A0A5K4FCX5_SCHMA Loading...

Secreted protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4FCX5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 88 aa.

						>A0A5K4FCX5_SCHMA|A0A5K4FCX5
MMLDLFNRLFYILLEILRMIFQLHDEPTPQLITSTTDHITTEAIKSQTENVTHPMLAVQDVYKIGNETKRKLTYCHMINKYQHLFVHH
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	67.7	Low	84.2	Confident	215 Å²	215	129.3 Å²	129.3	100%	1.059	61%	0.612	S	S	*	*				0	-45.3	0	-146.4	163.6	84.4	0	0	112.7	L3 D4	M1-L3 PolarHBondContact O-N 3.28Å; M1-D4 PolarHBondContact O-N 3.29Å
2	M	74.4	Confident	84.9	Confident	165 Å²	165	125.9 Å²	125.9	81%	0.813	60%	0.599	S	S	*	*	H	α-helix	trans	-61.5	-38.7	-179.8	-169	-173.6	-76	0	0	114.5	D4 L5 F6	M2-D4 VanDerWaalsContact C-N 3.3Å; M2-D4 PolarHBondContact O-N 2.85Å; M2-L5 PolarHBondContact O-N 2.87Å; M2-F6 PolarHBondContact O-N 2.81Å
3	L	78.3	Confident	85.6	Confident	124 Å²	124	124.9 Å²	124.9	65%	0.649	60%	0.598	S	S	*	*	H	α-helix	trans	-62.1	-35.6	178.6	-171.8	67.9	0	0	0	112.7	M1 F6 N7	M1-L3 PolarHBondContact O-N 3.28Å; L3-F6 PolarHBondContact O-N 2.87Å; L3-N7 WeakPolarHBondContact O-CB 3.44Å; L3-N7 PolarHBondContact O-N 3.41Å; L3-N7 PolarHBondContact O-ND2 3.13Å
4	D	83.5	Confident	86.1	Confident	109 Å²	109	121.5 Å²	121.5	58%	0.583	58%	0.584	S	S	*	*	H	α-helix	trans	-65.4	-41.8	177.6	-175.1	67.7	0	0	0	111.5	M1 M2 N7 R8	M1-D4 PolarHBondContact O-N 3.29Å; M2-D4 VanDerWaalsContact C-N 3.3Å; M2-D4 PolarHBondContact O-N 2.85Å; D4-N7 PolarHBondContact O-N 2.75Å; D4-R8 WeakPolarHBondContact O-CB 3.18Å; D4-R8 PolarHBondContact O-N 2.65Å
5	L	84.6	Confident	86.5	Confident	98 Å²	98	120.8 Å²	120.8	51%	0.513	58%	0.58	S	S	.	*	H	α-helix	trans	-64.3	-44	174.8	-172.9	70.4	0	0	0	111.6	M2 R8 L9	M2-L5 PolarHBondContact O-N 2.87Å; L5-R8 PolarHBondContact O-N 2.95Å; L5-L9 WeakPolarHBondContact O-CB 3.5Å; L5-L9 PolarHBondContact O-N 3.39Å
6	F	87.9	Confident	86.8	Confident	130 Å²	130	118.6 Å²	118.6	57%	0.57	57%	0.571	S	S	*	*	H	α-helix	trans	-63.3	-45	178.5	-174.6	-95.6	0	0	0	111.5	M2 L3 R8 L9 F10	M2-F6 PolarHBondContact O-N 2.81Å; L3-F6 PolarHBondContact O-N 2.87Å; F6-R8 PolarHBondContact O-N 2.74Å; F6-L9 PolarHBondContact O-N 3.2Å; F6-F10 WeakPolarHBondContact O-CB 3.46Å; F6-F10 PolarHBondContact O-N 3.2Å
7	N	87.2	Confident	87	Confident	64 Å²	64	116.5 Å²	116.5	34%	0.342	56%	0.563	S	S	.	*	H	α-helix	trans	-60.6	-46	175.8	-71.8	-20.8	0	0	0	111	L3 D4 L9 F10 Y11	L3-N7 WeakPolarHBondContact O-CB 3.44Å; L3-N7 PolarHBondContact O-N 3.41Å; L3-N7 PolarHBondContact O-ND2 3.13Å; D4-N7 PolarHBondContact O-N 2.75Å; N7-L9 VanDerWaalsContact C-N 3.31Å; N7-L9 PolarHBondContact O-N 2.78Å; N7-F10 WeakPolarHBondContact O-CB 3.21Å; N7-F10 PolarHBondContact O-N 3.03Å; N7-Y11 HydrophobicContact CB-CE2 4.37Å; N7-Y11 WeakPolarHBondContact O-CD2 3.46Å; N7-Y11 PolarHBondContact O-N 2.81Å
8	R	90.1	Very high	87	Confident	143 Å²	143	117.3 Å²	117.3	54%	0.54	56%	0.559	S	S	.	*	H	α-helix	trans	-59.6	-42.6	177.4	-166.4	172.5	78.9	-132.5	8.2	111.9	D4 L5 F6 Y11 I12	D4-R8 WeakPolarHBondContact O-CB 3.18Å; D4-R8 PolarHBondContact O-N 2.65Å; L5-R8 PolarHBondContact O-N 2.95Å; F6-R8 PolarHBondContact O-N 2.74Å; R8-Y11 PolarHBondContact O-N 3.11Å; R8-I12 HydrophobicContact CG-CD1 4.31Å; R8-I12 WeakPolarHBondContact O-CD1 3.43Å; R8-I12 VanDerWaalsContact O-CG1 3.28Å; R8-I12 WeakPolarHBondContact O-CG1 3.15Å; R8-I12 PolarHBondContact O-N 2.8Å; R8-I12 VanDerWaalsContact O-N 3.14Å
9	L	90.5	Very high	86.9	Confident	112 Å²	112	117.9 Å²	117.9	59%	0.586	56%	0.563	S	S	*	*	H	α-helix	trans	-64.1	-42.3	175.8	-176.9	62	0	0	0	111.9	L5 F6 N7 I12 L13	L5-L9 WeakPolarHBondContact O-CB 3.5Å; L5-L9 PolarHBondContact O-N 3.39Å; F6-L9 PolarHBondContact O-N 3.2Å; N7-L9 VanDerWaalsContact C-N 3.31Å; N7-L9 PolarHBondContact O-N 2.78Å; L9-I12 PolarHBondContact O-N 2.85Å; L9-L13 PolarHBondContact O-N 2.97Å
10	F	91.7	Very high	86.8	Confident	103 Å²	103	116.4 Å²	116.4	45%	0.452	56%	0.558	S	S	.	*	H	α-helix	trans	-61.3	-43.6	177.4	-176.2	-102.3	0	0	0	112	F6 N7 L13 L14	F6-F10 WeakPolarHBondContact O-CB 3.46Å; F6-F10 PolarHBondContact O-N 3.2Å; N7-F10 WeakPolarHBondContact O-CB 3.21Å; N7-F10 PolarHBondContact O-N 3.03Å; F10-L13 PolarHBondContact O-N 2.77Å; F10-L14 HydrophobicContact CD1-CD1 3.81Å; F10-L14 HydrophobicContact CD1-CG 4.41Å; F10-L14 HydrophobicContact CE1-CD1 3.37Å; F10-L14 HydrophobicContact CE1-CG 4.1Å; F10-L14 HydrophobicContact CZ-CD1 3.93Å; F10-L14 HydrophobicContact CZ-CD2 4.44Å; F10-L14 HydrophobicContact CZ-CG 4.27Å; F10-L14 WeakPolarHBondContact O-CG 3.44Å; F10-L14 PolarHBondContact O-N 2.97Å
