A0A077Z4D9_TRITR Loading...

Coatomer subunit beta

AlphaFold DB , UniProt , Accession A0A077Z4D9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 98 aa.

						>A0A077Z4D9_TRITR|A0A077Z4D9
MEQDLKSQINDSEAELASLDQQLQLLNERRIALMHDIEKKKEALRNLESSISTAEVSFQKLVESSDSLIAYMKKETSEVRKFIRETREHLKEDENSGG
					

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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	80.3	Confident	95	Very high	185 Å²	185	109.5 Å²	109.5	91%	0.911	55%	0.55	S	S	*	*				0	-56.4	0	-161.2	173.1	-175.3	0	0	111.4	Q3 D4 L5	M1-Q3 PolarHBondContact O-N 2.66Å; M1-D4 PolarHBondContact O-N 2.92Å; M1-L5 HydrophobicContact CG-CD1 4.37Å; M1-L5 PolarHBondContact O-N 3.45Å
2	E	93.6	Very high	95.3	Very high	132 Å²	132	106.4 Å²	106.4	62%	0.617	55%	0.546	S	S	*	.	H	α-helix	trans	-58.6	-46	178.7	-171.5	-172.3	160.8	0	0	113.6	D4 L5 K6	E2-D4 VanDerWaalsContact C-N 3.32Å; E2-D4 PolarHBondContact O-N 3.32Å; E2-L5 PolarHBondContact O-N 3.43Å; E2-K6 HydrophobicContact CG-CD 4.48Å; E2-K6 WeakPolarHBondContact O-CG 3.22Å; E2-K6 PolarHBondContact O-N 3.43Å; E2-K6 VanDerWaalsContact OE1-CE 3.22Å; E2-K6 WeakPolarHBondContact OE1-CE 3.24Å; E2-K6 IonicContact OE1-NZ 3.64Å; E2-K6 PolarHBondContact OE1-NZ 3.45Å
3	Q	94	Very high	95.5	Very high	168 Å²	168	107.3 Å²	107.3	79%	0.785	55%	0.547	S	S	*	.	H	α-helix	trans	-63.6	-37.1	178.2	-174.8	-179.7	-5.1	0	0	112.8	M1 K6 S7	M1-Q3 PolarHBondContact O-N 2.66Å; Q3-K6 PolarHBondContact O-N 3.15Å; Q3-S7 PolarHBondContact O-N 3.37Å
4	D	96	Very high	95.7	Very high	93 Å²	93	104.1 Å²	104.1	50%	0.497	55%	0.545	S	S	.	.	H	α-helix	trans	-67.9	-45.8	178.4	179.3	39.3	0	0	0	110.9	M1 E2 K6 S7 Q8	M1-D4 PolarHBondContact O-N 2.92Å; E2-D4 VanDerWaalsContact C-N 3.32Å; E2-D4 PolarHBondContact O-N 3.32Å; D4-K6 PolarHBondContact O-N 3.01Å; D4-S7 WeakPolarHBondContact O-CB 3.48Å; D4-S7 PolarHBondContact O-N 2.95Å; D4-S7 VanDerWaalsContact O-N 3.15Å; D4-Q8 WeakPolarHBondContact O-CG 3.42Å; D4-Q8 PolarHBondContact O-N 3.43Å; D4-Q8 PolarHBondContact OD1-NE2 2.79Å; D4-Q8 PolarHBondContact OD2-NE2 3.15Å; D4-Q8 VanDerWaalsContact OD2-NE2 3.15Å
5	L	96.6	Very high	95.9	Very high	82 Å²	82	105.9 Å²	105.9	43%	0.429	55%	0.549	S	S	.	.	H	α-helix	trans	-60.4	-42.4	172.9	-71.5	172.1	0	0	0	112.4	M1 E2 S7 Q8 I9	M1-L5 HydrophobicContact CG-CD1 4.37Å; M1-L5 PolarHBondContact O-N 3.45Å; E2-L5 PolarHBondContact O-N 3.43Å; L5-S7 VanDerWaalsContact C-N 3.31Å; L5-S7 PolarHBondContact O-N 2.99Å; L5-Q8 PolarHBondContact O-N 3.43Å; L5-I9 WeakPolarHBondContact O-CB 3.4Å; L5-I9 VanDerWaalsContact O-CG1 3.24Å; L5-I9 WeakPolarHBondContact O-CG1 3.4Å; L5-I9 PolarHBondContact O-N 3.25Å
6	K	97	Very high	96	Very high	111 Å²	111	105.6 Å²	105.6	48%	0.483	55%	0.548	S	S	.	.	H	α-helix	trans	-60.6	-40.6	174.7	-75.8	178.5	-176	171.1	0	111.8	E2 Q3 D4 I9 N10	E2-K6 HydrophobicContact CG-CD 4.48Å; E2-K6 WeakPolarHBondContact O-CG 3.22Å; E2-K6 PolarHBondContact O-N 3.43Å; E2-K6 VanDerWaalsContact OE1-CE 3.22Å; E2-K6 WeakPolarHBondContact OE1-CE 3.24Å; E2-K6 IonicContact OE1-NZ 3.64Å; E2-K6 PolarHBondContact OE1-NZ 3.45Å; Q3-K6 PolarHBondContact O-N 3.15Å; D4-K6 PolarHBondContact O-N 3.01Å; K6-I9 PolarHBondContact O-N 2.97Å; K6-N10 WeakPolarHBondContact O-CB 3.36Å; K6-N10 PolarHBondContact O-N 2.96Å; K6-N10 PolarHBondContact O-ND2 3.35Å; K6-N10 PolarHBondContact O-OD1 3.49Å
7	S	96.9	Very high	96.1	Very high	55 Å²	55	102.9 Å²	102.9	39%	0.385	55%	0.545	S	S	.	.	H	α-helix	trans	-61.9	-49.5	175.4	-163.2	0	0	0	0	111.3	Q3 D4 L5 I9 N10 D11	Q3-S7 PolarHBondContact O-N 3.37Å; D4-S7 WeakPolarHBondContact O-CB 3.48Å; D4-S7 PolarHBondContact O-N 2.95Å; D4-S7 VanDerWaalsContact O-N 3.15Å; L5-S7 VanDerWaalsContact C-N 3.31Å; L5-S7 PolarHBondContact O-N 2.99Å; S7-I9 VanDerWaalsContact C-N 3.31Å; S7-I9 PolarHBondContact O-N 3.03Å; S7-N10 WeakPolarHBondContact O-CB 3.5Å; S7-N10 PolarHBondContact O-N 3.15Å; S7-N10 VanDerWaalsContact O-N 3.15Å; S7-D11 PolarHBondContact O-N 3.42Å
8	Q	97.5	Very high	96.3	Very high	92 Å²	92	100.2 Å²	100.2	43%	0.43	54%	0.535	S	S	.	.	H	α-helix	trans	-63	-36.2	-179.9	-68.2	171.8	35.1	0	0	112.8	D4 L5 S12	D4-Q8 WeakPolarHBondContact O-CG 3.42Å; D4-Q8 PolarHBondContact O-N 3.43Å; D4-Q8 PolarHBondContact OD1-NE2 2.79Å; D4-Q8 PolarHBondContact OD2-NE2 3.15Å; D4-Q8 VanDerWaalsContact OD2-NE2 3.15Å; L5-Q8 PolarHBondContact O-N 3.43Å; Q8-S12 WeakPolarHBondContact O-CB 3.36Å; Q8-S12 PolarHBondContact O-N 3.16Å; Q8-S12 PolarHBondContact O-OG 3.36Å
9	I	97.9	Very high	96.4	Very high	91 Å²	91	99.1 Å²	99.1	47%	0.467	53%	0.529	S	S	.	.	H	α-helix	trans	-63	-50.5	172.9	-70.8	165	0	0	0	109.8	L5 K6 S7 D11 S12 E13	L5-I9 WeakPolarHBondContact O-CB 3.4Å; L5-I9 VanDerWaalsContact O-CG1 3.24Å; L5-I9 WeakPolarHBondContact O-CG1 3.4Å; L5-I9 PolarHBondContact O-N 3.25Å; K6-I9 PolarHBondContact O-N 2.97Å; S7-I9 VanDerWaalsContact C-N 3.31Å; S7-I9 PolarHBondContact O-N 3.03Å; I9-D11 VanDerWaalsContact C-N 3.29Å; I9-D11 PolarHBondContact O-N 2.84Å; I9-S12 PolarHBondContact O-N 2.98Å; I9-S12 VanDerWaalsContact O-N 3.16Å; I9-E13 HydrophobicContact CG2-CG 4.3Å; I9-E13 WeakPolarHBondContact O-CG 3.4Å; I9-E13 PolarHBondContact O-N 2.87Å
10	N	97.6	Very high	96.5	Very high	95 Å²	95	98.8 Å²	98.8	51%	0.508	53%	0.527	S	S	.	.	H	α-helix	trans	-60.2	-40	179	-66.5	-14.6	0	0	0	111.9	K6 S7 E13 A14	K6-N10 WeakPolarHBondContact O-CB 3.36Å; K6-N10 PolarHBondContact O-N 2.96Å; K6-N10 PolarHBondContact O-ND2 3.35Å; K6-N10 PolarHBondContact O-OD1 3.49Å; S7-N10 WeakPolarHBondContact O-CB 3.5Å; S7-N10 PolarHBondContact O-N 3.15Å; S7-N10 VanDerWaalsContact O-N 3.15Å; N10-E13 PolarHBondContact O-N 3.37Å; N10-A14 WeakPolarHBondContact O-CB 3.5Å; N10-A14 PolarHBondContact O-N 3.47Å
11	D	98	Very high	96.6	Very high	101 Å²	101	99.8 Å²	99.8	54%	0.54	53%	0.529	S	S	.	.	H	α-helix	trans	-64.4	-42.5	177.1	-65.9	-26.9	0	0	0	111	S7 I9 A14 E15	S7-D11 PolarHBondContact O-N 3.42Å; I9-D11 VanDerWaalsContact C-N 3.29Å; I9-D11 PolarHBondContact O-N 2.84Å; D11-A14 PolarHBondContact O-N 2.9Å; D11-E15 PolarHBondContact O-N 3.4Å
