A0A077ZFW0_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZFW0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 117 aa.

						>A0A077ZFW0_TRITR|A0A077ZFW0
MSDLYLKFNEMNLQLQGDQLNLIKTKTVVKAFIDKLSIFRQNLGRGEYRQFPNLDDLKKNGGLLDDVIRSFCDHLSMLHEDMCERYKHILSMTIPDWVLDPFTCLAEVEVAYKEELI
					

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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	73.5	Confident	91	Very high	72 Å²	72	64.9 Å²	64.9	36%	0.355	32%	0.316	S	S	.	.				0	-34.9	0	-68.1	-57.7	-93.4	0	0	112.8	D3 L4 Y5 F71 H74	M1-D3 VanDerWaalsContact C-N 3.28Å; M1-D3 PolarHBondContact O-N 3.23Å; M1-L4 HydrophobicContact CE-CD2 4.4Å; M1-L4 WeakPolarHBondContact O-CB 3.5Å; M1-L4 PolarHBondContact O-N 3.04Å; M1-Y5 HydrophobicContact CB-CE2 4.2Å; M1-Y5 VanDerWaalsContact O-CD2 3.31Å; M1-Y5 WeakPolarHBondContact O-CD2 3.48Å; M1-Y5 PolarHBondContact O-N 3.05Å; M1-F71 HydrophobicContact CG-CZ 4.44Å; M1-F71 HydrophobicContact SD-CD1 4.3Å; M1-F71 HydrophobicContact SD-CE1 4.1Å; M1-F71 HydrophobicContact SD-CE2 4.38Å; M1-F71 HydrophobicContact SD-CZ 4.19Å; M1-H74 HydrophobicContact CE-CB 3.87Å; M1-H74 VanDerWaalsContact CE-CG 3.47Å; M1-H74 WeakPolarHBondContact CE-ND1 3.42Å
2	S	86.9	Confident	91.3	Very high	61 Å²	61	62.6 Å²	62.6	43%	0.427	31%	0.306	S	S	.	.	H	α-helix	trans	-42.6	-48.9	172.1	43.9	0	0	0	0	114	L4 Y5 L6 N53	S2-L4 VanDerWaalsContact C-N 3.26Å; S2-L4 PolarHBondContact O-N 3.14Å; S2-Y5 WeakPolarHBondContact O-CB 3.4Å; S2-Y5 PolarHBondContact O-N 2.79Å; S2-Y5 VanDerWaalsContact O-N 3.11Å; S2-L6 PolarHBondContact O-N 3.13Å; S2-N53 PolarHBondContact OG-ND2 3.21Å
3	D	90.9	Very high	91.6	Very high	10 Å²	10	65.5 Å²	65.5	5%	0.053	32%	0.323	C	S	.	.	H	α-helix	trans	-58.1	-36	178.9	-66.5	-18.5	0	0	0	113.3	M1 K7 F51 N53	M1-D3 VanDerWaalsContact C-N 3.28Å; M1-D3 PolarHBondContact O-N 3.23Å; D3-K7 WeakPolarHBondContact O-CG 3.44Å; D3-K7 PolarHBondContact O-N 3.28Å; D3-F51 HydrophobicContact CB-CB 4.39Å; D3-F51 HydrophobicContact CB-CD1 3.66Å; D3-F51 VanDerWaalsContact OD2-CA 3.25Å; D3-F51 WeakPolarHBondContact OD2-CA 3.49Å; D3-N53 PolarHBondContact OD1-ND2 3.06Å; D3-N53 WeakPolarHBondContact OD2-CB 3.25Å; D3-N53 PolarHBondContact OD2-N 2.82Å
4	L	90.8	Very high	91.8	Very high	14 Å²	14	68.7 Å²	68.7	7%	0.073	34%	0.337	C	S	.	.	H	α-helix	trans	-71.8	-40.4	177.8	-176	59.9	0	0	0	110.8	M1 S2 L6 K7 F8 L36 L75 L78	M1-L4 HydrophobicContact CE-CD2 4.4Å; M1-L4 WeakPolarHBondContact O-CB 3.5Å; M1-L4 PolarHBondContact O-N 3.04Å; S2-L4 VanDerWaalsContact C-N 3.26Å; S2-L4 PolarHBondContact O-N 3.14Å; L4-L6 VanDerWaalsContact C-N 3.31Å; L4-L6 PolarHBondContact O-N 3.11Å; L4-K7 PolarHBondContact O-N 3.47Å; L4-F8 WeakPolarHBondContact O-CB 3.25Å; L4-F8 PolarHBondContact O-N 3.46Å; L4-L36 HydrophobicContact CD1-CD2 4.2Å; L4-L75 HydrophobicContact CD1-CD2 3.73Å; L4-L75 HydrophobicContact CD2-CD2 4.26Å; L4-L78 HydrophobicContact CD1-CD2 3.98Å; L4-L78 HydrophobicContact CD2-CD2 4.1Å; L4-L78 HydrophobicContact CG-CD2 4.21Å
5	Y	91.3	Very high	92.1	Very high	164 Å²	164	66.1 Å²	66.1	64%	0.643	33%	0.325	S	S	*	.	H	α-helix	trans	-60.6	-41.2	173.9	-73.8	-69.1	0	0	0	112	M1 S2 F8 N9	M1-Y5 HydrophobicContact CB-CE2 4.2Å; M1-Y5 VanDerWaalsContact O-CD2 3.31Å; M1-Y5 WeakPolarHBondContact O-CD2 3.48Å; M1-Y5 PolarHBondContact O-N 3.05Å; S2-Y5 WeakPolarHBondContact O-CB 3.4Å; S2-Y5 PolarHBondContact O-N 2.79Å; S2-Y5 VanDerWaalsContact O-N 3.11Å; Y5-F8 PolarHBondContact O-N 3.33Å; Y5-N9 VanDerWaalsContact O-CB 3.29Å; Y5-N9 WeakPolarHBondContact O-CB 3.34Å; Y5-N9 PolarHBondContact O-N 2.8Å
6	L	94.1	Very high	92.1	Very high	105 Å²	105	70.9 Å²	70.9	55%	0.55	35%	0.346	S	S	.	.	H	α-helix	trans	-59.2	-48.2	175.4	-70	172.9	0	0	0	111.2	S2 L4 F8 N9 E10	S2-L6 PolarHBondContact O-N 3.13Å; L4-L6 VanDerWaalsContact C-N 3.31Å; L4-L6 PolarHBondContact O-N 3.11Å; L6-F8 PolarHBondContact O-N 3.35Å; L6-N9 WeakPolarHBondContact O-CB 3.32Å; L6-N9 PolarHBondContact O-N 3.26Å; L6-E10 WeakPolarHBondContact O-CG 3.47Å; L6-E10 PolarHBondContact O-N 3.12Å