11	Y	90.7	Very high	86.5	Confident	159 Å²	159	116.7 Å²	116.7	62%	0.624	56%	0.557	S	S	*	*	H	α-helix	trans	-63.8	-40.4	175.9	-76.1	-66.1	0	0	0	112.9	N7 R8 L13 L14 E15	N7-Y11 HydrophobicContact CB-CE2 4.37Å; N7-Y11 WeakPolarHBondContact O-CD2 3.46Å; N7-Y11 PolarHBondContact O-N 2.81Å; R8-Y11 PolarHBondContact O-N 3.11Å; Y11-L13 VanDerWaalsContact C-N 3.33Å; Y11-L13 PolarHBondContact O-N 2.8Å; Y11-L14 PolarHBondContact O-N 3.21Å; Y11-E15 PolarHBondContact O-N 2.88Å; Y11-E15 VanDerWaalsContact O-N 3.08Å
12	I	92.7	Very high	86.8	Confident	89 Å²	89	112 Å²	112	46%	0.456	53%	0.532	S	S	.	.	H	α-helix	trans	-62.6	-42.6	176	-67.3	163.4	0	0	0	110.6	R8 L9 E15 I16	R8-I12 HydrophobicContact CG-CD1 4.31Å; R8-I12 WeakPolarHBondContact O-CD1 3.43Å; R8-I12 VanDerWaalsContact O-CG1 3.28Å; R8-I12 WeakPolarHBondContact O-CG1 3.15Å; R8-I12 PolarHBondContact O-N 2.8Å; R8-I12 VanDerWaalsContact O-N 3.14Å; L9-I12 PolarHBondContact O-N 2.85Å; I12-E15 PolarHBondContact O-N 3.43Å; I12-I16 HydrophobicContact CG2-CD1 4.01Å; I12-I16 WeakPolarHBondContact O-CG1 3.44Å; I12-I16 PolarHBondContact O-N 3.45Å; I12-I16 VanDerWaalsContact O-N 3.13Å
13	L	93.9	Very high	86.6	Confident	113 Å²	113	110.1 Å²	110.1	59%	0.592	53%	0.525	S	S	*	.	H	α-helix	trans	-63.3	-42.5	178.3	-175.6	65.7	0	0	0	111.9	L9 F10 Y11 I16 L17	L9-L13 PolarHBondContact O-N 2.97Å; F10-L13 PolarHBondContact O-N 2.77Å; Y11-L13 VanDerWaalsContact C-N 3.33Å; Y11-L13 PolarHBondContact O-N 2.8Å; L13-I16 PolarHBondContact O-N 2.81Å; L13-L17 WeakPolarHBondContact O-CB 3.33Å; L13-L17 PolarHBondContact O-N 2.88Å
14	L	92.7	Very high	85.9	Confident	77 Å²	77	111.7 Å²	111.7	40%	0.403	53%	0.528	S	S	.	.	H	α-helix	trans	-61.6	-41.3	176.3	-75.8	176.6	0	0	0	112.5	F10 Y11 L17 R18	F10-L14 HydrophobicContact CD1-CD1 3.81Å; F10-L14 HydrophobicContact CD1-CG 4.41Å; F10-L14 HydrophobicContact CE1-CD1 3.37Å; F10-L14 HydrophobicContact CE1-CG 4.1Å; F10-L14 HydrophobicContact CZ-CD1 3.93Å; F10-L14 HydrophobicContact CZ-CD2 4.44Å; F10-L14 HydrophobicContact CZ-CG 4.27Å; F10-L14 WeakPolarHBondContact O-CG 3.44Å; F10-L14 PolarHBondContact O-N 2.97Å; Y11-L14 PolarHBondContact O-N 3.21Å; L14-L17 PolarHBondContact O-N 3.33Å; L14-R18 WeakPolarHBondContact O-CB 3.32Å; L14-R18 PolarHBondContact O-N 3.04Å
15	E	91.2	Very high	84.7	Confident	111 Å²	111	112.6 Å²	112.6	52%	0.519	53%	0.533	S	S	.	.	H	α-helix	trans	-66.2	-41.4	178.4	-78.5	-72.4	105	0	0	112.4	Y11 I12 L17 R18 M19	Y11-E15 PolarHBondContact O-N 2.88Å; Y11-E15 VanDerWaalsContact O-N 3.08Å; I12-E15 PolarHBondContact O-N 3.43Å; E15-L17 VanDerWaalsContact C-N 3.34Å; E15-L17 PolarHBondContact O-N 3.34Å; E15-R18 PolarHBondContact O-N 2.84Å; E15-R18 IonicContact OE1-CZ 3.84Å; E15-R18 IonicContact OE1-NH1 2.89Å; E15-R18 PolarHBondContact OE1-NH1 2.89Å; E15-R18 IonicContact OE2-NH1 3.79Å; E15-M19 PolarHBondContact O-N 3.27Å
16	I	91.4	Very high	83.2	Confident	85 Å²	85	114.3 Å²	114.3	44%	0.436	54%	0.539	S	S	.	.	H	α-helix	trans	-61.8	-45.2	175.1	-66.5	166.4	0	0	0	110.3	I12 L13 R18 M19 I20	I12-I16 HydrophobicContact CG2-CD1 4.01Å; I12-I16 WeakPolarHBondContact O-CG1 3.44Å; I12-I16 PolarHBondContact O-N 3.45Å; I12-I16 VanDerWaalsContact O-N 3.13Å; L13-I16 PolarHBondContact O-N 2.81Å; I16-R18 VanDerWaalsContact C-N 3.33Å; I16-R18 PolarHBondContact O-N 3.49Å; I16-M19 PolarHBondContact O-N 3.32Å; I16-I20 HydrophobicContact CG2-CD1 3.99Å; I16-I20 WeakPolarHBondContact O-CG1 3.42Å; I16-I20 PolarHBondContact O-N 3.35Å; I16-I20 VanDerWaalsContact O-N 3.08Å
17	L	90.1	Very high	81.6	Confident	83 Å²	83	113 Å²	113	44%	0.435	54%	0.543	S	S	.	.	H	α-helix	trans	-62	-42.5	179.1	-175.1	65	0	0	0	111.4	L13 L14 E15 M19 I20 F21	L13-L17 WeakPolarHBondContact O-CB 3.33Å; L13-L17 PolarHBondContact O-N 2.88Å; L14-L17 PolarHBondContact O-N 3.33Å; E15-L17 VanDerWaalsContact C-N 3.34Å; E15-L17 PolarHBondContact O-N 3.34Å; L17-M19 PolarHBondContact O-N 2.91Å; L17-I20 PolarHBondContact O-N 3.03Å; L17-F21 HydrophobicContact CD1-CD2 4.12Å; L17-F21 HydrophobicContact CD1-CE2 3.54Å; L17-F21 HydrophobicContact CD1-CZ 4.17Å; L17-F21 HydrophobicContact CD2-CE2 3.96Å; L17-F21 HydrophobicContact CG-CD2 3.86Å; L17-F21 HydrophobicContact CG-CE2 3.48Å; L17-F21 VanDerWaalsContact CG-CE2 3.48Å; L17-F21 WeakPolarHBondContact O-CD2 3.41Å; L17-F21 PolarHBondContact O-N 3.29Å