12	S	97.9	Very high	97.5	Very high	72 Å²	72	95.8 Å²	95.8	50%	0.503	51%	0.508	S	S	.	.	H	α-helix	trans	-67	-39.6	176.5	-56.8	0	0	0	0	112.3	Q8 I9 A14 E15 L16	Q8-S12 WeakPolarHBondContact O-CB 3.36Å; Q8-S12 PolarHBondContact O-N 3.16Å; Q8-S12 PolarHBondContact O-OG 3.36Å; I9-S12 PolarHBondContact O-N 2.98Å; I9-S12 VanDerWaalsContact O-N 3.16Å; S12-A14 VanDerWaalsContact C-N 3.34Å; S12-E15 PolarHBondContact O-N 2.96Å; S12-L16 WeakPolarHBondContact O-CB 3.42Å; S12-L16 PolarHBondContact O-N 3.38Å
13	E	98.2	Very high	97.7	Very high	118 Å²	118	94.7 Å²	94.7	55%	0.551	51%	0.506	S	S	*	.	H	α-helix	trans	-64.1	-39.5	175.4	-74.6	178.5	167.8	0	0	111.4	I9 N10 A17	I9-E13 HydrophobicContact CG2-CG 4.3Å; I9-E13 WeakPolarHBondContact O-CG 3.4Å; I9-E13 PolarHBondContact O-N 2.87Å; N10-E13 PolarHBondContact O-N 3.37Å; E13-A17 WeakPolarHBondContact O-CB 3.41Å; E13-A17 PolarHBondContact O-N 3.47Å
14	A	98.1	Very high	97.9	Very high	63 Å²	63	92.2 Å²	92.2	52%	0.521	49%	0.494	S	S	.	.	H	α-helix	trans	-67.3	-41.5	175.3	0	0	0	0	0	112.2	N10 D11 S12 A17 S18	N10-A14 WeakPolarHBondContact O-CB 3.5Å; N10-A14 PolarHBondContact O-N 3.47Å; D11-A14 PolarHBondContact O-N 2.9Å; S12-A14 VanDerWaalsContact C-N 3.34Å; A14-A17 PolarHBondContact O-N 3.01Å; A14-S18 PolarHBondContact O-N 2.99Å
15	E	98.3	Very high	98	Very high	131 Å²	131	92.3 Å²	92.3	61%	0.612	49%	0.494	S	S	*	.	H	α-helix	trans	-62.9	-44.9	174.7	-174.1	175.8	-172.6	0	0	111.3	D11 S12 A17 S18 L19	D11-E15 PolarHBondContact O-N 3.4Å; S12-E15 PolarHBondContact O-N 2.96Å; E15-A17 PolarHBondContact O-N 2.97Å; E15-S18 WeakPolarHBondContact O-CB 3.45Å; E15-S18 PolarHBondContact O-N 2.88Å; E15-L19 HydrophobicContact CG-CD1 4.27Å; E15-L19 WeakPolarHBondContact O-CG 3.37Å; E15-L19 PolarHBondContact O-N 3.17Å
16	L	98.3	Very high	98.1	Very high	101 Å²	101	93.4 Å²	93.4	53%	0.529	50%	0.5	S	S	.	.	H	α-helix	trans	-59	-47.4	176.7	-178.5	62.5	0	0	0	111.6	S12 S18 L19 D20	S12-L16 WeakPolarHBondContact O-CB 3.42Å; S12-L16 PolarHBondContact O-N 3.38Å; L16-S18 VanDerWaalsContact C-N 3.28Å; L16-S18 PolarHBondContact O-N 3.21Å; L16-L19 PolarHBondContact O-N 2.93Å; L16-D20 PolarHBondContact O-N 3.17Å
17	A	98.2	Very high	98.2	Very high	60 Å²	60	91.1 Å²	91.1	50%	0.496	49%	0.493	S	S	.	.	H	α-helix	trans	-60.8	-37	177	0	0	0	0	0	112.5	E13 A14 E15 Q21	E13-A17 WeakPolarHBondContact O-CB 3.41Å; E13-A17 PolarHBondContact O-N 3.47Å; A14-A17 PolarHBondContact O-N 3.01Å; E15-A17 PolarHBondContact O-N 2.97Å; A17-Q21 PolarHBondContact O-N 3.35Å; A17-Q21 VanDerWaalsContact O-N 3.11Å
18	S	98.5	Very high	98.3	Very high	53 Å²	53	93.2 Å²	93.2	37%	0.371	50%	0.497	S	S	.	.	H	α-helix	trans	-66.2	-43	174.9	-172	0	0	0	0	112.2	A14 E15 L16 Q21 Q22	A14-S18 PolarHBondContact O-N 2.99Å; E15-S18 WeakPolarHBondContact O-CB 3.45Å; E15-S18 PolarHBondContact O-N 2.88Å; L16-S18 VanDerWaalsContact C-N 3.28Å; L16-S18 PolarHBondContact O-N 3.21Å; S18-Q21 PolarHBondContact O-N 3.45Å; S18-Q22 WeakPolarHBondContact O-CG 3.38Å; S18-Q22 PolarHBondContact O-N 2.9Å; S18-Q22 PolarHBondContact OG-NE2 3.48Å
19	L	98.6	Very high	98.3	Very high	80 Å²	80	96.9 Å²	96.9	42%	0.419	51%	0.507	S	S	.	.	H	α-helix	trans	-64.2	-41.6	176.9	-71.3	172	0	0	0	111.5	E15 L16 Q21 Q22 L23	E15-L19 HydrophobicContact CG-CD1 4.27Å; E15-L19 WeakPolarHBondContact O-CG 3.37Å; E15-L19 PolarHBondContact O-N 3.17Å; L16-L19 PolarHBondContact O-N 2.93Å; L19-Q21 VanDerWaalsContact C-N 3.34Å; L19-Q21 PolarHBondContact O-N 3.36Å; L19-Q22 PolarHBondContact O-N 3Å; L19-L23 WeakPolarHBondContact O-CG 3.42Å; L19-L23 PolarHBondContact O-N 3.34Å
20	D	98.5	Very high	98.4	Very high	92 Å²	92	99 Å²	99	49%	0.492	51%	0.509	S	S	.	.	H	α-helix	trans	-60.5	-42.9	175.6	-77.1	-22.1	0	0	0	111.7	L16 L23 Q24	L16-D20 PolarHBondContact O-N 3.17Å; D20-L23 PolarHBondContact O-N 3.06Å; D20-Q24 PolarHBondContact O-N 3.11Å
21	Q	98.6	Very high	98.4	Very high	121 Å²	121	98.9 Å²	98.9	57%	0.565	51%	0.507	S	S	*	.	H	α-helix	trans	-63.2	-42.4	174.9	-173	-178.6	-1.9	0	0	112	A17 S18 L19 Q24 L25	A17-Q21 PolarHBondContact O-N 3.35Å; A17-Q21 VanDerWaalsContact O-N 3.11Å; S18-Q21 PolarHBondContact O-N 3.45Å; L19-Q21 VanDerWaalsContact C-N 3.34Å; L19-Q21 PolarHBondContact O-N 3.36Å; Q21-Q24 PolarHBondContact O-N 2.72Å; Q21-L25 WeakPolarHBondContact O-CG 3.42Å; Q21-L25 PolarHBondContact O-N 3.31Å
22	Q	98.5	Very high	98.4	Very high	101 Å²	101	96.9 Å²	96.9	47%	0.472	51%	0.505	S	S	.	.	H	α-helix	trans	-64	-40.9	176.7	-71.8	177.4	50.8	0	0	111.9	S18 L19 Q24 L25 L26	S18-Q22 WeakPolarHBondContact O-CG 3.38Å; S18-Q22 PolarHBondContact O-N 2.9Å; S18-Q22 PolarHBondContact OG-NE2 3.48Å; L19-Q22 PolarHBondContact O-N 3Å; Q22-Q24 VanDerWaalsContact C-N 3.32Å; Q22-Q24 PolarHBondContact O-N 2.81Å; Q22-L25 PolarHBondContact O-N 2.92Å; Q22-L26 WeakPolarHBondContact O-CB 3.36Å; Q22-L26 VanDerWaalsContact O-CG 3.32Å; Q22-L26 WeakPolarHBondContact O-CG 3.43Å; Q22-L26 PolarHBondContact O-N 3.46Å
23	L	98.6	Very high	98.5	Very high	109 Å²	109	97.6 Å²	97.6	57%	0.571	50%	0.503	S	S	*	.	H	α-helix	trans	-61.3	-41.6	175.1	-76	173.1	0	0	0	111.5	L19 D20 L26 N27	L19-L23 WeakPolarHBondContact O-CG 3.42Å; L19-L23 PolarHBondContact O-N 3.34Å; D20-L23 PolarHBondContact O-N 3.06Å; L23-L26 PolarHBondContact O-N 3.04Å; L23-N27 VanDerWaalsContact O-CB 3.25Å; L23-N27 WeakPolarHBondContact O-CB 3.41Å; L23-N27 PolarHBondContact O-N 3.19Å
24	Q	98.5	Very high	98.5	Very high	115 Å²	115	96.8 Å²	96.8	54%	0.537	50%	0.5	S	S	.	.	H	α-helix	trans	-60.6	-49.3	174.8	-174.9	-179.1	-15.3	0	0	111.6	D20 Q21 Q22 L26 N27 E28	D20-Q24 PolarHBondContact O-N 3.11Å; Q21-Q24 PolarHBondContact O-N 2.72Å; Q22-Q24 VanDerWaalsContact C-N 3.32Å; Q22-Q24 PolarHBondContact O-N 2.81Å; Q24-L26 PolarHBondContact O-N 3.47Å; Q24-N27 WeakPolarHBondContact O-CB 3.37Å; Q24-N27 PolarHBondContact O-N 3.24Å; Q24-N27 VanDerWaalsContact O-N 3.17Å; Q24-E28 PolarHBondContact NE2-OE1 2.94Å; Q24-E28 WeakPolarHBondContact O-CG 3.25Å; Q24-E28 PolarHBondContact O-N 3.45Å
25	L	98.6	Very high	98.5	Very high	95 Å²	95	98.4 Å²	98.4	50%	0.497	50%	0.497	S	S	.	.	H	α-helix	trans	-62.4	-41.1	179.2	-69.8	172.2	0	0	0	112.4	Q21 Q22 N27 E28 R29	Q21-L25 WeakPolarHBondContact O-CG 3.42Å; Q21-L25 PolarHBondContact O-N 3.31Å; Q22-L25 PolarHBondContact O-N 2.92Å; L25-N27 VanDerWaalsContact C-N 3.32Å; L25-E28 PolarHBondContact O-N 2.96Å; L25-R29 WeakPolarHBondContact O-CB 3.32Å; L25-R29 PolarHBondContact O-N 3.17Å
