G4V8J3_SCHMA Loading...

Vacuolar ATPase assembly protein VMA22

AlphaFold DB , UniProt , Accession G4V8J3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 173 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	48	Very low	79.1	Confident	238 Å²	238	91.3 Å²	91.3	100%	1.172	48%	0.481	S	S	*	.				0	118.4	0	-90.2	171.1	156.8	0	0	107.5	T3	M1-T3 PolarHBondContact O-N 3.31Å
2	I	60.5	Low	80.2	Confident	102 Å²	102	90.1 Å²	90.1	52%	0.523	48%	0.48	S	S	.	.			trans	-75.2	109.6	169.1	-61.6	170.6	0	0	0	104.9	I4	I2-I4 PolarHBondContact O-N 3.21Å
3	T	71.5	Confident	81.1	Confident	90 Å²	90	85.2 Å²	85.2	55%	0.552	45%	0.454	S	S	*	.			trans	-72	108.1	173.7	47.2	0	0	0	0	107.2	M1 Y86	M1-T3 PolarHBondContact O-N 3.31Å; T3-Y86 VanDerWaalsContact O-CD1 3.28Å; T3-Y86 WeakPolarHBondContact O-CD1 3.42Å; T3-Y86 VanDerWaalsContact O-CE1 3.31Å; T3-Y86 WeakPolarHBondContact O-CE1 3.43Å; T3-Y86 VanDerWaalsContact OG1-CD1 3.25Å; T3-Y86 WeakPolarHBondContact OG1-CD1 3.38Å
4	I	76.5	Confident	82.1	Confident	89 Å²	89	82.6 Å²	82.6	46%	0.456	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-76.7	130.3	177.3	-60.5	168.2	0	0	0	107.1	I2	I2-I4 PolarHBondContact O-N 3.21Å
5	P	78.2	Confident	83.1	Confident	5 Å²	5	84.8 Å²	84.8	3%	0.032	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-62.6	138.1	177.3	25.5	-32.4	0	0	0	111.9	Y86 L161 L164 R165	P5-Y86 WeakPolarHBondContact CA-OH 3.36Å; P5-Y86 HydrophobicContact CB-CE1 4.35Å; P5-Y86 HydrophobicContact CB-CE2 4.09Å; P5-L161 HydrophobicContact CB-CB 4.47Å; P5-L161 HydrophobicContact CB-CD2 3.94Å; P5-L161 HydrophobicContact CG-CB 4.44Å; P5-L161 HydrophobicContact CG-CD2 4.42Å; P5-L164 HydrophobicContact CG-CB 4.45Å; P5-R165 HydrophobicContact CG-CB 4.09Å
6	T	85.2	Confident	83.8	Confident	66 Å²	66	84.9 Å²	84.9	41%	0.405	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-72.5	146.1	174.2	60.7	0	0	0	0	109.6	D8 E9 L10	T6-D8 PolarHBondContact O-N 3.48Å; T6-E9 PolarHBondContact O-N 3.21Å; T6-E9 WeakPolarHBondContact OG1-CB 3.36Å; T6-E9 WeakPolarHBondContact OG1-CG 3.25Å; T6-E9 PolarHBondContact OG1-N 3.14Å; T6-L10 PolarHBondContact O-N 3.36Å
7	D	87.6	Confident	84.5	Confident	79 Å²	79	81.8 Å²	81.8	42%	0.422	44%	0.436	S	S	.	.	H	α-helix	trans	-62.6	-35.4	178.9	-71.9	-12.4	0	0	0	110.9	E9 L10 D11 R165	D7-E9 VanDerWaalsContact C-N 3.35Å; D7-E9 PolarHBondContact O-N 2.79Å; D7-L10 PolarHBondContact O-N 3.29Å; D7-D11 WeakPolarHBondContact O-CB 3.44Å; D7-D11 PolarHBondContact O-N 3.32Å; D7-R165 IonicContact OD1-CZ 3.39Å; D7-R165 VanDerWaalsContact OD1-CZ 3.26Å; D7-R165 IonicContact OD1-NE 2.75Å; D7-R165 PolarHBondContact OD1-NE 3.27Å; D7-R165 IonicContact OD1-NH2 3.14Å; D7-R165 PolarHBondContact OD1-NH2 3.44Å; D7-R165 IonicContact OD2-NH2 2.69Å; D7-R165 PolarHBondContact OD2-NH2 3.16Å
8	D	90.4	Very high	85.3	Confident	125 Å²	125	82.5 Å²	82.5	67%	0.668	44%	0.44	S	S	*	.	H	α-helix	trans	-60.3	-39.1	176.1	-63.8	-24.3	0	0	0	113.1	T6 T12	T6-D8 PolarHBondContact O-N 3.48Å; D8-T12 VanDerWaalsContact O-CB 3.3Å; D8-T12 WeakPolarHBondContact O-CB 3.17Å; D8-T12 PolarHBondContact O-N 2.77Å; D8-T12 PolarHBondContact O-OG1 3.09Å
9	E	87.9	Confident	85.9	Confident	90 Å²	90	84.8 Å²	84.8	42%	0.421	45%	0.448	S	S	.	.	H	α-helix	trans	-68.3	-42	177.1	-78.5	168.6	-169.7	0	0	111.6	T6 D7 L13 Y86	T6-E9 PolarHBondContact O-N 3.21Å; T6-E9 WeakPolarHBondContact OG1-CB 3.36Å; T6-E9 WeakPolarHBondContact OG1-CG 3.25Å; T6-E9 PolarHBondContact OG1-N 3.14Å; D7-E9 VanDerWaalsContact C-N 3.35Å; D7-E9 PolarHBondContact O-N 2.79Å; E9-L13 WeakPolarHBondContact O-CB 3.31Å; E9-L13 PolarHBondContact O-N 2.97Å; E9-Y86 WeakPolarHBondContact OE2-CE2 3.45Å; E9-Y86 VanDerWaalsContact OE2-CZ 3.27Å; E9-Y86 PolarHBondContact OE2-OH 3.02Å
10	L	90.5	Very high	86.5	Confident	26 Å²	26	81 Å²	81	14%	0.136	43%	0.427	C	S	.	.	H	α-helix	trans	-65.4	-45.5	177.2	-178.5	60.8	0	0	0	110.8	T6 D7 L13 V14 I158 L161 I162	T6-L10 PolarHBondContact O-N 3.36Å; D7-L10 PolarHBondContact O-N 3.29Å; L10-L13 PolarHBondContact O-N 3.43Å; L10-V14 HydrophobicContact CD1-CG2 4.35Å; L10-V14 VanDerWaalsContact O-CG2 3.29Å; L10-V14 WeakPolarHBondContact O-CG2 3.31Å; L10-V14 PolarHBondContact O-N 2.93Å; L10-I158 HydrophobicContact CD1-CG2 4.25Å; L10-L161 HydrophobicContact CD1-CB 4.15Å; L10-L161 HydrophobicContact CD1-CD1 4.31Å; L10-I162 HydrophobicContact CD1-CG1 4.32Å; L10-I162 HydrophobicContact CD2-CG1 4.31Å
11	D	93.7	Very high	87	Confident	94 Å²	94	80.5 Å²	80.5	50%	0.503	42%	0.424	S	S	.	.	H	α-helix	trans	-62.3	-44.9	178.7	-77.1	-8.8	0	0	0	111.2	D7 L13 V14 L15	D7-D11 WeakPolarHBondContact O-CB 3.44Å; D7-D11 PolarHBondContact O-N 3.32Å; D11-L13 VanDerWaalsContact C-N 3.31Å; D11-L13 PolarHBondContact O-N 3.25Å; D11-V14 PolarHBondContact O-N 3.26Å; D11-L15 WeakPolarHBondContact O-CB 3.45Å; D11-L15 VanDerWaalsContact O-CG 3.31Å; D11-L15 WeakPolarHBondContact O-CG 3.37Å; D11-L15 PolarHBondContact O-N 3.19Å
12	T	93	Very high	89.4	Confident	77 Å²	77	72.1 Å²	72.1	47%	0.472	39%	0.389	S	S	.	.	H	α-helix	trans	-59.2	-43.5	175.6	-60.2	0	0	0	0	111.4	D8 L15 N16	D8-T12 VanDerWaalsContact O-CB 3.3Å; D8-T12 WeakPolarHBondContact O-CB 3.17Å; D8-T12 PolarHBondContact O-N 2.77Å; D8-T12 PolarHBondContact O-OG1 3.09Å; T12-L15 PolarHBondContact O-N 3.3Å; T12-N16 WeakPolarHBondContact O-CB 3.18Å; T12-N16 VanDerWaalsContact O-CG 3.32Å; T12-N16 PolarHBondContact O-N 3.19Å; T12-N16 PolarHBondContact O-ND2 3.34Å; T12-N16 VanDerWaalsContact O-ND2 3.14Å
13	L	92.1	Very high	91.2	Very high	26 Å²	26	69 Å²	69	14%	0.136	38%	0.375	C	S	.	.	H	α-helix	trans	-66.6	-39.4	178.4	-176.2	65.3	0	0	0	112.2	E9 L10 D11 H17 Q157 I158 L161	E9-L13 WeakPolarHBondContact O-CB 3.31Å; E9-L13 PolarHBondContact O-N 2.97Å; L10-L13 PolarHBondContact O-N 3.43Å; D11-L13 VanDerWaalsContact C-N 3.31Å; D11-L13 PolarHBondContact O-N 3.25Å; L13-H17 WeakPolarHBondContact O-CB 3.28Å; L13-H17 PolarHBondContact O-N 3.03Å; L13-Q157 HydrophobicContact CD1-CB 4.42Å; L13-Q157 HydrophobicContact CD2-CB 3.61Å; L13-I158 HydrophobicContact CB-CG1 4.47Å; L13-I158 HydrophobicContact CD2-CB 4.36Å; L13-I158 HydrophobicContact CD2-CG1 3.47Å; L13-I158 VanDerWaalsContact CD2-CG1 3.47Å; L13-I158 HydrophobicContact CG-CD1 4.26Å; L13-I158 HydrophobicContact CG-CG1 3.62Å; L13-L161 HydrophobicContact CD2-CD1 3.78Å
14	V	94.8	Very high	92.5	Very high	50 Å²	50	65.4 Å²	65.4	30%	0.303	35%	0.352	S	S	.	.	H	α-helix	trans	-66.5	-42.9	176.1	170.7	0	0	0	0	111	L10 D11 H17 L18 I158	L10-V14 HydrophobicContact CD1-CG2 4.35Å; L10-V14 VanDerWaalsContact O-CG2 3.29Å; L10-V14 WeakPolarHBondContact O-CG2 3.31Å; L10-V14 PolarHBondContact O-N 2.93Å; D11-V14 PolarHBondContact O-N 3.26Å; V14-H17 WeakPolarHBondContact O-CB 3.35Å; V14-H17 PolarHBondContact O-N 2.57Å; V14-L18 HydrophobicContact CG1-CD1 4.1Å; V14-L18 HydrophobicContact CG1-CG 4.42Å; V14-L18 WeakPolarHBondContact O-CG 3.45Å; V14-L18 PolarHBondContact O-N 3.27Å; V14-I158 HydrophobicContact CG2-CD1 4.01Å; V14-I158 HydrophobicContact CG2-CG1 4.3Å; V14-I158 HydrophobicContact CG2-CG2 4.4Å
15	L	96.3	Very high	93.5	Very high	115 Å²	115	65 Å²	65	60%	0.602	35%	0.35	S	S	*	.	H	α-helix	trans	-59.9	-48.1	175.8	-72.8	174.2	0	0	0	111.3	D11 T12 H17 L18 E19	D11-L15 WeakPolarHBondContact O-CB 3.45Å; D11-L15 VanDerWaalsContact O-CG 3.31Å; D11-L15 WeakPolarHBondContact O-CG 3.37Å; D11-L15 PolarHBondContact O-N 3.19Å; T12-L15 PolarHBondContact O-N 3.3Å; L15-H17 VanDerWaalsContact C-N 3.27Å; L15-H17 PolarHBondContact O-N 3.49Å; L15-L18 PolarHBondContact O-N 2.94Å; L15-E19 WeakPolarHBondContact O-CB 3.34Å; L15-E19 PolarHBondContact O-N 3.46Å
16	N	94.8	Very high	94.4	Very high	87 Å²	87	68.6 Å²	68.6	47%	0.465	37%	0.369	S	S	.	.	H	α-helix	trans	-60.3	-37.2	175.1	-73.9	-34.1	0	0	0	112.3	T12 N20	T12-N16 WeakPolarHBondContact O-CB 3.18Å; T12-N16 VanDerWaalsContact O-CG 3.32Å; T12-N16 PolarHBondContact O-N 3.19Å; T12-N16 PolarHBondContact O-ND2 3.34Å; T12-N16 VanDerWaalsContact O-ND2 3.14Å; N16-N20 VanDerWaalsContact O-CB 3.3Å; N16-N20 WeakPolarHBondContact O-CB 3.38Å; N16-N20 PolarHBondContact O-N 3.03Å
17	H	96.2	Very high	95.1	Very high	31 Å²	31	66.7 Å²	66.7	14%	0.144	36%	0.356	C	S	.	.	H	α-helix	trans	-64.9	-44.3	176.3	-179.5	84	0	0	0	112	L13 V14 L15 N20 L21 L151 S154 S155 I158	L13-H17 WeakPolarHBondContact O-CB 3.28Å; L13-H17 PolarHBondContact O-N 3.03Å; V14-H17 WeakPolarHBondContact O-CB 3.35Å; V14-H17 PolarHBondContact O-N 2.57Å; L15-H17 VanDerWaalsContact C-N 3.27Å; L15-H17 PolarHBondContact O-N 3.49Å; H17-N20 PolarHBondContact O-N 2.97Å; H17-L21 PolarHBondContact O-N 3Å; H17-L151 WeakPolarHBondContact CE1-CD1 3.47Å; H17-S154 PolarHBondContact ND1-OG 2.92Å; H17-S155 PolarHBondContact CE1-OG 2.97Å; H17-I158 HydrophobicContact CB-CD1 3.73Å
18	L	97.8	Very high	95.6	Very high	95 Å²	95	65.4 Å²	65.4	50%	0.497	35%	0.35	S	S	.	.	H	α-helix	trans	-68.1	-40.2	177.6	-68.3	174.8	0	0	0	112.2	V14 L15 N20 L21 S22	V14-L18 HydrophobicContact CG1-CD1 4.1Å; V14-L18 HydrophobicContact CG1-CG 4.42Å; V14-L18 WeakPolarHBondContact O-CG 3.45Å; V14-L18 PolarHBondContact O-N 3.27Å; L15-L18 PolarHBondContact O-N 2.94Å; L18-N20 VanDerWaalsContact C-N 3.34Å; L18-N20 PolarHBondContact O-N 2.92Å; L18-L21 WeakPolarHBondContact O-CB 3.48Å; L18-L21 PolarHBondContact O-N 3.29Å; L18-S22 PolarHBondContact O-N 3.01Å
19	E	97.6	Very high	95.9	Very high	127 Å²	127	64.8 Å²	64.8	59%	0.593	34%	0.342	S	S	*	.	H	α-helix	trans	-61.5	-43.8	174.1	-173.9	-174.9	174.2	0	0	111.3	L15 L21 S22 T23	L15-E19 WeakPolarHBondContact O-CB 3.34Å; L15-E19 PolarHBondContact O-N 3.46Å; E19-L21 VanDerWaalsContact C-N 3.3Å; E19-L21 PolarHBondContact O-N 3.33Å; E19-S22 WeakPolarHBondContact O-CB 3.27Å; E19-S22 PolarHBondContact O-N 3.18Å; E19-T23 PolarHBondContact O-N 3.26Å; E19-T23 PolarHBondContact O-OG1 2.93Å
20	N	97.3	Very high	96.4	Very high	7 Å²	7	65.4 Å²	65.4	4%	0.037	35%	0.345	C	S	.	.	H	α-helix	trans	-63.2	-37.8	176	-171.1	55	0	0	0	111.8	N16 H17 L18 T23 I24 R147 L151	N16-N20 VanDerWaalsContact O-CB 3.3Å; N16-N20 WeakPolarHBondContact O-CB 3.38Å; N16-N20 PolarHBondContact O-N 3.03Å; H17-N20 PolarHBondContact O-N 2.97Å; L18-N20 VanDerWaalsContact C-N 3.34Å; L18-N20 PolarHBondContact O-N 2.92Å; N20-T23 PolarHBondContact O-N 2.92Å; N20-I24 WeakPolarHBondContact O-CG1 3.48Å; N20-I24 PolarHBondContact O-N 2.96Å; N20-R147 PolarHBondContact ND2-O 3.37Å; N20-R147 WeakPolarHBondContact OD1-CD 3.23Å; N20-L151 HydrophobicContact CB-CD1 4.5Å; N20-L151 WeakPolarHBondContact ND2-CB 3.48Å; N20-L151 PolarHBondContact ND2-N 2.94Å
21	L	97.8	Very high	96.8	Very high	71 Å²	71	65.2 Å²	65.2	37%	0.372	34%	0.344	S	S	.	.	H	α-helix	trans	-64.8	-43.3	174.3	-174.8	146.5	0	0	0	111.8	H17 L18 E19 T23 I24 I25 L151	H17-L21 PolarHBondContact O-N 3Å; L18-L21 WeakPolarHBondContact O-CB 3.48Å; L18-L21 PolarHBondContact O-N 3.29Å; E19-L21 VanDerWaalsContact C-N 3.3Å; E19-L21 PolarHBondContact O-N 3.33Å; L21-T23 VanDerWaalsContact C-N 3.33Å; L21-T23 PolarHBondContact O-N 2.83Å; L21-I24 WeakPolarHBondContact O-CB 3.41Å; L21-I24 PolarHBondContact O-N 3.17Å; L21-I25 HydrophobicContact CD2-CD1 3.67Å; L21-I25 HydrophobicContact CD2-CG1 4.46Å; L21-I25 WeakPolarHBondContact O-CG1 3.5Å; L21-I25 PolarHBondContact O-N 2.9Å; L21-I25 VanDerWaalsContact O-N 3.12Å; L21-L151 HydrophobicContact CB-CD1 4.12Å
22	S	98	Very high	97	Very high	62 Å²	62	65.9 Å²	65.9	43%	0.434	34%	0.344	S	S	.	.	H	α-helix	trans	-57.5	-47.7	173.9	-168.8	0	0	0	0	110.9	L18 E19 I24 I25 D26	L18-S22 PolarHBondContact O-N 3.01Å; E19-S22 WeakPolarHBondContact O-CB 3.27Å; E19-S22 PolarHBondContact O-N 3.18Å; S22-I24 VanDerWaalsContact C-N 3.28Å; S22-I24 PolarHBondContact O-N 3.07Å; S22-I25 WeakPolarHBondContact O-CB 3.13Å; S22-I25 PolarHBondContact O-N 3.3Å; S22-D26 PolarHBondContact O-N 3.24Å
23	T	98.1	Very high	97.2	Very high	37 Å²	37	66.9 Å²	66.9	23%	0.227	35%	0.347	C	S	.	.	H	α-helix	trans	-58.8	-39.4	177.8	-55.3	0	0	0	0	111.9	E19 N20 L21 I25 D26 L27	E19-T23 PolarHBondContact O-N 3.26Å; E19-T23 PolarHBondContact O-OG1 2.93Å; N20-T23 PolarHBondContact O-N 2.92Å; L21-T23 VanDerWaalsContact C-N 3.33Å; L21-T23 PolarHBondContact O-N 2.83Å; T23-I25 VanDerWaalsContact C-N 3.33Å; T23-I25 PolarHBondContact O-N 3.47Å; T23-D26 PolarHBondContact O-N 3.37Å; T23-L27 HydrophobicContact CG2-CD1 3.95Å; T23-L27 HydrophobicContact CG2-CG 4.37Å; T23-L27 WeakPolarHBondContact O-CB 3.44Å; T23-L27 VanDerWaalsContact O-CG 3.23Å; T23-L27 WeakPolarHBondContact O-CG 3.3Å; T23-L27 PolarHBondContact O-N 2.72Å