18	R	87.9	Confident	80.1	Confident	131 Å²	131	115.8 Å²	115.8	49%	0.494	56%	0.563	S	S	.	*	H	α-helix	trans	-60.5	-44	175.8	-167.8	-174.8	118.1	-162	6.3	111.9	L14 E15 I16 I20 F21 Q22	L14-R18 WeakPolarHBondContact O-CB 3.32Å; L14-R18 PolarHBondContact O-N 3.04Å; E15-R18 PolarHBondContact O-N 2.84Å; E15-R18 IonicContact OE1-CZ 3.84Å; E15-R18 IonicContact OE1-NH1 2.89Å; E15-R18 PolarHBondContact OE1-NH1 2.89Å; E15-R18 IonicContact OE2-NH1 3.79Å; I16-R18 VanDerWaalsContact C-N 3.33Å; I16-R18 PolarHBondContact O-N 3.49Å; R18-I20 VanDerWaalsContact C-N 3.32Å; R18-I20 PolarHBondContact O-N 2.95Å; R18-F21 PolarHBondContact O-N 2.87Å; R18-Q22 WeakPolarHBondContact O-CG 3.38Å; R18-Q22 PolarHBondContact O-N 3.43Å
19	M	85.4	Confident	78.3	Confident	129 Å²	129	114.5 Å²	114.5	64%	0.635	57%	0.573	S	S	*	*	H	α-helix	trans	-62.6	-39.7	178.6	-169.7	174.7	75	0	0	111.9	E15 I16 L17 Q22 L23	E15-M19 PolarHBondContact O-N 3.27Å; I16-M19 PolarHBondContact O-N 3.32Å; L17-M19 PolarHBondContact O-N 2.91Å; M19-Q22 PolarHBondContact O-N 2.96Å; M19-L23 PolarHBondContact O-N 2.89Å; M19-L23 VanDerWaalsContact O-N 3.16Å
20	I	84.5	Confident	76.4	Confident	88 Å²	88	117.3 Å²	117.3	45%	0.451	58%	0.583	S	S	.	*	H	α-helix	trans	-64.8	-44.3	176.3	-66.4	165.7	0	0	0	110.7	I16 L17 R18 L23 H24	I16-I20 HydrophobicContact CG2-CD1 3.99Å; I16-I20 WeakPolarHBondContact O-CG1 3.42Å; I16-I20 PolarHBondContact O-N 3.35Å; I16-I20 VanDerWaalsContact O-N 3.08Å; L17-I20 PolarHBondContact O-N 3.03Å; R18-I20 VanDerWaalsContact C-N 3.32Å; R18-I20 PolarHBondContact O-N 2.95Å; I20-L23 PolarHBondContact O-N 3.46Å; I20-H24 PolarHBondContact O-N 3.5Å
21	F	80.7	Confident	74.3	Confident	123 Å²	123	119.6 Å²	119.6	54%	0.539	60%	0.599	S	S	.	*	H	α-helix	trans	-63.1	-41.8	177.5	-77.7	-59	0	0	0	112.4	L17 R18 L23 H24 D25	L17-F21 HydrophobicContact CD1-CD2 4.12Å; L17-F21 HydrophobicContact CD1-CE2 3.54Å; L17-F21 HydrophobicContact CD1-CZ 4.17Å; L17-F21 HydrophobicContact CD2-CE2 3.96Å; L17-F21 HydrophobicContact CG-CD2 3.86Å; L17-F21 HydrophobicContact CG-CE2 3.48Å; L17-F21 VanDerWaalsContact CG-CE2 3.48Å; L17-F21 WeakPolarHBondContact O-CD2 3.41Å; L17-F21 PolarHBondContact O-N 3.29Å; R18-F21 PolarHBondContact O-N 2.87Å; F21-L23 VanDerWaalsContact C-N 3.28Å; F21-L23 PolarHBondContact O-N 3.28Å; F21-H24 PolarHBondContact O-N 2.95Å; F21-D25 PolarHBondContact O-N 2.71Å
22	Q	73.7	Confident	72.4	Confident	115 Å²	115	119.3 Å²	119.3	54%	0.537	61%	0.607	S	S	.	*	H	α-helix	trans	-61.9	-34.9	176.5	-71.9	-178	-43.4	0	0	113.2	R18 M19 H24	R18-Q22 WeakPolarHBondContact O-CG 3.38Å; R18-Q22 PolarHBondContact O-N 3.43Å; M19-Q22 PolarHBondContact O-N 2.96Å; Q22-H24 VanDerWaalsContact C-N 3.34Å
23	L	70.2	Confident	70.1	Confident	126 Å²	126	120.2 Å²	120.2	66%	0.66	62%	0.617	S	S	*	*	H	α-helix	trans	-70.8	-33.7	174.1	-170.3	71.9	0	0	0	111.5	M19 I20 F21 E26	M19-L23 PolarHBondContact O-N 2.89Å; M19-L23 VanDerWaalsContact O-N 3.16Å; I20-L23 PolarHBondContact O-N 3.46Å; F21-L23 VanDerWaalsContact C-N 3.28Å; F21-L23 PolarHBondContact O-N 3.28Å; L23-E26 WeakPolarHBondContact O-CB 3.27Å; L23-E26 PolarHBondContact O-N 3.48Å
24	H	62.5	Low	67.8	Low	157 Å²	157	119.2 Å²	119.2	73%	0.727	62%	0.619	S	S	*	*	H	α-helix	trans	-76	-25.9	179.3	-124.8	-69.7	0	0	0	113.3	I20 F21 Q22	I20-H24 PolarHBondContact O-N 3.5Å; F21-H24 PolarHBondContact O-N 2.95Å; Q22-H24 VanDerWaalsContact C-N 3.34Å
25	D	58.9	Low	65.7	Low	129 Å²	129	121 Å²	121	69%	0.69	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	0.2	172.1	-70.8	-33.1	0	0	0	112.7	F21 P27	F21-D25 PolarHBondContact O-N 2.71Å; D25-P27 WeakPolarHBondContact O-CD 3.38Å; D25-P27 VanDerWaalsContact O-N 3.14Å
26	E	52.9	Low	63.7	Low	133 Å²	133	119.7 Å²	119.7	62%	0.621	63%	0.633	S	S	*	*	S	Bend	trans	-59.4	121.3	168.7	-165.8	169.9	145	0	0	107.7	L23 T28	L23-E26 WeakPolarHBondContact O-CB 3.27Å; L23-E26 PolarHBondContact O-N 3.48Å; E26-T28 PolarHBondContact O-N 3.26Å