7	K	94.6	Very high	91.7	Very high	38 Å²	38	69.1 Å²	69.1	17%	0.165	35%	0.35	C	S	.	.	H	α-helix	trans	-62.7	-41.1	178	-67.1	177.3	-164.9	-50.7	0	112.8	D3 L4 N9 E10 M11 F32 F39 Q50 F51	D3-K7 WeakPolarHBondContact O-CG 3.44Å; D3-K7 PolarHBondContact O-N 3.28Å; L4-K7 PolarHBondContact O-N 3.47Å; K7-N9 VanDerWaalsContact C-N 3.33Å; K7-E10 PolarHBondContact O-N 2.94Å; K7-M11 PolarHBondContact O-N 3.01Å; K7-M11 VanDerWaalsContact O-N 3.15Å; K7-F32 HydrophobicContact CB-CE2 4.18Å; K7-F32 WeakPolarHBondContact O-CE2 3Å; K7-F39 HydrophobicContact CD-CD2 4.32Å; K7-F39 HydrophobicContact CD-CE2 3.54Å; K7-F39 HydrophobicContact CD-CZ 3.74Å; K7-Q50 WeakPolarHBondContact CE-O 3.09Å; K7-Q50 PolarHBondContact NZ-O 3.19Å; K7-F51 HydrophobicContact CD-CE1 4.3Å
8	F	93.5	Very high	91.3	Very high	52 Å²	52	74.3 Å²	74.3	23%	0.228	38%	0.379	C	S	.	.	H	α-helix	trans	-63.9	-41.4	175.2	-177.7	-108.9	0	0	0	111.1	L4 Y5 L6 M11 N12 F32 M82	L4-F8 WeakPolarHBondContact O-CB 3.25Å; L4-F8 PolarHBondContact O-N 3.46Å; Y5-F8 PolarHBondContact O-N 3.33Å; L6-F8 PolarHBondContact O-N 3.35Å; F8-M11 HydrophobicContact CD2-CE 3.67Å; F8-M11 HydrophobicContact CE2-CE 3.52Å; F8-M11 HydrophobicContact CZ-CE 4.34Å; F8-M11 PolarHBondContact O-N 2.69Å; F8-N12 VanDerWaalsContact CD1-ND2 3.31Å; F8-N12 WeakPolarHBondContact CD1-ND2 3.23Å; F8-N12 WeakPolarHBondContact CE1-ND2 3.38Å; F8-N12 PolarHBondContact O-N 2.83Å; F8-F32 HydrophobicContact CB-CZ 4.19Å; F8-F32 HydrophobicContact CD2-CE1 4.06Å; F8-F32 HydrophobicContact CD2-CZ 4.1Å; F8-M82 HydrophobicContact CE2-CE 4.32Å; F8-M82 HydrophobicContact CE2-SD 3.95Å
9	N	94.6	Very high	91.1	Very high	84 Å²	84	78.3 Å²	78.3	45%	0.449	40%	0.396	S	S	.	.	H	α-helix	trans	-65.4	-41	176.6	-169.2	64.2	0	0	0	112.5	Y5 L6 K7 M11 N12 L13	Y5-N9 VanDerWaalsContact O-CB 3.29Å; Y5-N9 WeakPolarHBondContact O-CB 3.34Å; Y5-N9 PolarHBondContact O-N 2.8Å; L6-N9 WeakPolarHBondContact O-CB 3.32Å; L6-N9 PolarHBondContact O-N 3.26Å; K7-N9 VanDerWaalsContact C-N 3.33Å; N9-M11 VanDerWaalsContact C-N 3.26Å; N9-M11 PolarHBondContact O-N 2.82Å; N9-N12 PolarHBondContact O-N 3.28Å; N9-N12 VanDerWaalsContact O-N 3.16Å; N9-L13 WeakPolarHBondContact O-CG 3.43Å; N9-L13 PolarHBondContact O-N 2.95Å
10	E	95.2	Very high	91.2	Very high	111 Å²	111	77.6 Å²	77.6	52%	0.519	39%	0.393	S	S	.	.	H	α-helix	trans	-58	-38.7	173.3	-74.5	168.5	-170.6	0	0	112.4	L6 K7 Q14	L6-E10 WeakPolarHBondContact O-CG 3.47Å; L6-E10 PolarHBondContact O-N 3.12Å; K7-E10 PolarHBondContact O-N 2.94Å; E10-Q14 PolarHBondContact O-N 2.88Å; E10-Q14 PolarHBondContact O-NE2 3.11Å
11	M	95.6	Very high	91.3	Very high	3 Å²	3	77.5 Å²	77.5	2%	0.015	39%	0.393	C	S	.	.	H	α-helix	trans	-69	-45.8	173.7	-178.4	-78.3	-58.5	0	0	110.9	K7 F8 N9 L13 Q14 L15 V28 F32 M82	K7-M11 PolarHBondContact O-N 3.01Å; K7-M11 VanDerWaalsContact O-N 3.15Å; F8-M11 HydrophobicContact CD2-CE 3.67Å; F8-M11 HydrophobicContact CE2-CE 3.52Å; F8-M11 HydrophobicContact CZ-CE 4.34Å; F8-M11 PolarHBondContact O-N 2.69Å; N9-M11 VanDerWaalsContact C-N 3.26Å; N9-M11 PolarHBondContact O-N 2.82Å; M11-L13 VanDerWaalsContact C-N 3.32Å; M11-L13 PolarHBondContact O-N 3.02Å; M11-Q14 WeakPolarHBondContact O-CB 3.32Å; M11-Q14 PolarHBondContact O-N 3.19Å; M11-Q14 VanDerWaalsContact O-N 3.08Å; M11-L15 PolarHBondContact O-N 3.17Å; M11-L15 HydrophobicContact SD-CD1 3.4Å; M11-L15 WeakPolarHBondContact SD-CD1 3.46Å; M11-L15 HydrophobicContact SD-CG 3.88Å; M11-V28 HydrophobicContact CG-CG1 3.85Å; M11-V28 HydrophobicContact SD-CG1 4.27Å; M11-F32 HydrophobicContact CB-CB 4.4Å; M11-F32 HydrophobicContact CB-CD2 3.66Å; M11-F32 HydrophobicContact CB-CE2 4.05Å; M11-F32 HydrophobicContact CB-CG 4.01Å; M11-F32 HydrophobicContact CE-CD1 4.35Å; M11-F32 HydrophobicContact CE-CE1 4.47Å; M11-F32 HydrophobicContact CG-CB 3.69Å; M11-F32 HydrophobicContact CG-CD1 4.26Å; M11-F32 HydrophobicContact CG-CD2 3.88Å; M11-F32 HydrophobicContact CG-CG 3.68Å; M11-M82 HydrophobicContact CE-CE 3.54Å; M11-M82 HydrophobicContact SD-CE 4.39Å