26	L	98.6	Very high	98.5	Very high	106 Å²	106	95.1 Å²	95.1	56%	0.555	48%	0.483	S	S	*	.	H	α-helix	trans	-65.2	-37.7	175.5	-74.1	173.6	0	0	0	111.7	Q22 L23 Q24 R29 R30	Q22-L26 WeakPolarHBondContact O-CB 3.36Å; Q22-L26 VanDerWaalsContact O-CG 3.32Å; Q22-L26 WeakPolarHBondContact O-CG 3.43Å; Q22-L26 PolarHBondContact O-N 3.46Å; L23-L26 PolarHBondContact O-N 3.04Å; Q24-L26 PolarHBondContact O-N 3.47Å; L26-R29 PolarHBondContact O-N 2.85Å; L26-R30 WeakPolarHBondContact O-CB 3.44Å; L26-R30 PolarHBondContact O-N 3.04Å
27	N	98.6	Very high	98.6	Very high	63 Å²	63	94.4 Å²	94.4	34%	0.337	48%	0.479	S	S	.	.	H	α-helix	trans	-65.6	-43.7	176.2	-174.9	71.1	0	0	0	111.7	L23 Q24 L25 R30 I31	L23-N27 VanDerWaalsContact O-CB 3.25Å; L23-N27 WeakPolarHBondContact O-CB 3.41Å; L23-N27 PolarHBondContact O-N 3.19Å; Q24-N27 WeakPolarHBondContact O-CB 3.37Å; Q24-N27 PolarHBondContact O-N 3.24Å; Q24-N27 VanDerWaalsContact O-N 3.17Å; L25-N27 VanDerWaalsContact C-N 3.32Å; N27-R30 WeakPolarHBondContact O-CB 3.47Å; N27-R30 PolarHBondContact O-N 3.27Å; N27-R30 PolarHBondContact OD1-NH1 3.29Å; N27-R30 PolarHBondContact OD1-NH2 2.99Å; N27-I31 WeakPolarHBondContact O-CG1 3.43Å; N27-I31 PolarHBondContact O-N 3.27Å
28	E	98.5	Very high	98.6	Very high	98 Å²	98	97 Å²	97	46%	0.458	48%	0.481	S	S	.	.	H	α-helix	trans	-61.2	-45.7	173.9	-72.1	172.1	-168.5	0	0	111.5	Q24 L25 R30 I31 A32	Q24-E28 PolarHBondContact NE2-OE1 2.94Å; Q24-E28 WeakPolarHBondContact O-CG 3.25Å; Q24-E28 PolarHBondContact O-N 3.45Å; L25-E28 PolarHBondContact O-N 2.96Å; E28-R30 VanDerWaalsContact C-N 3.33Å; E28-R30 PolarHBondContact O-N 3.32Å; E28-I31 PolarHBondContact O-N 2.94Å; E28-A32 PolarHBondContact O-N 3.43Å
29	R	98.6	Very high	98.6	Very high	169 Å²	169	100.1 Å²	100.1	64%	0.638	49%	0.488	S	S	*	.	H	α-helix	trans	-62	-39.6	175.3	-174.6	177	178.3	-173.7	-0.3	112.1	L25 L26 I31 A32 L33	L25-R29 WeakPolarHBondContact O-CB 3.32Å; L25-R29 PolarHBondContact O-N 3.17Å; L26-R29 PolarHBondContact O-N 2.85Å; R29-I31 VanDerWaalsContact C-N 3.35Å; R29-A32 PolarHBondContact O-N 3.44Å; R29-L33 HydrophobicContact CG-CD1 4.19Å; R29-L33 WeakPolarHBondContact O-CG 3.41Å; R29-L33 PolarHBondContact O-N 2.9Å
30	R	98.6	Very high	98.6	Very high	135 Å²	135	102.4 Å²	102.4	51%	0.509	49%	0.494	S	S	.	.	H	α-helix	trans	-59.1	-47	175.6	-171.1	-173.5	76.6	-125	-5.2	110.6	L26 N27 E28 L33 M34	L26-R30 WeakPolarHBondContact O-CB 3.44Å; L26-R30 PolarHBondContact O-N 3.04Å; N27-R30 WeakPolarHBondContact O-CB 3.47Å; N27-R30 PolarHBondContact O-N 3.27Å; N27-R30 PolarHBondContact OD1-NH1 3.29Å; N27-R30 PolarHBondContact OD1-NH2 2.99Å; E28-R30 VanDerWaalsContact C-N 3.33Å; E28-R30 PolarHBondContact O-N 3.32Å; R30-L33 PolarHBondContact O-N 2.99Å; R30-M34 HydrophobicContact CG-SD 4.35Å; R30-M34 VanDerWaalsContact O-CG 3.31Å; R30-M34 WeakPolarHBondContact O-CG 3.31Å; R30-M34 PolarHBondContact O-N 3Å
31	I	98.6	Very high	98.6	Very high	94 Å²	94	104.1 Å²	104.1	48%	0.482	50%	0.497	S	S	.	.	H	α-helix	trans	-61.4	-45.3	177.9	-66.9	164.4	0	0	0	110.8	N27 E28 R29 L33 M34 H35	N27-I31 WeakPolarHBondContact O-CG1 3.43Å; N27-I31 PolarHBondContact O-N 3.27Å; E28-I31 PolarHBondContact O-N 2.94Å; R29-I31 VanDerWaalsContact C-N 3.35Å; I31-L33 VanDerWaalsContact C-N 3.34Å; I31-L33 PolarHBondContact O-N 3.33Å; I31-M34 PolarHBondContact O-N 3.05Å; I31-H35 PolarHBondContact O-N 3.45Å; I31-H35 VanDerWaalsContact O-N 3.1Å
32	A	98.6	Very high	98.6	Very high	59 Å²	59	103.5 Å²	103.5	49%	0.488	50%	0.495	S	S	.	.	H	α-helix	trans	-60.2	-42.8	177.7	0	0	0	0	0	112.5	E28 R29 H35 D36	E28-A32 PolarHBondContact O-N 3.43Å; R29-A32 PolarHBondContact O-N 3.44Å; A32-H35 PolarHBondContact O-N 3.42Å; A32-D36 PolarHBondContact O-N 3.32Å
33	L	98.7	Very high	98.6	Very high	87 Å²	87	101.1 Å²	101.1	46%	0.455	49%	0.492	S	S	.	.	H	α-helix	trans	-67	-39.3	176.7	-73.5	171.1	0	0	0	112.5	R29 R30 I31 H35 D36 I37	R29-L33 HydrophobicContact CG-CD1 4.19Å; R29-L33 WeakPolarHBondContact O-CG 3.41Å; R29-L33 PolarHBondContact O-N 2.9Å; R30-L33 PolarHBondContact O-N 2.99Å; I31-L33 VanDerWaalsContact C-N 3.34Å; I31-L33 PolarHBondContact O-N 3.33Å; L33-H35 VanDerWaalsContact C-N 3.33Å; L33-H35 PolarHBondContact O-N 3.42Å; L33-D36 PolarHBondContact O-N 2.97Å; L33-I37 WeakPolarHBondContact O-CB 3.48Å; L33-I37 VanDerWaalsContact O-CG1 3.25Å; L33-I37 WeakPolarHBondContact O-CG1 3.48Å; L33-I37 PolarHBondContact O-N 3.34Å
34	M	98.6	Very high	98.6	Very high	100 Å²	100	100.4 Å²	100.4	49%	0.493	49%	0.488	S	S	.	.	H	α-helix	trans	-58.4	-47	175.2	-74.6	175.1	63.9	0	0	111.1	R30 I31 I37 E38	R30-M34 HydrophobicContact CG-SD 4.35Å; R30-M34 VanDerWaalsContact O-CG 3.31Å; R30-M34 WeakPolarHBondContact O-CG 3.31Å; R30-M34 PolarHBondContact O-N 3Å; I31-M34 PolarHBondContact O-N 3.05Å; M34-I37 PolarHBondContact O-N 3.37Å; M34-E38 WeakPolarHBondContact O-CG 3.33Å; M34-E38 PolarHBondContact O-N 3.1Å
35	H	98.4	Very high	98.6	Very high	98 Å²	98	102.2 Å²	102.2	45%	0.454	49%	0.49	S	S	.	.	H	α-helix	trans	-66.1	-38.2	177.5	172.9	-103.4	0	0	0	113.1	I31 A32 L33 E38 K39	I31-H35 PolarHBondContact O-N 3.45Å; I31-H35 VanDerWaalsContact O-N 3.1Å; A32-H35 PolarHBondContact O-N 3.42Å; L33-H35 VanDerWaalsContact C-N 3.33Å; L33-H35 PolarHBondContact O-N 3.42Å; H35-E38 PolarHBondContact O-N 3.25Å; H35-K39 WeakPolarHBondContact CE1-CE 3.25Å; H35-K39 PolarHBondContact CE1-NZ 3.24Å; H35-K39 WeakPolarHBondContact NE2-CE 3.47Å; H35-K39 WeakPolarHBondContact O-CG 3.37Å; H35-K39 PolarHBondContact O-N 2.91Å
36	D	98.7	Very high	98.6	Very high	62 Å²	62	102.2 Å²	102.2	33%	0.332	49%	0.49	S	S	.	.	H	α-helix	trans	-62.4	-42.1	172.7	179.6	61.7	0	0	0	112	A32 L33 E38 K39 K40	A32-D36 PolarHBondContact O-N 3.32Å; L33-D36 PolarHBondContact O-N 2.97Å; D36-E38 PolarHBondContact O-N 3.2Å; D36-K39 PolarHBondContact O-N 3.29Å; D36-K40 WeakPolarHBondContact O-CG 3.5Å; D36-K40 PolarHBondContact O-N 2.89Å; D36-K40 WeakPolarHBondContact OD1-CE 3.35Å; D36-K40 IonicContact OD1-NZ 3.45Å; D36-K40 VanDerWaalsContact OD2-CE 3.27Å; D36-K40 WeakPolarHBondContact OD2-CE 3.17Å; D36-K40 IonicContact OD2-NZ 3.9Å; D36-K40 PolarHBondContact OD2-NZ 3.47Å