27	P	54.6	Low	61.3	Low	102 Å²	102	121.3 Å²	121.3	66%	0.662	64%	0.642	S	S	*	*			trans	-57.4	118.7	-175.5	21.2	-31.4	0	0	0	107.7	D25 P29	D25-P27 WeakPolarHBondContact O-CD 3.38Å; D25-P27 VanDerWaalsContact O-N 3.14Å; P27-P29 WeakPolarHBondContact O-CD 3.34Å
28	T	56.8	Low	59.3	Low	124 Å²	124	125.4 Å²	125.4	76%	0.761	66%	0.659	S	S	*	*			trans	-41.6	118	168.5	-62.5	0	0	0	0	106.5	E26 Q30	E26-T28 PolarHBondContact O-N 3.26Å; T28-Q30 PolarHBondContact O-N 3.01Å
29	P	51.5	Low	57.4	Low	115 Å²	115	124 Å²	124	75%	0.747	66%	0.66	S	S	*	*			trans	-54.9	112.4	-175.5	17.7	-29.2	0	0	0	106	P27 L31	P27-P29 WeakPolarHBondContact O-CD 3.34Å; P29-L31 PolarHBondContact O-N 3.43Å
30	Q	49.4	Very low	55.5	Low	171 Å²	171	122 Å²	122	80%	0.799	66%	0.655	S	S	*	*			trans	-54.8	112.1	177.7	-69.1	-179.5	34.1	0	0	104.3	T28 I32	T28-Q30 PolarHBondContact O-N 3.01Å; Q30-I32 WeakPolarHBondContact O-CG1 3.37Å; Q30-I32 PolarHBondContact O-N 2.87Å
31	L	48.9	Very low	54	Low	152 Å²	152	123.4 Å²	123.4	80%	0.796	67%	0.668	S	S	*	*			trans	-60.1	95.7	169.5	-177.6	73.8	0	0	0	104	P29 T33	P29-L31 PolarHBondContact O-N 3.43Å; L31-T33 HydrophobicContact CD2-CG2 4.04Å; L31-T33 HydrophobicContact CG-CG2 4.22Å; L31-T33 PolarHBondContact O-N 3.39Å
32	I	50.1	Low	52.5	Low	153 Å²	153	125.2 Å²	125.2	79%	0.785	68%	0.679	S	S	*	*			trans	-67.5	90.1	170	-41.2	176.4	0	0	0	102.8	Q30 S34	Q30-I32 WeakPolarHBondContact O-CG1 3.37Å; Q30-I32 PolarHBondContact O-N 2.87Å; I32-S34 PolarHBondContact O-N 3.09Å
33	T	45.3	Very low	51.2	Low	108 Å²	108	122.6 Å²	122.6	66%	0.663	68%	0.676	S	S	*	*			trans	-60.9	95.3	163.5	49.6	0	0	0	0	104.2	L31 T35	L31-T33 HydrophobicContact CD2-CG2 4.04Å; L31-T33 HydrophobicContact CG-CG2 4.22Å; L31-T33 PolarHBondContact O-N 3.39Å; T33-T35 PolarHBondContact O-N 3.48Å
34	S	45.9	Very low	50.1	Low	92 Å²	92	121.8 Å²	121.8	64%	0.643	67%	0.672	S	S	*	*			trans	-43	118.9	168.9	178.2	0	0	0	0	106.5	I32 T36	I32-S34 PolarHBondContact O-N 3.09Å; S34-T36 PolarHBondContact O-N 3.38Å; S34-T36 PolarHBondContact O-OG1 3.25Å; S34-T36 VanDerWaalsContact O-OG1 3.13Å
35	T	48.1	Very low	49.3	Very low	113 Å²	113	123.1 Å²	123.1	69%	0.693	68%	0.675	S	S	*	*			trans	-56	85.9	178.6	-1	0	0	0	0	108.1	T33 D37	T33-T35 PolarHBondContact O-N 3.48Å; T35-D37 WeakPolarHBondContact CG2-OD2 3.42Å; T35-D37 PolarHBondContact O-N 3.4Å
36	T	48.4	Very low	48.8	Very low	85 Å²	85	122 Å²	122	52%	0.521	68%	0.678	S	S	.	*			trans	-89.1	50.6	166.8	-48.3	0	0	0	0	105.7	S34 H38 I39	S34-T36 PolarHBondContact O-N 3.38Å; S34-T36 PolarHBondContact O-OG1 3.25Å; S34-T36 VanDerWaalsContact O-OG1 3.13Å; T36-H38 PolarHBondContact O-N 3.44Å; T36-I39 HydrophobicContact CG2-CB 3.82Å; T36-I39 HydrophobicContact CG2-CD1 3.33Å; T36-I39 HydrophobicContact CG2-CG1 3.38Å
37	D	42	Very low	48.5	Very low	118 Å²	118	123 Å²	123	63%	0.631	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	112.2	164.4	-72.7	-26.3	0	0	0	104.9	T35	T35-D37 WeakPolarHBondContact CG2-OD2 3.42Å; T35-D37 PolarHBondContact O-N 3.4Å
38	H	47.2	Very low	47.9	Very low	170 Å²	170	124.1 Å²	124.1	79%	0.787	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	95.2	19	170.1	-46.2	-65	0	0	0	120.3	T36 T40	T36-H38 PolarHBondContact O-N 3.44Å; H38-T40 PolarHBondContact O-N 3.39Å
39	I	48.8	Very low	47.3	Very low	101 Å²	101	125.9 Å²	125.9	52%	0.518	69%	0.687	S	S	.	*			trans	-76.3	77.9	157.6	-55.4	-178.5	0	0	0	108.5	T36 T41 I44	T36-I39 HydrophobicContact CG2-CB 3.82Å; T36-I39 HydrophobicContact CG2-CD1 3.33Å; T36-I39 HydrophobicContact CG2-CG1 3.38Å; I39-T41 PolarHBondContact O-N 2.82Å; I39-I44 HydrophobicContact CG2-CD1 3.66Å; I39-I44 HydrophobicContact CG2-CG1 3.61Å
40	T	45.5	Very low	46.9	Very low	86 Å²	86	127.5 Å²	127.5	53%	0.528	69%	0.689	S	S	.	*			trans	-52.3	124.1	167.2	-48.7	0	0	0	0	107.7	H38 E42 A43	H38-T40 PolarHBondContact O-N 3.39Å; T40-E42 HydrophobicContact CG2-CB 4.05Å; T40-E42 HydrophobicContact CG2-CG 3.9Å; T40-E42 PolarHBondContact O-N 3.4Å; T40-A43 PolarHBondContact O-N 3.14Å
41	T	53.2	Low	46.6	Very low	118 Å²	118	124.3 Å²	124.3	72%	0.724	68%	0.681	S	S	*	*	H	α-helix	trans	-52.5	-17.9	-177.5	-48.5	0	0	0	0	113.7	I39	I39-T41 PolarHBondContact O-N 2.82Å
42	E	48	Very low	46.4	Very low	162 Å²	162	122.5 Å²	122.5	76%	0.757	68%	0.677	S	S	*	*	H	α-helix	trans	-69	-33.4	173.8	-57.5	-88.4	128.7	0	0	113.4	T40	T40-E42 HydrophobicContact CG2-CB 4.05Å; T40-E42 HydrophobicContact CG2-CG 3.9Å; T40-E42 PolarHBondContact O-N 3.4Å