12	N	94.3	Very high	92.3	Very high	37 Å²	37	78.9 Å²	78.9	20%	0.198	40%	0.402	C	S	.	.	H	α-helix	trans	-60	-39.2	177.7	-73.6	-21.9	0	0	0	112.9	F8 N9 Q14 L15 Q16	F8-N12 VanDerWaalsContact CD1-ND2 3.31Å; F8-N12 WeakPolarHBondContact CD1-ND2 3.23Å; F8-N12 WeakPolarHBondContact CE1-ND2 3.38Å; F8-N12 PolarHBondContact O-N 2.83Å; N9-N12 PolarHBondContact O-N 3.28Å; N9-N12 VanDerWaalsContact O-N 3.16Å; N12-Q14 VanDerWaalsContact C-N 3.26Å; N12-Q14 PolarHBondContact O-N 2.89Å; N12-L15 CarbonylContact O-C 3.53Å; N12-L15 WeakPolarHBondContact O-CA 3.47Å; N12-L15 WeakPolarHBondContact O-CB 3.38Å; N12-L15 PolarHBondContact O-N 3.07Å; N12-Q16 WeakPolarHBondContact O-CG 3.41Å; N12-Q16 PolarHBondContact O-N 3.02Å
13	L	95	Very high	92.6	Very high	100 Å²	100	78.2 Å²	78.2	52%	0.524	39%	0.393	S	S	.	.	H	α-helix	trans	-60.1	-37.7	175.7	-74.8	170.3	0	0	0	111.8	N9 M11 L15 Q16	N9-L13 WeakPolarHBondContact O-CG 3.43Å; N9-L13 PolarHBondContact O-N 2.95Å; M11-L13 VanDerWaalsContact C-N 3.32Å; M11-L13 PolarHBondContact O-N 3.02Å; L13-L15 PolarHBondContact O-N 3.08Å; L13-Q16 PolarHBondContact O-N 2.97Å
14	Q	95.1	Very high	92.8	Very high	111 Å²	111	82.3 Å²	82.3	52%	0.519	41%	0.41	S	S	.	.	H	α-helix	trans	-67.1	-25	174.1	-69.4	169.4	71.8	0	0	112.6	E10 M11 N12 V28	E10-Q14 PolarHBondContact O-N 2.88Å; E10-Q14 PolarHBondContact O-NE2 3.11Å; M11-Q14 WeakPolarHBondContact O-CB 3.32Å; M11-Q14 PolarHBondContact O-N 3.19Å; M11-Q14 VanDerWaalsContact O-N 3.08Å; N12-Q14 VanDerWaalsContact C-N 3.26Å; N12-Q14 PolarHBondContact O-N 2.89Å; Q14-V28 HydrophobicContact CB-CG1 3.86Å; Q14-V28 HydrophobicContact CB-CG2 4.08Å
15	L	95.6	Very high	93	Very high	29 Å²	29	82.5 Å²	82.5	15%	0.152	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	1.4	176.6	-62.5	-173.7	0	0	0	114.2	M11 N12 L13 L20 T25 V28 V29 Y86	M11-L15 PolarHBondContact O-N 3.17Å; M11-L15 HydrophobicContact SD-CD1 3.4Å; M11-L15 WeakPolarHBondContact SD-CD1 3.46Å; M11-L15 HydrophobicContact SD-CG 3.88Å; N12-L15 CarbonylContact O-C 3.53Å; N12-L15 WeakPolarHBondContact O-CA 3.47Å; N12-L15 WeakPolarHBondContact O-CB 3.38Å; N12-L15 PolarHBondContact O-N 3.07Å; L13-L15 PolarHBondContact O-N 3.08Å; L15-L20 HydrophobicContact CD2-CD1 4.14Å; L15-L20 VanDerWaalsContact O-CD2 3.23Å; L15-L20 WeakPolarHBondContact O-CD2 3.35Å; L15-T25 HydrophobicContact CD2-CG2 4.01Å; L15-V28 HydrophobicContact CD2-CB 3.97Å; L15-V28 HydrophobicContact CD2-CG1 3.76Å; L15-V28 HydrophobicContact CG-CG1 4.08Å; L15-V29 HydrophobicContact CD1-CG2 4.06Å; L15-V29 HydrophobicContact CD2-CG2 4.39Å; L15-Y86 HydrophobicContact CD1-CE1 4.5Å
16	Q	92.5	Very high	93.3	Very high	144 Å²	144	76.8 Å²	76.8	67%	0.673	39%	0.39	S	S	*	.	S	Bend	trans	-107.7	-3.2	-179.3	-74.8	175.8	-10.2	0	0	113.9	N12 L13	N12-Q16 WeakPolarHBondContact O-CG 3.41Å; N12-Q16 PolarHBondContact O-N 3.02Å; L13-Q16 PolarHBondContact O-N 2.97Å
17	G	85	Confident	93.4	Very high	39 Å²	39	75.9 Å²	75.9	40%	0.402	39%	0.389	S	S	.	.	S	Bend	trans	-73.6	145.1	-176	0	0	0	0	0	114	Q19 L20	G17-Q19 PolarHBondContact O-N 2.8Å; G17-L20 VanDerWaalsContact O-CB 3.23Å; G17-L20 WeakPolarHBondContact O-CB 3.47Å; G17-L20 PolarHBondContact O-N 3.49Å
18	D	85	Confident	93.5	Very high	164 Å²	164	75 Å²	75	88%	0.877	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-21.8	-179.6	-62.1	-25.1	0	0	0	114.4	L20	D18-L20 VanDerWaalsContact C-N 3.35Å
19	Q	87.1	Confident	93.7	Very high	149 Å²	149	72.6 Å²	72.6	70%	0.696	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	19.3	-179.7	-60.2	-59.7	-46.1	0	0	112.9	G17 K24	G17-Q19 PolarHBondContact O-N 2.8Å; Q19-K24 WeakPolarHBondContact O-CD 3.12Å; Q19-K24 PolarHBondContact O-NZ 3.37Å
20	L	93.2	Very high	93.9	Very high	64 Å²	64	73.3 Å²	73.3	34%	0.335	38%	0.376	S	S	.	.			trans	-72.9	133	179	-169.7	74.1	0	0	0	110.9	L15 G17 D18 K24 T25	L15-L20 HydrophobicContact CD2-CD1 4.14Å; L15-L20 VanDerWaalsContact O-CD2 3.23Å; L15-L20 WeakPolarHBondContact O-CD2 3.35Å; G17-L20 VanDerWaalsContact O-CB 3.23Å; G17-L20 WeakPolarHBondContact O-CB 3.47Å; G17-L20 PolarHBondContact O-N 3.49Å; D18-L20 VanDerWaalsContact C-N 3.35Å; L20-K24 HydrophobicContact CD1-CB 4.11Å; L20-T25 WeakPolarHBondContact CD1-OG1 3.43Å; L20-T25 WeakPolarHBondContact CG-OG1 3.23Å