37	I	98.8	Very high	98.6	Very high	86 Å²	86	102.2 Å²	102.2	44%	0.441	49%	0.49	S	S	.	.	H	α-helix	trans	-62	-43.4	175.9	-71.6	165.5	0	0	0	110.8	L33 M34 K40 K41	L33-I37 WeakPolarHBondContact O-CB 3.48Å; L33-I37 VanDerWaalsContact O-CG1 3.25Å; L33-I37 WeakPolarHBondContact O-CG1 3.48Å; L33-I37 PolarHBondContact O-N 3.34Å; M34-I37 PolarHBondContact O-N 3.37Å; I37-K40 PolarHBondContact O-N 3.45Å; I37-K41 HydrophobicContact CG2-CD 4.13Å; I37-K41 HydrophobicContact CG2-CG 4.42Å; I37-K41 WeakPolarHBondContact O-CB 3.27Å; I37-K41 WeakPolarHBondContact O-CG 3.41Å; I37-K41 PolarHBondContact O-N 2.95Å
38	E	98.6	Very high	98.6	Very high	115 Å²	115	104.2 Å²	104.2	54%	0.537	50%	0.498	S	S	.	.	H	α-helix	trans	-61.3	-45.8	177.5	-75	172	-176.7	0	0	111.9	M34 H35 D36 K40 K41 E42	M34-E38 WeakPolarHBondContact O-CG 3.33Å; M34-E38 PolarHBondContact O-N 3.1Å; H35-E38 PolarHBondContact O-N 3.25Å; D36-E38 PolarHBondContact O-N 3.2Å; E38-K40 PolarHBondContact O-N 3.33Å; E38-K41 WeakPolarHBondContact O-CB 3.48Å; E38-K41 PolarHBondContact O-N 2.93Å; E38-E42 PolarHBondContact O-N 3.38Å
39	K	98.6	Very high	98.6	Very high	117 Å²	117	103 Å²	103	51%	0.509	50%	0.5	S	S	.	.	H	α-helix	trans	-59.6	-44	174.5	-76.5	-177	168.7	-177.5	0	112.5	H35 D36 E42 A43	H35-K39 WeakPolarHBondContact CE1-CE 3.25Å; H35-K39 PolarHBondContact CE1-NZ 3.24Å; H35-K39 WeakPolarHBondContact NE2-CE 3.47Å; H35-K39 WeakPolarHBondContact O-CG 3.37Å; H35-K39 PolarHBondContact O-N 2.91Å; D36-K39 PolarHBondContact O-N 3.29Å; K39-E42 PolarHBondContact O-N 3.49Å; K39-A43 PolarHBondContact O-N 2.97Å
40	K	98.6	Very high	98.6	Very high	129 Å²	129	98.5 Å²	98.5	56%	0.561	49%	0.494	S	S	*	.	H	α-helix	trans	-65.5	-37.9	177.1	-75.3	173	177.8	164.7	0	112.2	D36 I37 E38 E42 A43 L44	D36-K40 WeakPolarHBondContact O-CG 3.5Å; D36-K40 PolarHBondContact O-N 2.89Å; D36-K40 WeakPolarHBondContact OD1-CE 3.35Å; D36-K40 IonicContact OD1-NZ 3.45Å; D36-K40 VanDerWaalsContact OD2-CE 3.27Å; D36-K40 WeakPolarHBondContact OD2-CE 3.17Å; D36-K40 IonicContact OD2-NZ 3.9Å; D36-K40 PolarHBondContact OD2-NZ 3.47Å; I37-K40 PolarHBondContact O-N 3.45Å; E38-K40 PolarHBondContact O-N 3.33Å; K40-E42 VanDerWaalsContact C-N 3.34Å; K40-A43 PolarHBondContact O-N 2.69Å; K40-L44 WeakPolarHBondContact O-CB 3.4Å; K40-L44 PolarHBondContact O-N 3.33Å
41	K	98.7	Very high	98.6	Very high	128 Å²	128	96.6 Å²	96.6	56%	0.557	49%	0.493	S	S	*	.	H	α-helix	trans	-64.4	-37.4	173.7	-76.8	176.4	176.3	-179.4	0	112.4	I37 E38 R45	I37-K41 HydrophobicContact CG2-CD 4.13Å; I37-K41 HydrophobicContact CG2-CG 4.42Å; I37-K41 WeakPolarHBondContact O-CB 3.27Å; I37-K41 WeakPolarHBondContact O-CG 3.41Å; I37-K41 PolarHBondContact O-N 2.95Å; E38-K41 WeakPolarHBondContact O-CB 3.48Å; E38-K41 PolarHBondContact O-N 2.93Å; K41-R45 WeakPolarHBondContact O-CG 3.44Å; K41-R45 PolarHBondContact O-N 3.22Å; K41-R45 VanDerWaalsContact O-N 3.15Å; K41-R45 PolarHBondContact O-NE 2.88Å
42	E	98.6	Very high	98.6	Very high	108 Å²	108	95 Å²	95	51%	0.505	49%	0.49	S	S	.	.	H	α-helix	trans	-67.3	-47.5	173.6	-172.6	179.8	176.5	0	0	111.7	E38 K39 K40 L44 R45 N46	E38-E42 PolarHBondContact O-N 3.38Å; K39-E42 PolarHBondContact O-N 3.49Å; K40-E42 VanDerWaalsContact C-N 3.34Å; E42-L44 VanDerWaalsContact C-N 3.3Å; E42-L44 PolarHBondContact O-N 3.02Å; E42-R45 PolarHBondContact O-N 3.15Å; E42-N46 PolarHBondContact O-N 3.41Å
43	A	98.6	Very high	98.6	Very high	50 Å²	50	96.1 Å²	96.1	41%	0.413	49%	0.492	S	S	.	.	H	α-helix	trans	-58.8	-41.1	176.1	0	0	0	0	0	112.3	K39 K40 N46 L47	K39-A43 PolarHBondContact O-N 2.97Å; K40-A43 PolarHBondContact O-N 2.69Å; A43-N46 PolarHBondContact O-N 3Å; A43-L47 WeakPolarHBondContact O-CG 3.34Å; A43-L47 PolarHBondContact O-N 3.32Å
44	L	98.7	Very high	98.6	Very high	94 Å²	94	94.9 Å²	94.9	49%	0.492	49%	0.494	S	S	.	.	H	α-helix	trans	-61.3	-48.1	175.9	-177.5	63.1	0	0	0	111.6	K40 E42 N46 L47 E48	K40-L44 WeakPolarHBondContact O-CB 3.4Å; K40-L44 PolarHBondContact O-N 3.33Å; E42-L44 VanDerWaalsContact C-N 3.3Å; E42-L44 PolarHBondContact O-N 3.02Å; L44-N46 VanDerWaalsContact C-N 3.28Å; L44-N46 PolarHBondContact O-N 3.41Å; L44-L47 WeakPolarHBondContact O-CB 3.49Å; L44-L47 PolarHBondContact O-N 3.01Å; L44-L47 VanDerWaalsContact O-N 3.14Å; L44-E48 HydrophobicContact CD1-CG 4.39Å; L44-E48 HydrophobicContact CG-CG 4.44Å; L44-E48 WeakPolarHBondContact O-CG 3.46Å; L44-E48 PolarHBondContact O-N 2.95Å
45	R	98.6	Very high	98.6	Very high	154 Å²	154	96 Å²	96	58%	0.581	50%	0.498	S	S	*	.	H	α-helix	trans	-58.3	-39.7	176.6	-76.5	-179.3	-75.5	168.1	-1.6	112.4	K41 E42 S49	K41-R45 WeakPolarHBondContact O-CG 3.44Å; K41-R45 PolarHBondContact O-N 3.22Å; K41-R45 VanDerWaalsContact O-N 3.15Å; K41-R45 PolarHBondContact O-NE 2.88Å; E42-R45 PolarHBondContact O-N 3.15Å; R45-S49 WeakPolarHBondContact O-CB 3.33Å; R45-S49 PolarHBondContact O-N 3.36Å
46	N	98.4	Very high	98.6	Very high	94 Å²	94	94.9 Å²	94.9	50%	0.503	50%	0.498	S	S	.	.	H	α-helix	trans	-67.2	-39.7	177.4	-69.4	-19.8	0	0	0	112.1	E42 A43 L44 S50	E42-N46 PolarHBondContact O-N 3.41Å; A43-N46 PolarHBondContact O-N 3Å; L44-N46 VanDerWaalsContact C-N 3.28Å; L44-N46 PolarHBondContact O-N 3.41Å; N46-S50 WeakPolarHBondContact O-CB 3.49Å; N46-S50 PolarHBondContact O-N 2.97Å; N46-S50 PolarHBondContact O-OG 2.79Å
47	L	98.6	Very high	98.5	Very high	106 Å²	106	95.1 Å²	95.1	56%	0.555	50%	0.504	S	S	*	.	H	α-helix	trans	-65.4	-46.4	174.9	-76.8	164.8	0	0	0	111.6	A43 L44 S49 S50 I51	A43-L47 WeakPolarHBondContact O-CG 3.34Å; A43-L47 PolarHBondContact O-N 3.32Å; L44-L47 WeakPolarHBondContact O-CB 3.49Å; L44-L47 PolarHBondContact O-N 3.01Å; L44-L47 VanDerWaalsContact O-N 3.14Å; L47-S49 VanDerWaalsContact C-N 3.32Å; L47-S49 PolarHBondContact O-N 3.14Å; L47-S50 WeakPolarHBondContact O-CB 3.34Å; L47-S50 PolarHBondContact O-N 3.38Å; L47-S50 VanDerWaalsContact O-N 3.13Å; L47-I51 WeakPolarHBondContact O-CG1 3.34Å; L47-I51 PolarHBondContact O-N 3.49Å
48	E	98.6	Very high	98.5	Very high	105 Å²	105	97.5 Å²	97.5	49%	0.491	51%	0.512	S	S	.	.	H	α-helix	trans	-58.6	-43.7	177	-71.7	170.1	160.2	0	0	111.6	L44 S50 I51 S52	L44-E48 HydrophobicContact CD1-CG 4.39Å; L44-E48 HydrophobicContact CG-CG 4.44Å; L44-E48 WeakPolarHBondContact O-CG 3.46Å; L44-E48 PolarHBondContact O-N 2.95Å; E48-S50 PolarHBondContact O-N 2.88Å; E48-I51 PolarHBondContact O-N 2.86Å; E48-S52 WeakPolarHBondContact O-CB 3.45Å; E48-S52 PolarHBondContact O-N 3.13Å