43	A	46.9	Very low	46.5	Very low	59 Å²	59	122.5 Å²	122.5	49%	0.488	67%	0.673	S	S	.	*	H	α-helix	trans	-75.1	-28.5	-177.2	0	0	0	0	0	113	T40 K45 S46	T40-A43 PolarHBondContact O-N 3.14Å; A43-K45 VanDerWaalsContact C-N 3.29Å; A43-K45 PolarHBondContact O-N 2.99Å; A43-S46 PolarHBondContact O-N 3.41Å
44	I	47.5	Very low	46.9	Very low	110 Å²	110	122.4 Å²	122.4	56%	0.564	67%	0.674	S	S	*	*	H	α-helix	trans	-69.3	-29	-178.9	-57.1	176.5	0	0	0	111.2	I39	I39-I44 HydrophobicContact CG2-CD1 3.66Å; I39-I44 HydrophobicContact CG2-CG1 3.61Å
45	K	45.4	Very low	47.1	Very low	184 Å²	184	127.1 Å²	127.1	80%	0.8	69%	0.689	S	S	*	*	H	α-helix	trans	-76.2	-26.6	176.2	-96.3	-178.6	174.1	178.8	0	113.6	A43 Q47	A43-K45 VanDerWaalsContact C-N 3.29Å; A43-K45 PolarHBondContact O-N 2.99Å; K45-Q47 VanDerWaalsContact C-N 3.34Å
46	S	48.1	Very low	47.4	Very low	106 Å²	106	126.8 Å²	126.8	74%	0.741	68%	0.682	S	S	*	*	H	α-helix	trans	-80.5	-14.2	-177.8	-174.5	0	0	0	0	113.7	A43	A43-S46 PolarHBondContact O-N 3.41Å
47	Q	46.2	Very low	47.7	Very low	154 Å²	154	125.4 Å²	125.4	72%	0.72	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.1	22	-177.1	-143.4	179.2	14.2	0	0	112.9	K45 E49	K45-Q47 VanDerWaalsContact C-N 3.34Å; Q47-E49 PolarHBondContact O-N 3.18Å
48	T	43.8	Very low	48.4	Very low	125 Å²	125	125.2 Å²	125.2	77%	0.767	68%	0.682	S	S	*	*			trans	-74.6	51.2	159.6	-46.2	0	0	0	0	109.2	N50	T48-N50 PolarHBondContact O-N 2.98Å
49	E	43.4	Very low	48.9	Very low	162 Å²	162	125 Å²	125	76%	0.757	68%	0.681	S	S	*	*			trans	-83.6	104.7	168.3	-148	174.4	-157.1	0	0	104.7	Q47 V51	Q47-E49 PolarHBondContact O-N 3.18Å; E49-V51 WeakPolarHBondContact O-CG2 3.42Å; E49-V51 PolarHBondContact O-N 3.43Å
50	N	42.1	Very low	49.2	Very low	149 Å²	149	123.5 Å²	123.5	80%	0.797	67%	0.674	S	S	*	*			trans	-19.7	83.6	179.3	-141.8	8.5	0	0	0	114.2	T48 T52	T48-N50 PolarHBondContact O-N 2.98Å; N50-T52 PolarHBondContact O-N 2.94Å
51	V	44.1	Very low	49.7	Very low	104 Å²	104	123.5 Å²	123.5	63%	0.63	67%	0.674	S	S	*	*			trans	-72	87.4	174.8	-178.5	0	0	0	0	106.4	E49 H53	E49-V51 WeakPolarHBondContact O-CG2 3.42Å; E49-V51 PolarHBondContact O-N 3.43Å; V51-H53 VanDerWaalsContact C-N 3.28Å; V51-H53 PolarHBondContact O-N 2.94Å
52	T	44.5	Very low	49.8	Very low	114 Å²	114	126 Å²	126	70%	0.699	67%	0.671	S	S	*	*			trans	-67.1	96.2	166.4	-54.4	0	0	0	0	105.3	N50 P54	N50-T52 PolarHBondContact O-N 2.94Å; T52-P54 WeakPolarHBondContact O-CD 3.17Å; T52-P54 VanDerWaalsContact O-N 3.12Å
53	H	51.1	Low	50.3	Low	153 Å²	153	124.6 Å²	124.6	71%	0.708	66%	0.663	S	S	*	*			trans	-60.5	115.4	173.1	-69.8	-73.4	0	0	0	107.6	V51 M55	V51-H53 VanDerWaalsContact C-N 3.28Å; V51-H53 PolarHBondContact O-N 2.94Å; H53-M55 PolarHBondContact O-N 3.46Å; H53-M55 VanDerWaalsContact O-N 3.11Å
54	P	54.1	Low	50.9	Low	106 Å²	106	125.8 Å²	125.8	69%	0.688	66%	0.66	S	S	*	*			trans	-59.1	123.2	166	24.9	-30.1	0	0	0	106.1	T52 L56	T52-P54 WeakPolarHBondContact O-CD 3.17Å; T52-P54 VanDerWaalsContact O-N 3.12Å; P54-L56 VanDerWaalsContact C-N 3.34Å; P54-L56 PolarHBondContact O-N 3.35Å
55	M	51	Low	51.4	Low	191 Å²	191	122.1 Å²	122.1	94%	0.941	65%	0.65	S	S	*	*			trans	-55.8	100.4	178	-150.7	165.5	90.7	0	0	106.8	H53 A57	H53-M55 PolarHBondContact O-N 3.46Å; H53-M55 VanDerWaalsContact O-N 3.11Å; M55-A57 PolarHBondContact O-N 3.05Å
56	L	53.8	Low	52	Low	106 Å²	106	117.9 Å²	117.9	56%	0.555	64%	0.636	S	S	*	*			trans	-58.7	113.4	-177.4	-76.8	172.1	0	0	0	107.1	P54 D60	P54-L56 VanDerWaalsContact C-N 3.34Å; P54-L56 PolarHBondContact O-N 3.35Å; L56-D60 HydrophobicContact CB-CB 4.48Å; L56-D60 HydrophobicContact CD2-CB 3.93Å
57	A	54.4	Low	52.6	Low	56 Å²	56	117.5 Å²	117.5	46%	0.463	62%	0.622	S	S	.	*			trans	-61.1	148	176.3	0	0	0	0	0	108	M55 Q59 D60	M55-A57 PolarHBondContact O-N 3.05Å; A57-Q59 PolarHBondContact O-N 3.31Å; A57-D60 WeakPolarHBondContact O-CB 3.45Å; A57-D60 PolarHBondContact O-N 3.49Å
58	V	57.3	Low	53.1	Low	114 Å²	114	113.4 Å²	113.4	69%	0.691	61%	0.608	S	S	*	*	H	α-helix	trans	-50.8	-26.8	179.7	176.2	0	0	0	0	112.4	V61 Y62	V58-V61 PolarHBondContact O-N 3.45Å; V58-Y62 HydrophobicContact CG1-CD2 4.46Å; V58-Y62 PolarHBondContact O-N 3.08Å