24	I	98.2	Very high	97.5	Very high	14 Å²	14	66 Å²	66	7%	0.072	34%	0.343	C	S	.	.	H	α-helix	trans	-62.8	-41	176.6	-72.7	165.2	0	0	0	111	N20 L21 S22 L27 N28 L144 R147 R148 L151	N20-I24 WeakPolarHBondContact O-CG1 3.48Å; N20-I24 PolarHBondContact O-N 2.96Å; L21-I24 WeakPolarHBondContact O-CB 3.41Å; L21-I24 PolarHBondContact O-N 3.17Å; S22-I24 VanDerWaalsContact C-N 3.28Å; S22-I24 PolarHBondContact O-N 3.07Å; I24-L27 PolarHBondContact O-N 2.98Å; I24-N28 PolarHBondContact O-N 3.42Å; I24-N28 PolarHBondContact O-ND2 3.22Å; I24-L144 HydrophobicContact CG2-CD2 3.99Å; I24-R147 HydrophobicContact CD1-CB 4.02Å; I24-R147 HydrophobicContact CG1-CB 3.59Å; I24-R148 HydrophobicContact CD1-CG 4.27Å; I24-L151 HydrophobicContact CD1-CB 4.07Å; I24-L151 HydrophobicContact CD1-CD1 4.43Å; I24-L151 HydrophobicContact CD1-CD2 3.86Å; I24-L151 HydrophobicContact CD1-CG 4.35Å
25	I	98.2	Very high	97.7	Very high	80 Å²	80	65.2 Å²	65.2	41%	0.41	34%	0.337	S	S	.	.	H	α-helix	trans	-62.9	-47.9	178.1	-67.5	170.3	0	0	0	110.1	L21 S22 T23 L27 N28 H29	L21-I25 HydrophobicContact CD2-CD1 3.67Å; L21-I25 HydrophobicContact CD2-CG1 4.46Å; L21-I25 WeakPolarHBondContact O-CG1 3.5Å; L21-I25 PolarHBondContact O-N 2.9Å; L21-I25 VanDerWaalsContact O-N 3.12Å; S22-I25 WeakPolarHBondContact O-CB 3.13Å; S22-I25 PolarHBondContact O-N 3.3Å; T23-I25 VanDerWaalsContact C-N 3.33Å; T23-I25 PolarHBondContact O-N 3.47Å; I25-L27 VanDerWaalsContact C-N 3.34Å; I25-L27 PolarHBondContact O-N 3.1Å; I25-N28 PolarHBondContact O-N 2.96Å; I25-N28 VanDerWaalsContact O-N 3.17Å; I25-H29 VanDerWaalsContact CG2-CE1 3.44Å; I25-H29 WeakPolarHBondContact CG2-CE1 3.37Å; I25-H29 PolarHBondContact O-N 3.43Å; I25-H29 PolarHBondContact O-ND1 3.37Å
26	D	98.1	Very high	97.8	Very high	81 Å²	81	62.6 Å²	62.6	43%	0.433	33%	0.328	S	S	.	.	H	α-helix	trans	-60.5	-43.5	178.5	-63.6	-29.4	0	0	0	112	S22 T23 N28 H29 H30	S22-D26 PolarHBondContact O-N 3.24Å; T23-D26 PolarHBondContact O-N 3.37Å; D26-N28 VanDerWaalsContact C-N 3.32Å; D26-N28 PolarHBondContact O-N 3.23Å; D26-H29 PolarHBondContact O-N 3.28Å; D26-H30 PolarHBondContact O-CD2 3.1Å; D26-H30 PolarHBondContact O-N 3.02Å
27	L	98.4	Very high	97.9	Very high	26 Å²	26	62.1 Å²	62.1	14%	0.136	32%	0.323	C	S	.	.	H	α-helix	trans	-63.3	-35.1	176.7	-72.1	168.2	0	0	0	112.8	T23 I24 I25 H30 L31 I140 E143 L144 R147	T23-L27 HydrophobicContact CG2-CD1 3.95Å; T23-L27 HydrophobicContact CG2-CG 4.37Å; T23-L27 WeakPolarHBondContact O-CB 3.44Å; T23-L27 VanDerWaalsContact O-CG 3.23Å; T23-L27 WeakPolarHBondContact O-CG 3.3Å; T23-L27 PolarHBondContact O-N 2.72Å; I24-L27 PolarHBondContact O-N 2.98Å; I25-L27 VanDerWaalsContact C-N 3.34Å; I25-L27 PolarHBondContact O-N 3.1Å; L27-H30 PolarHBondContact O-N 3.01Å; L27-L31 WeakPolarHBondContact O-CB 3.35Å; L27-L31 PolarHBondContact O-N 3.34Å; L27-I140 HydrophobicContact CB-CG2 4.23Å; L27-I140 HydrophobicContact CD2-CG2 4.15Å; L27-I140 VanDerWaalsContact O-CG2 3.28Å; L27-I140 WeakPolarHBondContact O-CG2 3.11Å; L27-E143 HydrophobicContact CD1-CB 4.29Å; L27-E143 HydrophobicContact CD1-CG 3.59Å; L27-E143 HydrophobicContact CD2-CG 4.14Å; L27-L144 HydrophobicContact CB-CD1 4.38Å; L27-L144 HydrophobicContact CB-CD2 3.56Å; L27-L144 HydrophobicContact CB-CG 3.75Å; L27-L144 HydrophobicContact CD1-CD2 4.28Å; L27-L144 HydrophobicContact CD1-CG 4.37Å; L27-R147 HydrophobicContact CD1-CG 4.04Å
28	N	98	Very high	98	Very high	53 Å²	53	60.7 Å²	60.7	28%	0.283	32%	0.317	S	S	.	.	H	α-helix	trans	-65.3	-40.8	175	-72.1	-49.3	0	0	0	111.4	I24 I25 D26 L31 E32	I24-N28 PolarHBondContact O-N 3.42Å; I24-N28 PolarHBondContact O-ND2 3.22Å; I25-N28 PolarHBondContact O-N 2.96Å; I25-N28 VanDerWaalsContact O-N 3.17Å; D26-N28 VanDerWaalsContact C-N 3.32Å; D26-N28 PolarHBondContact O-N 3.23Å; N28-L31 WeakPolarHBondContact O-CB 3.46Å; N28-L31 PolarHBondContact O-N 2.88Å; N28-E32 PolarHBondContact O-N 2.96Å
29	H	98.1	Very high	97.9	Very high	111 Å²	111	62.3 Å²	62.3	51%	0.514	32%	0.316	S	S	.	.	H	α-helix	trans	-60.4	-48.8	174.7	-65.7	108.9	0	0	0	111	I25 D26 L31 E32 D33	I25-H29 VanDerWaalsContact CG2-CE1 3.44Å; I25-H29 WeakPolarHBondContact CG2-CE1 3.37Å; I25-H29 PolarHBondContact O-N 3.43Å; I25-H29 PolarHBondContact O-ND1 3.37Å; D26-H29 PolarHBondContact O-N 3.28Å; H29-L31 VanDerWaalsContact C-N 3.28Å; H29-L31 PolarHBondContact O-N 3.18Å; H29-E32 PolarHBondContact O-N 2.82Å; H29-D33 PolarHBondContact O-N 3.23Å
30	H	98	Very high	97.9	Very high	104 Å²	104	61.6 Å²	61.6	48%	0.481	32%	0.316	S	S	.	.	H	α-helix	trans	-63.8	-31.8	177.7	-67.8	-39.4	0	0	0	113.9	D26 L27 S34 I140	D26-H30 PolarHBondContact O-CD2 3.1Å; D26-H30 PolarHBondContact O-N 3.02Å; L27-H30 PolarHBondContact O-N 3.01Å; H30-S34 WeakPolarHBondContact O-CB 3.34Å; H30-S34 PolarHBondContact O-N 3.38Å; H30-S34 PolarHBondContact O-OG 2.9Å; H30-I140 HydrophobicContact CB-CD1 3.97Å
31	L	98.4	Very high	97.9	Very high	22 Å²	22	62.1 Å²	62.1	12%	0.115	32%	0.319	C	S	.	.	H	α-helix	trans	-64	-49.3	173.5	179.7	60.6	0	0	0	110.4	L27 N28 H29 S34 L35 A137 I140 L144	L27-L31 WeakPolarHBondContact O-CB 3.35Å; L27-L31 PolarHBondContact O-N 3.34Å; N28-L31 WeakPolarHBondContact O-CB 3.46Å; N28-L31 PolarHBondContact O-N 2.88Å; H29-L31 VanDerWaalsContact C-N 3.28Å; H29-L31 PolarHBondContact O-N 3.18Å; L31-S34 PolarHBondContact O-N 2.73Å; L31-L35 HydrophobicContact CD1-CD1 3.82Å; L31-L35 HydrophobicContact CD1-CG 4.01Å; L31-L35 HydrophobicContact CD2-CD1 4.46Å; L31-L35 HydrophobicContact CG-CD1 3.77Å; L31-L35 HydrophobicContact CG-CG 4.35Å; L31-L35 WeakPolarHBondContact O-CB 3.03Å; L31-L35 VanDerWaalsContact O-CG 3.23Å; L31-L35 WeakPolarHBondContact O-CG 3.3Å; L31-L35 PolarHBondContact O-N 3.39Å; L31-A137 HydrophobicContact CD1-CB 3.78Å; L31-A137 WeakPolarHBondContact CD1-O 3.35Å; L31-I140 HydrophobicContact CB-CG2 3.8Å; L31-I140 HydrophobicContact CD1-CB 4.44Å; L31-I140 HydrophobicContact CD1-CG2 4.39Å; L31-L144 HydrophobicContact CB-CD1 4.3Å; L31-L144 HydrophobicContact CD2-CD1 3.7Å
32	E	98	Very high	97.6	Very high	107 Å²	107	60.2 Å²	60.2	50%	0.5	31%	0.309	S	S	.	.	H	α-helix	trans	-63.9	-40.8	178.9	-71.6	-54.8	144.7	0	0	112.3	N28 H29 S34 L35 S36	N28-E32 PolarHBondContact O-N 2.96Å; H29-E32 PolarHBondContact O-N 2.82Å; E32-S34 PolarHBondContact O-N 2.8Å; E32-L35 PolarHBondContact O-N 3.24Å; E32-S36 VanDerWaalsContact O-CB 3.23Å; E32-S36 WeakPolarHBondContact O-CB 3.18Å; E32-S36 PolarHBondContact O-N 3.38Å; E32-S36 PolarHBondContact O-OG 2.96Å
33	D	97.9	Very high	97.4	Very high	98 Å²	98	59.8 Å²	59.8	52%	0.524	31%	0.309	S	S	.	.	H	α-helix	trans	-59.8	-47.1	173.8	-69.2	-19.9	0	0	0	111.3	H29 L35 S36 E37	H29-D33 PolarHBondContact O-N 3.23Å; D33-L35 PolarHBondContact O-N 3.03Å; D33-S36 WeakPolarHBondContact CA-OG 3.45Å; D33-S36 PolarHBondContact O-OG 2.85Å; D33-E37 WeakPolarHBondContact O-CB 3.34Å; D33-E37 PolarHBondContact O-N 2.86Å; D33-E37 VanDerWaalsContact O-N 3.1Å
34	S	97.8	Very high	97.1	Very high	9 Å²	9	63.9 Å²	63.9	6%	0.063	32%	0.323	C	S	.	.	H	α-helix	trans	-65.1	-40.3	179.3	-63.1	0	0	0	0	111.9	H30 L31 E32 G38 C133	H30-S34 WeakPolarHBondContact O-CB 3.34Å; H30-S34 PolarHBondContact O-N 3.38Å; H30-S34 PolarHBondContact O-OG 2.9Å; L31-S34 PolarHBondContact O-N 2.73Å; E32-S34 PolarHBondContact O-N 2.8Å; S34-G38 PolarHBondContact O-N 3.02Å; S34-C133 WeakPolarHBondContact O-CB 3.34Å
35	L	98.3	Very high	96.8	Very high	32 Å²	32	63.3 Å²	63.3	17%	0.168	32%	0.32	C	S	.	.	H	α-helix	trans	-73.1	-39.9	-179.8	-72.5	174.4	0	0	0	112.2	L31 E32 D33 R39 F134 A137	L31-L35 HydrophobicContact CD1-CD1 3.82Å; L31-L35 HydrophobicContact CD1-CG 4.01Å; L31-L35 HydrophobicContact CD2-CD1 4.46Å; L31-L35 HydrophobicContact CG-CD1 3.77Å; L31-L35 HydrophobicContact CG-CG 4.35Å; L31-L35 WeakPolarHBondContact O-CB 3.03Å; L31-L35 VanDerWaalsContact O-CG 3.23Å; L31-L35 WeakPolarHBondContact O-CG 3.3Å; L31-L35 PolarHBondContact O-N 3.39Å; E32-L35 PolarHBondContact O-N 3.24Å; D33-L35 PolarHBondContact O-N 3.03Å; L35-R39 VanDerWaalsContact CB-NH1 3.35Å; L35-R39 WeakPolarHBondContact O-CB 3.31Å; L35-R39 WeakPolarHBondContact O-CG 3.29Å; L35-R39 PolarHBondContact O-N 3.31Å; L35-F134 HydrophobicContact CD2-CD1 4.27Å; L35-F134 HydrophobicContact CD2-CE1 4.5Å; L35-A137 HydrophobicContact CD2-CB 3.63Å; L35-A137 HydrophobicContact CG-CB 3.95Å
36	S	98.2	Very high	96.3	Very high	61 Å²	61	65.6 Å²	65.6	43%	0.427	32%	0.324	S	S	.	.	H	α-helix	trans	-63.6	-49.8	178.1	60.6	0	0	0	0	111.2	E32 D33 G38 R39 L40	E32-S36 VanDerWaalsContact O-CB 3.23Å; E32-S36 WeakPolarHBondContact O-CB 3.18Å; E32-S36 PolarHBondContact O-N 3.38Å; E32-S36 PolarHBondContact O-OG 2.96Å; D33-S36 WeakPolarHBondContact CA-OG 3.45Å; D33-S36 PolarHBondContact O-OG 2.85Å; S36-G38 PolarHBondContact O-N 3.49Å; S36-R39 PolarHBondContact O-N 3.18Å; S36-L40 WeakPolarHBondContact O-CB 3.34Å; S36-L40 PolarHBondContact O-N 2.95Å
37	E	98	Very high	95.9	Very high	77 Å²	77	68 Å²	68	36%	0.36	33%	0.332	S	S	.	.	H	α-helix	trans	-62	-45.3	176.6	-176.5	57.8	-153	0	0	111.5	D33 R39 L40 L41	D33-E37 WeakPolarHBondContact O-CB 3.34Å; D33-E37 PolarHBondContact O-N 2.86Å; D33-E37 VanDerWaalsContact O-N 3.1Å; E37-R39 VanDerWaalsContact C-N 3.35Å; E37-R39 PolarHBondContact O-N 3.45Å; E37-L40 PolarHBondContact O-N 3.35Å; E37-L41 HydrophobicContact CG-CD1 3.89Å; E37-L41 WeakPolarHBondContact O-CB 3.19Å; E37-L41 WeakPolarHBondContact O-CG 3.4Å; E37-L41 PolarHBondContact O-N 2.98Å; E37-L41 VanDerWaalsContact OE1-CD1 3.27Å; E37-L41 WeakPolarHBondContact OE1-CD1 3.36Å; E37-L41 WeakPolarHBondContact OE1-CG 3.44Å
38	G	97.4	Very high	95.4	Very high	0 Å²	0	71.6 Å²	71.6	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-58.6	-43.3	177.2	0	0	0	0	0	113	S34 S36 L42 F134	S34-G38 PolarHBondContact O-N 3.02Å; S36-G38 PolarHBondContact O-N 3.49Å; G38-L42 WeakPolarHBondContact O-CB 3.37Å; G38-L42 PolarHBondContact O-N 2.95Å; G38-F134 WeakPolarHBondContact O-CZ 3.46Å
39	R	96.9	Very high	94.7	Very high	130 Å²	130	70.2 Å²	70.2	49%	0.491	34%	0.344	S	S	.	.	H	α-helix	trans	-67.7	-42	177.1	-72.4	173.8	-163.6	123.7	-3	112	L35 S36 E37 L42 A43 F134	L35-R39 VanDerWaalsContact CB-NH1 3.35Å; L35-R39 WeakPolarHBondContact O-CB 3.31Å; L35-R39 WeakPolarHBondContact O-CG 3.29Å; L35-R39 PolarHBondContact O-N 3.31Å; S36-R39 PolarHBondContact O-N 3.18Å; E37-R39 VanDerWaalsContact C-N 3.35Å; E37-R39 PolarHBondContact O-N 3.45Å; R39-L42 PolarHBondContact O-N 2.92Å; R39-A43 WeakPolarHBondContact O-CB 3.48Å; R39-A43 PolarHBondContact O-N 2.92Å; R39-F134 HydrophobicContact CG-CE1 4.3Å; R39-F134 HydrophobicContact CG-CZ 4.36Å
40	L	97.2	Very high	93.4	Very high	111 Å²	111	75.5 Å²	75.5	58%	0.581	36%	0.359	S	S	*	.	H	α-helix	trans	-61	-47.3	177.8	-179.6	64	0	0	0	111.2	S36 E37 L42 A43 K44	S36-L40 WeakPolarHBondContact O-CB 3.34Å; S36-L40 PolarHBondContact O-N 2.95Å; E37-L40 PolarHBondContact O-N 3.35Å; L40-L42 PolarHBondContact O-N 3.42Å; L40-A43 WeakPolarHBondContact O-CB 3.45Å; L40-A43 PolarHBondContact O-N 2.7Å; L40-K44 WeakPolarHBondContact O-CB 3.41Å; L40-K44 PolarHBondContact O-N 3.19Å
41	L	96	Very high	92	Very high	19 Å²	19	74.2 Å²	74.2	10%	0.099	37%	0.374	C	S	.	.	H	α-helix	trans	-66.5	-36.9	178.5	-71.5	167.1	0	0	0	112.9	E37 K44 T45 H129 A130	E37-L41 HydrophobicContact CG-CD1 3.89Å; E37-L41 WeakPolarHBondContact O-CB 3.19Å; E37-L41 WeakPolarHBondContact O-CG 3.4Å; E37-L41 PolarHBondContact O-N 2.98Å; E37-L41 VanDerWaalsContact OE1-CD1 3.27Å; E37-L41 WeakPolarHBondContact OE1-CD1 3.36Å; E37-L41 WeakPolarHBondContact OE1-CG 3.44Å; L41-K44 PolarHBondContact O-N 2.86Å; L41-T45 WeakPolarHBondContact O-CB 3.32Å; L41-T45 PolarHBondContact O-N 2.94Å; L41-T45 PolarHBondContact O-OG1 2.9Å; L41-H129 HydrophobicContact CD1-CB 3.85Å; L41-H129 WeakPolarHBondContact CD1-CD2 3Å; L41-A130 HydrophobicContact CB-CB 3.81Å
42	L	93.4	Very high	90.2	Very high	31 Å²	31	78.2 Å²	78.2	16%	0.162	40%	0.396	C	S	.	.	H	α-helix	trans	-63.7	-43.7	172.9	-179.5	60.5	0	0	0	111.1	G38 R39 L40 T45 R46 I56 L127 A130 F134	G38-L42 WeakPolarHBondContact O-CB 3.37Å; G38-L42 PolarHBondContact O-N 2.95Å; R39-L42 PolarHBondContact O-N 2.92Å; L40-L42 PolarHBondContact O-N 3.42Å; L42-T45 WeakPolarHBondContact O-CB 3.29Å; L42-T45 PolarHBondContact O-N 3.14Å; L42-R46 WeakPolarHBondContact O-CG 3.41Å; L42-R46 PolarHBondContact O-N 2.86Å; L42-I56 HydrophobicContact CD1-CG2 4.14Å; L42-L127 HydrophobicContact CD1-CD1 3.89Å; L42-A130 HydrophobicContact CB-CB 4.27Å; L42-F134 HydrophobicContact CB-CE2 4.42Å; L42-F134 HydrophobicContact CD2-CE2 4.21Å; L42-F134 HydrophobicContact CD2-CZ 4.31Å