49	S	98.4	Very high	98.5	Very high	72 Å²	72	96.7 Å²	96.7	50%	0.503	51%	0.508	S	S	.	.	H	α-helix	trans	-62.1	-41.2	174.3	-177.6	0	0	0	0	112.7	R45 L47 S52 T53	R45-S49 WeakPolarHBondContact O-CB 3.33Å; R45-S49 PolarHBondContact O-N 3.36Å; L47-S49 VanDerWaalsContact C-N 3.32Å; L47-S49 PolarHBondContact O-N 3.14Å; S49-S52 PolarHBondContact O-N 3.43Å; S49-T53 WeakPolarHBondContact O-CB 3.37Å; S49-T53 PolarHBondContact O-N 2.91Å; S49-T53 PolarHBondContact O-OG1 3.25Å
50	S	98.4	Very high	98.5	Very high	75 Å²	75	97.5 Å²	97.5	52%	0.524	51%	0.511	S	S	.	.	H	α-helix	trans	-66.1	-41.3	177.8	-58.5	0	0	0	0	111.8	N46 L47 E48 T53 A54	N46-S50 WeakPolarHBondContact O-CB 3.49Å; N46-S50 PolarHBondContact O-N 2.97Å; N46-S50 PolarHBondContact O-OG 2.79Å; L47-S50 WeakPolarHBondContact O-CB 3.34Å; L47-S50 PolarHBondContact O-N 3.38Å; L47-S50 VanDerWaalsContact O-N 3.13Å; E48-S50 PolarHBondContact O-N 2.88Å; S50-T53 PolarHBondContact O-N 3.06Å; S50-A54 WeakPolarHBondContact O-CB 3.36Å; S50-A54 PolarHBondContact O-N 3.02Å
51	I	98.5	Very high	98.5	Very high	95 Å²	95	96.9 Å²	96.9	49%	0.487	51%	0.514	S	S	.	.	H	α-helix	trans	-61.4	-50.5	174.8	-70.8	167.1	0	0	0	109.7	L47 E48 T53 A54 E55	L47-I51 WeakPolarHBondContact O-CG1 3.34Å; L47-I51 PolarHBondContact O-N 3.49Å; E48-I51 PolarHBondContact O-N 2.86Å; I51-T53 VanDerWaalsContact C-N 3.28Å; I51-T53 PolarHBondContact O-N 3.01Å; I51-A54 WeakPolarHBondContact O-CB 3.48Å; I51-A54 PolarHBondContact O-N 3.03Å; I51-E55 HydrophobicContact CG2-CG 4.27Å; I51-E55 WeakPolarHBondContact O-CG 3.45Å; I51-E55 PolarHBondContact O-N 3.4Å
52	S	98.5	Very high	98.5	Very high	60 Å²	60	93.2 Å²	93.2	42%	0.42	50%	0.502	S	S	.	.	H	α-helix	trans	-58.4	-40.5	178.8	-176.5	0	0	0	0	112.3	E48 S49 E55 V56	E48-S52 WeakPolarHBondContact O-CB 3.45Å; E48-S52 PolarHBondContact O-N 3.13Å; S49-S52 PolarHBondContact O-N 3.43Å; S52-E55 PolarHBondContact O-N 2.85Å; S52-V56 WeakPolarHBondContact O-CG2 3.42Å; S52-V56 PolarHBondContact O-N 2.98Å
53	T	98.5	Very high	98.4	Very high	84 Å²	84	92.9 Å²	92.9	52%	0.515	50%	0.5	S	S	.	.	H	α-helix	trans	-64.7	-41.3	175.7	-58.8	0	0	0	0	112	S49 S50 I51 S57	S49-T53 WeakPolarHBondContact O-CB 3.37Å; S49-T53 PolarHBondContact O-N 2.91Å; S49-T53 PolarHBondContact O-OG1 3.25Å; S50-T53 PolarHBondContact O-N 3.06Å; I51-T53 VanDerWaalsContact C-N 3.28Å; I51-T53 PolarHBondContact O-N 3.01Å; T53-S57 WeakPolarHBondContact O-CB 3.43Å; T53-S57 PolarHBondContact O-N 2.9Å; T53-S57 PolarHBondContact O-OG 3.29Å
54	A	98.3	Very high	98.4	Very high	61 Å²	61	94 Å²	94	50%	0.504	51%	0.506	S	S	.	.	H	α-helix	trans	-65.8	-41.8	176.8	0	0	0	0	0	111.6	S50 I51 S57 F58	S50-A54 WeakPolarHBondContact O-CB 3.36Å; S50-A54 PolarHBondContact O-N 3.02Å; I51-A54 WeakPolarHBondContact O-CB 3.48Å; I51-A54 PolarHBondContact O-N 3.03Å; A54-S57 PolarHBondContact O-N 3.3Å; A54-F58 WeakPolarHBondContact O-CB 3.49Å; A54-F58 PolarHBondContact O-N 3.42Å
55	E	98.6	Very high	98.4	Very high	123 Å²	123	92.4 Å²	92.4	58%	0.575	50%	0.502	S	S	*	.	H	α-helix	trans	-60.4	-47.1	175.9	-72.6	173.2	161	0	0	111.7	I51 S52 S57 F58 Q59	I51-E55 HydrophobicContact CG2-CG 4.27Å; I51-E55 WeakPolarHBondContact O-CG 3.45Å; I51-E55 PolarHBondContact O-N 3.4Å; S52-E55 PolarHBondContact O-N 2.85Å; E55-S57 VanDerWaalsContact C-N 3.31Å; E55-S57 PolarHBondContact O-N 2.96Å; E55-F58 PolarHBondContact O-N 2.8Å; E55-Q59 WeakPolarHBondContact O-CB 3.4Å; E55-Q59 PolarHBondContact O-N 3.4Å
56	V	98.5	Very high	98.4	Very high	74 Å²	74	89.7 Å²	89.7	45%	0.448	50%	0.499	S	S	.	.	H	α-helix	trans	-62	-40.7	175.8	171.2	0	0	0	0	111.4	S52 Q59 K60	S52-V56 WeakPolarHBondContact O-CG2 3.42Å; S52-V56 PolarHBondContact O-N 2.98Å; V56-Q59 PolarHBondContact O-N 2.94Å; V56-K60 HydrophobicContact CG1-CD 4.46Å; V56-K60 WeakPolarHBondContact O-CG 3.38Å; V56-K60 PolarHBondContact O-N 3.4Å
57	S	98.2	Very high	98.4	Very high	67 Å²	67	89 Å²	89	47%	0.469	50%	0.502	S	S	.	.	H	α-helix	trans	-66.4	-40.6	178.6	-58.7	0	0	0	0	111.6	T53 A54 E55 K60 L61	T53-S57 WeakPolarHBondContact O-CB 3.43Å; T53-S57 PolarHBondContact O-N 2.9Å; T53-S57 PolarHBondContact O-OG 3.29Å; A54-S57 PolarHBondContact O-N 3.3Å; E55-S57 VanDerWaalsContact C-N 3.31Å; E55-S57 PolarHBondContact O-N 2.96Å; S57-K60 PolarHBondContact O-N 3.05Å; S57-L61 PolarHBondContact O-N 3.41Å
58	F	98.3	Very high	98.3	Very high	136 Å²	136	88.8 Å²	88.8	60%	0.596	50%	0.501	S	S	*	.	H	α-helix	trans	-63.7	-44.3	175.1	-176.3	-98.7	0	0	0	111.5	A54 E55 K60 L61 V62	A54-F58 WeakPolarHBondContact O-CB 3.49Å; A54-F58 PolarHBondContact O-N 3.42Å; E55-F58 PolarHBondContact O-N 2.8Å; F58-K60 VanDerWaalsContact C-N 3.34Å; F58-K60 PolarHBondContact O-N 3.1Å; F58-L61 WeakPolarHBondContact O-CB 3.46Å; F58-L61 PolarHBondContact O-N 3.42Å; F58-L61 VanDerWaalsContact O-N 3.1Å; F58-V62 HydrophobicContact CD1-CG2 4.14Å; F58-V62 HydrophobicContact CE1-CG2 3.75Å; F58-V62 HydrophobicContact CZ-CG2 4.03Å; F58-V62 WeakPolarHBondContact O-CG2 3.49Å; F58-V62 PolarHBondContact O-N 2.83Å
59	Q	98.6	Very high	98.3	Very high	98 Å²	98	87.3 Å²	87.3	46%	0.458	50%	0.495	S	S	.	.	H	α-helix	trans	-58.9	-44.6	176.6	-177.3	56.5	37.5	0	0	112	E55 V56 L61 V62 E63	E55-Q59 WeakPolarHBondContact O-CB 3.4Å; E55-Q59 PolarHBondContact O-N 3.4Å; V56-Q59 PolarHBondContact O-N 2.94Å; Q59-L61 VanDerWaalsContact C-N 3.31Å; Q59-L61 PolarHBondContact O-N 3.48Å; Q59-V62 PolarHBondContact O-N 2.99Å; Q59-E63 WeakPolarHBondContact CG-OE1 3.44Å; Q59-E63 PolarHBondContact NE2-OE1 2.91Å; Q59-E63 WeakPolarHBondContact O-CG 3.4Å; Q59-E63 PolarHBondContact O-N 3.24Å
60	K	98.4	Very high	98.3	Very high	134 Å²	134	86.7 Å²	86.7	58%	0.583	50%	0.495	S	S	*	.	H	α-helix	trans	-61.7	-37.5	174.5	-72.1	175.7	-179.6	178.8	0	112.8	V56 S57 F58 E63 S64	V56-K60 HydrophobicContact CG1-CD 4.46Å; V56-K60 WeakPolarHBondContact O-CG 3.38Å; V56-K60 PolarHBondContact O-N 3.4Å; S57-K60 PolarHBondContact O-N 3.05Å; F58-K60 VanDerWaalsContact C-N 3.34Å; F58-K60 PolarHBondContact O-N 3.1Å; K60-E63 PolarHBondContact O-N 3.43Å; K60-S64 WeakPolarHBondContact O-CB 3.37Å; K60-S64 PolarHBondContact O-N 3.07Å
61	L	98.3	Very high	98.3	Very high	117 Å²	117	89.7 Å²	89.7	61%	0.613	50%	0.495	S	S	*	.	H	α-helix	trans	-65.2	-42.3	176.8	-179.2	64.6	0	0	0	111.2	S57 F58 Q59 S64 S65	S57-L61 PolarHBondContact O-N 3.41Å; F58-L61 WeakPolarHBondContact O-CB 3.46Å; F58-L61 PolarHBondContact O-N 3.42Å; F58-L61 VanDerWaalsContact O-N 3.1Å; Q59-L61 VanDerWaalsContact C-N 3.31Å; Q59-L61 PolarHBondContact O-N 3.48Å; L61-S64 PolarHBondContact O-N 3.05Å; L61-S65 WeakPolarHBondContact O-CB 3.42Å; L61-S65 PolarHBondContact O-N 2.84Å