59	Q	57.1	Low	53.8	Low	165 Å²	165	114.2 Å²	114.2	77%	0.771	60%	0.601	S	S	*	*	H	α-helix	trans	-67.8	-35.2	176.3	-141	166.1	37.6	0	0	113.5	A57 Y62 K63	A57-Q59 PolarHBondContact O-N 3.31Å; Q59-Y62 PolarHBondContact O-N 3.16Å; Q59-K63 PolarHBondContact O-N 3.01Å; Q59-K63 VanDerWaalsContact O-N 3.09Å
60	D	55.4	Low	54.5	Low	70 Å²	70	116.3 Å²	116.3	37%	0.374	60%	0.602	S	S	.	*	H	α-helix	trans	-69.4	-37.5	175.9	-68.2	-39.4	0	0	0	111.2	L56 A57 Y62 K63 I64	L56-D60 HydrophobicContact CB-CB 4.48Å; L56-D60 HydrophobicContact CD2-CB 3.93Å; A57-D60 WeakPolarHBondContact O-CB 3.45Å; A57-D60 PolarHBondContact O-N 3.49Å; D60-Y62 VanDerWaalsContact C-N 3.31Å; D60-Y62 PolarHBondContact O-N 3.47Å; D60-K63 PolarHBondContact O-N 2.99Å; D60-I64 WeakPolarHBondContact O-CB 3.34Å; D60-I64 WeakPolarHBondContact O-CD1 3.43Å; D60-I64 WeakPolarHBondContact O-CG1 3.34Å; D60-I64 PolarHBondContact O-N 3.29Å
61	V	57.1	Low	55.3	Low	86 Å²	86	116.5 Å²	116.5	52%	0.521	60%	0.595	S	S	.	*	H	α-helix	trans	-61.8	-40.8	174.8	-177.4	0	0	0	0	111	V58 G65	V58-V61 PolarHBondContact O-N 3.45Å; V61-G65 PolarHBondContact O-N 3.27Å
62	Y	55.4	Low	55.9	Low	169 Å²	169	116.9 Å²	116.9	66%	0.663	59%	0.593	S	S	*	*	H	α-helix	trans	-65.1	-40.7	175.2	-102.9	-82.9	0	0	0	112.6	V58 Q59 D60 G65 N66	V58-Y62 HydrophobicContact CG1-CD2 4.46Å; V58-Y62 PolarHBondContact O-N 3.08Å; Q59-Y62 PolarHBondContact O-N 3.16Å; D60-Y62 VanDerWaalsContact C-N 3.31Å; D60-Y62 PolarHBondContact O-N 3.47Å; Y62-G65 PolarHBondContact O-N 3.3Å; Y62-N66 PolarHBondContact O-N 3.44Å
63	K	57.9	Low	56.6	Low	133 Å²	133	115.3 Å²	115.3	58%	0.578	58%	0.583	S	S	*	*	H	α-helix	trans	-64.7	-46.7	177.2	-167.6	179.2	175.8	-171.6	0	111.1	Q59 D60 G65 N66 E67	Q59-K63 PolarHBondContact O-N 3.01Å; Q59-K63 VanDerWaalsContact O-N 3.09Å; D60-K63 PolarHBondContact O-N 2.99Å; K63-G65 VanDerWaalsContact C-N 3.32Å; K63-G65 PolarHBondContact O-N 2.92Å; K63-N66 PolarHBondContact O-N 3.37Å; K63-E67 WeakPolarHBondContact CE-OE1 3.35Å; K63-E67 WeakPolarHBondContact O-CG 3.31Å; K63-E67 PolarHBondContact O-N 3.47Å
64	I	59.9	Low	56.8	Low	85 Å²	85	115 Å²	115	44%	0.436	58%	0.577	S	S	.	*	H	α-helix	trans	-60.7	-42	175.2	-66.1	163.3	0	0	0	110.8	D60 N66 E67 T68	D60-I64 WeakPolarHBondContact O-CB 3.34Å; D60-I64 WeakPolarHBondContact O-CD1 3.43Å; D60-I64 WeakPolarHBondContact O-CG1 3.34Å; D60-I64 PolarHBondContact O-N 3.29Å; I64-N66 PolarHBondContact O-N 2.86Å; I64-E67 PolarHBondContact O-N 2.96Å; I64-T68 VanDerWaalsContact O-CB 3.27Å; I64-T68 WeakPolarHBondContact O-CB 3.41Å; I64-T68 PolarHBondContact O-N 2.89Å; I64-T68 PolarHBondContact O-OG1 2.99Å
65	G	56.4	Low	56.8	Low	33 Å²	33	113.2 Å²	113.2	34%	0.34	57%	0.567	S	S	.	*	H	α-helix	trans	-61.7	-42.4	177.3	0	0	0	0	0	112.8	V61 Y62 K63 K69	V61-G65 PolarHBondContact O-N 3.27Å; Y62-G65 PolarHBondContact O-N 3.3Å; K63-G65 VanDerWaalsContact C-N 3.32Å; K63-G65 PolarHBondContact O-N 2.92Å; G65-K69 WeakPolarHBondContact O-CG 3.36Å; G65-K69 PolarHBondContact O-N 3.39Å
66	N	58.7	Low	57.1	Low	95 Å²	95	110.7 Å²	110.7	51%	0.508	55%	0.552	S	S	.	*	H	α-helix	trans	-71.5	-39	178.1	-80.6	-14.4	0	0	0	112.7	Y62 K63 I64 T68 K69 R70	Y62-N66 PolarHBondContact O-N 3.44Å; K63-N66 PolarHBondContact O-N 3.37Å; I64-N66 PolarHBondContact O-N 2.86Å; N66-T68 VanDerWaalsContact C-N 3.35Å; N66-K69 PolarHBondContact O-N 3.43Å; N66-R70 PolarHBondContact O-N 2.87Å
67	E	60.1	Low	57.3	Low	97 Å²	97	109.6 Å²	109.6	45%	0.453	55%	0.545	S	S	.	.	H	α-helix	trans	-65.6	-40.3	174.9	-72.6	177.3	-168.7	0	0	111.4	K63 I64 R70 K71	K63-E67 WeakPolarHBondContact CE-OE1 3.35Å; K63-E67 WeakPolarHBondContact O-CG 3.31Å; K63-E67 PolarHBondContact O-N 3.47Å; I64-E67 PolarHBondContact O-N 2.96Å; E67-R70 PolarHBondContact O-N 3.43Å; E67-K71 PolarHBondContact O-N 3.23Å
68	T	58.2	Low	57.5	Low	69 Å²	69	110.7 Å²	110.7	42%	0.423	54%	0.542	S	S	.	.	H	α-helix	trans	-64.8	-41.8	175.6	-55.4	0	0	0	0	111	I64 N66 R70 K71 L72	I64-T68 VanDerWaalsContact O-CB 3.27Å; I64-T68 WeakPolarHBondContact O-CB 3.41Å; I64-T68 PolarHBondContact O-N 2.89Å; I64-T68 PolarHBondContact O-OG1 2.99Å; N66-T68 VanDerWaalsContact C-N 3.35Å; T68-R70 PolarHBondContact O-N 2.95Å; T68-K71 PolarHBondContact O-N 2.89Å; T68-L72 HydrophobicContact CG2-CD1 4.01Å; T68-L72 HydrophobicContact CG2-CG 4.43Å; T68-L72 WeakPolarHBondContact O-CB 3.49Å; T68-L72 WeakPolarHBondContact O-CG 3Å; T68-L72 PolarHBondContact O-N 3.39Å