43	A	92.3	Very high	88.5	Confident	53 Å²	53	79.8 Å²	79.8	44%	0.438	42%	0.419	S	S	.	.	H	α-helix	trans	-62.4	-45.4	175.3	0	0	0	0	0	111.8	R39 L40 T45 R46 H47	R39-A43 WeakPolarHBondContact O-CB 3.48Å; R39-A43 PolarHBondContact O-N 2.92Å; L40-A43 WeakPolarHBondContact O-CB 3.45Å; L40-A43 PolarHBondContact O-N 2.7Å; A43-T45 VanDerWaalsContact C-N 3.29Å; A43-T45 PolarHBondContact O-N 3.09Å; A43-R46 PolarHBondContact O-N 3.17Å; A43-H47 PolarHBondContact O-N 3.04Å
44	K	92.6	Very high	86.8	Confident	123 Å²	123	77.3 Å²	77.3	54%	0.535	41%	0.408	S	S	.	.	H	α-helix	trans	-56.1	-44	173.4	-177.8	176.7	-179.1	176	0	111.6	L40 L41 H47 N48	L40-K44 WeakPolarHBondContact O-CB 3.41Å; L40-K44 PolarHBondContact O-N 3.19Å; L41-K44 PolarHBondContact O-N 2.86Å; K44-H47 PolarHBondContact O-N 2.89Å; K44-N48 WeakPolarHBondContact O-CB 2.97Å; K44-N48 PolarHBondContact O-N 3.45Å; K44-N48 PolarHBondContact O-ND2 2.96Å
45	T	91.2	Very high	85.5	Confident	1 Å²	1	80.2 Å²	80.2	1%	0.006	43%	0.429	C	S	.	.	H	α-helix	trans	-63	-47.4	177.5	-52.4	0	0	0	0	111.4	L41 L42 A43 H47 N48 L49 I56 P124 S126 L127	L41-T45 WeakPolarHBondContact O-CB 3.32Å; L41-T45 PolarHBondContact O-N 2.94Å; L41-T45 PolarHBondContact O-OG1 2.9Å; L42-T45 WeakPolarHBondContact O-CB 3.29Å; L42-T45 PolarHBondContact O-N 3.14Å; A43-T45 VanDerWaalsContact C-N 3.29Å; A43-T45 PolarHBondContact O-N 3.09Å; T45-H47 VanDerWaalsContact C-N 3.31Å; T45-H47 PolarHBondContact O-N 3.21Å; T45-N48 PolarHBondContact O-N 2.69Å; T45-L49 HydrophobicContact CG2-CD1 3.94Å; T45-L49 HydrophobicContact CG2-CG 4.49Å; T45-L49 WeakPolarHBondContact O-CG 3.3Å; T45-L49 PolarHBondContact O-N 2.89Å; T45-I56 HydrophobicContact CG2-CD1 3.33Å; T45-P124 HydrophobicContact CG2-CB 4.1Å; T45-P124 HydrophobicContact CG2-CG 4.1Å; T45-S126 VanDerWaalsContact OG1-CB 3.29Å; T45-S126 WeakPolarHBondContact OG1-CB 3.2Å; T45-S126 PolarHBondContact OG1-OG 2.89Å; T45-L127 HydrophobicContact CG2-CB 3.89Å; T45-L127 HydrophobicContact CG2-CD1 4.34Å; T45-L127 HydrophobicContact CG2-CG 4.47Å; T45-L127 PolarHBondContact OG1-N 2.91Å
46	R	88.8	Confident	84.7	Confident	128 Å²	128	79.4 Å²	79.4	48%	0.483	43%	0.425	S	S	.	.	H	α-helix	trans	-61	-39.7	177.6	-75.7	175.2	171.5	157.7	1.4	112.4	L42 A43 L49 R50 I56	L42-R46 WeakPolarHBondContact O-CG 3.41Å; L42-R46 PolarHBondContact O-N 2.86Å; A43-R46 PolarHBondContact O-N 3.17Å; R46-L49 PolarHBondContact O-N 3.34Å; R46-R50 PolarHBondContact O-N 2.99Å; R46-I56 HydrophobicContact CG-CB 4.18Å; R46-I56 PolarHBondContact NE-O 2.84Å
47	H	88.7	Confident	83.8	Confident	133 Å²	133	78.1 Å²	78.1	62%	0.616	42%	0.415	S	S	*	.	H	α-helix	trans	-64.1	-47.7	176.7	-176.5	77.5	0	0	0	111.5	A43 K44 T45 L49 R50	A43-H47 PolarHBondContact O-N 3.04Å; K44-H47 PolarHBondContact O-N 2.89Å; T45-H47 VanDerWaalsContact C-N 3.31Å; T45-H47 PolarHBondContact O-N 3.21Å; H47-L49 PolarHBondContact O-N 3.48Å; H47-R50 WeakPolarHBondContact O-CB 3.45Å; H47-R50 PolarHBondContact O-N 3.01Å; H47-R50 VanDerWaalsContact O-N 3.09Å
48	N	87.5	Confident	82.9	Confident	101 Å²	101	78.8 Å²	78.8	54%	0.54	43%	0.429	S	S	.	.	H	α-helix	trans	-67.1	-24.7	-179.1	-68.7	-10.7	0	0	0	113.5	K44 T45	K44-N48 WeakPolarHBondContact O-CB 2.97Å; K44-N48 PolarHBondContact O-N 3.45Å; K44-N48 PolarHBondContact O-ND2 2.96Å; T45-N48 PolarHBondContact O-N 2.69Å
49	L	83.4	Confident	82.1	Confident	24 Å²	24	84.3 Å²	84.3	13%	0.126	46%	0.463	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-6.2	175.9	-69.4	174	0	0	0	113.3	T45 R46 H47 G51 N52 I56	T45-L49 HydrophobicContact CG2-CD1 3.94Å; T45-L49 HydrophobicContact CG2-CG 4.49Å; T45-L49 WeakPolarHBondContact O-CG 3.3Å; T45-L49 PolarHBondContact O-N 2.89Å; R46-L49 PolarHBondContact O-N 3.34Å; H47-L49 PolarHBondContact O-N 3.48Å; L49-G51 PolarHBondContact O-N 3.17Å; L49-N52 PolarHBondContact O-N 3.42Å; L49-I56 HydrophobicContact CD1-CD1 3.56Å; L49-I56 HydrophobicContact CD1-CG1 3.65Å
50	R	70.5	Confident	81.5	Confident	221 Å²	221	79.4 Å²	79.4	83%	0.834	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	96.5	-179.1	-167	176.1	-175.5	-124.5	2.1	109.9	R46 H47	R46-R50 PolarHBondContact O-N 2.99Å; H47-R50 WeakPolarHBondContact O-CB 3.45Å; H47-R50 PolarHBondContact O-N 3.01Å; H47-R50 VanDerWaalsContact O-N 3.09Å
51	G	68.6	Low	80.8	Confident	77 Å²	77	79.2 Å²	79.2	79%	0.794	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	134.1	-21.2	-173.9	0	0	0	0	0	112.9	L49	L49-G51 PolarHBondContact O-N 3.17Å
52	N	62.4	Low	80.2	Confident	107 Å²	107	80.9 Å²	80.9	57%	0.572	45%	0.45	S	S	*	.	S	Bend	trans	-92.3	140.2	170.9	-62.6	-11.9	0	0	0	108.3	L49 C54	L49-N52 PolarHBondContact O-N 3.42Å; N52-C54 PolarHBondContact O-N 3.36Å
53	S	62.4	Low	79.8	Confident	139 Å²	139	85.7 Å²	85.7	97%	0.972	48%	0.475	S	S	*	.	S	Bend	trans	-58.2	-6.2	-178.6	-50.1	0	0	0	0	114.7
54	C	61.9	Low	79.3	Confident	46 Å²	46	89 Å²	89	31%	0.311	49%	0.485	S	S	.	.			trans	-96.6	91.8	-178.8	-145	0	0	0	0	110.3	N52 F118	N52-C54 PolarHBondContact O-N 3.36Å; C54-F118 PolarHBondContact SG-O 3.06Å
55	S	69.5	Low	78.7	Confident	71 Å²	71	84.9 Å²	84.9	50%	0.497	47%	0.468	S	S	.	.			trans	-87.9	129.1	170.8	73.5	0	0	0	0	110.1	S57 S60	S55-S57 PolarHBondContact O-N 2.88Å; S55-S60 PolarHBondContact O-OG 3.2Å
56	I	80.8	Confident	78.1	Confident	15 Å²	15	89.1 Å²	89.1	8%	0.077	49%	0.488	C	S	.	.			trans	-77.7	94.1	174.2	-56.2	175	0	0	0	108	L42 T45 R46 L49 F118 L127	L42-I56 HydrophobicContact CD1-CG2 4.14Å; T45-I56 HydrophobicContact CG2-CD1 3.33Å; R46-I56 HydrophobicContact CG-CB 4.18Å; R46-I56 PolarHBondContact NE-O 2.84Å; L49-I56 HydrophobicContact CD1-CD1 3.56Å; L49-I56 HydrophobicContact CD1-CG1 3.65Å; I56-F118 HydrophobicContact CG1-CB 4.28Å; I56-F118 HydrophobicContact CG2-CB 4.34Å; I56-F118 HydrophobicContact CG2-CD1 3.74Å; I56-F118 HydrophobicContact CG2-CE1 4.31Å; I56-F118 HydrophobicContact CG2-CG 4.2Å; I56-L127 HydrophobicContact CD1-CD1 3.81Å; I56-L127 HydrophobicContact CD1-CD2 3.74Å; I56-L127 HydrophobicContact CD1-CG 4.33Å
57	S	80.5	Confident	77.5	Confident	33 Å²	33	88 Å²	88	23%	0.231	50%	0.5	C	S	.	.	S	Bend	trans	-140.6	175.9	179.5	83.3	0	0	0	0	111.3	S55 T59 S60	S55-S57 PolarHBondContact O-N 2.88Å; S57-T59 PolarHBondContact O-N 3.4Å; S57-T59 PolarHBondContact OG-N 2.82Å; S57-T59 PolarHBondContact OG-OG1 3.32Å; S57-S60 WeakPolarHBondContact O-CB 3.48Å; S57-S60 PolarHBondContact O-N 2.92Å; S57-S60 VanDerWaalsContact O-N 3.14Å; S57-S60 PolarHBondContact O-OG 2.95Å
58	S	78.8	Confident	77	Confident	92 Å²	92	86.6 Å²	86.6	64%	0.643	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-62.6	-16.2	174.3	49.5	0	0	0	0	113.6	S60 Y61	S58-S60 PolarHBondContact O-N 2.99Å; S58-Y61 WeakPolarHBondContact O-CD2 3.49Å
59	T	81.1	Confident	76.4	Confident	116 Å²	116	86.4 Å²	86.4	71%	0.712	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-77	-13.3	176.1	65.4	0	0	0	0	113	S57 Y61	S57-T59 PolarHBondContact O-N 3.4Å; S57-T59 PolarHBondContact OG-N 2.82Å; S57-T59 PolarHBondContact OG-OG1 3.32Å; T59-Y61 VanDerWaalsContact C-N 3.31Å
60	S	83	Confident	76.2	Confident	26 Å²	26	87 Å²	87	18%	0.182	51%	0.506	C	S	.	.	G	3₁₀ helix	trans	-80	-10.8	179	-47.7	0	0	0	0	113.4	S55 S57 S58 N62 W117	S55-S60 PolarHBondContact O-OG 3.2Å; S57-S60 WeakPolarHBondContact O-CB 3.48Å; S57-S60 PolarHBondContact O-N 2.92Å; S57-S60 VanDerWaalsContact O-N 3.14Å; S57-S60 PolarHBondContact O-OG 2.95Å; S58-S60 PolarHBondContact O-N 2.99Å; S60-N62 PolarHBondContact O-N 2.97Å; S60-W117 WeakPolarHBondContact O-CB 3.31Å
61	Y	83	Confident	76.8	Confident	107 Å²	107	78.9 Å²	78.9	42%	0.42	49%	0.486	S	S	.	.			trans	-65.5	130.8	-178.8	-68.2	-62.3	0	0	0	111.3	S58 T59 L63 W117 F118	S58-Y61 WeakPolarHBondContact O-CD2 3.49Å; T59-Y61 VanDerWaalsContact C-N 3.31Å; Y61-L63 PolarHBondContact O-N 3.3Å; Y61-W117 HydrophobicContact CD1-CE3 4.13Å; Y61-W117 HydrophobicContact CD1-CZ3 4.33Å; Y61-F118 HydrophobicContact CD1-CE1 4.34Å; Y61-F118 AromaticContact CD1-CZ 3.88Å; Y61-F118 HydrophobicContact CD1-CZ 3.88Å; Y61-F118 AromaticContact CE1-CE1 4Å; Y61-F118 HydrophobicContact CE1-CE1 4Å; Y61-F118 HydrophobicContact CE1-CE2 4.35Å; Y61-F118 AromaticContact CE1-CZ 3.37Å; Y61-F118 HydrophobicContact CE1-CZ 3.37Å; Y61-F118 AromaticContact CZ-CZ 3.93Å
62	N	83.9	Confident	77.5	Confident	55 Å²	55	77.2 Å²	77.2	29%	0.294	46%	0.462	S	S	.	.			trans	-77.9	90.6	167.4	-172.3	-24.2	0	0	0	109	S60 N64 E65 M66 W117	S60-N62 PolarHBondContact O-N 2.97Å; N62-N64 PolarHBondContact O-N 2.81Å; N62-N64 PolarHBondContact OD1-N 2.91Å; N62-E65 HydrophobicContact CB-CB 4.17Å; N62-E65 WeakPolarHBondContact ND2-CG 3.45Å; N62-E65 PolarHBondContact ND2-OE1 3.43Å; N62-E65 PolarHBondContact ND2-OE2 2.93Å; N62-E65 VanDerWaalsContact ND2-OE2 3.13Å; N62-E65 PolarHBondContact O-N 3Å; N62-E65 PolarHBondContact OD1-N 3.5Å; N62-M66 VanDerWaalsContact O-CB 3.31Å; N62-M66 WeakPolarHBondContact O-CB 3.41Å; N62-M66 PolarHBondContact O-N 3.25Å; N62-W117 HydrophobicContact CB-CD2 3.87Å; N62-W117 HydrophobicContact CB-CE3 4.43Å; N62-W117 HydrophobicContact CB-CG 4.1Å; N62-W117 HydrophobicContact CB-CZ2 4.11Å
63	L	84.1	Confident	78.7	Confident	132 Å²	132	74.2 Å²	74.2	69%	0.691	44%	0.444	S	S	*	.	H	α-helix	trans	-58.4	-33	-176.7	-64.6	177	0	0	0	112.9	Y61 S67	Y61-L63 PolarHBondContact O-N 3.3Å; L63-S67 VanDerWaalsContact O-CB 3.28Å; L63-S67 WeakPolarHBondContact O-CB 3.39Å; L63-S67 PolarHBondContact O-N 2.95Å
64	N	83.2	Confident	80	Confident	123 Å²	123	72.9 Å²	72.9	66%	0.658	42%	0.417	S	S	*	.	H	α-helix	trans	-68.5	-46.7	179.1	-175	67.8	0	0	0	111.5	N62 S67 T68	N62-N64 PolarHBondContact O-N 2.81Å; N62-N64 PolarHBondContact OD1-N 2.91Å; N64-S67 PolarHBondContact O-N 3.14Å; N64-T68 WeakPolarHBondContact O-CG2 3.37Å; N64-T68 PolarHBondContact O-N 2.75Å; N64-T68 PolarHBondContact O-OG1 3.23Å
65	E	79.6	Confident	81.5	Confident	36 Å²	36	74 Å²	74	17%	0.168	42%	0.423	C	S	.	.	H	α-helix	trans	-70.7	-37.2	176.4	-72.3	176.1	179.1	0	0	112.4	N62 S67 T68 R69 S111 W117	N62-E65 HydrophobicContact CB-CB 4.17Å; N62-E65 WeakPolarHBondContact ND2-CG 3.45Å; N62-E65 PolarHBondContact ND2-OE1 3.43Å; N62-E65 PolarHBondContact ND2-OE2 2.93Å; N62-E65 VanDerWaalsContact ND2-OE2 3.13Å; N62-E65 PolarHBondContact O-N 3Å; N62-E65 PolarHBondContact OD1-N 3.5Å; E65-S67 VanDerWaalsContact C-N 3.3Å; E65-S67 PolarHBondContact O-N 3.28Å; E65-T68 WeakPolarHBondContact CA-OG1 3.43Å; E65-T68 PolarHBondContact O-N 3.43Å; E65-T68 PolarHBondContact O-OG1 3.45Å; E65-R69 PolarHBondContact O-N 2.92Å; E65-S111 WeakPolarHBondContact OE1-CB 3.46Å; E65-S111 VanDerWaalsContact OE2-CA 3.23Å; E65-S111 WeakPolarHBondContact OE2-CA 3.41Å; E65-W117 HydrophobicContact CB-CH2 4.36Å; E65-W117 HydrophobicContact CB-CZ2 3.66Å; E65-W117 WeakPolarHBondContact OE2-CZ2 3.44Å; E65-W117 PolarHBondContact OE2-NE1 3.23Å
66	M	77.8	Confident	82.6	Confident	89 Å²	89	72 Å²	72	44%	0.438	41%	0.41	S	S	.	.	H	α-helix	trans	-62.3	-39.5	174.4	-173.4	175.5	176.3	0	0	111.4	N62 T68 G70 W117	N62-M66 VanDerWaalsContact O-CB 3.31Å; N62-M66 WeakPolarHBondContact O-CB 3.41Å; N62-M66 PolarHBondContact O-N 3.25Å; M66-T68 VanDerWaalsContact C-N 3.29Å; M66-T68 PolarHBondContact O-N 3.42Å; M66-G70 VanDerWaalsContact O-CA 3.26Å; M66-G70 WeakPolarHBondContact O-CA 3.49Å; M66-G70 PolarHBondContact O-N 3.42Å; M66-W117 HydrophobicContact CB-CH2 4.02Å; M66-W117 HydrophobicContact CB-CZ3 4.26Å
67	S	76.4	Confident	83.3	Confident	104 Å²	104	75.8 Å²	75.8	73%	0.727	43%	0.434	S	S	*	.	H	α-helix	trans	-67	-29.5	177.2	-173.2	0	0	0	0	113	L63 N64 E65	L63-S67 VanDerWaalsContact O-CB 3.28Å; L63-S67 WeakPolarHBondContact O-CB 3.39Å; L63-S67 PolarHBondContact O-N 2.95Å; N64-S67 PolarHBondContact O-N 3.14Å; E65-S67 VanDerWaalsContact C-N 3.3Å; E65-S67 PolarHBondContact O-N 3.28Å
68	T	78.1	Confident	83.8	Confident	105 Å²	105	77.3 Å²	77.3	64%	0.644	44%	0.439	S	S	*	.	H	α-helix	trans	-89	-45	-176.9	49.5	0	0	0	0	112.4	N64 E65 M66	N64-T68 WeakPolarHBondContact O-CG2 3.37Å; N64-T68 PolarHBondContact O-N 2.75Å; N64-T68 PolarHBondContact O-OG1 3.23Å; E65-T68 WeakPolarHBondContact CA-OG1 3.43Å; E65-T68 PolarHBondContact O-N 3.43Å; E65-T68 PolarHBondContact O-OG1 3.45Å; M66-T68 VanDerWaalsContact C-N 3.29Å; M66-T68 PolarHBondContact O-N 3.42Å