62	V	98.5	Very high	98.3	Very high	51 Å²	51	90.4 Å²	90.4	31%	0.309	50%	0.498	S	S	.	.	H	α-helix	trans	-60.6	-49.5	175	172.8	0	0	0	0	110.5	F58 Q59 S64 S65 D66	F58-V62 HydrophobicContact CD1-CG2 4.14Å; F58-V62 HydrophobicContact CE1-CG2 3.75Å; F58-V62 HydrophobicContact CZ-CG2 4.03Å; F58-V62 WeakPolarHBondContact O-CG2 3.49Å; F58-V62 PolarHBondContact O-N 2.83Å; Q59-V62 PolarHBondContact O-N 2.99Å; V62-S64 VanDerWaalsContact C-N 3.33Å; V62-S64 PolarHBondContact O-N 2.91Å; V62-S65 WeakPolarHBondContact O-CA 3.42Å; V62-S65 WeakPolarHBondContact O-CB 3.34Å; V62-S65 PolarHBondContact O-N 3Å; V62-D66 PolarHBondContact O-N 3.49Å
63	E	97.9	Very high	98.3	Very high	100 Å²	100	94.4 Å²	94.4	47%	0.467	51%	0.508	S	S	.	.	H	α-helix	trans	-60.3	-40.7	178.2	-72.1	167	-168.3	0	0	112.9	Q59 K60 S65 D66 S67	Q59-E63 WeakPolarHBondContact CG-OE1 3.44Å; Q59-E63 PolarHBondContact NE2-OE1 2.91Å; Q59-E63 WeakPolarHBondContact O-CG 3.4Å; Q59-E63 PolarHBondContact O-N 3.24Å; K60-E63 PolarHBondContact O-N 3.43Å; E63-S65 VanDerWaalsContact C-N 3.33Å; E63-D66 PolarHBondContact O-N 3.37Å; E63-S67 WeakPolarHBondContact O-CB 3.45Å; E63-S67 PolarHBondContact O-N 3.42Å; E63-S67 PolarHBondContact O-OG 3.18Å
64	S	98.1	Very high	98.2	Very high	75 Å²	75	96.4 Å²	96.4	52%	0.524	51%	0.509	S	S	.	.	H	α-helix	trans	-65.7	-37.6	174.5	-175.8	0	0	0	0	111.8	K60 L61 V62 S67 L68	K60-S64 WeakPolarHBondContact O-CB 3.37Å; K60-S64 PolarHBondContact O-N 3.07Å; L61-S64 PolarHBondContact O-N 3.05Å; V62-S64 VanDerWaalsContact C-N 3.33Å; V62-S64 PolarHBondContact O-N 2.91Å; S64-S67 PolarHBondContact O-N 3.34Å; S64-L68 WeakPolarHBondContact O-CB 3.38Å; S64-L68 PolarHBondContact O-N 2.96Å
65	S	97.8	Very high	98.2	Very high	59 Å²	59	97 Å²	97	41%	0.413	50%	0.501	S	S	.	.	H	α-helix	trans	-65.3	-46.4	176.9	-168.9	0	0	0	0	111	L61 V62 E63 S67 L68 I69	L61-S65 WeakPolarHBondContact O-CB 3.42Å; L61-S65 PolarHBondContact O-N 2.84Å; V62-S65 WeakPolarHBondContact O-CA 3.42Å; V62-S65 WeakPolarHBondContact O-CB 3.34Å; V62-S65 PolarHBondContact O-N 3Å; E63-S65 VanDerWaalsContact C-N 3.33Å; S65-S67 VanDerWaalsContact C-N 3.31Å; S65-S67 PolarHBondContact O-N 2.87Å; S65-L68 PolarHBondContact O-N 2.99Å; S65-I69 VanDerWaalsContact O-CG1 3.3Å; S65-I69 WeakPolarHBondContact O-CG1 3.45Å; S65-I69 PolarHBondContact O-N 3.49Å
66	D	98.3	Very high	98.2	Very high	98 Å²	98	94.2 Å²	94.2	52%	0.524	49%	0.493	S	S	.	.	H	α-helix	trans	-60.4	-41.9	176.4	-74.9	-22.7	0	0	0	111.8	V62 E63 I69 A70	V62-D66 PolarHBondContact O-N 3.49Å; E63-D66 PolarHBondContact O-N 3.37Å; D66-I69 PolarHBondContact O-N 3.4Å; D66-A70 WeakPolarHBondContact O-CB 3.48Å; D66-A70 PolarHBondContact O-N 2.91Å
67	S	98.1	Very high	98.2	Very high	80 Å²	80	93 Å²	93	56%	0.559	49%	0.488	S	S	*	.	H	α-helix	trans	-62	-43.3	175.7	-60.8	0	0	0	0	112	E63 S64 S65 A70 Y71	E63-S67 WeakPolarHBondContact O-CB 3.45Å; E63-S67 PolarHBondContact O-N 3.42Å; E63-S67 PolarHBondContact O-OG 3.18Å; S64-S67 PolarHBondContact O-N 3.34Å; S65-S67 VanDerWaalsContact C-N 3.31Å; S65-S67 PolarHBondContact O-N 2.87Å; S67-A70 PolarHBondContact O-N 2.96Å; S67-Y71 PolarHBondContact O-N 3.45Å
68	L	98.2	Very high	98.1	Very high	101 Å²	101	94 Å²	94	53%	0.529	49%	0.485	S	S	.	.	H	α-helix	trans	-65.3	-42.7	176.3	-179.4	62.2	0	0	0	111.6	S64 S65 A70 Y71 M72	S64-L68 WeakPolarHBondContact O-CB 3.38Å; S64-L68 PolarHBondContact O-N 2.96Å; S65-L68 PolarHBondContact O-N 2.99Å; L68-A70 VanDerWaalsContact C-N 3.32Å; L68-A70 PolarHBondContact O-N 2.86Å; L68-Y71 WeakPolarHBondContact O-CB 3.35Å; L68-Y71 PolarHBondContact O-N 3.38Å; L68-M72 HydrophobicContact CD1-CG 4.37Å; L68-M72 HydrophobicContact CG-SD 4.3Å; L68-M72 WeakPolarHBondContact O-CG 3.3Å; L68-M72 PolarHBondContact O-N 3.26Å
69	I	98.3	Very high	98.1	Very high	73 Å²	73	91.5 Å²	91.5	37%	0.374	48%	0.481	S	S	.	.	H	α-helix	trans	-60.1	-44.1	175.9	-70.5	165.6	0	0	0	110.3	S65 D66 M72 K73	S65-I69 VanDerWaalsContact O-CG1 3.3Å; S65-I69 WeakPolarHBondContact O-CG1 3.45Å; S65-I69 PolarHBondContact O-N 3.49Å; D66-I69 PolarHBondContact O-N 3.4Å; I69-M72 PolarHBondContact O-N 3.08Å; I69-K73 HydrophobicContact CG2-CD 4.17Å; I69-K73 WeakPolarHBondContact O-CB 3.37Å; I69-K73 WeakPolarHBondContact O-CG 3.49Å; I69-K73 PolarHBondContact O-N 2.98Å
70	A	98.1	Very high	98	Very high	60 Å²	60	93.9 Å²	93.9	50%	0.496	49%	0.486	S	S	.	.	H	α-helix	trans	-61.8	-44.9	176.6	0	0	0	0	0	111.7	D66 S67 L68 K73 K74	D66-A70 WeakPolarHBondContact O-CB 3.48Å; D66-A70 PolarHBondContact O-N 2.91Å; S67-A70 PolarHBondContact O-N 2.96Å; L68-A70 VanDerWaalsContact C-N 3.32Å; L68-A70 PolarHBondContact O-N 2.86Å; A70-K73 PolarHBondContact O-N 3.06Å; A70-K74 PolarHBondContact O-N 3.38Å
71	Y	98.2	Very high	98	Very high	138 Å²	138	92.7 Å²	92.7	54%	0.541	48%	0.481	S	S	.	.	H	α-helix	trans	-58.6	-50.5	174.8	178.2	-95.7	0	0	0	111.8	S67 L68 K73 K74 E75	S67-Y71 PolarHBondContact O-N 3.45Å; L68-Y71 WeakPolarHBondContact O-CB 3.35Å; L68-Y71 PolarHBondContact O-N 3.38Å; Y71-K73 VanDerWaalsContact C-N 3.31Å; Y71-K73 PolarHBondContact O-N 2.9Å; Y71-K74 WeakPolarHBondContact O-CB 3.33Å; Y71-K74 PolarHBondContact O-N 3.42Å; Y71-K74 VanDerWaalsContact O-N 3.08Å; Y71-E75 HydrophobicContact CD1-CG 3.98Å; Y71-E75 HydrophobicContact CE1-CG 3.48Å; Y71-E75 VanDerWaalsContact CE1-CG 3.48Å; Y71-E75 HydrophobicContact CE2-CG 4.08Å; Y71-E75 HydrophobicContact CG-CG 4.46Å; Y71-E75 WeakPolarHBondContact O-CG 3.48Å; Y71-E75 PolarHBondContact O-N 3.24Å
72	M	98.2	Very high	97.9	Very high	110 Å²	110	93.4 Å²	93.4	54%	0.542	48%	0.479	S	S	.	.	H	α-helix	trans	-61.3	-38.2	179.5	-72	-178.4	70.4	0	0	112.8	L68 I69 K74 T76	L68-M72 HydrophobicContact CD1-CG 4.37Å; L68-M72 HydrophobicContact CG-SD 4.3Å; L68-M72 WeakPolarHBondContact O-CG 3.3Å; L68-M72 PolarHBondContact O-N 3.26Å; I69-M72 PolarHBondContact O-N 3.08Å; M72-K74 VanDerWaalsContact C-N 3.34Å; M72-T76 VanDerWaalsContact O-CB 3.31Å; M72-T76 WeakPolarHBondContact O-CB 3.4Å; M72-T76 PolarHBondContact O-N 2.99Å; M72-T76 PolarHBondContact O-OG1 3.33Å