21	N	93.2	Very high	94	Very high	76 Å²	76	70 Å²	70	41%	0.406	37%	0.368	S	S	.	.			trans	-134.3	169	171.3	63.6	41	0	0	0	109.2	I23 K24 T25	N21-I23 PolarHBondContact O-N 2.94Å; N21-I23 WeakPolarHBondContact OD1-CB 3.42Å; N21-I23 PolarHBondContact OD1-N 2.87Å; N21-K24 PolarHBondContact O-N 3.38Å; N21-K24 VanDerWaalsContact O-N 3.11Å; N21-K24 WeakPolarHBondContact OD1-CG 3.26Å; N21-K24 PolarHBondContact OD1-N 3.43Å; N21-T25 PolarHBondContact O-N 3.18Å; N21-T25 PolarHBondContact O-OG1 3.38Å; N21-T25 VanDerWaalsContact O-OG1 3.07Å
22	L	94	Very high	94.2	Very high	102 Å²	102	70.4 Å²	70.4	53%	0.534	37%	0.37	S	S	.	.	H	α-helix	trans	-58.8	-33.1	-175	-63.7	175.3	0	0	0	113.2	K26 I89 M92	L22-K26 WeakPolarHBondContact O-CB 3.35Å; L22-K26 PolarHBondContact O-N 3.25Å; L22-I89 HydrophobicContact CD2-CD1 3.82Å; L22-M92 HydrophobicContact CB-CE 3.75Å; L22-M92 HydrophobicContact CB-SD 3.85Å; L22-M92 HydrophobicContact CD1-SD 4.1Å
23	I	94.5	Very high	94.3	Very high	46 Å²	46	69.1 Å²	69.1	24%	0.236	36%	0.362	C	S	.	.	H	α-helix	trans	-66.5	-47.7	177.5	-62.4	170.6	0	0	0	110.5	N21 K26 T27 I94 V98 L99	N21-I23 PolarHBondContact O-N 2.94Å; N21-I23 WeakPolarHBondContact OD1-CB 3.42Å; N21-I23 PolarHBondContact OD1-N 2.87Å; I23-K26 PolarHBondContact O-N 2.89Å; I23-T27 WeakPolarHBondContact O-CB 3.37Å; I23-T27 PolarHBondContact O-N 3.25Å; I23-T27 PolarHBondContact O-OG1 3.21Å; I23-I94 HydrophobicContact CB-CD1 4.22Å; I23-I94 HydrophobicContact CD1-CG2 4.13Å; I23-I94 HydrophobicContact CG1-CD1 3.93Å; I23-I94 HydrophobicContact CG1-CG1 4.25Å; I23-I94 HydrophobicContact CG1-CG2 4.22Å; I23-I94 HydrophobicContact CG2-CD1 3.98Å; I23-V98 HydrophobicContact CD1-CG1 3.4Å; I23-L99 HydrophobicContact CG2-CD2 4Å
24	K	94.2	Very high	94.5	Very high	96 Å²	96	67.7 Å²	67.7	42%	0.417	36%	0.355	S	S	.	.	H	α-helix	trans	-62.2	-46.3	175.7	-72.8	180	-177.8	175.8	0	110.9	Q19 L20 N21 K26 T27 V28	Q19-K24 WeakPolarHBondContact O-CD 3.12Å; Q19-K24 PolarHBondContact O-NZ 3.37Å; L20-K24 HydrophobicContact CD1-CB 4.11Å; N21-K24 PolarHBondContact O-N 3.38Å; N21-K24 VanDerWaalsContact O-N 3.11Å; N21-K24 WeakPolarHBondContact OD1-CG 3.26Å; N21-K24 PolarHBondContact OD1-N 3.43Å; K24-K26 PolarHBondContact O-N 3.48Å; K24-T27 PolarHBondContact O-N 2.96Å; K24-V28 WeakPolarHBondContact O-CB 3.5Å; K24-V28 WeakPolarHBondContact O-CG2 3.36Å; K24-V28 PolarHBondContact O-N 3.08Å
25	T	96.4	Very high	94.6	Very high	18 Å²	18	67.5 Å²	67.5	11%	0.11	35%	0.353	C	S	.	.	H	α-helix	trans	-55.8	-50.4	175.9	-55.7	0	0	0	0	110.9	L15 L20 N21 T27 V28 V29 I89	L15-T25 HydrophobicContact CD2-CG2 4.01Å; L20-T25 WeakPolarHBondContact CD1-OG1 3.43Å; L20-T25 WeakPolarHBondContact CG-OG1 3.23Å; N21-T25 PolarHBondContact O-N 3.18Å; N21-T25 PolarHBondContact O-OG1 3.38Å; N21-T25 VanDerWaalsContact O-OG1 3.07Å; T25-T27 VanDerWaalsContact C-N 3.31Å; T25-T27 PolarHBondContact O-N 2.86Å; T25-V28 PolarHBondContact O-N 2.94Å; T25-V29 HydrophobicContact CG2-CG2 4.29Å; T25-V29 WeakPolarHBondContact O-CB 3.48Å; T25-V29 VanDerWaalsContact O-CG2 3.25Å; T25-V29 WeakPolarHBondContact O-CG2 3.49Å; T25-V29 PolarHBondContact O-N 3.45Å; T25-I89 HydrophobicContact CG2-CG2 4.08Å
26	K	97.1	Very high	94.7	Very high	44 Å²	44	66.1 Å²	66.1	19%	0.191	35%	0.346	C	S	.	.	H	α-helix	trans	-57.4	-45.7	177.6	-177	-178.9	-179.9	179.8	0	111.6	L22 I23 K24 K30 I89 L90 M92 I94	L22-K26 WeakPolarHBondContact O-CB 3.35Å; L22-K26 PolarHBondContact O-N 3.25Å; I23-K26 PolarHBondContact O-N 2.89Å; K24-K26 PolarHBondContact O-N 3.48Å; K26-K30 WeakPolarHBondContact O-CB 3.35Å; K26-K30 PolarHBondContact O-N 3.36Å; K26-I89 HydrophobicContact CB-CG2 3.79Å; K26-I89 WeakPolarHBondContact CD-O 3.4Å; K26-I89 HydrophobicContact CG-CG2 4.38Å; K26-I89 WeakPolarHBondContact CG-O 3.2Å; K26-L90 WeakPolarHBondContact CE-O 3.44Å; K26-L90 PolarHBondContact NZ-O 3.04Å; K26-M92 HydrophobicContact CB-CE 4.19Å; K26-M92 HydrophobicContact CD-CE 4.18Å; K26-M92 PolarHBondContact NZ-O 2.68Å; K26-I94 HydrophobicContact CD-CD1 3.8Å; K26-I94 HydrophobicContact CD-CG1 4.42Å