69	R	74.7	Confident	84.4	Confident	96 Å²	96	79 Å²	79	36%	0.362	44%	0.436	S	S	.	.	H	α-helix	trans	-81.1	-27	179.1	-64.5	-174.9	178.8	-137.5	10.2	112.7	E65 R74 S111 T112	E65-R69 PolarHBondContact O-N 2.92Å; R69-R74 PolarHBondContact O-NH2 3.38Å; R69-R74 VanDerWaalsContact O-NH2 3.09Å; R69-S111 PolarHBondContact NE-O 3.36Å; R69-S111 VanDerWaalsContact NE-O 3.11Å; R69-S111 PolarHBondContact NH1-O 2.95Å; R69-S111 VanDerWaalsContact NH2-C 3.27Å; R69-S111 PolarHBondContact NH2-O 2.92Å; R69-S111 VanDerWaalsContact NH2-O 3.1Å; R69-S111 PolarHBondContact NH2-OG 3.35Å; R69-T112 PolarHBondContact NH2-OG1 2.95Å
70	G	79.4	Confident	84.7	Confident	38 Å²	38	76.1 Å²	76.1	39%	0.392	42%	0.415	S	S	.	.			trans	72	-127.5	-173.3	0	0	0	0	0	111.5	M66	M66-G70 VanDerWaalsContact O-CA 3.26Å; M66-G70 WeakPolarHBondContact O-CA 3.49Å; M66-G70 PolarHBondContact O-N 3.42Å
71	A	83.6	Confident	84.7	Confident	50 Å²	50	80.3 Å²	80.3	41%	0.413	44%	0.441	S	S	.	.			trans	-100.4	132.6	-176.4	0	0	0	0	0	111.8	F73	A71-F73 WeakPolarHBondContact CB-O 3.14Å; A71-F73 PolarHBondContact O-N 3.4Å
72	S	82.6	Confident	84.5	Confident	42 Å²	42	77.1 Å²	77.1	29%	0.294	43%	0.431	S	S	.	.	S	Bend	trans	-67.4	-21.8	175.7	-44.3	0	0	0	0	113.6	E100	S72-E100 PolarHBondContact O-N 3.3Å; S72-E100 VanDerWaalsContact O-N 3.16Å
73	F	87.7	Confident	84	Confident	44 Å²	44	82.5 Å²	82.5	19%	0.193	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	125.6	171.8	-75.7	-40	0	0	0	109.4	A71 L97 D99 R135 V138	A71-F73 WeakPolarHBondContact CB-O 3.14Å; A71-F73 PolarHBondContact O-N 3.4Å; F73-L97 HydrophobicContact CB-CD1 3.9Å; F73-L97 HydrophobicContact CD1-CD1 3.77Å; F73-L97 HydrophobicContact CD1-CD2 3.91Å; F73-L97 HydrophobicContact CD1-CG 4.1Å; F73-L97 HydrophobicContact CE1-CD1 4.37Å; F73-L97 HydrophobicContact CE1-CD2 3.7Å; F73-L97 HydrophobicContact CE1-CG 4.38Å; F73-L97 HydrophobicContact CG-CD1 3.91Å; F73-L97 HydrophobicContact CZ-CD2 4.25Å; F73-D99 HydrophobicContact CD1-CB 4.04Å; F73-D99 HydrophobicContact CE1-CB 3.87Å; F73-D99 VanDerWaalsContact CE1-CG 3.42Å; F73-R135 VanDerWaalsContact CE1-CZ 3.41Å; F73-R135 VanDerWaalsContact CE1-NH2 3.3Å; F73-R135 HydrophobicContact CE2-CB 3.93Å; F73-R135 HydrophobicContact CE2-CG 3.58Å; F73-R135 HydrophobicContact CZ-CB 3.75Å; F73-R135 HydrophobicContact CZ-CG 3.54Å; F73-V138 HydrophobicContact CD2-CB 4.42Å; F73-V138 HydrophobicContact CD2-CG1 4.18Å; F73-V138 HydrophobicContact CD2-CG2 4.36Å; F73-V138 HydrophobicContact CE2-CB 4.37Å; F73-V138 HydrophobicContact CE2-CG2 4.46Å
74	R	90.5	Very high	83.2	Confident	110 Å²	110	80.5 Å²	80.5	42%	0.415	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	161.3	173.1	-61	-179.6	-175.5	-100.6	-1.2	109.3	R69 I98 E100	R69-R74 PolarHBondContact O-NH2 3.38Å; R69-R74 VanDerWaalsContact O-NH2 3.09Å; R74-I98 HydrophobicContact CB-CB 4.18Å; R74-I98 PolarHBondContact N-O 2.83Å; R74-I98 PolarHBondContact O-N 3.16Å; R74-E100 WeakPolarHBondContact CD-OE1 3.45Å; R74-E100 IonicContact CZ-OE1 3.9Å; R74-E100 IonicContact NE-OE1 3.02Å; R74-E100 PolarHBondContact NE-OE1 3.28Å; R74-E100 IonicContact NE-OE2 2.92Å; R74-E100 IonicContact NH2-OE1 3.58Å
75	V	92.8	Very high	82.5	Confident	71 Å²	71	76 Å²	76	43%	0.43	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	123.5	-179.4	-177.1	0	0	0	0	108	F95 Q96 L142	V75-F95 HydrophobicContact CG1-CB 3.89Å; V75-F95 HydrophobicContact CG1-CD1 3.91Å; V75-F95 HydrophobicContact CG1-CG 4.37Å; V75-Q96 WeakPolarHBondContact CA-O 3.49Å; V75-L142 HydrophobicContact CB-CD2 4.24Å; V75-L142 HydrophobicContact CG1-CD2 3.64Å; V75-L142 HydrophobicContact CG2-CD1 4.14Å; V75-L142 HydrophobicContact CG2-CD2 3.51Å; V75-L142 HydrophobicContact CG2-CG 4.45Å
76	A	93.3	Very high	81.9	Confident	28 Å²	28	77.1 Å²	77.1	23%	0.231	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	137.2	165.9	0	0	0	0	0	109.4	F95 Q96 I98	A76-F95 WeakPolarHBondContact O-CA 3.33Å; A76-Q96 HydrophobicContact CB-CB 4.48Å; A76-Q96 PolarHBondContact N-O 3.05Å; A76-Q96 PolarHBondContact O-N 3.39Å; A76-I98 HydrophobicContact CB-CD1 3.87Å; A76-I98 HydrophobicContact CB-CG1 4.42Å
77	V	94.4	Very high	81.5	Confident	94 Å²	94	76.7 Å²	76.7	57%	0.57	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.6	123.9	172.3	-174.5	0	0	0	0	107.6	T93 F95	V77-T93 HydrophobicContact CG1-CG2 4.43Å; V77-F95 HydrophobicContact CG1-CE1 4.31Å; V77-F95 HydrophobicContact CG2-CD1 3.99Å; V77-F95 HydrophobicContact CG2-CE1 3.9Å
78	I	92.7	Very high	81.6	Confident	65 Å²	65	76.2 Å²	76.2	33%	0.333	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	119.4	178.5	-57.2	173	0	0	0	107	E80 R94 Q96	I78-E80 HydrophobicContact CG2-CG 4.33Å; I78-R94 HydrophobicContact CB-CB 4.46Å; I78-R94 PolarHBondContact N-O 3.18Å; I78-R94 PolarHBondContact O-N 3.44Å; I78-Q96 HydrophobicContact CD1-CB 4.04Å
79	E	90.8	Very high	81.7	Confident	127 Å²	127	77.3 Å²	77.3	59%	0.593	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81	117.8	170.1	-66.3	-172.1	-173.8	0	0	108.8	K91	E79-K91 IonicContact OE2-NZ 3.49Å; E79-K91 PolarHBondContact OE2-NZ 2.95Å
80	E	86.9	Confident	82.1	Confident	56 Å²	56	73 Å²	73	26%	0.262	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	116.8	173.4	-68.2	176.9	165.6	0	0	107.9	I78 I82 T92 R94	I78-E80 HydrophobicContact CG2-CG 4.33Å; E80-I82 PolarHBondContact O-N 3.29Å; E80-T92 HydrophobicContact CB-CG2 3.77Å; E80-T92 PolarHBondContact N-O 3.19Å; E80-T92 PolarHBondContact O-N 3.04Å; E80-R94 HydrophobicContact CG-CB 4.36Å; E80-R94 WeakPolarHBondContact OE1-CD 3.28Å; E80-R94 IonicContact OE1-NH1 2.73Å
81	P	82.3	Confident	82.4	Confident	114 Å²	114	77.8 Å²	77.8	74%	0.74	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.2	131.8	171.2	28.7	-31.9	0	0	0	108.8
82	I	79.8	Confident	82.7	Confident	41 Å²	41	75.8 Å²	75.8	21%	0.21	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	141.2	169	-58.3	163.7	0	0	0	107.1	E80 F90 T92 A153	E80-I82 PolarHBondContact O-N 3.29Å; I82-F90 HydrophobicContact CB-CB 4.14Å; I82-F90 WeakPolarHBondContact CB-O 3.26Å; I82-F90 HydrophobicContact CD1-CB 4.07Å; I82-F90 PolarHBondContact N-O 3.46Å; I82-T92 HydrophobicContact CD1-CG2 4.07Å; I82-T92 HydrophobicContact CG1-CG2 3.91Å; I82-A153 HydrophobicContact CD1-CB 3.53Å
83	E	73.4	Confident	83.1	Confident	167 Å²	167	76 Å²	76	78%	0.78	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-49	132.5	179.6	-68.6	-174.5	170.4	0	0	111.2	T85	E83-T85 PolarHBondContact O-N 3.12Å; E83-T85 PolarHBondContact O-OG1 3.41Å
84	P	67.2	Low	83.3	Confident	91 Å²	91	78.9 Å²	78.9	59%	0.591	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.6	116.3	-173.8	24.1	-33.2	0	0	0	109.4
85	T	69.5	Low	83.5	Confident	27 Å²	27	76.2 Å²	76.2	17%	0.166	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	107.5	-179.6	-52.5	0	0	0	0	107.3	E83 G87 K88 Q157 L161	E83-T85 PolarHBondContact O-N 3.12Å; E83-T85 PolarHBondContact O-OG1 3.41Å; T85-G87 PolarHBondContact O-N 3.2Å; T85-K88 PolarHBondContact N-O 2.91Å; T85-K88 PolarHBondContact O-N 2.92Å; T85-Q157 PolarHBondContact OG1-NE2 3.22Å; T85-L161 HydrophobicContact CG2-CD1 4.1Å; T85-L161 HydrophobicContact CG2-CD2 3.53Å; T85-L161 HydrophobicContact CG2-CG 4.01Å
86	Y	65.9	Low	83.4	Confident	61 Å²	61	78 Å²	78	24%	0.239	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.5	46.2	176.3	-66.7	-99.9	0	0	0	114.3	T3 P5 E9 K88 L161 L164	T3-Y86 VanDerWaalsContact O-CD1 3.28Å; T3-Y86 WeakPolarHBondContact O-CD1 3.42Å; T3-Y86 VanDerWaalsContact O-CE1 3.31Å; T3-Y86 WeakPolarHBondContact O-CE1 3.43Å; T3-Y86 VanDerWaalsContact OG1-CD1 3.25Å; T3-Y86 WeakPolarHBondContact OG1-CD1 3.38Å; P5-Y86 WeakPolarHBondContact CA-OH 3.36Å; P5-Y86 HydrophobicContact CB-CE1 4.35Å; P5-Y86 HydrophobicContact CB-CE2 4.09Å; E9-Y86 WeakPolarHBondContact OE2-CE2 3.45Å; E9-Y86 VanDerWaalsContact OE2-CZ 3.27Å; E9-Y86 PolarHBondContact OE2-OH 3.02Å; Y86-K88 VanDerWaalsContact C-N 3.25Å; Y86-K88 PolarHBondContact O-N 3.1Å; Y86-L161 HydrophobicContact CD2-CD2 3.4Å; Y86-L161 VanDerWaalsContact CD2-CD2 3.4Å; Y86-L161 HydrophobicContact CE2-CD2 3.83Å; Y86-L161 HydrophobicContact CG-CD2 4.12Å; Y86-L164 VanDerWaalsContact CB-CD1 3.45Å; Y86-L164 HydrophobicContact CD1-CD1 4.23Å; Y86-L164 HydrophobicContact CG-CD1 3.94Å
87	G	69.7	Low	83.4	Confident	80 Å²	80	78.3 Å²	78.3	83%	0.825	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.2	7.6	174	0	0	0	0	0	115	T85	T85-G87 PolarHBondContact O-N 3.2Å
88	K	78.6	Confident	83.1	Confident	93 Å²	93	77.5 Å²	77.5	40%	0.404	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	123.4	170.3	-171.8	171.1	177.6	-173.9	0	110.2	T85 Y86 F90	T85-K88 PolarHBondContact N-O 2.91Å; T85-K88 PolarHBondContact O-N 2.92Å; Y86-K88 VanDerWaalsContact C-N 3.25Å; Y86-K88 PolarHBondContact O-N 3.1Å; K88-F90 HydrophobicContact CB-CE2 3.84Å; K88-F90 HydrophobicContact CB-CZ 4.15Å; K88-F90 HydrophobicContact CD-CE1 4.1Å; K88-F90 HydrophobicContact CD-CE2 4.22Å; K88-F90 HydrophobicContact CD-CZ 3.66Å; K88-F90 HydrophobicContact CG-CE1 4.42Å; K88-F90 HydrophobicContact CG-CE2 3.93Å; K88-F90 HydrophobicContact CG-CZ 3.88Å; K88-F90 WeakPolarHBondContact O-CD2 3.42Å; K88-F90 WeakPolarHBondContact O-CE2 3.37Å
89	D	80.5	Confident	82.8	Confident	128 Å²	128	76.4 Å²	76.4	68%	0.684	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78	125.9	175.1	-62.5	-20.3	0	0	0	109.5
90	F	81.8	Confident	82.3	Confident	5 Å²	5	74 Å²	74	2%	0.022	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	140	171.8	-63	-90.1	0	0	0	108.8	I82 K88 Q156 Q157 H160	I82-F90 HydrophobicContact CB-CB 4.14Å; I82-F90 WeakPolarHBondContact CB-O 3.26Å; I82-F90 HydrophobicContact CD1-CB 4.07Å; I82-F90 PolarHBondContact N-O 3.46Å; K88-F90 HydrophobicContact CB-CE2 3.84Å; K88-F90 HydrophobicContact CB-CZ 4.15Å; K88-F90 HydrophobicContact CD-CE1 4.1Å; K88-F90 HydrophobicContact CD-CE2 4.22Å; K88-F90 HydrophobicContact CD-CZ 3.66Å; K88-F90 HydrophobicContact CG-CE1 4.42Å; K88-F90 HydrophobicContact CG-CE2 3.93Å; K88-F90 HydrophobicContact CG-CZ 3.88Å; K88-F90 WeakPolarHBondContact O-CD2 3.42Å; K88-F90 WeakPolarHBondContact O-CE2 3.37Å; F90-Q156 HydrophobicContact CD1-CB 4.1Å; F90-Q156 HydrophobicContact CE1-CB 3.81Å; F90-Q157 HydrophobicContact CB-CG 4.05Å; F90-Q157 HydrophobicContact CD1-CG 3.56Å; F90-Q157 HydrophobicContact CD2-CG 3.44Å; F90-Q157 VanDerWaalsContact CD2-CG 3.44Å; F90-Q157 HydrophobicContact CE1-CB 4.35Å; F90-Q157 HydrophobicContact CE1-CG 3.76Å; F90-Q157 HydrophobicContact CE2-CB 4.42Å; F90-Q157 HydrophobicContact CE2-CG 3.65Å; F90-Q157 HydrophobicContact CG-CG 3.39Å; F90-Q157 HydrophobicContact CZ-CB 4.26Å; F90-Q157 HydrophobicContact CZ-CG 3.78Å; F90-H160 HydrophobicContact CZ-CB 3.8Å; F90-H160 AromaticContact CZ-CD2 3.92Å
91	K	87.3	Confident	81.7	Confident	140 Å²	140	72.9 Å²	72.9	61%	0.609	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.5	139.9	176.7	-62.8	-174.8	175.1	-166.3	0	108.6	E79	E79-K91 IonicContact OE2-NZ 3.49Å; E79-K91 PolarHBondContact OE2-NZ 2.95Å
92	T	89.1	Confident	81.2	Confident	7 Å²	7	69.3 Å²	69.3	4%	0.043	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	148.9	166.7	-174.1	0	0	0	0	109.5	E80 I82 R150	E80-T92 HydrophobicContact CB-CG2 3.77Å; E80-T92 PolarHBondContact N-O 3.19Å; E80-T92 PolarHBondContact O-N 3.04Å; I82-T92 HydrophobicContact CD1-CG2 4.07Å; I82-T92 HydrophobicContact CG1-CG2 3.91Å; T92-R150 WeakPolarHBondContact OG1-CA 3.46Å; T92-R150 PolarHBondContact OG1-N 3.15Å
93	T	90.9	Very high	80.3	Confident	46 Å²	46	74.3 Å²	74.3	28%	0.282	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	130.3	174.4	55.2	0	0	0	0	109.3	V77 A149	V77-T93 HydrophobicContact CG1-CG2 4.43Å; T93-A149 WeakPolarHBondContact O-CB 3.25Å; T93-A149 WeakPolarHBondContact OG1-CB 3.34Å
94	R	92.7	Very high	79.7	Confident	105 Å²	105	68.4 Å²	68.4	40%	0.396	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	139	170.4	-178.8	176.2	-178.6	155.1	2.5	109.7	I78 E80	I78-R94 HydrophobicContact CB-CB 4.46Å; I78-R94 PolarHBondContact N-O 3.18Å; I78-R94 PolarHBondContact O-N 3.44Å; E80-R94 HydrophobicContact CG-CB 4.36Å; E80-R94 WeakPolarHBondContact OE1-CD 3.28Å; E80-R94 IonicContact OE1-NH1 2.73Å
95	F	93.9	Very high	79.2	Confident	55 Å²	55	71.8 Å²	71.8	24%	0.241	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	128.1	176.9	-57.3	-82.7	0	0	0	109.6	V75 A76 V77 L142 A145 S146	V75-F95 HydrophobicContact CG1-CB 3.89Å; V75-F95 HydrophobicContact CG1-CD1 3.91Å; V75-F95 HydrophobicContact CG1-CG 4.37Å; A76-F95 WeakPolarHBondContact O-CA 3.33Å; V77-F95 HydrophobicContact CG1-CE1 4.31Å; V77-F95 HydrophobicContact CG2-CD1 3.99Å; V77-F95 HydrophobicContact CG2-CE1 3.9Å; F95-L142 HydrophobicContact CB-CB 4.4Å; F95-L142 HydrophobicContact CB-CD2 3.98Å; F95-A145 HydrophobicContact CD2-CB 3.56Å; F95-A145 HydrophobicContact CE2-CB 3.69Å; F95-A145 HydrophobicContact CG-CB 4.37Å; F95-S146 PolarHBondContact N-OG 3.3Å
