	114.1	W187 L193 N194 K195	W187-P191 WeakPolarHBondContact O-CD 3.43Å; P191-L193 PolarHBondContact O-N 2.94Å; P191-N194 PolarHBondContact O-N 2.95Å; P191-N194 VanDerWaalsContact O-N 3.15Å; P191-K195 PolarHBondContact O-N 2.88Å
192	S	45.1	Very low	46.2	Very low	77 Å²	77	115.6 Å²	115.6	54%	0.538	60%	0.601	S	S	.	*	H	α-helix	trans	-62.2	-28.1	177.3	10.5	0	0	0	0	112.7	I189 I190	I189-S192 PolarHBondContact O-N 2.89Å; I189-S192 PolarHBondContact O-OG 2.7Å; I190-S192 VanDerWaalsContact C-N 3.27Å; I190-S192 PolarHBondContact O-N 3.36Å
193	L	47.3	Very low	45.5	Very low	132 Å²	132	119 Å²	119	69%	0.691	62%	0.619	S	S	*	*	H	α-helix	trans	-74.7	-31.5	177.6	-150.4	76.3	0	0	0	112.1	I190 P191	I190-L193 PolarHBondContact O-N 3.25Å; I190-L193 VanDerWaalsContact O-N 3.13Å; P191-L193 PolarHBondContact O-N 2.94Å
194	N	40.8	Very low	44.6	Very low	102 Å²	102	121.6 Å²	121.6	55%	0.545	63%	0.634	S	S	.	*	H	α-helix	trans	-78	-23.3	178.8	-91.7	-14.1	0	0	0	113.8	P191 N198	P191-N194 PolarHBondContact O-N 2.95Å; P191-N194 VanDerWaalsContact O-N 3.15Å; N194-N198 PolarHBondContact O-ND2 3.01Å
195	K	37.4	Very low	43.7	Very low	167 Å²	167	122.9 Å²	122.9	73%	0.726	64%	0.644	S	S	*	*	H	α-helix	trans	-77.3	-23.8	178.7	-148	176.3	-175.3	-178.3	0	113.1	P191 I197	P191-K195 PolarHBondContact O-N 2.88Å; K195-I197 VanDerWaalsContact C-N 3.29Å; K195-I197 PolarHBondContact O-N 2.8Å
196	S	42.1	Very low	42.8	Very low	103 Å²	103	122.2 Å²	122.2	72%	0.72	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	-23	174.9	-171.7	0	0	0	0	113.1
197	I	47.8	Very low	41.7	Very low	113 Å²	113	123 Å²	123	58%	0.579	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	-24.4	-173.9	-61.6	173.5	0	0	0	111.7	K195	K195-I197 VanDerWaalsContact C-N 3.29Å; K195-I197 PolarHBondContact O-N 2.8Å
198	N	40.5	Very low	40.8	Very low	108 Å²	108	123.3 Å²	123.3	58%	0.578	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.3	0	-169.6	-63.6	-16.8	0	0	0	115.3	N194	N194-N198 PolarHBondContact O-ND2 3.01Å
199	N	36.8	Very low	39.9	Very low	133 Å²	133	124.6 Å²	124.6	71%	0.711	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	2.8	-175	-114.7	34.3	0	0	0	115.6
200	E	38.6	Very low	38.9	Very low	184 Å²	184	124.1 Å²	124.1	86%	0.86	70%	0.695	S	S	*	*	S	Bend	trans	-102.9	-2	175.3	-78.8	-166.7	151.8	0	0	115.1
201	Y	37.3	Very low	38.2	Very low	217 Å²	217	124.9 Å²	124.9	85%	0.851	71%	0.708	S	S	*	*	S	Bend	trans	-102.6	2.5	-175.4	-90.3	-84.7	0	0	0	116.4
202	S	35.6	Very low	37.3	Very low	89 Å²	89	126 Å²	126	62%	0.622	72%	0.718	S	S	*	*	S	Bend	trans	-116.6	54.7	179.9	34.9	0	0	0	0	112.5
203	N	34.2	Very low	36.6	Very low	156 Å²	156	127.4 Å²	127.4	83%	0.834	73%	0.728	S	S	*	*	S	Bend	trans	-155.8	44.1	165.8	-91	-31	0	0	0	113