27	T	96.3	Very high	94.9	Very high	86 Å²	86	61.3 Å²	61.3	53%	0.528	33%	0.328	S	S	.	.	H	α-helix	trans	-63.8	-49.2	-178.4	-56.8	0	0	0	0	111.7	I23 K24 T25 A31	I23-T27 WeakPolarHBondContact O-CB 3.37Å; I23-T27 PolarHBondContact O-N 3.25Å; I23-T27 PolarHBondContact O-OG1 3.21Å; K24-T27 PolarHBondContact O-N 2.96Å; T25-T27 VanDerWaalsContact C-N 3.31Å; T25-T27 PolarHBondContact O-N 2.86Å; T27-A31 VanDerWaalsContact O-CB 3.26Å; T27-A31 WeakPolarHBondContact O-CB 3.4Å; T27-A31 PolarHBondContact O-N 3.24Å
28	V	97	Very high	95.5	Very high	21 Å²	21	63.3 Å²	63.3	13%	0.127	33%	0.329	C	S	.	.	H	α-helix	trans	-62.1	-49.4	-179.8	169.4	0	0	0	0	111	M11 Q14 L15 K24 T25 A31 F32	M11-V28 HydrophobicContact CG-CG1 3.85Å; M11-V28 HydrophobicContact SD-CG1 4.27Å; Q14-V28 HydrophobicContact CB-CG1 3.86Å; Q14-V28 HydrophobicContact CB-CG2 4.08Å; L15-V28 HydrophobicContact CD2-CB 3.97Å; L15-V28 HydrophobicContact CD2-CG1 3.76Å; L15-V28 HydrophobicContact CG-CG1 4.08Å; K24-V28 WeakPolarHBondContact O-CB 3.5Å; K24-V28 WeakPolarHBondContact O-CG2 3.36Å; K24-V28 PolarHBondContact O-N 3.08Å; T25-V28 PolarHBondContact O-N 2.94Å; V28-A31 PolarHBondContact O-N 3.31Å; V28-F32 WeakPolarHBondContact O-CB 3.25Å; V28-F32 PolarHBondContact O-N 3.45Å
29	V	97.7	Very high	96.1	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-63.6	-47.8	-179.9	172	0	0	0	0	110.9	L15 T25 A31 F32 I33 Y86 L90	L15-V29 HydrophobicContact CD1-CG2 4.06Å; L15-V29 HydrophobicContact CD2-CG2 4.39Å; T25-V29 HydrophobicContact CG2-CG2 4.29Å; T25-V29 WeakPolarHBondContact O-CB 3.48Å; T25-V29 VanDerWaalsContact O-CG2 3.25Å; T25-V29 WeakPolarHBondContact O-CG2 3.49Å; T25-V29 PolarHBondContact O-N 3.45Å; V29-A31 PolarHBondContact O-N 3.4Å; V29-F32 PolarHBondContact O-N 3.06Å; V29-I33 HydrophobicContact CG1-CD1 3.79Å; V29-I33 HydrophobicContact CG1-CG1 4.43Å; V29-I33 WeakPolarHBondContact O-CG1 3.24Å; V29-I33 PolarHBondContact O-N 3.01Å; V29-Y86 HydrophobicContact CB-CD1 4.48Å; V29-Y86 HydrophobicContact CB-CG 4.4Å; V29-Y86 HydrophobicContact CG1-CD1 4.1Å; V29-Y86 HydrophobicContact CG1-CD2 3.72Å; V29-Y86 HydrophobicContact CG1-CE2 4.38Å; V29-Y86 HydrophobicContact CG1-CG 3.55Å; V29-Y86 HydrophobicContact CG2-CD1 3.72Å; V29-Y86 HydrophobicContact CG2-CD2 4.3Å; V29-Y86 HydrophobicContact CG2-CE1 3.72Å; V29-Y86 HydrophobicContact CG2-CE2 4.3Å; V29-Y86 HydrophobicContact CG2-CG 4.02Å; V29-L90 HydrophobicContact CG1-CD2 4.2Å
30	K	97.9	Very high	96.5	Very high	99 Å²	99	55 Å²	55	43%	0.43	28%	0.279	S	S	.	.	H	α-helix	trans	-58.5	-48.5	178.3	175.5	166.1	172	40.2	0	111.3	K26 F32 I33 D34 L90	K26-K30 WeakPolarHBondContact O-CB 3.35Å; K26-K30 PolarHBondContact O-N 3.36Å; K30-F32 VanDerWaalsContact C-N 3.25Å; K30-F32 PolarHBondContact O-N 2.9Å; K30-I33 PolarHBondContact O-N 2.65Å; K30-D34 WeakPolarHBondContact CG-OD2 3.36Å; K30-D34 IonicContact NZ-OD1 3.24Å; K30-D34 PolarHBondContact NZ-OD1 3.36Å; K30-D34 IonicContact NZ-OD2 2.8Å; K30-D34 PolarHBondContact NZ-OD2 3.45Å; K30-D34 WeakPolarHBondContact O-CB 3.44Å; K30-D34 VanDerWaalsContact O-CG 3.25Å; K30-D34 PolarHBondContact O-N 3.38Å; K30-L90 HydrophobicContact CB-CD2 4.03Å
31	A	98.1	Very high	96.7	Very high	43 Å²	43	57.2 Å²	57.2	36%	0.355	29%	0.288	S	S	.	.	H	α-helix	trans	-60.5	-36.3	178.8	0	0	0	0	0	112.2	T27 V28 V29 K35	T27-A31 VanDerWaalsContact O-CB 3.26Å; T27-A31 WeakPolarHBondContact O-CB 3.4Å; T27-A31 PolarHBondContact O-N 3.24Å; V28-A31 PolarHBondContact O-N 3.31Å; V29-A31 PolarHBondContact O-N 3.4Å; A31-K35 WeakPolarHBondContact O-CB 3.49Å; A31-K35 VanDerWaalsContact O-CG 3.24Å; A31-K35 WeakPolarHBondContact O-CG 3.26Å; A31-K35 PolarHBondContact O-N 2.91Å