96	Q	91.8	Very high	78.4	Confident	107 Å²	107	80 Å²	80	50%	0.5	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	131.8	177.2	-172.3	177.2	26.9	0	0	110.2	V75 A76 I78	V75-Q96 WeakPolarHBondContact CA-O 3.49Å; A76-Q96 HydrophobicContact CB-CB 4.48Å; A76-Q96 PolarHBondContact N-O 3.05Å; A76-Q96 PolarHBondContact O-N 3.39Å; I78-Q96 HydrophobicContact CD1-CB 4.04Å
97	L	91.5	Very high	77.9	Confident	35 Å²	35	80.3 Å²	80.3	18%	0.183	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	129.4	174.3	-172.6	69.9	0	0	0	110.4	F73 V138 N139 L142	F73-L97 HydrophobicContact CB-CD1 3.9Å; F73-L97 HydrophobicContact CD1-CD1 3.77Å; F73-L97 HydrophobicContact CD1-CD2 3.91Å; F73-L97 HydrophobicContact CD1-CG 4.1Å; F73-L97 HydrophobicContact CE1-CD1 4.37Å; F73-L97 HydrophobicContact CE1-CD2 3.7Å; F73-L97 HydrophobicContact CE1-CG 4.38Å; F73-L97 HydrophobicContact CG-CD1 3.91Å; F73-L97 HydrophobicContact CZ-CD2 4.25Å; L97-V138 HydrophobicContact CD1-CG1 4.06Å; L97-N139 WeakPolarHBondContact CD2-OD1 3.47Å; L97-L142 HydrophobicContact CB-CD1 3.6Å; L97-L142 HydrophobicContact CD1-CD1 3.56Å; L97-L142 HydrophobicContact CG-CD1 4.13Å
98	I	89.1	Confident	77.2	Confident	78 Å²	78	81.5 Å²	81.5	40%	0.4	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	111.7	166.2	-60.6	172.7	0	0	0	107.2	R74 A76	R74-I98 HydrophobicContact CB-CB 4.18Å; R74-I98 PolarHBondContact N-O 2.83Å; R74-I98 PolarHBondContact O-N 3.16Å; A76-I98 HydrophobicContact CB-CD1 3.87Å; A76-I98 HydrophobicContact CB-CG1 4.42Å
99	D	85.3	Confident	76.3	Confident	41 Å²	41	80.8 Å²	80.8	22%	0.219	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	96.3	-178.9	-175.5	0.9	0	0	0	110.5	F73 L101 A102 R135	F73-D99 HydrophobicContact CD1-CB 4.04Å; F73-D99 HydrophobicContact CE1-CB 3.87Å; F73-D99 VanDerWaalsContact CE1-CG 3.42Å; D99-L101 PolarHBondContact O-N 3.11Å; D99-L101 PolarHBondContact OD1-N 2.91Å; D99-A102 HydrophobicContact CB-CB 4Å; D99-A102 VanDerWaalsContact CG-CB 3.46Å; D99-A102 PolarHBondContact O-N 3.42Å; D99-A102 PolarHBondContact OD1-N 3.06Å; D99-A102 VanDerWaalsContact OD1-N 3.15Å; D99-A102 VanDerWaalsContact OD2-CB 3.31Å; D99-A102 WeakPolarHBondContact OD2-CB 3.49Å; D99-R135 IonicContact OD1-CZ 3.74Å; D99-R135 IonicContact OD1-NH2 3.81Å; D99-R135 PolarHBondContact OD1-NH2 2.73Å; D99-R135 IonicContact OD2-CZ 2.58Å; D99-R135 IonicContact OD2-NH2 3.47Å; D99-R135 PolarHBondContact OD2-NH2 2.58Å
100	E	80.2	Confident	75.2	Confident	77 Å²	77	77.8 Å²	77.8	36%	0.36	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-27.3	-179.3	-64.3	-174.3	168.7	0	0	111.8	S72 R74	S72-E100 PolarHBondContact O-N 3.3Å; S72-E100 VanDerWaalsContact O-N 3.16Å; R74-E100 WeakPolarHBondContact CD-OE1 3.45Å; R74-E100 IonicContact CZ-OE1 3.9Å; R74-E100 IonicContact NE-OE1 3.02Å; R74-E100 PolarHBondContact NE-OE1 3.28Å; R74-E100 IonicContact NE-OE2 2.92Å; R74-E100 IonicContact NH2-OE1 3.58Å
101	L	75.7	Confident	74.3	Confident	33 Å²	33	78 Å²	78	17%	0.173	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-32.5	-179.3	-170.3	67.1	0	0	0	111.9	D99 N103 S104 T112	D99-L101 PolarHBondContact O-N 3.11Å; D99-L101 PolarHBondContact OD1-N 2.91Å; L101-N103 PolarHBondContact O-N 3.22Å; L101-S104 PolarHBondContact O-N 3.17Å; L101-T112 WeakPolarHBondContact CD1-O 3.43Å
102	A	71.8	Confident	73.5	Confident	38 Å²	38	71.6 Å²	71.6	31%	0.314	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-25.7	178.5	0	0	0	0	0	113.4	D99 S104 K105	D99-A102 HydrophobicContact CB-CB 4Å; D99-A102 VanDerWaalsContact CG-CB 3.46Å; D99-A102 PolarHBondContact O-N 3.42Å; D99-A102 PolarHBondContact OD1-N 3.06Å; D99-A102 VanDerWaalsContact OD1-N 3.15Å; D99-A102 VanDerWaalsContact OD2-CB 3.31Å; D99-A102 WeakPolarHBondContact OD2-CB 3.49Å; A102-S104 VanDerWaalsContact C-N 3.3Å; A102-K105 WeakPolarHBondContact O-CE 3.31Å; A102-K105 WeakPolarHBondContact O-CG 2.9Å
103	N	60.7	Low	73	Confident	147 Å²	147	72.6 Å²	72.6	79%	0.786	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-11.7	177.7	-67	-21.4	0	0	0	112.9	L101	L101-N103 PolarHBondContact O-N 3.22Å
104	S	60.1	Low	72.8	Confident	42 Å²	42	71.5 Å²	71.5	29%	0.294	37%	0.368	S	S	.	.			trans	-113.7	39.3	-168.7	-162.4	0	0	0	0	113.6	L101 A102 F106 T112	L101-S104 PolarHBondContact O-N 3.17Å; A102-S104 VanDerWaalsContact C-N 3.3Å; S104-F106 PolarHBondContact O-N 3.25Å; S104-T112 WeakPolarHBondContact OG-CG2 3.47Å
105	K	56.5	Low	72.5	Confident	163 Å²	163	66.8 Å²	66.8	71%	0.709	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	0.6	-169.1	-71.4	-175.9	-178.8	-179.5	0	116.6	A102	A102-K105 WeakPolarHBondContact O-CE 3.31Å; A102-K105 WeakPolarHBondContact O-CG 2.9Å
106	F	53.8	Low	72	Confident	199 Å²	199	67 Å²	67	87%	0.873	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.9	14.7	-173.5	-76.6	-76.7	0	0	0	116.7	S104 P108	S104-F106 PolarHBondContact O-N 3.25Å; F106-P108 WeakPolarHBondContact O-CD 3.04Å
107	D	55.2	Low	71.6	Confident	67 Å²	67	64 Å²	64	36%	0.358	33%	0.334	S	S	.	.			trans	-85.8	120.4	176.5	-170.4	-11.3	0	0	0	111	N109 T112	D107-N109 PolarHBondContact O-N 3.13Å; D107-N109 VanDerWaalsContact OD1-CB 3.26Å; D107-N109 WeakPolarHBondContact OD1-CB 3.43Å; D107-N109 PolarHBondContact OD1-N 3.29Å; D107-T112 HydrophobicContact CB-CG2 3.49Å; D107-T112 VanDerWaalsContact CB-CG2 3.49Å; D107-T112 PolarHBondContact OD2-OG1 2.94Å
108	P	54.6	Low	71.2	Confident	106 Å²	106	63.9 Å²	63.9	69%	0.688	33%	0.332	S	S	*	.			trans	-68.2	-15.8	178	27.6	-34.9	0	0	0	113.5	F106 R116	F106-P108 WeakPolarHBondContact O-CD 3.04Å; P108-R116 PolarHBondContact O-NH1 2.86Å
109	N	60.9	Low	70.7	Confident	78 Å²	78	61 Å²	61	42%	0.417	32%	0.319	S	S	.	.	S	Bend	trans	-64.9	126.1	-176.9	-159.4	-13.4	0	0	0	110.7	D107 S111 T112	D107-N109 PolarHBondContact O-N 3.13Å; D107-N109 VanDerWaalsContact OD1-CB 3.26Å; D107-N109 WeakPolarHBondContact OD1-CB 3.43Å; D107-N109 PolarHBondContact OD1-N 3.29Å; N109-S111 PolarHBondContact ND2-OG 3.25Å; N109-S111 PolarHBondContact O-N 3.45Å; N109-S111 PolarHBondContact OD1-N 3.19Å; N109-S111 PolarHBondContact OD1-OG 2.72Å; N109-T112 WeakPolarHBondContact O-CB 3.42Å; N109-T112 PolarHBondContact O-N 2.88Å
110	P	56.6	Low	70.3	Confident	65 Å²	65	60.9 Å²	60.9	42%	0.422	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-20.2	174.1	23.8	-35.8	0	0	0	113	T112 R116	P110-T112 PolarHBondContact O-N 3.44Å; P110-T112 VanDerWaalsContact O-N 3.17Å; P110-R116 HydrophobicContact CB-CB 4.2Å
111	S	62	Low	70	Confident	9 Å²	9	62.6 Å²	62.6	6%	0.063	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-21.5	170.6	74.8	0	0	0	0	113.6	E65 R69 N109	E65-S111 WeakPolarHBondContact OE1-CB 3.46Å; E65-S111 VanDerWaalsContact OE2-CA 3.23Å; E65-S111 WeakPolarHBondContact OE2-CA 3.41Å; R69-S111 PolarHBondContact NE-O 3.36Å; R69-S111 VanDerWaalsContact NE-O 3.11Å; R69-S111 PolarHBondContact NH1-O 2.95Å; R69-S111 VanDerWaalsContact NH2-C 3.27Å; R69-S111 PolarHBondContact NH2-O 2.92Å; R69-S111 VanDerWaalsContact NH2-O 3.1Å; R69-S111 PolarHBondContact NH2-OG 3.35Å; N109-S111 PolarHBondContact ND2-OG 3.25Å; N109-S111 PolarHBondContact O-N 3.45Å; N109-S111 PolarHBondContact OD1-N 3.19Å; N109-S111 PolarHBondContact OD1-OG 2.72Å
112	T	71.3	Confident	70.4	Confident	5 Å²	5	68.3 Å²	68.3	3%	0.031	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-28.5	-170.8	-59	0	0	0	0	114.6	R69 L101 S104 D107 N109 P110	R69-T112 PolarHBondContact NH2-OG1 2.95Å; L101-T112 WeakPolarHBondContact CD1-O 3.43Å; S104-T112 WeakPolarHBondContact OG-CG2 3.47Å; D107-T112 HydrophobicContact CB-CG2 3.49Å; D107-T112 VanDerWaalsContact CB-CG2 3.49Å; D107-T112 PolarHBondContact OD2-OG1 2.94Å; N109-T112 WeakPolarHBondContact O-CB 3.42Å; N109-T112 PolarHBondContact O-N 2.88Å; P110-T112 PolarHBondContact O-N 3.44Å; P110-T112 VanDerWaalsContact O-N 3.17Å
113	D	79.3	Confident	71.1	Confident	28 Å²	28	67.2 Å²	67.2	15%	0.15	36%	0.362	C	S	.	.			trans	-120.5	99.7	173.7	-175.1	5.8	0	0	0	109.9	I115 R116 R128	D113-I115 HydrophobicContact CB-CG2 4.45Å; D113-I115 PolarHBondContact O-N 3.44Å; D113-I115 WeakPolarHBondContact OD1-CG2 3.28Å; D113-I115 PolarHBondContact OD1-N 3.48Å; D113-I115 WeakPolarHBondContact OD2-CG2 3.23Å; D113-R116 HydrophobicContact CB-CG 4.33Å; D113-R116 WeakPolarHBondContact O-CB 3.38Å; D113-R116 PolarHBondContact O-N 2.89Å; D113-R128 IonicContact OD2-NH1 3.6Å; D113-R128 PolarHBondContact OD2-NH1 3.28Å
114	P	85.1	Confident	72.5	Confident	23 Å²	23	61.9 Å²	61.9	15%	0.149	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-54.8	-19.6	-176.2	-30	36.7	0	0	0	115.1	R116 W117	P114-R116 PolarHBondContact O-N 3.42Å; P114-W117 HydrophobicContact CB-CD2 4.07Å; P114-W117 HydrophobicContact CB-CE3 3.89Å; P114-W117 HydrophobicContact CB-CH2 3.97Å; P114-W117 HydrophobicContact CB-CZ2 4.13Å; P114-W117 HydrophobicContact CB-CZ3 3.85Å; P114-W117 HydrophobicContact CG-CH2 4.19Å; P114-W117 HydrophobicContact CG-CZ2 4.25Å; P114-W117 WeakPolarHBondContact O-CB 3.47Å; P114-W117 PolarHBondContact O-N 2.98Å
115	I	86.7	Confident	74	Confident	7 Å²	7	64.8 Å²	64.8	4%	0.036	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-63	-25.4	174.6	-161.9	172.4	0	0	0	112.4	D113 W117 F118 V123 L127 R128 Q131	D113-I115 HydrophobicContact CB-CG2 4.45Å; D113-I115 PolarHBondContact O-N 3.44Å; D113-I115 WeakPolarHBondContact OD1-CG2 3.28Å; D113-I115 PolarHBondContact OD1-N 3.48Å; D113-I115 WeakPolarHBondContact OD2-CG2 3.23Å; I115-W117 PolarHBondContact O-N 3.05Å; I115-F118 PolarHBondContact O-N 3.41Å; I115-V123 HydrophobicContact CD1-CG1 3.65Å; I115-V123 HydrophobicContact CG1-CG1 3.76Å; I115-V123 HydrophobicContact CG2-CG1 4.25Å; I115-V123 HydrophobicContact CG2-CG2 4.1Å; I115-L127 HydrophobicContact CD1-CG 4.01Å; I115-L127 HydrophobicContact CG1-CD2 4.13Å; I115-L127 HydrophobicContact CG1-CG 4.08Å; I115-R128 HydrophobicContact CD1-CG 4.1Å; I115-Q131 HydrophobicContact CD1-CB 3.82Å; I115-Q131 HydrophobicContact CD1-CG 4.21Å; I115-Q131 VanDerWaalsContact CD1-OE1 3.23Å
116	R	84.4	Confident	75.8	Confident	60 Å²	60	57.8 Å²	57.8	23%	0.226	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-71.2	-18.1	178.5	-64.9	179.3	-179.6	-165.3	2.6	112.4	P108 P110 D113 P114 F118 G120 V123	P108-R116 PolarHBondContact O-NH1 2.86Å; P110-R116 HydrophobicContact CB-CB 4.2Å; D113-R116 HydrophobicContact CB-CG 4.33Å; D113-R116 WeakPolarHBondContact O-CB 3.38Å; D113-R116 PolarHBondContact O-N 2.89Å; P114-R116 PolarHBondContact O-N 3.42Å; R116-F118 PolarHBondContact O-N 3.06Å; R116-G120 WeakPolarHBondContact CA-O 3.35Å; R116-G120 WeakPolarHBondContact CB-O 3.43Å; R116-G120 WeakPolarHBondContact O-CA 3.44Å; R116-G120 PolarHBondContact O-N 3.48Å; R116-V123 HydrophobicContact CG-CG2 3.97Å
117	W	83.1	Confident	77.6	Confident	44 Å²	44	48.9 Å²	48.9	17%	0.167	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-62.4	-25.6	173.8	-58.3	-22	0	0	0	112.9	S60 Y61 N62 E65 M66 P114 I115	S60-W117 WeakPolarHBondContact O-CB 3.31Å; Y61-W117 HydrophobicContact CD1-CE3 4.13Å; Y61-W117 HydrophobicContact CD1-CZ3 4.33Å; N62-W117 HydrophobicContact CB-CD2 3.87Å; N62-W117 HydrophobicContact CB-CE3 4.43Å; N62-W117 HydrophobicContact CB-CG 4.1Å; N62-W117 HydrophobicContact CB-CZ2 4.11Å; E65-W117 HydrophobicContact CB-CH2 4.36Å; E65-W117 HydrophobicContact CB-CZ2 3.66Å; E65-W117 WeakPolarHBondContact OE2-CZ2 3.44Å; E65-W117 PolarHBondContact OE2-NE1 3.23Å; M66-W117 HydrophobicContact CB-CH2 4.02Å; M66-W117 HydrophobicContact CB-CZ3 4.26Å; P114-W117 HydrophobicContact CB-CD2 4.07Å; P114-W117 HydrophobicContact CB-CE3 3.89Å; P114-W117 HydrophobicContact CB-CH2 3.97Å; P114-W117 HydrophobicContact CB-CZ2 4.13Å; P114-W117 HydrophobicContact CB-CZ3 3.85Å; P114-W117 HydrophobicContact CG-CH2 4.19Å; P114-W117 HydrophobicContact CG-CZ2 4.25Å; P114-W117 WeakPolarHBondContact O-CB 3.47Å; P114-W117 PolarHBondContact O-N 2.98Å; I115-W117 PolarHBondContact O-N 3.05Å