69	K	58	Low	57.4	Low	142 Å²	142	110.2 Å²	110.2	62%	0.617	54%	0.536	S	S	*	.	H	α-helix	trans	-59.7	-45.7	172.3	-78.5	-179.2	-179.9	-178.7	0	112.1	G65 N66 K71 L72 T73	G65-K69 WeakPolarHBondContact O-CG 3.36Å; G65-K69 PolarHBondContact O-N 3.39Å; N66-K69 PolarHBondContact O-N 3.43Å; K69-K71 PolarHBondContact O-N 2.95Å; K69-L72 PolarHBondContact O-N 3.05Å; K69-T73 PolarHBondContact O-N 3.49Å; K69-T73 PolarHBondContact O-OG1 3.44Å
70	R	57.9	Low	57.6	Low	206 Å²	206	109.1 Å²	109.1	78%	0.777	53%	0.529	S	S	*	.	H	α-helix	trans	-62.4	-42	177.7	-73	-175.6	95.4	-174	7.6	112.1	N66 E67 T68 T73 Y74	N66-R70 PolarHBondContact O-N 2.87Å; E67-R70 PolarHBondContact O-N 3.43Å; T68-R70 PolarHBondContact O-N 2.95Å; R70-T73 PolarHBondContact O-N 3.13Å; R70-Y74 WeakPolarHBondContact O-CB 3.44Å; R70-Y74 PolarHBondContact O-N 3.08Å
71	K	58.2	Low	57.6	Low	152 Å²	152	111.6 Å²	111.6	66%	0.661	53%	0.533	S	S	*	.	H	α-helix	trans	-64.9	-42	176.4	-75.9	-177.3	179	177.8	0	111.8	E67 T68 K69 Y74 C75	E67-K71 PolarHBondContact O-N 3.23Å; T68-K71 PolarHBondContact O-N 2.89Å; K69-K71 PolarHBondContact O-N 2.95Å; K71-Y74 PolarHBondContact O-N 3.02Å; K71-C75 PolarHBondContact O-N 3.36Å; K71-C75 PolarHBondContact O-SG 3.14Å
72	L	57.9	Low	57.3	Low	112 Å²	112	112.9 Å²	112.9	59%	0.586	53%	0.534	S	S	*	.	H	α-helix	trans	-64.9	-41.1	175.8	-73.3	170.3	0	0	0	112	T68 K69 Y74 C75 H76	T68-L72 HydrophobicContact CG2-CD1 4.01Å; T68-L72 HydrophobicContact CG2-CG 4.43Å; T68-L72 WeakPolarHBondContact O-CB 3.49Å; T68-L72 WeakPolarHBondContact O-CG 3Å; T68-L72 PolarHBondContact O-N 3.39Å; K69-L72 PolarHBondContact O-N 3.05Å; L72-Y74 VanDerWaalsContact C-N 3.33Å; L72-Y74 PolarHBondContact O-N 3.36Å; L72-C75 PolarHBondContact O-N 3.31Å; L72-H76 VanDerWaalsContact O-CB 3.31Å; L72-H76 WeakPolarHBondContact O-CB 3.39Å; L72-H76 PolarHBondContact O-N 2.93Å
73	T	58.3	Low	57.2	Low	81 Å²	81	113 Å²	113	50%	0.497	54%	0.54	S	S	.	.	H	α-helix	trans	-62.8	-40.5	173.8	-52.7	0	0	0	0	111.4	K69 R70 H76 M77	K69-T73 PolarHBondContact O-N 3.49Å; K69-T73 PolarHBondContact O-OG1 3.44Å; R70-T73 PolarHBondContact O-N 3.13Å; T73-H76 PolarHBondContact O-N 3.47Å; T73-M77 HydrophobicContact CG2-CE 4.47Å; T73-M77 WeakPolarHBondContact O-CG 3.48Å; T73-M77 PolarHBondContact O-N 3.39Å
74	Y	55.5	Low	57	Low	148 Å²	148	112.6 Å²	112.6	58%	0.58	54%	0.544	S	S	*	.	H	α-helix	trans	-66	-45.3	177.4	-168.8	-103.9	0	0	0	112.1	R70 K71 L72 H76 M77 I78	R70-Y74 WeakPolarHBondContact O-CB 3.44Å; R70-Y74 PolarHBondContact O-N 3.08Å; K71-Y74 PolarHBondContact O-N 3.02Å; L72-Y74 VanDerWaalsContact C-N 3.33Å; L72-Y74 PolarHBondContact O-N 3.36Å; Y74-H76 VanDerWaalsContact C-N 3.33Å; Y74-H76 PolarHBondContact O-N 3.3Å; Y74-M77 HydrophobicContact CD2-CE 4.08Å; Y74-M77 PolarHBondContact O-N 3.17Å; Y74-I78 HydrophobicContact CD1-CD1 3.58Å; Y74-I78 HydrophobicContact CD1-CG1 4.44Å; Y74-I78 HydrophobicContact CE1-CD1 3.2Å; Y74-I78 HydrophobicContact CE1-CG1 4.22Å; Y74-I78 HydrophobicContact CG-CD1 4.44Å; Y74-I78 WeakPolarHBondContact O-CG1 3.5Å; Y74-I78 PolarHBondContact O-N 3.48Å
75	C	54.8	Low	56.6	Low	68 Å²	68	117 Å²	117	46%	0.459	56%	0.56	S	S	.	*	H	α-helix	trans	-62.9	-37.5	173.6	-72.9	0	0	0	0	112.3	K71 L72 I78 N79	K71-C75 PolarHBondContact O-N 3.36Å; K71-C75 PolarHBondContact O-SG 3.14Å; L72-C75 PolarHBondContact O-N 3.31Å; C75-I78 PolarHBondContact O-N 3.27Å; C75-N79 PolarHBondContact O-N 3.02Å; C75-N79 PolarHBondContact O-ND2 3.25Å
76	H	56.7	Low	56.6	Low	137 Å²	137	121 Å²	121	63%	0.634	58%	0.577	S	S	*	*	H	α-helix	trans	-67.9	-39	176.7	-168.5	82.9	0	0	0	111.9	L72 T73 Y74 K80	L72-H76 VanDerWaalsContact O-CB 3.31Å; L72-H76 WeakPolarHBondContact O-CB 3.39Å; L72-H76 PolarHBondContact O-N 2.93Å; T73-H76 PolarHBondContact O-N 3.47Å; Y74-H76 VanDerWaalsContact C-N 3.33Å; Y74-H76 PolarHBondContact O-N 3.3Å; H76-K80 WeakPolarHBondContact O-CB 3.4Å; H76-K80 PolarHBondContact O-N 2.88Å
77	M	58.1	Low	56.1	Low	84 Å²	84	125.5 Å²	125.5	41%	0.414	60%	0.595	S	S	.	*	H	α-helix	trans	-63.3	-47.7	172.3	-72	-172.7	-59.7	0	0	111.1	T73 Y74 N79 K80 Y81	T73-M77 HydrophobicContact CG2-CE 4.47Å; T73-M77 WeakPolarHBondContact O-CG 3.48Å; T73-M77 PolarHBondContact O-N 3.39Å; Y74-M77 HydrophobicContact CD2-CE 4.08Å; Y74-M77 PolarHBondContact O-N 3.17Å; M77-N79 PolarHBondContact O-N 3.36Å; M77-K80 WeakPolarHBondContact O-CB 3.47Å; M77-K80 PolarHBondContact O-N 3.37Å; M77-K80 VanDerWaalsContact O-N 3.14Å; M77-Y81 HydrophobicContact CB-CD2 4.34Å; M77-Y81 HydrophobicContact CB-CE2 4.27Å; M77-Y81 WeakPolarHBondContact O-CD2 3.02Å; M77-Y81 PolarHBondContact O-N 3.31Å