32	F	98.2	Very high	96.8	Very high	11 Å²	11	54.4 Å²	54.4	5%	0.048	27%	0.273	C	S	.	.	H	α-helix	trans	-68.7	-45.3	175.7	-173.5	-102.7	0	0	0	112.4	K7 F8 M11 V28 V29 K30 D34 K35 L36 L78 M82	K7-F32 HydrophobicContact CB-CE2 4.18Å; K7-F32 WeakPolarHBondContact O-CE2 3Å; F8-F32 HydrophobicContact CB-CZ 4.19Å; F8-F32 HydrophobicContact CD2-CE1 4.06Å; F8-F32 HydrophobicContact CD2-CZ 4.1Å; M11-F32 HydrophobicContact CB-CB 4.4Å; M11-F32 HydrophobicContact CB-CD2 3.66Å; M11-F32 HydrophobicContact CB-CE2 4.05Å; M11-F32 HydrophobicContact CB-CG 4.01Å; M11-F32 HydrophobicContact CE-CD1 4.35Å; M11-F32 HydrophobicContact CE-CE1 4.47Å; M11-F32 HydrophobicContact CG-CB 3.69Å; M11-F32 HydrophobicContact CG-CD1 4.26Å; M11-F32 HydrophobicContact CG-CD2 3.88Å; M11-F32 HydrophobicContact CG-CG 3.68Å; V28-F32 WeakPolarHBondContact O-CB 3.25Å; V28-F32 PolarHBondContact O-N 3.45Å; V29-F32 PolarHBondContact O-N 3.06Å; K30-F32 VanDerWaalsContact C-N 3.25Å; K30-F32 PolarHBondContact O-N 2.9Å; F32-D34 VanDerWaalsContact C-N 3.34Å; F32-D34 PolarHBondContact O-N 2.85Å; F32-K35 WeakPolarHBondContact O-CB 3.5Å; F32-K35 PolarHBondContact O-N 3.16Å; F32-K35 VanDerWaalsContact O-N 3.15Å; F32-L36 HydrophobicContact CD1-CD1 4.19Å; F32-L36 HydrophobicContact CD1-CG 4.32Å; F32-L36 HydrophobicContact CE1-CD1 3.92Å; F32-L36 HydrophobicContact CE1-CD2 4Å; F32-L36 HydrophobicContact CE1-CG 4.08Å; F32-L36 HydrophobicContact CZ-CD2 4Å; F32-L36 WeakPolarHBondContact O-CG 3.29Å; F32-L36 PolarHBondContact O-N 2.96Å; F32-L78 HydrophobicContact CE1-CD2 4.43Å; F32-M82 HydrophobicContact CD1-CE 3.84Å; F32-M82 HydrophobicContact CE1-CE 4.21Å
33	I	98.3	Very high	96.8	Very high	9 Å²	9	49.7 Å²	49.7	5%	0.046	25%	0.248	C	C	.	.	H	α-helix	trans	-58.3	-46.7	175.3	-70.3	170.8	0	0	0	110.8	V29 K30 K35 L36 S37 H79 M82 L90	V29-I33 HydrophobicContact CG1-CD1 3.79Å; V29-I33 HydrophobicContact CG1-CG1 4.43Å; V29-I33 WeakPolarHBondContact O-CG1 3.24Å; V29-I33 PolarHBondContact O-N 3.01Å; K30-I33 PolarHBondContact O-N 2.65Å; I33-K35 VanDerWaalsContact C-N 3.29Å; I33-K35 PolarHBondContact O-N 3.28Å; I33-L36 WeakPolarHBondContact O-CB 3.31Å; I33-L36 PolarHBondContact O-N 3.41Å; I33-L36 VanDerWaalsContact O-N 3.09Å; I33-S37 PolarHBondContact O-N 3.15Å; I33-H79 WeakPolarHBondContact CG2-NE2 3.23Å; I33-M82 HydrophobicContact CD1-CB 4.05Å; I33-M82 HydrophobicContact CG1-CB 3.81Å; I33-L90 HydrophobicContact CD1-CD1 3.63Å; I33-L90 HydrophobicContact CD1-CD2 4.22Å
34	D	98.3	Very high	96.7	Very high	71 Å²	71	50.6 Å²	50.6	38%	0.38	27%	0.268	S	S	.	.	H	α-helix	trans	-60.7	-40.2	177.4	-66.6	-22.4	0	0	0	110.8	K30 F32 L36 S37 I38	K30-D34 WeakPolarHBondContact CG-OD2 3.36Å; K30-D34 IonicContact NZ-OD1 3.24Å; K30-D34 PolarHBondContact NZ-OD1 3.36Å; K30-D34 IonicContact NZ-OD2 2.8Å; K30-D34 PolarHBondContact NZ-OD2 3.45Å; K30-D34 WeakPolarHBondContact O-CB 3.44Å; K30-D34 VanDerWaalsContact O-CG 3.25Å; K30-D34 PolarHBondContact O-N 3.38Å; F32-D34 VanDerWaalsContact C-N 3.34Å; F32-D34 PolarHBondContact O-N 2.85Å; D34-L36 PolarHBondContact O-N 2.94Å; D34-S37 PolarHBondContact O-N 3.36Å; D34-I38 WeakPolarHBondContact O-CG1 3.34Å; D34-I38 PolarHBondContact O-N 3.36Å; D34-I38 VanDerWaalsContact O-N 3.12Å
35	K	97.9	Very high	96.7	Very high	106 Å²	106	54.3 Å²	54.3	46%	0.461	28%	0.28	S	S	.	.	H	α-helix	trans	-61.7	-38.4	173.5	-78.4	172	-177.2	178.1	0	113	A31 F32 I33 S37 I38 F39	A31-K35 WeakPolarHBondContact O-CB 3.49Å; A31-K35 VanDerWaalsContact O-CG 3.24Å; A31-K35 WeakPolarHBondContact O-CG 3.26Å; A31-K35 PolarHBondContact O-N 2.91Å; F32-K35 WeakPolarHBondContact O-CB 3.5Å; F32-K35 PolarHBondContact O-N 3.16Å; F32-K35 VanDerWaalsContact O-N 3.15Å; I33-K35 VanDerWaalsContact C-N 3.29Å; I33-K35 PolarHBondContact O-N 3.28Å; K35-S37 VanDerWaalsContact C-N 3.32Å; K35-S37 PolarHBondContact O-N 3.45Å; K35-I38 PolarHBondContact O-N 2.8Å; K35-F39 HydrophobicContact CB-CE1 4.45Å; K35-F39 HydrophobicContact CB-CE2 3.92Å; K35-F39 HydrophobicContact CB-CZ 3.85Å; K35-F39 HydrophobicContact CD-CZ 4.45Å; K35-F39 HydrophobicContact CG-CZ 4.37Å; K35-F39 WeakPolarHBondContact O-CB 3.38Å; K35-F39 WeakPolarHBondContact O-CD1 3.45Å; K35-F39 VanDerWaalsContact O-CD2 3.24Å; K35-F39 WeakPolarHBondContact O-CD2 3.34Å; K35-F39 WeakPolarHBondContact O-CG 3.42Å; K35-F39 PolarHBondContact O-N 3.37Å