118	F	83	Confident	79.4	Confident	31 Å²	31	50.1 Å²	50.1	14%	0.136	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-93.6	-17.5	-174.2	-60	-80.3	0	0	0	115.6	C54 I56 Y61 I115 R116 L127	C54-F118 PolarHBondContact SG-O 3.06Å; I56-F118 HydrophobicContact CG1-CB 4.28Å; I56-F118 HydrophobicContact CG2-CB 4.34Å; I56-F118 HydrophobicContact CG2-CD1 3.74Å; I56-F118 HydrophobicContact CG2-CE1 4.31Å; I56-F118 HydrophobicContact CG2-CG 4.2Å; Y61-F118 HydrophobicContact CD1-CE1 4.34Å; Y61-F118 AromaticContact CD1-CZ 3.88Å; Y61-F118 HydrophobicContact CD1-CZ 3.88Å; Y61-F118 AromaticContact CE1-CE1 4Å; Y61-F118 HydrophobicContact CE1-CE1 4Å; Y61-F118 HydrophobicContact CE1-CE2 4.35Å; Y61-F118 AromaticContact CE1-CZ 3.37Å; Y61-F118 HydrophobicContact CE1-CZ 3.37Å; Y61-F118 AromaticContact CZ-CZ 3.93Å; I115-F118 PolarHBondContact O-N 3.41Å; R116-F118 PolarHBondContact O-N 3.06Å; F118-L127 HydrophobicContact CB-CD2 4.22Å
119	S	77.6	Confident	81.3	Confident	19 Å²	19	49.6 Å²	49.6	13%	0.133	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-148.3	9.2	-172.9	47.1	0	0	0	0	113.3	V123	S119-V123 WeakPolarHBondContact OG-CA 3.06Å
120	G	78.5	Confident	83	Confident	37 Å²	37	46 Å²	46	38%	0.381	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.7	-140.7	-174.2	0	0	0	0	0	111.8	R116	R116-G120 WeakPolarHBondContact CA-O 3.35Å; R116-G120 WeakPolarHBondContact CB-O 3.43Å; R116-G120 WeakPolarHBondContact O-CA 3.44Å; R116-G120 PolarHBondContact O-N 3.48Å
121	V	74	Confident	84.7	Confident	114 Å²	114	45.2 Å²	45.2	69%	0.691	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-37.4	-175.5	-178.5	0	0	0	0	111.8	V123	V121-V123 PolarHBondContact O-N 2.94Å
122	L	83	Confident	86.3	Confident	153 Å²	153	47.3 Å²	47.3	80%	0.801	26%	0.263	S	S	*	.	S	Bend	trans	-94.1	76.9	-175.4	-66.5	179.5	0	0	0	111.5	P124	L122-P124 WeakPolarHBondContact O-CD 3.42Å
123	V	86.5	Confident	87.5	Confident	15 Å²	15	47.1 Å²	47.1	9%	0.091	26%	0.262	C	S	.	.			trans	-71.6	121.6	178.4	-175	0	0	0	0	110.4	I115 R116 S119 V121 L127 R128	I115-V123 HydrophobicContact CD1-CG1 3.65Å; I115-V123 HydrophobicContact CG1-CG1 3.76Å; I115-V123 HydrophobicContact CG2-CG1 4.25Å; I115-V123 HydrophobicContact CG2-CG2 4.1Å; R116-V123 HydrophobicContact CG-CG2 3.97Å; S119-V123 WeakPolarHBondContact OG-CA 3.06Å; V121-V123 PolarHBondContact O-N 2.94Å; V123-L127 HydrophobicContact CG1-CB 4.14Å; V123-L127 HydrophobicContact CG1-CD2 4.07Å; V123-L127 HydrophobicContact CG1-CG 4.32Å; V123-R128 HydrophobicContact CB-CG 4.21Å; V123-R128 HydrophobicContact CG1-CG 3.58Å
124	P	90.2	Very high	88.3	Confident	35 Å²	35	48.9 Å²	48.9	23%	0.227	27%	0.268	C	S	.	.			trans	-55.9	140.9	177.5	-26.1	34.6	0	0	0	112.1	T45 L122 S126 L127 R128	T45-P124 HydrophobicContact CG2-CB 4.1Å; T45-P124 HydrophobicContact CG2-CG 4.1Å; L122-P124 WeakPolarHBondContact O-CD 3.42Å; P124-S126 PolarHBondContact O-N 3.17Å; P124-L127 HydrophobicContact CB-CB 4.24Å; P124-L127 WeakPolarHBondContact O-CA 3.33Å; P124-L127 WeakPolarHBondContact O-CB 3.39Å; P124-L127 PolarHBondContact O-N 3.21Å; P124-R128 PolarHBondContact O-N 3.35Å; P124-R128 VanDerWaalsContact O-N 3.09Å
125	S	92.2	Very high	88.7	Confident	103 Å²	103	50.2 Å²	50.2	72%	0.72	27%	0.27	S	S	*	.	H	α-helix	trans	-58.3	-38	179	57.2	0	0	0	0	112.3	L127 R128 H129	S125-L127 VanDerWaalsContact C-N 3.28Å; S125-L127 PolarHBondContact O-N 3.01Å; S125-R128 PolarHBondContact O-N 3.45Å; S125-H129 WeakPolarHBondContact O-CB 3.26Å; S125-H129 PolarHBondContact O-N 3.05Å
126	S	93.3	Very high	89.1	Confident	16 Å²	16	55.3 Å²	55.3	11%	0.112	29%	0.289	C	S	.	.	H	α-helix	trans	-62.2	-33.8	174.2	56.1	0	0	0	0	112.7	T45 P124 A130	T45-S126 VanDerWaalsContact OG1-CB 3.29Å; T45-S126 WeakPolarHBondContact OG1-CB 3.2Å; T45-S126 PolarHBondContact OG1-OG 2.89Å; P124-S126 PolarHBondContact O-N 3.17Å; S126-A130 WeakPolarHBondContact O-CB 3.23Å; S126-A130 PolarHBondContact O-N 2.84Å
127	L	92.7	Very high	89.7	Confident	11 Å²	11	52.6 Å²	52.6	6%	0.058	28%	0.279	C	S	.	.	H	α-helix	trans	-72.5	-43	177.1	-168.6	54	0	0	0	111.4	L42 T45 I56 I115 F118 V123 P124 S125 H129 A130 Q131	L42-L127 HydrophobicContact CD1-CD1 3.89Å; T45-L127 HydrophobicContact CG2-CB 3.89Å; T45-L127 HydrophobicContact CG2-CD1 4.34Å; T45-L127 HydrophobicContact CG2-CG 4.47Å; T45-L127 PolarHBondContact OG1-N 2.91Å; I56-L127 HydrophobicContact CD1-CD1 3.81Å; I56-L127 HydrophobicContact CD1-CD2 3.74Å; I56-L127 HydrophobicContact CD1-CG 4.33Å; I115-L127 HydrophobicContact CD1-CG 4.01Å; I115-L127 HydrophobicContact CG1-CD2 4.13Å; I115-L127 HydrophobicContact CG1-CG 4.08Å; F118-L127 HydrophobicContact CB-CD2 4.22Å; V123-L127 HydrophobicContact CG1-CB 4.14Å; V123-L127 HydrophobicContact CG1-CD2 4.07Å; V123-L127 HydrophobicContact CG1-CG 4.32Å; P124-L127 HydrophobicContact CB-CB 4.24Å; P124-L127 WeakPolarHBondContact O-CA 3.33Å; P124-L127 WeakPolarHBondContact O-CB 3.39Å; P124-L127 PolarHBondContact O-N 3.21Å; S125-L127 VanDerWaalsContact C-N 3.28Å; S125-L127 PolarHBondContact O-N 3.01Å; L127-H129 VanDerWaalsContact C-N 3.28Å; L127-H129 PolarHBondContact O-N 3.01Å; L127-A130 PolarHBondContact O-N 2.63Å; L127-Q131 WeakPolarHBondContact O-CB 3.23Å; L127-Q131 PolarHBondContact O-N 2.96Å
128	R	92.7	Very high	90.3	Very high	94 Å²	94	53.1 Å²	53.1	36%	0.355	29%	0.287	S	S	.	.	H	α-helix	trans	-61.2	-40.5	174	-65.7	-166.5	-180	-77.6	2.4	111.3	D113 I115 V123 P124 S125 Q131 S132	D113-R128 IonicContact OD2-NH1 3.6Å; D113-R128 PolarHBondContact OD2-NH1 3.28Å; I115-R128 HydrophobicContact CD1-CG 4.1Å; V123-R128 HydrophobicContact CB-CG 4.21Å; V123-R128 HydrophobicContact CG1-CG 3.58Å; P124-R128 PolarHBondContact O-N 3.35Å; P124-R128 VanDerWaalsContact O-N 3.09Å; S125-R128 PolarHBondContact O-N 3.45Å; R128-Q131 WeakPolarHBondContact O-CB 3.47Å; R128-Q131 PolarHBondContact O-N 3.46Å; R128-S132 PolarHBondContact O-N 3.13Å
129	H	95.1	Very high	90.9	Very high	95 Å²	95	55.3 Å²	55.3	44%	0.44	30%	0.3	S	S	.	.	H	α-helix	trans	-66.4	-45.9	176.3	-162.7	121.7	0	0	0	111.1	L41 S125 L127 Q131 S132 C133	L41-H129 HydrophobicContact CD1-CB 3.85Å; L41-H129 WeakPolarHBondContact CD1-CD2 3Å; S125-H129 WeakPolarHBondContact O-CB 3.26Å; S125-H129 PolarHBondContact O-N 3.05Å; L127-H129 VanDerWaalsContact C-N 3.28Å; L127-H129 PolarHBondContact O-N 3.01Å; H129-Q131 VanDerWaalsContact C-N 3.28Å; H129-Q131 PolarHBondContact O-N 2.9Å; H129-S132 WeakPolarHBondContact O-CB 3.43Å; H129-S132 PolarHBondContact O-N 2.76Å; H129-C133 VanDerWaalsContact CD2-SG 3.53Å; H129-C133 PolarHBondContact O-N 3.17Å
130	A	95.2	Very high	91.8	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.008	30%	0.299	C	S	.	.	H	α-helix	trans	-55.3	-45.1	174.2	0	0	0	0	0	111.6	L41 L42 S126 L127 S132 C133 F134	L41-A130 HydrophobicContact CB-CB 3.81Å; L42-A130 HydrophobicContact CB-CB 4.27Å; S126-A130 WeakPolarHBondContact O-CB 3.23Å; S126-A130 PolarHBondContact O-N 2.84Å; L127-A130 PolarHBondContact O-N 2.63Å; A130-S132 PolarHBondContact O-N 3.25Å; A130-C133 WeakPolarHBondContact O-CB 3.15Å; A130-C133 PolarHBondContact O-N 3.06Å; A130-F134 HydrophobicContact CB-CE2 4.2Å; A130-F134 WeakPolarHBondContact O-CD2 2.95Å; A130-F134 WeakPolarHBondContact O-CG 3.34Å; A130-F134 PolarHBondContact O-N 3.17Å
131	Q	93.4	Very high	92.7	Very high	50 Å²	50	56.2 Å²	56.2	23%	0.234	30%	0.299	C	S	.	.	H	α-helix	trans	-57.9	-48.2	173.8	-174	-165.1	32.4	0	0	111.2	I115 L127 R128 H129 C133 F134 R135	I115-Q131 HydrophobicContact CD1-CB 3.82Å; I115-Q131 HydrophobicContact CD1-CG 4.21Å; I115-Q131 VanDerWaalsContact CD1-OE1 3.23Å; L127-Q131 WeakPolarHBondContact O-CB 3.23Å; L127-Q131 PolarHBondContact O-N 2.96Å; R128-Q131 WeakPolarHBondContact O-CB 3.47Å; R128-Q131 PolarHBondContact O-N 3.46Å; H129-Q131 VanDerWaalsContact C-N 3.28Å; H129-Q131 PolarHBondContact O-N 2.9Å; Q131-C133 VanDerWaalsContact C-N 3.27Å; Q131-C133 PolarHBondContact O-N 2.93Å; Q131-F134 PolarHBondContact O-N 2.83Å; Q131-R135 HydrophobicContact CG-CG 4.26Å; Q131-R135 WeakPolarHBondContact O-CB 3.49Å; Q131-R135 VanDerWaalsContact O-CG 3.23Å; Q131-R135 WeakPolarHBondContact O-CG 3.33Å; Q131-R135 PolarHBondContact O-N 3.23Å
132	S	94.2	Very high	93.8	Very high	53 Å²	53	51.8 Å²	51.8	37%	0.371	27%	0.271	S	S	.	.	H	α-helix	trans	-57.3	-40.1	176.8	-173.5	0	0	0	0	112.5	R128 H129 A130 R135 R136	R128-S132 PolarHBondContact O-N 3.13Å; H129-S132 WeakPolarHBondContact O-CB 3.43Å; H129-S132 PolarHBondContact O-N 2.76Å; A130-S132 PolarHBondContact O-N 3.25Å; S132-R135 PolarHBondContact O-N 3.47Å; S132-R136 WeakPolarHBondContact O-CB 3.44Å; S132-R136 PolarHBondContact O-N 2.97Å
133	C	97.1	Very high	94.5	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.007	25%	0.246	C	C	.	.	H	α-helix	trans	-64.3	-45.5	175.8	-71.1	0	0	0	0	111.9	S34 H129 A130 Q131 R135 R136 A137	S34-C133 WeakPolarHBondContact O-CB 3.34Å; H129-C133 VanDerWaalsContact CD2-SG 3.53Å; H129-C133 PolarHBondContact O-N 3.17Å; A130-C133 WeakPolarHBondContact O-CB 3.15Å; A130-C133 PolarHBondContact O-N 3.06Å; Q131-C133 VanDerWaalsContact C-N 3.27Å; Q131-C133 PolarHBondContact O-N 2.93Å; C133-R135 PolarHBondContact O-N 3.17Å; C133-R136 WeakPolarHBondContact O-CB 3.45Å; C133-R136 PolarHBondContact O-N 3.31Å; C133-A137 PolarHBondContact O-N 3.25Å
134	F	95.7	Very high	95	Very high	65 Å²	65	46.8 Å²	46.8	29%	0.285	24%	0.243	S	C	.	.	H	α-helix	trans	-66	-37.2	175.8	-64.1	-51.8	0	0	0	112.8	L35 G38 R39 L42 A130 Q131 R136 A137 V138	L35-F134 HydrophobicContact CD2-CD1 4.27Å; L35-F134 HydrophobicContact CD2-CE1 4.5Å; G38-F134 WeakPolarHBondContact O-CZ 3.46Å; R39-F134 HydrophobicContact CG-CE1 4.3Å; R39-F134 HydrophobicContact CG-CZ 4.36Å; L42-F134 HydrophobicContact CB-CE2 4.42Å; L42-F134 HydrophobicContact CD2-CE2 4.21Å; L42-F134 HydrophobicContact CD2-CZ 4.31Å; A130-F134 HydrophobicContact CB-CE2 4.2Å; A130-F134 WeakPolarHBondContact O-CD2 2.95Å; A130-F134 WeakPolarHBondContact O-CG 3.34Å; A130-F134 PolarHBondContact O-N 3.17Å; Q131-F134 PolarHBondContact O-N 2.83Å; F134-R136 VanDerWaalsContact C-N 3.32Å; F134-R136 PolarHBondContact O-N 3.48Å; F134-A137 WeakPolarHBondContact O-CB 3.49Å; F134-A137 PolarHBondContact O-N 3.46Å; F134-V138 WeakPolarHBondContact O-CG2 3.23Å; F134-V138 PolarHBondContact O-N 3.33Å
135	R	94	Very high	95.3	Very high	51 Å²	51	46.9 Å²	46.9	19%	0.192	25%	0.246	C	C	.	.	H	α-helix	trans	-62.1	-40.3	173.8	-68.4	180	75.5	83.7	-9.6	111.6	F73 D99 Q131 S132 C133 N139	F73-R135 VanDerWaalsContact CE1-CZ 3.41Å; F73-R135 VanDerWaalsContact CE1-NH2 3.3Å; F73-R135 HydrophobicContact CE2-CB 3.93Å; F73-R135 HydrophobicContact CE2-CG 3.58Å; F73-R135 HydrophobicContact CZ-CB 3.75Å; F73-R135 HydrophobicContact CZ-CG 3.54Å; D99-R135 IonicContact OD1-CZ 3.74Å; D99-R135 IonicContact OD1-NH2 3.81Å; D99-R135 PolarHBondContact OD1-NH2 2.73Å; D99-R135 IonicContact OD2-CZ 2.58Å; D99-R135 IonicContact OD2-NH2 3.47Å; D99-R135 PolarHBondContact OD2-NH2 2.58Å; Q131-R135 HydrophobicContact CG-CG 4.26Å; Q131-R135 WeakPolarHBondContact O-CB 3.49Å; Q131-R135 VanDerWaalsContact O-CG 3.23Å; Q131-R135 WeakPolarHBondContact O-CG 3.33Å; Q131-R135 PolarHBondContact O-N 3.23Å; S132-R135 PolarHBondContact O-N 3.47Å; C133-R135 PolarHBondContact O-N 3.17Å; R135-N139 PolarHBondContact O-N 3.42Å; R135-N139 PolarHBondContact O-ND2 2.9Å
136	R	95.2	Very high	95.5	Very high	113 Å²	113	42 Å²	42	43%	0.426	21%	0.213	S	C	.	.	H	α-helix	trans	-64.5	-44.8	172.9	-168	-179.5	-53.7	110.1	4.7	111.5	S132 C133 F134 V138 N139 I140	S132-R136 WeakPolarHBondContact O-CB 3.44Å; S132-R136 PolarHBondContact O-N 2.97Å; C133-R136 WeakPolarHBondContact O-CB 3.45Å; C133-R136 PolarHBondContact O-N 3.31Å; F134-R136 VanDerWaalsContact C-N 3.32Å; F134-R136 PolarHBondContact O-N 3.48Å; R136-V138 VanDerWaalsContact C-N 3.31Å; R136-V138 PolarHBondContact O-N 3.06Å; R136-N139 WeakPolarHBondContact O-CB 3.36Å; R136-N139 PolarHBondContact O-N 3.46Å; R136-N139 VanDerWaalsContact O-N 3.13Å; R136-I140 HydrophobicContact CG-CD1 3.94Å; R136-I140 HydrophobicContact CG-CG1 4.49Å; R136-I140 WeakPolarHBondContact O-CG1 3.23Å; R136-I140 PolarHBondContact O-N 2.89Å
137	A	97.7	Very high	95.7	Very high	4 Å²	4	44.2 Å²	44.2	3%	0.033	22%	0.218	C	C	.	.	H	α-helix	trans	-59	-39.5	177.3	0	0	0	0	0	112.7	L31 L35 C133 F134 I140 S141	L31-A137 HydrophobicContact CD1-CB 3.78Å; L31-A137 WeakPolarHBondContact CD1-O 3.35Å; L35-A137 HydrophobicContact CD2-CB 3.63Å; L35-A137 HydrophobicContact CG-CB 3.95Å; C133-A137 PolarHBondContact O-N 3.25Å; F134-A137 WeakPolarHBondContact O-CB 3.49Å; F134-A137 PolarHBondContact O-N 3.46Å; A137-I140 PolarHBondContact O-N 2.99Å; A137-S141 WeakPolarHBondContact O-CB 3.4Å; A137-S141 PolarHBondContact O-N 2.87Å; A137-S141 PolarHBondContact O-OG 3.02Å