73	K	98.1	Very high	97.8	Very high	143 Å²	143	95.7 Å²	95.7	62%	0.622	49%	0.488	S	S	*	.	H	α-helix	trans	-61.9	-42.8	174.2	-77.4	174.7	179.1	174.8	0	111.5	I69 A70 Y71 S77	I69-K73 HydrophobicContact CG2-CD 4.17Å; I69-K73 WeakPolarHBondContact O-CB 3.37Å; I69-K73 WeakPolarHBondContact O-CG 3.49Å; I69-K73 PolarHBondContact O-N 2.98Å; A70-K73 PolarHBondContact O-N 3.06Å; Y71-K73 VanDerWaalsContact C-N 3.31Å; Y71-K73 PolarHBondContact O-N 2.9Å; K73-S77 PolarHBondContact O-N 3.03Å
74	K	98.1	Very high	97.7	Very high	126 Å²	126	98.6 Å²	98.6	55%	0.548	50%	0.495	S	S	.	.	H	α-helix	trans	-62.4	-53.6	175.3	-175.5	-173.6	175.3	-170.9	0	110.9	A70 Y71 M72 T76 S77 E78	A70-K74 PolarHBondContact O-N 3.38Å; Y71-K74 WeakPolarHBondContact O-CB 3.33Å; Y71-K74 PolarHBondContact O-N 3.42Å; Y71-K74 VanDerWaalsContact O-N 3.08Å; M72-K74 VanDerWaalsContact C-N 3.34Å; K74-T76 VanDerWaalsContact C-N 3.28Å; K74-T76 PolarHBondContact O-N 2.62Å; K74-S77 WeakPolarHBondContact O-CA 3.42Å; K74-S77 WeakPolarHBondContact O-CB 3.31Å; K74-S77 PolarHBondContact O-N 3.36Å; K74-S77 PolarHBondContact O-OG 2.76Å; K74-E78 PolarHBondContact O-N 2.95Å
75	E	97.8	Very high	97.6	Very high	73 Å²	73	98.8 Å²	98.8	34%	0.341	49%	0.488	S	S	.	.	H	α-helix	trans	-56.6	-43	179.1	-69.9	-57.4	117	0	0	111.8	Y71 S77 E78 V79	Y71-E75 HydrophobicContact CD1-CG 3.98Å; Y71-E75 HydrophobicContact CE1-CG 3.48Å; Y71-E75 VanDerWaalsContact CE1-CG 3.48Å; Y71-E75 HydrophobicContact CE2-CG 4.08Å; Y71-E75 HydrophobicContact CG-CG 4.46Å; Y71-E75 WeakPolarHBondContact O-CG 3.48Å; Y71-E75 PolarHBondContact O-N 3.24Å; E75-S77 VanDerWaalsContact C-N 3.28Å; E75-S77 PolarHBondContact O-N 3.27Å; E75-E78 PolarHBondContact O-N 2.86Å; E75-V79 WeakPolarHBondContact O-CG2 2.85Å; E75-V79 PolarHBondContact O-N 3.44Å
76	T	98.1	Very high	97.4	Very high	66 Å²	66	98.8 Å²	98.8	41%	0.405	49%	0.485	S	S	.	.	H	α-helix	trans	-65	-33.8	177	-55.9	0	0	0	0	111.8	M72 K74 R80	M72-T76 VanDerWaalsContact O-CB 3.31Å; M72-T76 WeakPolarHBondContact O-CB 3.4Å; M72-T76 PolarHBondContact O-N 2.99Å; M72-T76 PolarHBondContact O-OG1 3.33Å; K74-T76 VanDerWaalsContact C-N 3.28Å; K74-T76 PolarHBondContact O-N 2.62Å; T76-R80 WeakPolarHBondContact O-CB 3.43Å; T76-R80 WeakPolarHBondContact O-CG 3.49Å; T76-R80 PolarHBondContact O-N 2.94Å; T76-R80 VanDerWaalsContact O-N 3.1Å; T76-R80 PolarHBondContact O-NE 3.2Å
77	S	97.8	Very high	97.2	Very high	47 Å²	47	102.3 Å²	102.3	33%	0.329	49%	0.491	S	S	.	.	H	α-helix	trans	-68.2	-40.6	174.8	74.8	0	0	0	0	112.5	K73 K74 E75 R80 K81	K73-S77 PolarHBondContact O-N 3.03Å; K74-S77 WeakPolarHBondContact O-CA 3.42Å; K74-S77 WeakPolarHBondContact O-CB 3.31Å; K74-S77 PolarHBondContact O-N 3.36Å; K74-S77 PolarHBondContact O-OG 2.76Å; E75-S77 VanDerWaalsContact C-N 3.28Å; E75-S77 PolarHBondContact O-N 3.27Å; S77-R80 PolarHBondContact O-N 2.92Å; S77-K81 PolarHBondContact O-N 3.34Å
78	E	97.6	Very high	97	Very high	90 Å²	90	103.2 Å²	103.2	42%	0.421	49%	0.487	S	S	.	.	H	α-helix	trans	-65.7	-44.4	176.5	-65.8	-57.4	148.5	0	0	111.3	K74 E75 R80 K81 F82	K74-E78 PolarHBondContact O-N 2.95Å; E75-E78 PolarHBondContact O-N 2.86Å; E78-R80 VanDerWaalsContact C-N 3.32Å; E78-R80 PolarHBondContact O-N 3.38Å; E78-K81 WeakPolarHBondContact O-CB 3.35Å; E78-K81 PolarHBondContact O-N 3.39Å; E78-K81 VanDerWaalsContact O-N 3.13Å; E78-F82 WeakPolarHBondContact O-CB 3.48Å; E78-F82 PolarHBondContact O-N 2.97Å
79	V	97.6	Very high	96.5	Very high	83 Å²	83	103.8 Å²	103.8	50%	0.503	49%	0.486	S	S	.	.	H	α-helix	trans	-59.5	-43.4	174.8	172.1	0	0	0	0	111.3	E75 K81 F82 I83	E75-V79 WeakPolarHBondContact O-CG2 2.85Å; E75-V79 PolarHBondContact O-N 3.44Å; V79-K81 VanDerWaalsContact C-N 3.31Å; V79-K81 PolarHBondContact O-N 3.1Å; V79-F82 PolarHBondContact O-N 3.4Å; V79-I83 HydrophobicContact CG1-CD1 3.82Å; V79-I83 HydrophobicContact CG1-CG1 4.45Å; V79-I83 VanDerWaalsContact O-CG1 3.27Å; V79-I83 WeakPolarHBondContact O-CG1 3.37Å; V79-I83 PolarHBondContact O-N 3.39Å
80	R	97	Very high	96.1	Very high	148 Å²	148	105.4 Å²	105.4	56%	0.558	50%	0.495	S	S	*	.	H	α-helix	trans	-63.9	-36.2	176.5	-78.4	-174.7	-66.6	-126.7	-1.7	112.8	T76 S77 E78 R84	T76-R80 WeakPolarHBondContact O-CB 3.43Å; T76-R80 WeakPolarHBondContact O-CG 3.49Å; T76-R80 PolarHBondContact O-N 2.94Å; T76-R80 VanDerWaalsContact O-N 3.1Å; T76-R80 PolarHBondContact O-NE 3.2Å; S77-R80 PolarHBondContact O-N 2.92Å; E78-R80 VanDerWaalsContact C-N 3.32Å; E78-R80 PolarHBondContact O-N 3.38Å; R80-R84 PolarHBondContact O-N 3.13Å
81	K	97.3	Very high	95.6	Very high	109 Å²	109	108.7 Å²	108.7	47%	0.474	50%	0.498	S	S	.	.	H	α-helix	trans	-66.1	-50.7	175.3	179.4	-177.9	167	-171.5	0	110.3	S77 E78 V79 I83 R84 E85	S77-K81 PolarHBondContact O-N 3.34Å; E78-K81 WeakPolarHBondContact O-CB 3.35Å; E78-K81 PolarHBondContact O-N 3.39Å; E78-K81 VanDerWaalsContact O-N 3.13Å; V79-K81 VanDerWaalsContact C-N 3.31Å; V79-K81 PolarHBondContact O-N 3.1Å; K81-I83 VanDerWaalsContact C-N 3.33Å; K81-I83 PolarHBondContact O-N 2.93Å; K81-R84 WeakPolarHBondContact O-CA 3.4Å; K81-R84 WeakPolarHBondContact O-CB 3.4Å; K81-R84 PolarHBondContact O-N 3.42Å; K81-E85 WeakPolarHBondContact CE-OE1 3.35Å; K81-E85 IonicContact NZ-OE1 2.66Å; K81-E85 PolarHBondContact O-N 2.81Å
82	F	96.6	Very high	94.9	Very high	132 Å²	132	107.8 Å²	107.8	58%	0.579	50%	0.499	S	S	*	.	H	α-helix	trans	-55.7	-44.7	177	177.8	-98	0	0	0	112.8	E78 V79 R84 E85 T86	E78-F82 WeakPolarHBondContact O-CB 3.48Å; E78-F82 PolarHBondContact O-N 2.97Å; V79-F82 PolarHBondContact O-N 3.4Å; F82-R84 VanDerWaalsContact C-N 3.3Å; F82-R84 PolarHBondContact O-N 2.96Å; F82-E85 PolarHBondContact O-N 3.02Å; F82-T86 WeakPolarHBondContact O-CB 3.49Å; F82-T86 PolarHBondContact O-N 3.34Å; F82-T86 PolarHBondContact O-OG1 2.96Å
83	I	96.1	Very high	94	Very high	98 Å²	98	107.7 Å²	107.7	50%	0.503	50%	0.5	S	S	.	.	H	α-helix	trans	-61.6	-39.4	176.5	-70.4	167.2	0	0	0	111.4	V79 K81 R87	V79-I83 HydrophobicContact CG1-CD1 3.82Å; V79-I83 HydrophobicContact CG1-CG1 4.45Å; V79-I83 VanDerWaalsContact O-CG1 3.27Å; V79-I83 WeakPolarHBondContact O-CG1 3.37Å; V79-I83 PolarHBondContact O-N 3.39Å; K81-I83 VanDerWaalsContact C-N 3.33Å; K81-I83 PolarHBondContact O-N 2.93Å; I83-R87 WeakPolarHBondContact O-CB 3.27Å; I83-R87 PolarHBondContact O-N 3.44Å