36	L	97.6	Very high	96.5	Very high	1 Å²	1	55 Å²	55	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-60	-43.1	177.3	-64.4	176.2	0	0	0	111.6	L4 F32 I33 D34 F39 R40 L75 L78 H79	L4-L36 HydrophobicContact CD1-CD2 4.2Å; F32-L36 HydrophobicContact CD1-CD1 4.19Å; F32-L36 HydrophobicContact CD1-CG 4.32Å; F32-L36 HydrophobicContact CE1-CD1 3.92Å; F32-L36 HydrophobicContact CE1-CD2 4Å; F32-L36 HydrophobicContact CE1-CG 4.08Å; F32-L36 HydrophobicContact CZ-CD2 4Å; F32-L36 WeakPolarHBondContact O-CG 3.29Å; F32-L36 PolarHBondContact O-N 2.96Å; I33-L36 WeakPolarHBondContact O-CB 3.31Å; I33-L36 PolarHBondContact O-N 3.41Å; I33-L36 VanDerWaalsContact O-N 3.09Å; D34-L36 PolarHBondContact O-N 2.94Å; L36-F39 HydrophobicContact CD2-CD2 4.36Å; L36-F39 PolarHBondContact O-N 3.15Å; L36-R40 PolarHBondContact O-N 3.46Å; L36-L75 HydrophobicContact CD2-CD2 3.86Å; L36-L78 HydrophobicContact CD1-CB 4.38Å; L36-L78 HydrophobicContact CD1-CD2 4.11Å; L36-L78 HydrophobicContact CD1-CG 3.85Å; L36-L78 HydrophobicContact CD2-CD2 3.85Å; L36-L78 HydrophobicContact CD2-CG 4.48Å; L36-H79 HydrophobicContact CB-CB 4.26Å; L36-H79 HydrophobicContact CD1-CB 4.1Å
37	S	97	Very high	96.4	Very high	43 Å²	43	57.2 Å²	57.2	30%	0.301	30%	0.302	S	S	.	.	H	α-helix	trans	-62.8	-43.1	174.7	-70.5	0	0	0	0	112.1	I33 D34 K35 R40 Q41 H79	I33-S37 PolarHBondContact O-N 3.15Å; D34-S37 PolarHBondContact O-N 3.36Å; K35-S37 VanDerWaalsContact C-N 3.32Å; K35-S37 PolarHBondContact O-N 3.45Å; S37-R40 PolarHBondContact O-N 3.24Å; S37-Q41 WeakPolarHBondContact O-CG 3.38Å; S37-Q41 PolarHBondContact O-N 3.26Å; S37-H79 PolarHBondContact OG-CD2 2.85Å; S37-H79 PolarHBondContact OG-NE2 3.07Å
38	I	97.7	Very high	96.2	Very high	81 Å²	81	53.8 Å²	53.8	42%	0.415	28%	0.28	S	S	.	.	H	α-helix	trans	-61.8	-45.5	175.8	-68.3	166.4	0	0	0	110.8	D34 K35 R40 Q41 N42	D34-I38 WeakPolarHBondContact O-CG1 3.34Å; D34-I38 PolarHBondContact O-N 3.36Å; D34-I38 VanDerWaalsContact O-N 3.12Å; K35-I38 PolarHBondContact O-N 2.8Å; I38-R40 VanDerWaalsContact C-N 3.33Å; I38-R40 PolarHBondContact O-N 3.24Å; I38-Q41 PolarHBondContact O-N 3.03Å; I38-N42 WeakPolarHBondContact CG2-ND2 3.43Å; I38-N42 WeakPolarHBondContact O-CB 3.48Å; I38-N42 PolarHBondContact O-N 2.94Å; I38-N42 PolarHBondContact O-ND2 3.19Å
39	F	96.9	Very high	96.1	Very high	18 Å²	18	63.1 Å²	63.1	8%	0.079	31%	0.313	C	S	.	.	H	α-helix	trans	-58.7	-45.4	177.9	-64.2	-25.4	0	0	0	111.6	K7 K35 L36 Q41 N42 L43 Q50 F51 L75	K7-F39 HydrophobicContact CD-CD2 4.32Å; K7-F39 HydrophobicContact CD-CE2 3.54Å; K7-F39 HydrophobicContact CD-CZ 3.74Å; K35-F39 HydrophobicContact CB-CE1 4.45Å; K35-F39 HydrophobicContact CB-CE2 3.92Å; K35-F39 HydrophobicContact CB-CZ 3.85Å; K35-F39 HydrophobicContact CD-CZ 4.45Å; K35-F39 HydrophobicContact CG-CZ 4.37Å; K35-F39 WeakPolarHBondContact O-CB 3.38Å; K35-F39 WeakPolarHBondContact O-CD1 3.45Å; K35-F39 VanDerWaalsContact O-CD2 3.24Å; K35-F39 WeakPolarHBondContact O-CD2 3.34Å; K35-F39 WeakPolarHBondContact O-CG 3.42Å; K35-F39 PolarHBondContact O-N 3.37Å; L36-F39 HydrophobicContact CD2-CD2 4.36Å; L36-F39 PolarHBondContact O-N 3.15Å; F39-Q41 PolarHBondContact O-N 2.91Å; F39-N42 PolarHBondContact O-N 2.98Å; F39-L43 WeakPolarHBondContact O-CG 3.33Å; F39-L43 PolarHBondContact O-N 3.28Å; F39-Q50 HydrophobicContact CD1-CB 4.1Å; F39-Q50 HydrophobicContact CD1-CG 4.03Å; F39-Q50 HydrophobicContact CE1-CB 4.01Å; F39-Q50 HydrophobicContact CE1-CG 3.91Å; F39-F51 HydrophobicContact CB-CE2 3.84Å; F39-F51 HydrophobicContact CB-CZ 3.82Å; F39-F51 HydrophobicContact CD1-CE2 4.46Å; F39-F51 HydrophobicContact CD2-CZ 4.01Å; F39-F51 HydrophobicContact CG-CE2 4.09Å; F39-F51 AromaticContact CG-CZ 3.88Å; F39-F51 HydrophobicContact CG-CZ 3.88Å; F39-L75 HydrophobicContact CB-CD1 3.86Å; F39-L75 HydrophobicContact CB-CD2 4.38Å; F39-L75 HydrophobicContact CD2-CD2 4.49Å