138	V	96	Very high	95.8	Very high	55 Å²	55	50.3 Å²	50.3	33%	0.333	24%	0.241	S	C	.	.	H	α-helix	trans	-62.2	-46.7	173.8	174.1	0	0	0	0	111.1	F73 L97 F134 R136 I140 S141 L142	F73-V138 HydrophobicContact CD2-CB 4.42Å; F73-V138 HydrophobicContact CD2-CG1 4.18Å; F73-V138 HydrophobicContact CD2-CG2 4.36Å; F73-V138 HydrophobicContact CE2-CB 4.37Å; F73-V138 HydrophobicContact CE2-CG2 4.46Å; L97-V138 HydrophobicContact CD1-CG1 4.06Å; F134-V138 WeakPolarHBondContact O-CG2 3.23Å; F134-V138 PolarHBondContact O-N 3.33Å; R136-V138 VanDerWaalsContact C-N 3.31Å; R136-V138 PolarHBondContact O-N 3.06Å; V138-I140 PolarHBondContact O-N 3.21Å; V138-S141 WeakPolarHBondContact O-CB 3.18Å; V138-S141 PolarHBondContact O-N 3.39Å; V138-L142 HydrophobicContact CG1-CD1 4.37Å; V138-L142 WeakPolarHBondContact O-CG 3.39Å; V138-L142 PolarHBondContact O-N 3.48Å
139	N	94.8	Very high	96	Very high	77 Å²	77	46.6 Å²	46.6	41%	0.412	23%	0.23	S	C	.	.	H	α-helix	trans	-58	-47.4	176.6	-80.3	-70.5	0	0	0	112.1	L97 R135 R136 S141 L142 E143	L97-N139 WeakPolarHBondContact CD2-OD1 3.47Å; R135-N139 PolarHBondContact O-N 3.42Å; R135-N139 PolarHBondContact O-ND2 2.9Å; R136-N139 WeakPolarHBondContact O-CB 3.36Å; R136-N139 PolarHBondContact O-N 3.46Å; R136-N139 VanDerWaalsContact O-N 3.13Å; N139-S141 VanDerWaalsContact C-N 3.3Å; N139-S141 PolarHBondContact O-N 3.34Å; N139-L142 PolarHBondContact O-N 2.87Å; N139-E143 PolarHBondContact O-N 2.95Å
140	I	97.4	Very high	95.9	Very high	21 Å²	21	45.4 Å²	45.4	11%	0.108	22%	0.222	C	C	.	.	H	α-helix	trans	-62	-40.2	177.6	-64.8	165.7	0	0	0	110.7	L27 H30 L31 R136 A137 V138 L142 E143 L144	L27-I140 HydrophobicContact CB-CG2 4.23Å; L27-I140 HydrophobicContact CD2-CG2 4.15Å; L27-I140 VanDerWaalsContact O-CG2 3.28Å; L27-I140 WeakPolarHBondContact O-CG2 3.11Å; H30-I140 HydrophobicContact CB-CD1 3.97Å; L31-I140 HydrophobicContact CB-CG2 3.8Å; L31-I140 HydrophobicContact CD1-CB 4.44Å; L31-I140 HydrophobicContact CD1-CG2 4.39Å; R136-I140 HydrophobicContact CG-CD1 3.94Å; R136-I140 HydrophobicContact CG-CG1 4.49Å; R136-I140 WeakPolarHBondContact O-CG1 3.23Å; R136-I140 PolarHBondContact O-N 2.89Å; A137-I140 PolarHBondContact O-N 2.99Å; V138-I140 PolarHBondContact O-N 3.21Å; I140-L142 VanDerWaalsContact C-N 3.3Å; I140-L142 PolarHBondContact O-N 2.8Å; I140-E143 PolarHBondContact O-N 3.18Å; I140-L144 HydrophobicContact CG2-CD1 4.07Å; I140-L144 HydrophobicContact CG2-CG 4.44Å; I140-L144 WeakPolarHBondContact O-CB 3.39Å; I140-L144 WeakPolarHBondContact O-CG 3.04Å; I140-L144 PolarHBondContact O-N 3.03Å
141	S	97.3	Very high	95.9	Very high	53 Å²	53	47.1 Å²	47.1	37%	0.371	23%	0.23	S	C	.	.	H	α-helix	trans	-62.3	-36.6	177.9	-59.1	0	0	0	0	112.4	A137 V138 N139 A145	A137-S141 WeakPolarHBondContact O-CB 3.4Å; A137-S141 PolarHBondContact O-N 2.87Å; A137-S141 PolarHBondContact O-OG 3.02Å; V138-S141 WeakPolarHBondContact O-CB 3.18Å; V138-S141 PolarHBondContact O-N 3.39Å; N139-S141 VanDerWaalsContact C-N 3.3Å; N139-S141 PolarHBondContact O-N 3.34Å; S141-A145 WeakPolarHBondContact O-CB 3.49Å; S141-A145 PolarHBondContact O-N 3.3Å
142	L	96.5	Very high	96	Very high	21 Å²	21	50.5 Å²	50.5	11%	0.11	25%	0.246	C	C	.	.	H	α-helix	trans	-71.3	-40.4	175.9	-67.4	172.8	0	0	0	112.6	V75 F95 L97 V138 N139 I140 A145 S146	V75-L142 HydrophobicContact CB-CD2 4.24Å; V75-L142 HydrophobicContact CG1-CD2 3.64Å; V75-L142 HydrophobicContact CG2-CD1 4.14Å; V75-L142 HydrophobicContact CG2-CD2 3.51Å; V75-L142 HydrophobicContact CG2-CG 4.45Å; F95-L142 HydrophobicContact CB-CB 4.4Å; F95-L142 HydrophobicContact CB-CD2 3.98Å; L97-L142 HydrophobicContact CB-CD1 3.6Å; L97-L142 HydrophobicContact CD1-CD1 3.56Å; L97-L142 HydrophobicContact CG-CD1 4.13Å; V138-L142 HydrophobicContact CG1-CD1 4.37Å; V138-L142 WeakPolarHBondContact O-CG 3.39Å; V138-L142 PolarHBondContact O-N 3.48Å; N139-L142 PolarHBondContact O-N 2.87Å; I140-L142 VanDerWaalsContact C-N 3.3Å; I140-L142 PolarHBondContact O-N 2.8Å; L142-A145 PolarHBondContact O-N 3.32Å; L142-S146 PolarHBondContact O-N 2.82Å; L142-S146 PolarHBondContact O-OG 3.3Å
143	E	96.5	Very high	96	Very high	58 Å²	58	48.1 Å²	48.1	27%	0.271	23%	0.23	S	C	.	.	H	α-helix	trans	-62.9	-44.7	172.8	-175.3	64.6	-166.8	0	0	110.2	L27 N139 I140 A145 S146 R147	L27-E143 HydrophobicContact CD1-CB 4.29Å; L27-E143 HydrophobicContact CD1-CG 3.59Å; L27-E143 HydrophobicContact CD2-CG 4.14Å; N139-E143 PolarHBondContact O-N 2.95Å; I140-E143 PolarHBondContact O-N 3.18Å; E143-A145 VanDerWaalsContact C-N 3.35Å; E143-A145 PolarHBondContact O-N 3.3Å; E143-S146 PolarHBondContact O-N 3.17Å; E143-R147 HydrophobicContact CG-CG 4.17Å; E143-R147 WeakPolarHBondContact O-CB 3.46Å; E143-R147 WeakPolarHBondContact O-CG 3.35Å; E143-R147 PolarHBondContact O-N 2.99Å; E143-R147 IonicContact OE1-CZ 3.26Å; E143-R147 IonicContact OE1-NE 2.98Å; E143-R147 PolarHBondContact OE1-NE 3.24Å; E143-R147 IonicContact OE1-NH2 2.72Å; E143-R147 PolarHBondContact OE1-NH2 3.33Å; E143-R147 VanDerWaalsContact OE1-NH2 3.14Å
144	L	97.7	Very high	95.7	Very high	6 Å²	6	48.5 Å²	48.5	3%	0.031	23%	0.233	C	C	.	.	H	α-helix	trans	-56.3	-46.3	173.8	-83.7	167.5	0	0	0	112.2	I24 L27 L31 I140 S146 R147 R148	I24-L144 HydrophobicContact CG2-CD2 3.99Å; L27-L144 HydrophobicContact CB-CD1 4.38Å; L27-L144 HydrophobicContact CB-CD2 3.56Å; L27-L144 HydrophobicContact CB-CG 3.75Å; L27-L144 HydrophobicContact CD1-CD2 4.28Å; L27-L144 HydrophobicContact CD1-CG 4.37Å; L31-L144 HydrophobicContact CB-CD1 4.3Å; L31-L144 HydrophobicContact CD2-CD1 3.7Å; I140-L144 HydrophobicContact CG2-CD1 4.07Å; I140-L144 HydrophobicContact CG2-CG 4.44Å; I140-L144 WeakPolarHBondContact O-CB 3.39Å; I140-L144 WeakPolarHBondContact O-CG 3.04Å; I140-L144 PolarHBondContact O-N 3.03Å; L144-S146 VanDerWaalsContact C-N 3.34Å; L144-S146 PolarHBondContact O-N 3.19Å; L144-R147 PolarHBondContact O-N 3.47Å; L144-R148 WeakPolarHBondContact O-CB 3.49Å; L144-R148 VanDerWaalsContact O-CG 3.25Å; L144-R148 WeakPolarHBondContact O-CG 3.48Å; L144-R148 PolarHBondContact O-N 3.45Å
145	A	97.1	Very high	95.7	Very high	36 Å²	36	47 Å²	47	30%	0.298	23%	0.23	S	C	.	.	H	α-helix	trans	-61.4	-43.1	177.5	0	0	0	0	0	111.6	F95 S141 L142 E143 R148 A149	F95-A145 HydrophobicContact CD2-CB 3.56Å; F95-A145 HydrophobicContact CE2-CB 3.69Å; F95-A145 HydrophobicContact CG-CB 4.37Å; S141-A145 WeakPolarHBondContact O-CB 3.49Å; S141-A145 PolarHBondContact O-N 3.3Å; L142-A145 PolarHBondContact O-N 3.32Å; E143-A145 VanDerWaalsContact C-N 3.35Å; E143-A145 PolarHBondContact O-N 3.3Å; A145-R148 PolarHBondContact O-N 3.44Å; A145-A149 PolarHBondContact O-N 3.14Å
146	S	96.3	Very high	95.7	Very high	2 Å²	2	48.8 Å²	48.8	1%	0.014	24%	0.241	C	C	.	.	H	α-helix	trans	-65.3	-43.3	178.2	-55.4	0	0	0	0	111.6	F95 L142 E143 L144 A149 R150	F95-S146 PolarHBondContact N-OG 3.3Å; L142-S146 PolarHBondContact O-N 2.82Å; L142-S146 PolarHBondContact O-OG 3.3Å; E143-S146 PolarHBondContact O-N 3.17Å; L144-S146 VanDerWaalsContact C-N 3.34Å; L144-S146 PolarHBondContact O-N 3.19Å; S146-A149 PolarHBondContact O-N 3.48Å; S146-R150 PolarHBondContact O-N 3.4Å
147	R	96.2	Very high	95.5	Very high	61 Å²	61	44 Å²	44	23%	0.23	22%	0.223	C	C	.	.	H	α-helix	trans	-65.8	-39.2	178.1	-68	-76.2	173.3	167	5.4	111.8	N20 I24 L27 E143 L144 R150 L151	N20-R147 PolarHBondContact ND2-O 3.37Å; N20-R147 WeakPolarHBondContact OD1-CD 3.23Å; I24-R147 HydrophobicContact CD1-CB 4.02Å; I24-R147 HydrophobicContact CG1-CB 3.59Å; L27-R147 HydrophobicContact CD1-CG 4.04Å; E143-R147 HydrophobicContact CG-CG 4.17Å; E143-R147 WeakPolarHBondContact O-CB 3.46Å; E143-R147 WeakPolarHBondContact O-CG 3.35Å; E143-R147 PolarHBondContact O-N 2.99Å; E143-R147 IonicContact OE1-CZ 3.26Å; E143-R147 IonicContact OE1-NE 2.98Å; E143-R147 PolarHBondContact OE1-NE 3.24Å; E143-R147 IonicContact OE1-NH2 2.72Å; E143-R147 PolarHBondContact OE1-NH2 3.33Å; E143-R147 VanDerWaalsContact OE1-NH2 3.14Å; L144-R147 PolarHBondContact O-N 3.47Å; R147-R150 VanDerWaalsContact CZ-NH1 3.3Å; R147-R150 VanDerWaalsContact NH1-NH1 3.16Å; R147-R150 PolarHBondContact O-N 3.2Å; R147-L151 WeakPolarHBondContact O-CB 3.41Å; R147-L151 PolarHBondContact O-N 2.87Å
148	R	96.5	Very high	95.3	Very high	140 Å²	140	44.9 Å²	44.9	53%	0.528	23%	0.227	S	C	.	.	H	α-helix	trans	-64.5	-42.9	174.2	-76.9	176.5	178.5	171.5	3.1	111.9	I24 L144 A145 R150 L151 E152	I24-R148 HydrophobicContact CD1-CG 4.27Å; L144-R148 WeakPolarHBondContact O-CB 3.49Å; L144-R148 VanDerWaalsContact O-CG 3.25Å; L144-R148 WeakPolarHBondContact O-CG 3.48Å; L144-R148 PolarHBondContact O-N 3.45Å; A145-R148 PolarHBondContact O-N 3.44Å; R148-R150 VanDerWaalsContact C-N 3.33Å; R148-R150 PolarHBondContact O-N 2.89Å; R148-L151 WeakPolarHBondContact O-CB 3.34Å; R148-L151 PolarHBondContact O-N 2.89Å; R148-E152 PolarHBondContact O-N 3.31Å
149	A	95.6	Very high	95.1	Very high	16 Å²	16	48.7 Å²	48.7	13%	0.132	24%	0.239	C	C	.	.	H	α-helix	trans	-60.3	-42.6	173.9	0	0	0	0	0	111.9	T93 A145 S146 L151 E152 A153	T93-A149 WeakPolarHBondContact O-CB 3.25Å; T93-A149 WeakPolarHBondContact OG1-CB 3.34Å; A145-A149 PolarHBondContact O-N 3.14Å; S146-A149 PolarHBondContact O-N 3.48Å; A149-L151 PolarHBondContact O-N 3.04Å; A149-E152 PolarHBondContact O-N 2.94Å; A149-A153 PolarHBondContact O-N 3.33Å
150	R	93.9	Very high	95	Very high	70 Å²	70	46.8 Å²	46.8	26%	0.264	23%	0.228	S	C	.	.	H	α-helix	trans	-65.1	-37.4	174.2	-169.1	-177.2	-63.1	137.6	1.9	112.7	T92 S146 R147 R148 E152 A153 S154	T92-R150 WeakPolarHBondContact OG1-CA 3.46Å; T92-R150 PolarHBondContact OG1-N 3.15Å; S146-R150 PolarHBondContact O-N 3.4Å; R147-R150 VanDerWaalsContact CZ-NH1 3.3Å; R147-R150 VanDerWaalsContact NH1-NH1 3.16Å; R147-R150 PolarHBondContact O-N 3.2Å; R148-R150 VanDerWaalsContact C-N 3.33Å; R148-R150 PolarHBondContact O-N 2.89Å; R150-E152 VanDerWaalsContact C-N 3.33Å; R150-A153 PolarHBondContact O-N 3.05Å; R150-S154 WeakPolarHBondContact O-CB 3.42Å; R150-S154 PolarHBondContact O-N 2.94Å; R150-S154 PolarHBondContact O-OG 3.05Å
151	L	95.1	Very high	94.6	Very high	36 Å²	36	45.9 Å²	45.9	19%	0.188	22%	0.223	C	C	.	.	H	α-helix	trans	-63.5	-41.5	175.8	-167	75.3	0	0	0	110.9	H17 N20 L21 I24 R147 R148 A149 S154 S155	H17-L151 WeakPolarHBondContact CE1-CD1 3.47Å; N20-L151 HydrophobicContact CB-CD1 4.5Å; N20-L151 WeakPolarHBondContact ND2-CB 3.48Å; N20-L151 PolarHBondContact ND2-N 2.94Å; L21-L151 HydrophobicContact CB-CD1 4.12Å; I24-L151 HydrophobicContact CD1-CB 4.07Å; I24-L151 HydrophobicContact CD1-CD1 4.43Å; I24-L151 HydrophobicContact CD1-CD2 3.86Å; I24-L151 HydrophobicContact CD1-CG 4.35Å; R147-L151 WeakPolarHBondContact O-CB 3.41Å; R147-L151 PolarHBondContact O-N 2.87Å; R148-L151 WeakPolarHBondContact O-CB 3.34Å; R148-L151 PolarHBondContact O-N 2.89Å; A149-L151 PolarHBondContact O-N 3.04Å; L151-S154 WeakPolarHBondContact CA-OG 3.38Å; L151-S154 PolarHBondContact O-OG 3.2Å; L151-S155 WeakPolarHBondContact O-CB 3.42Å; L151-S155 PolarHBondContact O-N 2.92Å; L151-S155 PolarHBondContact O-OG 2.94Å
152	E	95.2	Very high	94.3	Very high	121 Å²	121	47.1 Å²	47.1	57%	0.565	23%	0.225	S	C	*	.	H	α-helix	trans	-65.7	-46.5	175.8	-174.2	173.6	-177.7	0	0	111.4	R148 A149 R150 S155 Q156	R148-E152 PolarHBondContact O-N 3.31Å; A149-E152 PolarHBondContact O-N 2.94Å; R150-E152 VanDerWaalsContact C-N 3.33Å; E152-S155 WeakPolarHBondContact O-CB 3.18Å; E152-S155 PolarHBondContact O-N 3.02Å; E152-Q156 WeakPolarHBondContact O-CG 3.37Å; E152-Q156 PolarHBondContact O-N 2.95Å
153	A	93.2	Very high	94	Very high	4 Å²	4	52.8 Å²	52.8	3%	0.033	25%	0.249	C	C	.	.	H	α-helix	trans	-60.5	-48	178.1	0	0	0	0	0	112.2	I82 A149 R150 S155 Q156 Q157	I82-A153 HydrophobicContact CD1-CB 3.53Å; A149-A153 PolarHBondContact O-N 3.33Å; R150-A153 PolarHBondContact O-N 3.05Å; A153-S155 VanDerWaalsContact C-N 3.33Å; A153-S155 PolarHBondContact O-N 3.49Å; A153-Q156 WeakPolarHBondContact O-CB 3.45Å; A153-Q156 PolarHBondContact O-N 3.32Å; A153-Q156 VanDerWaalsContact O-N 3.1Å; A153-Q157 PolarHBondContact O-N 3.1Å
154	S	92.8	Very high	93.6	Very high	9 Å²	9	51.7 Å²	51.7	6%	0.063	24%	0.244	C	C	.	.	H	α-helix	trans	-62.7	-37.5	175.2	54.4	0	0	0	0	112.5	H17 R150 L151 Q156 Q157 I158	H17-S154 PolarHBondContact ND1-OG 2.92Å; R150-S154 WeakPolarHBondContact O-CB 3.42Å; R150-S154 PolarHBondContact O-N 2.94Å; R150-S154 PolarHBondContact O-OG 3.05Å; L151-S154 WeakPolarHBondContact CA-OG 3.38Å; L151-S154 PolarHBondContact O-OG 3.2Å; S154-Q156 VanDerWaalsContact C-N 3.26Å; S154-Q156 PolarHBondContact O-N 2.97Å; S154-Q157 PolarHBondContact O-N 3.23Å; S154-I158 VanDerWaalsContact O-CG1 3.32Å; S154-I158 WeakPolarHBondContact O-CG1 3.37Å; S154-I158 PolarHBondContact O-N 3.33Å