84	R	95.8	Very high	93.1	Very high	162 Å²	162	108.1 Å²	108.1	61%	0.611	51%	0.505	S	S	*	.	H	α-helix	trans	-66.1	-49.6	178.7	-174	-171.9	-51.2	-145	0.2	111.2	R80 K81 F82 T86 R87 E88	R80-R84 PolarHBondContact O-N 3.13Å; K81-R84 WeakPolarHBondContact O-CA 3.4Å; K81-R84 WeakPolarHBondContact O-CB 3.4Å; K81-R84 PolarHBondContact O-N 3.42Å; F82-R84 VanDerWaalsContact C-N 3.3Å; F82-R84 PolarHBondContact O-N 2.96Å; R84-T86 VanDerWaalsContact C-N 3.32Å; R84-T86 PolarHBondContact O-N 3.12Å; R84-R87 PolarHBondContact O-N 3.17Å; R84-R87 VanDerWaalsContact O-N 3.12Å; R84-E88 WeakPolarHBondContact CG-OE1 3.47Å; R84-E88 WeakPolarHBondContact O-CG 3.43Å; R84-E88 PolarHBondContact O-N 3.45Å
85	E	95.8	Very high	92	Very high	79 Å²	79	109 Å²	109	37%	0.369	52%	0.515	S	S	.	.	H	α-helix	trans	-59.2	-44.3	177.9	-69.6	170.6	171	0	0	110.8	K81 F82 R87 E88 H89	K81-E85 WeakPolarHBondContact CE-OE1 3.35Å; K81-E85 IonicContact NZ-OE1 2.66Å; K81-E85 PolarHBondContact O-N 2.81Å; F82-E85 PolarHBondContact O-N 3.02Å; E85-R87 VanDerWaalsContact C-N 3.32Å; E85-R87 PolarHBondContact O-N 2.95Å; E85-E88 PolarHBondContact O-N 3.19Å; E85-E88 VanDerWaalsContact O-N 3.17Å; E85-H89 PolarHBondContact O-CD2 3.12Å; E85-H89 PolarHBondContact O-N 3.36Å
86	T	94.6	Very high	90.8	Very high	58 Å²	58	110 Å²	110	36%	0.356	53%	0.53	S	S	.	.	H	α-helix	trans	-59.3	-41.7	175.2	-55.8	0	0	0	0	111.9	F82 R84 L90	F82-T86 WeakPolarHBondContact O-CB 3.49Å; F82-T86 PolarHBondContact O-N 3.34Å; F82-T86 PolarHBondContact O-OG1 2.96Å; R84-T86 VanDerWaalsContact C-N 3.32Å; R84-T86 PolarHBondContact O-N 3.12Å; T86-L90 HydrophobicContact CG2-CD1 4.48Å; T86-L90 WeakPolarHBondContact O-CG 3.45Å; T86-L90 PolarHBondContact O-N 3.04Å; T86-L90 VanDerWaalsContact O-N 3.12Å
87	R	93.8	Very high	89	Confident	172 Å²	172	110.3 Å²	110.3	65%	0.649	55%	0.547	S	S	*	.	H	α-helix	trans	-68.8	-35.9	177	174.3	-178.7	-94.1	175.4	-5.9	112.4	I83 R84 E85 K91	I83-R87 WeakPolarHBondContact O-CB 3.27Å; I83-R87 PolarHBondContact O-N 3.44Å; R84-R87 PolarHBondContact O-N 3.17Å; R84-R87 VanDerWaalsContact O-N 3.12Å; E85-R87 VanDerWaalsContact C-N 3.32Å; E85-R87 PolarHBondContact O-N 2.95Å; R87-K91 WeakPolarHBondContact O-CG 3.38Å; R87-K91 PolarHBondContact O-N 2.9Å
88	E	93.3	Very high	86.5	Confident	100 Å²	100	114.2 Å²	114.2	47%	0.467	60%	0.595	S	S	.	*	H	α-helix	trans	-65.7	-46	176.7	-74.6	169.4	-174.4	0	0	110.4	R84 E85 L90 K91 E92	R84-E88 WeakPolarHBondContact CG-OE1 3.47Å; R84-E88 WeakPolarHBondContact O-CG 3.43Å; R84-E88 PolarHBondContact O-N 3.45Å; E85-E88 PolarHBondContact O-N 3.19Å; E85-E88 VanDerWaalsContact O-N 3.17Å; E88-L90 PolarHBondContact O-N 3.12Å; E88-K91 PolarHBondContact O-N 3.11Å; E88-K91 VanDerWaalsContact O-N 3.15Å; E88-E92 PolarHBondContact O-N 3.03Å; E88-E92 VanDerWaalsContact O-N 3.11Å
89	H	89	Confident	86	Confident	113 Å²	113	115.5 Å²	115.5	52%	0.523	60%	0.603	S	S	.	*	H	α-helix	trans	-59	-43.7	174.4	-72.4	-48.9	0	0	0	113.5	E85 K91 E92 D93	E85-H89 PolarHBondContact O-CD2 3.12Å; E85-H89 PolarHBondContact O-N 3.36Å; H89-K91 VanDerWaalsContact C-N 3.25Å; H89-K91 PolarHBondContact O-N 3.42Å; H89-E92 IonicContact ND1-OE2 2.69Å; H89-E92 PolarHBondContact ND1-OE2 3.15Å; H89-E92 PolarHBondContact O-N 3.27Å; H89-E92 VanDerWaalsContact O-N 3.12Å; H89-D93 PolarHBondContact O-N 3.02Å
90	L	89.4	Confident	85.4	Confident	107 Å²	107	117.2 Å²	117.2	56%	0.56	61%	0.609	S	S	*	*	H	α-helix	trans	-60.6	-34	177	-73.8	169.8	0	0	0	113	T86 E88 E94	T86-L90 HydrophobicContact CG2-CD1 4.48Å; T86-L90 WeakPolarHBondContact O-CG 3.45Å; T86-L90 PolarHBondContact O-N 3.04Å; T86-L90 VanDerWaalsContact O-N 3.12Å; E88-L90 PolarHBondContact O-N 3.12Å; L90-E94 WeakPolarHBondContact O-CG 3.5Å; L90-E94 PolarHBondContact O-N 2.7Å
91	K	86.6	Confident	84.7	Confident	129 Å²	129	115.4 Å²	115.4	56%	0.561	61%	0.611	S	S	*	*	H	α-helix	trans	-73.3	-33.9	176	-71.9	178.6	175.4	-172.3	0	112.6	R87 E88 H89 N95	R87-K91 WeakPolarHBondContact O-CG 3.38Å; R87-K91 PolarHBondContact O-N 2.9Å; E88-K91 PolarHBondContact O-N 3.11Å; E88-K91 VanDerWaalsContact O-N 3.15Å; H89-K91 VanDerWaalsContact C-N 3.25Å; H89-K91 PolarHBondContact O-N 3.42Å; K91-N95 PolarHBondContact O-N 3.31Å
92	E	84.5	Confident	84	Confident	118 Å²	118	115.8 Å²	115.8	55%	0.551	62%	0.62	S	S	*	*	H	α-helix	trans	-66.1	-41.4	175.3	-69.9	175.1	166	0	0	110.9	E88 H89 N95 S96	E88-E92 PolarHBondContact O-N 3.03Å; E88-E92 VanDerWaalsContact O-N 3.11Å; H89-E92 IonicContact ND1-OE2 2.69Å; H89-E92 PolarHBondContact ND1-OE2 3.15Å; H89-E92 PolarHBondContact O-N 3.27Å; H89-E92 VanDerWaalsContact O-N 3.12Å; E92-N95 PolarHBondContact O-N 3.17Å; E92-S96 PolarHBondContact O-N 3.31Å; E92-S96 VanDerWaalsContact O-N 3.12Å; E92-S96 PolarHBondContact O-OG 3.44Å
93	D	79.6	Confident	83.2	Confident	108 Å²	108	114.8 Å²	114.8	58%	0.578	62%	0.622	S	S	*	*	H	α-helix	trans	-64	-42.5	175.6	-72.2	-18.3	0	0	0	112.1	H89 N95 S96 G97	H89-D93 PolarHBondContact O-N 3.02Å; D93-N95 VanDerWaalsContact C-N 3.34Å; D93-N95 PolarHBondContact O-N 3.4Å; D93-S96 PolarHBondContact O-N 3.12Å; D93-S96 PolarHBondContact O-OG 3.35Å; D93-G97 PolarHBondContact O-N 3.18Å
94	E	78.7	Confident	82.3	Confident	152 Å²	152	115.9 Å²	115.9	71%	0.71	63%	0.63	S	S	*	*	H	α-helix	trans	-62.8	-37.5	175.6	-77.4	-177.6	171.4	0	0	112.8	L90	L90-E94 WeakPolarHBondContact O-CG 3.5Å; L90-E94 PolarHBondContact O-N 2.7Å
95	N	74.7	Confident	81.4	Confident	145 Å²	145	112.6 Å²	112.6	78%	0.775	63%	0.631	S	S	*	*	H	α-helix	trans	-77.3	-18.6	179.1	-85.3	-3.9	0	0	0	114	K91 E92 D93	K91-N95 PolarHBondContact O-N 3.31Å; E92-N95 PolarHBondContact O-N 3.17Å; D93-N95 VanDerWaalsContact C-N 3.34Å; D93-N95 PolarHBondContact O-N 3.4Å
96	S	73.5	Confident	80.3	Confident	94 Å²	94	115.2 Å²	115.2	66%	0.657	65%	0.652	S	S	*	*	H	α-helix	trans	-102.6	-10.5	179.7	48.4	0	0	0	0	113.5	E92 D93	E92-S96 PolarHBondContact O-N 3.31Å; E92-S96 VanDerWaalsContact O-N 3.12Å; E92-S96 PolarHBondContact O-OG 3.44Å; D93-S96 PolarHBondContact O-N 3.12Å; D93-S96 PolarHBondContact O-OG 3.35Å
97	G	60.1	Low	79.1	Confident	73 Å²	73	120 Å²	120	75%	0.753	68%	0.676	S	S	*	*			trans	-105.4	10.4	177.8	0	0	0	0	0	116.6	D93	D93-G97 PolarHBondContact O-N 3.18Å
98	G	45.8	Very low	77.7	Confident	129 Å²	129	115.3 Å²	115.3	100%	1.33	68%	0.679	S	S	*	*			trans	-110.7	0	172.7	0	0	0	0	0	112.6

Retrieved 98 of 98 residues in 236.1 ms (Link to these results)

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