204	L	37.3	Very low	36.1	Very low	167 Å²	167	126 Å²	126	87%	0.874	73%	0.729	S	S	*	*			trans	-140.2	82.3	161.3	-74	172.4	0	0	0	107.4	P206	L204-P206 WeakPolarHBondContact O-CD 3.39Å
205	L	30.2	Very low	35.9	Very low	156 Å²	156	126.3 Å²	126.3	82%	0.817	74%	0.739	S	S	*	*			trans	-86	101	169.6	-168.2	79.6	0	0	0	107.2	S207	L205-S207 PolarHBondContact O-N 3.11Å
206	P	35.7	Very low	35.9	Very low	114 Å²	114	123.6 Å²	123.6	74%	0.74	74%	0.742	S	S	*	*			trans	-80	107.3	174	-2.3	23.9	0	0	0	106.9	L204 S208	L204-P206 WeakPolarHBondContact O-CD 3.39Å; P206-S208 PolarHBondContact O-N 2.79Å
207	S	31.5	Very low	35.6	Very low	108 Å²	108	125 Å²	125	76%	0.755	75%	0.746	S	S	*	*			trans	-76	101.8	172.4	-60.6	0	0	0	0	109.2	L205	L205-S207 PolarHBondContact O-N 3.11Å
208	S	35.5	Very low	35.2	Very low	96 Å²	96	125.3 Å²	125.3	67%	0.671	76%	0.758	S	S	*	*			trans	-175.2	85.4	158.8	38.8	0	0	0	0	107.8	P206	P206-S208 PolarHBondContact O-N 2.79Å
209	S	32.3	Very low	34.9	Very low	108 Å²	108	128 Å²	128	76%	0.755	77%	0.771	S	S	*	*				58.7	119.3	89.6	68.7	0	0	0	0	114.5
210	S	31.8	Very low	34.8	Very low	106 Å²	106	128 Å²	128	74%	0.741	78%	0.777	S	S	*	*			trans	81.3	109.9	147.2	53.4	0	0	0	0	120.3
211	S	35.3	Very low	34.5	Very low	102 Å²	102	124.5 Å²	124.5	71%	0.713	77%	0.773	S	S	*	*			trans	71.2	102.1	133.2	44.9	0	0	0	0	118.3
212	S	29.8	Very low	34.5	Very low	107 Å²	107	119.3 Å²	119.3	75%	0.748	77%	0.768	S	S	*	*				88.9	118.2	73.9	-68.2	0	0	0	0	113
213	S	32	Very low	34.7	Very low	107 Å²	107	121.5 Å²	121.5	75%	0.748	78%	0.783	S	S	*	*			trans	60.7	125.2	148.6	52.9	0	0	0	0	117.5
214	S	36.7	Very low	34.9	Very low	102 Å²	102	118.9 Å²	118.9	71%	0.713	78%	0.777	S	S	*	*				-174.9	121.7	67.8	-47.5	0	0	0	0	107
215	S	35.3	Very low	34.9	Very low	110 Å²	110	116.4 Å²	116.4	77%	0.769	77%	0.774	S	S	*	*				95.3	134	84.7	-68.6	0	0	0	0	114.3
216	S	38.5	Very low	35.5	Very low	110 Å²	110	114.5 Å²	114.5	77%	0.769	77%	0.773	S	S	*	*			trans	94	71.8	151.9	-26.5	0	0	0	0	117.8
217	T	35.4	Very low	35.7	Very low	133 Å²	133	113.8 Å²	113.8	82%	0.816	77%	0.771	S	S	*	*			trans	-57.4	135.6	138.2	42.3	0	0	0	0	111.1
218	S	38.6	Very low	36.3	Very low	119 Å²	119	116 Å²	116	83%	0.832	78%	0.78	S	S	*	*			trans	-153	103.8	153.9	-68	0	0	0	0	109.2
219	L	34.8	Very low	36.8	Very low	163 Å²	163	117.4 Å²	117.4	85%	0.853	78%	0.784	S	S	*	*			trans	-63.5	144	168.3	-65.9	147.3	0	0	0	109.7
220	T	35.5	Very low	37	Very low	134 Å²	134	115.8 Å²	115.8	82%	0.822	79%	0.785	S	S	*	*				167.9	110.1	129.3	47.2	0	0	0	0	109.3
221	S	31.7	Very low	37.5	Very low	111 Å²	111	118.3 Å²	118.3	78%	0.776	79%	0.788	S	S	*	*			trans	-167.4	126.2	142.4	2	0	0	0	0	111.5
222	S	38	Very low	37.6	Very low	108 Å²	108	118.7 Å²	118.7	76%	0.755	79%	0.79	S	S	*	*			trans	74.9	80	136.1	-43.1	0	0	0	0	118.1