155	S	94.6	Very high	93	Very high	33 Å²	33	55.1 Å²	55.1	23%	0.231	26%	0.257	C	S	.	.	H	α-helix	trans	-59.4	-38.9	173.1	-61.2	0	0	0	0	111.9	H17 L151 E152 A153 K159	H17-S155 PolarHBondContact CE1-OG 2.97Å; L151-S155 WeakPolarHBondContact O-CB 3.42Å; L151-S155 PolarHBondContact O-N 2.92Å; L151-S155 PolarHBondContact O-OG 2.94Å; E152-S155 WeakPolarHBondContact O-CB 3.18Å; E152-S155 PolarHBondContact O-N 3.02Å; A153-S155 VanDerWaalsContact C-N 3.33Å; A153-S155 PolarHBondContact O-N 3.49Å; S155-K159 WeakPolarHBondContact O-CB 3.48Å; S155-K159 WeakPolarHBondContact O-CD 3.35Å; S155-K159 WeakPolarHBondContact O-CG 3.41Å; S155-K159 PolarHBondContact O-N 3.09Å; S155-K159 VanDerWaalsContact O-N 3.1Å
156	Q	93.3	Very high	92.6	Very high	89 Å²	89	59 Å²	59	42%	0.416	27%	0.27	S	S	.	.	H	α-helix	trans	-71.3	-37.8	176.9	-65.5	177.8	12.4	0	0	111.8	F90 E152 A153 S154 H160	F90-Q156 HydrophobicContact CD1-CB 4.1Å; F90-Q156 HydrophobicContact CE1-CB 3.81Å; E152-Q156 WeakPolarHBondContact O-CG 3.37Å; E152-Q156 PolarHBondContact O-N 2.95Å; A153-Q156 WeakPolarHBondContact O-CB 3.45Å; A153-Q156 PolarHBondContact O-N 3.32Å; A153-Q156 VanDerWaalsContact O-N 3.1Å; S154-Q156 VanDerWaalsContact C-N 3.26Å; S154-Q156 PolarHBondContact O-N 2.97Å; Q156-H160 WeakPolarHBondContact O-CB 3.29Å; Q156-H160 PolarHBondContact O-N 2.94Å
157	Q	92.2	Very high	92.1	Very high	12 Å²	12	65.4 Å²	65.4	6%	0.056	30%	0.298	C	S	.	.	H	α-helix	trans	-62.4	-51.5	174.1	-71.9	178.1	-63.5	0	0	111.4	L13 T85 F90 A153 S154 K159 H160 L161	L13-Q157 HydrophobicContact CD1-CB 4.42Å; L13-Q157 HydrophobicContact CD2-CB 3.61Å; T85-Q157 PolarHBondContact OG1-NE2 3.22Å; F90-Q157 HydrophobicContact CB-CG 4.05Å; F90-Q157 HydrophobicContact CD1-CG 3.56Å; F90-Q157 HydrophobicContact CD2-CG 3.44Å; F90-Q157 VanDerWaalsContact CD2-CG 3.44Å; F90-Q157 HydrophobicContact CE1-CB 4.35Å; F90-Q157 HydrophobicContact CE1-CG 3.76Å; F90-Q157 HydrophobicContact CE2-CB 4.42Å; F90-Q157 HydrophobicContact CE2-CG 3.65Å; F90-Q157 HydrophobicContact CG-CG 3.39Å; F90-Q157 HydrophobicContact CZ-CB 4.26Å; F90-Q157 HydrophobicContact CZ-CG 3.78Å; A153-Q157 PolarHBondContact O-N 3.1Å; S154-Q157 PolarHBondContact O-N 3.23Å; Q157-K159 VanDerWaalsContact C-N 3.34Å; Q157-K159 PolarHBondContact O-N 3.39Å; Q157-H160 WeakPolarHBondContact O-CA 3.05Å; Q157-H160 WeakPolarHBondContact O-CB 3.5Å; Q157-H160 PolarHBondContact O-N 3.37Å; Q157-L161 WeakPolarHBondContact O-CG 3.36Å; Q157-L161 PolarHBondContact O-N 2.9Å
158	I	92.6	Very high	91.3	Very high	22 Å²	22	62.5 Å²	62.5	11%	0.113	29%	0.287	C	S	.	.	H	α-helix	trans	-57.2	-48.7	178.1	-67.4	167.5	0	0	0	110.2	L10 L13 V14 H17 S154 H160 L161 I162	L10-I158 HydrophobicContact CD1-CG2 4.25Å; L13-I158 HydrophobicContact CB-CG1 4.47Å; L13-I158 HydrophobicContact CD2-CB 4.36Å; L13-I158 HydrophobicContact CD2-CG1 3.47Å; L13-I158 VanDerWaalsContact CD2-CG1 3.47Å; L13-I158 HydrophobicContact CG-CD1 4.26Å; L13-I158 HydrophobicContact CG-CG1 3.62Å; V14-I158 HydrophobicContact CG2-CD1 4.01Å; V14-I158 HydrophobicContact CG2-CG1 4.3Å; V14-I158 HydrophobicContact CG2-CG2 4.4Å; H17-I158 HydrophobicContact CB-CD1 3.73Å; S154-I158 VanDerWaalsContact O-CG1 3.32Å; S154-I158 WeakPolarHBondContact O-CG1 3.37Å; S154-I158 PolarHBondContact O-N 3.33Å; I158-H160 PolarHBondContact O-N 3.27Å; I158-L161 PolarHBondContact O-N 2.7Å; I158-I162 HydrophobicContact CG2-CD1 3.67Å; I158-I162 HydrophobicContact CG2-CG1 4.4Å; I158-I162 VanDerWaalsContact O-CG1 3.3Å; I158-I162 WeakPolarHBondContact O-CG1 3.46Å; I158-I162 PolarHBondContact O-N 3.49Å
159	K	92.8	Very high	90.4	Very high	136 Å²	136	60 Å²	60	59%	0.591	28%	0.281	S	S	*	.	H	α-helix	trans	-59.7	-34.3	176.4	-75.4	172.8	-175.3	176.6	0	112.6	S155 Q157 K163	S155-K159 WeakPolarHBondContact O-CB 3.48Å; S155-K159 WeakPolarHBondContact O-CD 3.35Å; S155-K159 WeakPolarHBondContact O-CG 3.41Å; S155-K159 PolarHBondContact O-N 3.09Å; S155-K159 VanDerWaalsContact O-N 3.1Å; Q157-K159 VanDerWaalsContact C-N 3.34Å; Q157-K159 PolarHBondContact O-N 3.39Å; K159-K163 WeakPolarHBondContact O-CB 3.27Å; K159-K163 VanDerWaalsContact O-CG 3.23Å; K159-K163 WeakPolarHBondContact O-CG 3.34Å; K159-K163 PolarHBondContact O-N 3.38Å
160	H	91.2	Very high	89.5	Confident	36 Å²	36	63 Å²	63	17%	0.167	30%	0.301	C	S	.	.	H	α-helix	trans	-71.7	-46.9	178.1	-179.9	52.7	0	0	0	111.7	F90 Q156 Q157 I158 K163 L164	F90-H160 HydrophobicContact CZ-CB 3.8Å; F90-H160 AromaticContact CZ-CD2 3.92Å; Q156-H160 WeakPolarHBondContact O-CB 3.29Å; Q156-H160 PolarHBondContact O-N 2.94Å; Q157-H160 WeakPolarHBondContact O-CA 3.05Å; Q157-H160 WeakPolarHBondContact O-CB 3.5Å; Q157-H160 PolarHBondContact O-N 3.37Å; I158-H160 PolarHBondContact O-N 3.27Å; H160-K163 WeakPolarHBondContact O-CB 3.46Å; H160-K163 PolarHBondContact O-N 3.45Å; H160-L164 PolarHBondContact O-N 3.28Å
161	L	89.4	Confident	88.2	Confident	3 Å²	3	63.9 Å²	63.9	2%	0.016	32%	0.315	C	S	.	.	H	α-helix	trans	-61	-46.1	178.2	-68.7	-174.4	0	0	0	111.8	P5 L10 L13 T85 Y86 Q157 I158 K163 L164 R165	P5-L161 HydrophobicContact CB-CB 4.47Å; P5-L161 HydrophobicContact CB-CD2 3.94Å; P5-L161 HydrophobicContact CG-CB 4.44Å; P5-L161 HydrophobicContact CG-CD2 4.42Å; L10-L161 HydrophobicContact CD1-CB 4.15Å; L10-L161 HydrophobicContact CD1-CD1 4.31Å; L13-L161 HydrophobicContact CD2-CD1 3.78Å; T85-L161 HydrophobicContact CG2-CD1 4.1Å; T85-L161 HydrophobicContact CG2-CD2 3.53Å; T85-L161 HydrophobicContact CG2-CG 4.01Å; Y86-L161 HydrophobicContact CD2-CD2 3.4Å; Y86-L161 VanDerWaalsContact CD2-CD2 3.4Å; Y86-L161 HydrophobicContact CE2-CD2 3.83Å; Y86-L161 HydrophobicContact CG-CD2 4.12Å; Q157-L161 WeakPolarHBondContact O-CG 3.36Å; Q157-L161 PolarHBondContact O-N 2.9Å; I158-L161 PolarHBondContact O-N 2.7Å; L161-K163 VanDerWaalsContact C-N 3.29Å; L161-K163 PolarHBondContact O-N 2.9Å; L161-L164 PolarHBondContact O-N 3.39Å; L161-L164 VanDerWaalsContact O-N 3.09Å; L161-R165 PolarHBondContact O-N 2.72Å
162	I	90.5	Very high	86.5	Confident	79 Å²	79	67.9 Å²	67.9	41%	0.405	34%	0.341	S	S	.	.	H	α-helix	trans	-58.2	-43	175.4	-66.5	169.3	0	0	0	110.6	L10 I158 L164 R165 M166	L10-I162 HydrophobicContact CD1-CG1 4.32Å; L10-I162 HydrophobicContact CD2-CG1 4.31Å; I158-I162 HydrophobicContact CG2-CD1 3.67Å; I158-I162 HydrophobicContact CG2-CG1 4.4Å; I158-I162 VanDerWaalsContact O-CG1 3.3Å; I158-I162 WeakPolarHBondContact O-CG1 3.46Å; I158-I162 PolarHBondContact O-N 3.49Å; I162-L164 VanDerWaalsContact C-N 3.34Å; I162-L164 PolarHBondContact O-N 2.81Å; I162-R165 PolarHBondContact O-N 3.36Å; I162-M166 HydrophobicContact CG2-CG 4.39Å; I162-M166 VanDerWaalsContact O-CG 3.27Å; I162-M166 WeakPolarHBondContact O-CG 3.35Å; I162-M166 PolarHBondContact O-N 3.41Å
163	K	90.5	Very high	84.4	Confident	140 Å²	140	73.3 Å²	73.3	61%	0.609	37%	0.366	S	S	*	.	H	α-helix	trans	-63.9	-35.9	176.7	-77.3	176	-178.1	-174.4	0	113.1	K159 H160 L161 K167	K159-K163 WeakPolarHBondContact O-CB 3.27Å; K159-K163 VanDerWaalsContact O-CG 3.23Å; K159-K163 WeakPolarHBondContact O-CG 3.34Å; K159-K163 PolarHBondContact O-N 3.38Å; H160-K163 WeakPolarHBondContact O-CB 3.46Å; H160-K163 PolarHBondContact O-N 3.45Å; L161-K163 VanDerWaalsContact C-N 3.29Å; L161-K163 PolarHBondContact O-N 2.9Å; K163-K167 VanDerWaalsContact O-CG 3.31Å; K163-K167 WeakPolarHBondContact O-CG 3.46Å; K163-K167 PolarHBondContact O-N 2.96Å
164	L	88.5	Confident	83.9	Confident	34 Å²	34	76.8 Å²	76.8	18%	0.178	38%	0.383	C	S	.	.	H	α-helix	trans	-69.3	-41	175.7	-72.2	177.1	0	0	0	111.3	P5 Y86 H160 L161 I162 K167 G168	P5-L164 HydrophobicContact CG-CB 4.45Å; Y86-L164 VanDerWaalsContact CB-CD1 3.45Å; Y86-L164 HydrophobicContact CD1-CD1 4.23Å; Y86-L164 HydrophobicContact CG-CD1 3.94Å; H160-L164 PolarHBondContact O-N 3.28Å; L161-L164 PolarHBondContact O-N 3.39Å; L161-L164 VanDerWaalsContact O-N 3.09Å; I162-L164 VanDerWaalsContact C-N 3.34Å; I162-L164 PolarHBondContact O-N 2.81Å; L164-K167 PolarHBondContact O-N 2.91Å; L164-G168 PolarHBondContact O-N 3.05Å
165	R	86.1	Confident	83.4	Confident	79 Å²	79	80.4 Å²	80.4	30%	0.298	40%	0.399	S	S	.	.	H	α-helix	trans	-60.2	-50.6	176.5	-162.2	176.9	-168.2	-102.4	17.1	111.8	P5 D7 L161 I162 K167 G168 E169	P5-R165 HydrophobicContact CG-CB 4.09Å; D7-R165 IonicContact OD1-CZ 3.39Å; D7-R165 VanDerWaalsContact OD1-CZ 3.26Å; D7-R165 IonicContact OD1-NE 2.75Å; D7-R165 PolarHBondContact OD1-NE 3.27Å; D7-R165 IonicContact OD1-NH2 3.14Å; D7-R165 PolarHBondContact OD1-NH2 3.44Å; D7-R165 IonicContact OD2-NH2 2.69Å; D7-R165 PolarHBondContact OD2-NH2 3.16Å; L161-R165 PolarHBondContact O-N 2.72Å; I162-R165 PolarHBondContact O-N 3.36Å; R165-K167 VanDerWaalsContact C-N 3.27Å; R165-K167 PolarHBondContact O-N 3.4Å; R165-G168 PolarHBondContact O-N 3.38Å; R165-E169 IonicContact CZ-OE1 3.85Å; R165-E169 IonicContact NE-OE1 3.63Å; R165-E169 IonicContact NH1-OE1 3.76Å; R165-E169 PolarHBondContact NH1-OE1 3.28Å; R165-E169 WeakPolarHBondContact O-CG 3.48Å; R165-E169 PolarHBondContact O-N 3.49Å
166	M	87.5	Confident	82.8	Confident	118 Å²	118	83 Å²	83	58%	0.581	41%	0.409	S	S	*	.	H	α-helix	trans	-59.9	-35.1	177.3	-64.9	-66.8	-63.7	0	0	112.9	I162 S170	I162-M166 HydrophobicContact CG2-CG 4.39Å; I162-M166 VanDerWaalsContact O-CG 3.27Å; I162-M166 WeakPolarHBondContact O-CG 3.35Å; I162-M166 PolarHBondContact O-N 3.41Å; M166-S170 PolarHBondContact O-N 2.85Å; M166-S170 PolarHBondContact O-OG 3.46Å
167	K	86.6	Confident	82.2	Confident	135 Å²	135	82.6 Å²	82.6	59%	0.587	41%	0.408	S	S	*	.	H	α-helix	trans	-72.1	-35.2	174.8	-76.8	179.8	178.7	-170.7	0	112.6	K163 L164 R165 S170 T171	K163-K167 VanDerWaalsContact O-CG 3.31Å; K163-K167 WeakPolarHBondContact O-CG 3.46Å; K163-K167 PolarHBondContact O-N 2.96Å; L164-K167 PolarHBondContact O-N 2.91Å; R165-K167 VanDerWaalsContact C-N 3.27Å; R165-K167 PolarHBondContact O-N 3.4Å; K167-S170 WeakPolarHBondContact CA-OG 3.49Å; K167-S170 PolarHBondContact O-OG 3.22Å; K167-T171 WeakPolarHBondContact O-CG2 3.47Å; K167-T171 PolarHBondContact O-N 2.96Å; K167-T171 PolarHBondContact O-OG1 3.31Å
168	G	79.7	Confident	81.6	Confident	1 Å²	1	87.1 Å²	87.1	1%	0.01	43%	0.43	C	S	.	.	H	α-helix	trans	-66	-47.6	174.5	0	0	0	0	0	111.5	L164 R165 S170 T171 V172	L164-G168 PolarHBondContact O-N 3.05Å; R165-G168 PolarHBondContact O-N 3.38Å; G168-S170 PolarHBondContact O-N 3.25Å; G168-T171 PolarHBondContact O-N 2.91Å; G168-T171 VanDerWaalsContact O-N 3.14Å; G168-T171 PolarHBondContact O-OG1 2.89Å; G168-V172 WeakPolarHBondContact O-CG2 3.21Å; G168-V172 PolarHBondContact O-N 3.3Å
169	E	77.1	Confident	80.9	Confident	87 Å²	87	91.4 Å²	91.4	41%	0.407	45%	0.451	S	S	.	.	H	α-helix	trans	-60.7	-44	179.3	-69.4	168	-176.4	0	0	111.8	R165 T171 V172	R165-E169 IonicContact CZ-OE1 3.85Å; R165-E169 IonicContact NE-OE1 3.63Å; R165-E169 IonicContact NH1-OE1 3.76Å; R165-E169 PolarHBondContact NH1-OE1 3.28Å; R165-E169 WeakPolarHBondContact O-CG 3.48Å; R165-E169 PolarHBondContact O-N 3.49Å; E169-T171 PolarHBondContact O-N 3.09Å; E169-V172 PolarHBondContact O-N 3.01Å; E169-V172 VanDerWaalsContact O-N 3.16Å
170	S	75.6	Confident	80	Confident	78 Å²	78	88.2 Å²	88.2	55%	0.545	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-9.4	177.1	49.8	0	0	0	0	115.5	M166 K167 G168	M166-S170 PolarHBondContact O-N 2.85Å; M166-S170 PolarHBondContact O-OG 3.46Å; K167-S170 WeakPolarHBondContact CA-OG 3.49Å; K167-S170 PolarHBondContact O-OG 3.22Å; G168-S170 PolarHBondContact O-N 3.25Å
171	T	66.8	Low	79.1	Confident	90 Å²	90	92.2 Å²	92.2	55%	0.552	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	-6.2	173.1	53.9	0	0	0	0	113.6	K167 G168 E169	K167-T171 WeakPolarHBondContact O-CG2 3.47Å; K167-T171 PolarHBondContact O-N 2.96Å; K167-T171 PolarHBondContact O-OG1 3.31Å; G168-T171 PolarHBondContact O-N 2.91Å; G168-T171 VanDerWaalsContact O-N 3.14Å; G168-T171 PolarHBondContact O-OG1 2.89Å; E169-T171 PolarHBondContact O-N 3.09Å
172	V	60.9	Low	78.3	Confident	120 Å²	120	99.7 Å²	99.7	73%	0.727	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	-17.1	-179.5	179.1	0	0	0	0	111.7	G168 E169	G168-V172 WeakPolarHBondContact O-CG2 3.21Å; G168-V172 PolarHBondContact O-N 3.3Å; E169-V172 PolarHBondContact O-N 3.01Å; E169-V172 VanDerWaalsContact O-N 3.16Å
173	E	49.6	Very low	77.2	Confident	235 Å²	235	101.5 Å²	101.5	100%	1.098	51%	0.508	S	S	*	.			trans	-88.3	0	165.3	-66.3	-173.4	165.1	0	0	112.1

Retrieved 173 of 173 residues in 541.2 ms (Link to these results)

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