78	I	57.9	Low	55.3	Low	79 Å²	79	132.7 Å²	132.7	41%	0.405	63%	0.628	S	S	.	*	H	α-helix	trans	-58.5	-47	178.8	-70.4	172.5	0	0	0	110.9	Y74 C75 K80 Y81 Q82	Y74-I78 HydrophobicContact CD1-CD1 3.58Å; Y74-I78 HydrophobicContact CD1-CG1 4.44Å; Y74-I78 HydrophobicContact CE1-CD1 3.2Å; Y74-I78 HydrophobicContact CE1-CG1 4.22Å; Y74-I78 HydrophobicContact CG-CD1 4.44Å; Y74-I78 WeakPolarHBondContact O-CG1 3.5Å; Y74-I78 PolarHBondContact O-N 3.48Å; C75-I78 PolarHBondContact O-N 3.27Å; I78-K80 VanDerWaalsContact C-N 3.32Å; I78-K80 PolarHBondContact O-N 3.37Å; I78-Y81 CarbonylContact O-C 3.55Å; I78-Y81 PolarHBondContact O-N 2.87Å; I78-Q82 WeakPolarHBondContact O-CB 3.46Å; I78-Q82 PolarHBondContact O-N 3.04Å
79	N	56.8	Low	55.1	Low	104 Å²	104	135.9 Å²	135.9	56%	0.556	64%	0.639	S	S	*	*	H	α-helix	trans	-62.7	-38.4	177.3	-80.3	-74.5	0	0	0	112.2	C75 M77 Y81 Q82	C75-N79 PolarHBondContact O-N 3.02Å; C75-N79 PolarHBondContact O-ND2 3.25Å; M77-N79 PolarHBondContact O-N 3.36Å; N79-Y81 VanDerWaalsContact C-N 3.32Å; N79-Y81 PolarHBondContact O-N 2.94Å; N79-Q82 PolarHBondContact O-N 3.48Å
80	K	60	Low	55	Low	142 Å²	142	135.6 Å²	135.6	62%	0.617	64%	0.64	S	S	*	*	H	α-helix	trans	-64.5	-34.8	175.6	-171.6	178.7	-178.7	-178.3	0	112.8	H76 M77 I78	H76-K80 WeakPolarHBondContact O-CB 3.4Å; H76-K80 PolarHBondContact O-N 2.88Å; M77-K80 WeakPolarHBondContact O-CB 3.47Å; M77-K80 PolarHBondContact O-N 3.37Å; M77-K80 VanDerWaalsContact O-N 3.14Å; I78-K80 VanDerWaalsContact C-N 3.32Å; I78-K80 PolarHBondContact O-N 3.37Å
81	Y	55.4	Low	54.8	Low	121 Å²	121	131.7 Å²	131.7	48%	0.475	63%	0.632	S	S	.	*	H	α-helix	trans	-91.2	-11.7	178.9	-66.9	-68	0	0	0	113.8	M77 I78 N79 H83 L84 F85	M77-Y81 HydrophobicContact CB-CD2 4.34Å; M77-Y81 HydrophobicContact CB-CE2 4.27Å; M77-Y81 WeakPolarHBondContact O-CD2 3.02Å; M77-Y81 PolarHBondContact O-N 3.31Å; I78-Y81 CarbonylContact O-C 3.55Å; I78-Y81 PolarHBondContact O-N 2.87Å; N79-Y81 VanDerWaalsContact C-N 3.32Å; N79-Y81 PolarHBondContact O-N 2.94Å; Y81-H83 PolarHBondContact O-N 3.42Å; Y81-L84 HydrophobicContact CD1-CD2 4.41Å; Y81-L84 WeakPolarHBondContact O-CB 3.28Å; Y81-L84 PolarHBondContact O-N 2.96Å; Y81-F85 WeakPolarHBondContact O-CD2 3.36Å
82	Q	52.2	Low	54.6	Low	114 Å²	114	130.5 Å²	130.5	53%	0.533	63%	0.63	S	S	.	*	H	α-helix	trans	-61.3	-30.9	178.9	-159.5	167.5	1.3	0	0	111.6	I78 N79 L84 F85 V86	I78-Q82 WeakPolarHBondContact O-CB 3.46Å; I78-Q82 PolarHBondContact O-N 3.04Å; N79-Q82 PolarHBondContact O-N 3.48Å; Q82-L84 VanDerWaalsContact C-N 3.29Å; Q82-L84 PolarHBondContact O-N 3.25Å; Q82-F85 PolarHBondContact O-N 3.48Å; Q82-V86 WeakPolarHBondContact O-CG2 3.4Å
83	H	52	Low	54.4	Low	170 Å²	170	131.6 Å²	131.6	79%	0.787	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	-15.4	172.7	-161.3	-71.1	0	0	0	113.9	Y81	Y81-H83 PolarHBondContact O-N 3.42Å
84	L	53.1	Low	54.2	Low	126 Å²	126	135 Å²	135	66%	0.66	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-14.2	177	-96	81.8	0	0	0	113.7	Y81 Q82	Y81-L84 HydrophobicContact CD1-CD2 4.41Å; Y81-L84 WeakPolarHBondContact O-CB 3.28Å; Y81-L84 PolarHBondContact O-N 2.96Å; Q82-L84 VanDerWaalsContact C-N 3.29Å; Q82-L84 PolarHBondContact O-N 3.25Å
85	F	53	Low	54.1	Low	176 Å²	176	134.1 Å²	134.1	77%	0.772	65%	0.647	S	S	*	*	S	Bend	trans	-107.4	5.9	-175.4	-72.2	-80.1	0	0	0	114.6	Y81 Q82	Y81-F85 WeakPolarHBondContact O-CD2 3.36Å; Q82-F85 PolarHBondContact O-N 3.48Å
86	V	56.7	Low	54	Low	117 Å²	117	139.2 Å²	139.2	71%	0.709	66%	0.661	S	S	*	*	S	Bend	trans	-95.4	17	-176.4	-176.1	0	0	0	0	112.7	Q82	Q82-V86 WeakPolarHBondContact O-CG2 3.4Å
87	H	46.9	Very low	53.8	Low	190 Å²	190	139.3 Å²	139.3	88%	0.88	66%	0.663	S	S	*	*			trans	-127.8	32	-173.1	-124	-73.8	0	0	0	115.8
88	H	43.3	Very low	53.4	Low	249 Å²	249	144.4 Å²	144.4	100%	1.153	69%	0.686	S	S	*	*			trans	-104	0	171.2	-156.8	-58.5	0	0	0	112.3

Retrieved 88 of 88 residues in 22.3 ms (Link to these results)

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