223	S	38.4	Very low	38.6	Very low	134 Å²	134	118.6 Å²	118.6	94%	0.937	79%	0.788	S	S	*	*			trans	-96	88.3	157.4	-57.9	0	0	0	0	109.6
224	S	39.2	Very low	39	Very low	101 Å²	101	121 Å²	121	71%	0.706	79%	0.787	S	S	*	*			trans	-97.9	123.3	169.2	-68	0	0	0	0	110.4
225	S	36.7	Very low	39.8	Very low	116 Å²	116	121.8 Å²	121.8	81%	0.811	79%	0.792	S	S	*	*			trans	39.5	114.8	142.4	54	0	0	0	0	120.5
226	S	42.8	Very low	40.4	Very low	115 Å²	115	123.8 Å²	123.8	80%	0.804	79%	0.794	S	S	*	*			trans	-141.1	96.2	149.8	61.7	0	0	0	0	108.3
227	S	40.1	Very low	41	Very low	100 Å²	100	126.2 Å²	126.2	70%	0.699	80%	0.796	S	S	*	*				64.6	102.4	100.2	-168.1	0	0	0	0	113.4	T229	S227-T229 PolarHBondContact O-N 2.99Å
228	V	44.6	Very low	41.8	Very low	154 Å²	154	129.2 Å²	129.2	93%	0.933	80%	0.801	S	S	*	*			trans	-76.3	108.5	170	176.7	0	0	0	0	107.6
229	T	45	Very low	42.3	Very low	125 Å²	125	126 Å²	126	77%	0.767	79%	0.787	S	S	*	*			trans	-110.5	121.1	172.9	42.8	0	0	0	0	111.4	S227	S227-T229 PolarHBondContact O-N 2.99Å
230	G	37.9	Very low	43.2	Very low	74 Å²	74	128.9 Å²	128.9	76%	0.763	81%	0.812	S	S	*	*			trans	92.7	78.5	130.6	0	0	0	0	0	117.2
231	I	40.4	Very low	43.6	Very low	160 Å²	160	128.7 Å²	128.7	82%	0.821	81%	0.811	S	S	*	*			trans	-90.9	98.6	152.1	-57.7	175.6	0	0	0	106.4	C233	I231-C233 PolarHBondContact O-N 3.17Å
232	C	38.6	Very low	44.2	Very low	110 Å²	110	129.6 Å²	129.6	74%	0.743	81%	0.813	S	S	*	*			trans	-85.7	97.9	174.3	-171	0	0	0	0	108.6
233	C	49.9	Very low	44.5	Very low	104 Å²	104	130.8 Å²	130.8	70%	0.703	82%	0.816	S	S	*	*			trans	-90.9	91.5	168.7	-65.4	0	0	0	0	108.8	I231	I231-C233 PolarHBondContact O-N 3.17Å
234	H	41.7	Very low	44.9	Very low	158 Å²	158	130.6 Å²	130.6	73%	0.731	81%	0.809	S	S	*	*			trans	-96.1	87.8	162.6	-107	-62.2	0	0	0	108.6	L236	H234-L236 PolarHBondContact O-N 3.35Å
235	S	52.7	Low	45.2	Very low	118 Å²	118	132.4 Å²	132.4	83%	0.825	82%	0.816	S	S	*	*			trans	-78.3	96.3	162.5	-60.6	0	0	0	0	107.5
236	L	47.9	Very low	45.8	Very low	152 Å²	152	133.5 Å²	133.5	80%	0.796	82%	0.816	S	S	*	*			trans	-82	135.5	172.5	-106.8	154.8	0	0	0	109.8	H234	H234-L236 PolarHBondContact O-N 3.35Å
237	I	50.5	Low	46	Very low	161 Å²	161	134.9 Å²	134.9	83%	0.826	82%	0.817	S	S	*	*			trans	-58.6	128.3	179.9	-72.3	148.7	0	0	0	111.6
238	E	51.8	Low	46.5	Very low	196 Å²	196	137.5 Å²	137.5	92%	0.916	83%	0.826	S	S	*	*			trans	-132.4	115.9	159.8	-168	172.2	-155.6	0	0	103.2
239	G	50.9	Low	46.6	Very low	52 Å²	52	136.2 Å²	136.2	54%	0.536	82%	0.817	S	S	.	*			cis	124.8	110	28.1	0	0	0	0	0	105
240	T	52.3	Low	46.8	Very low	224 Å²	224	137.2 Å²	137.2	100%	1.374	82%	0.821	S	S	*	*			trans	85.8	0	-177.8	78	0	0	0	0	117.7

Retrieved 240 of 240 residues in 361.7 ms (Link to these results)

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