40	R	96	Very high	95.9	Very high	120 Å²	120	65.6 Å²	65.6	45%	0.453	32%	0.324	S	S	.	.	H	α-helix	trans	-60.4	-45	177.4	-176.6	-179	177.6	178.5	1.9	111.8	L36 S37 I38 N42 L43 G44 C72 L75 S76	L36-R40 PolarHBondContact O-N 3.46Å; S37-R40 PolarHBondContact O-N 3.24Å; I38-R40 VanDerWaalsContact C-N 3.33Å; I38-R40 PolarHBondContact O-N 3.24Å; R40-N42 VanDerWaalsContact C-N 3.34Å; R40-N42 PolarHBondContact O-N 3.18Å; R40-L43 PolarHBondContact O-N 3.18Å; R40-G44 PolarHBondContact O-N 3.31Å; R40-G44 VanDerWaalsContact O-N 3.09Å; R40-C72 HydrophobicContact CG-CB 4.3Å; R40-L75 HydrophobicContact CB-CB 4.44Å; R40-L75 HydrophobicContact CB-CD1 4.17Å; R40-S76 WeakPolarHBondContact CD-OG 3.48Å; R40-S76 PolarHBondContact NE-OG 2.91Å; R40-S76 PolarHBondContact NH1-OG 2.9Å
41	Q	96.6	Very high	95.7	Very high	111 Å²	111	60.9 Å²	60.9	52%	0.519	30%	0.304	S	S	.	.	H	α-helix	trans	-62.1	-42.8	177.9	-70.7	174.2	14.7	0	0	111.9	S37 I38 F39 G44 R45	S37-Q41 WeakPolarHBondContact O-CG 3.38Å; S37-Q41 PolarHBondContact O-N 3.26Å; I38-Q41 PolarHBondContact O-N 3.03Å; F39-Q41 PolarHBondContact O-N 2.91Å; Q41-G44 PolarHBondContact O-N 3.23Å; Q41-R45 WeakPolarHBondContact O-CG 3.44Å; Q41-R45 PolarHBondContact O-N 2.76Å; Q41-R45 VanDerWaalsContact O-N 3.13Å
42	N	96.1	Very high	95.5	Very high	17 Å²	17	62.2 Å²	62.2	9%	0.091	31%	0.308	C	S	.	.	H	α-helix	trans	-66.5	-42	180	-68.1	-11.9	0	0	0	111.7	I38 F39 R40 G44 R45 G46 E47 Q50	I38-N42 WeakPolarHBondContact CG2-ND2 3.43Å; I38-N42 WeakPolarHBondContact O-CB 3.48Å; I38-N42 PolarHBondContact O-N 2.94Å; I38-N42 PolarHBondContact O-ND2 3.19Å; F39-N42 PolarHBondContact O-N 2.98Å; R40-N42 VanDerWaalsContact C-N 3.34Å; R40-N42 PolarHBondContact O-N 3.18Å; N42-G44 VanDerWaalsContact C-N 3.29Å; N42-G44 PolarHBondContact O-N 3.08Å; N42-R45 CarbonylContact O-C 3.4Å; N42-R45 WeakPolarHBondContact O-CA 3.19Å; N42-R45 PolarHBondContact O-N 3.19Å; N42-G46 PolarHBondContact O-N 3.14Å; N42-G46 VanDerWaalsContact O-N 3.16Å; N42-E47 CarbonylContact C-O 3.48Å; N42-E47 HydrophobicContact CB-CB 4.03Å; N42-E47 WeakPolarHBondContact O-CB 3.5Å; N42-E47 PolarHBondContact O-N 3.36Å; N42-Q50 PolarHBondContact ND2-NE2 3.09Å
43	L	94	Very high	95.2	Very high	2 Å²	2	65.8 Å²	65.8	1%	0.01	33%	0.328	C	S	.	.	H	α-helix	trans	-58.1	-42.2	172.2	-69.6	-177.9	0	0	0	111.8	F39 R40 R45 G46 Y48 F51 L54 I68 F71 L75	F39-L43 WeakPolarHBondContact O-CG 3.33Å; F39-L43 PolarHBondContact O-N 3.28Å; R40-L43 PolarHBondContact O-N 3.18Å; L43-R45 PolarHBondContact O-N 3.44Å; L43-G46 PolarHBondContact O-N 2.92Å; L43-Y48 HydrophobicContact CD2-CD1 3.58Å; L43-Y48 HydrophobicContact CD2-CE1 3.98Å; L43-F51 HydrophobicContact CD1-CE2 4.22Å; L43-F51 HydrophobicContact CD2-CD2 3.88Å; L43-F51 HydrophobicContact CD2-CE2 4.11Å; L43-F51 HydrophobicContact CG-CD2 4.44Å; L43-F51 HydrophobicContact CG-CE2 4.16Å; L43-L54 HydrophobicContact CD2-CD1 3.8Å; L43-I68 HydrophobicContact CB-CG2 4.43Å; L43-F71 HydrophobicContact CD1-CB 3.88Å; L43-L75 HydrophobicContact CD1-CD1 3.62Å
44	G	91.4	Very high	94.9	Very high	65 Å²	65	65.6 Å²	65.6	67%	0.67	33%	0.327	S	S	*	.	H	α-helix	trans	-63.5	-24.5	175.2	0	0	0	0	0	114.3	R40 Q41 N42	R40-G44 PolarHBondContact O-N 3.31Å; R40-G44 VanDerWaalsContact O-N 3.09Å; Q41-G44 PolarHBondContact O-N 3.23Å; N42-G44 VanDerWaalsContact C-N 3.29Å; N42-G44 PolarHBondContact O-N 3.08Å
45	R	93.7	Very high	94.6	Very high	174 Å²	174	64 Å²	64	66%	0.657	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-2	174	-66.7	175.3	-177	-177.6	2.3	113.3	Q41 N42 L43 E47	Q41-R45 WeakPolarHBondContact O-CG 3.44Å; Q41-R45 PolarHBondContact O-N 2.76Å; Q41-R45 VanDerWaalsContact O-N 3.13Å; N42-R45 CarbonylContact O-C 3.4Å; N42-R45 WeakPolarHBondContact O-CA 3.19Å; N42-R45 PolarHBondContact O-N 3.19Å; L43-R45 PolarHBondContact O-N 3.44Å; R45-E47 VanDerWaalsContact C-N 3.34Å; R45-E47 HydrophobicContact CB-CG 4.25Å
46	G	92.4	Very high	94.4	Very high	34 Å²	34	62.6 Å²	62.6	35%	0.351	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.6	22.3	-174.3	0	0	0	0	0	114.1	N42 L43 Y48	N42-G46 PolarHBondContact O-N 3.14Å; N42-G46 VanDerWaalsContact O-N 3.16Å; L43-G46 PolarHBondContact O-N 2.92Å; G46-Y48 WeakPolarHBondContact CA-OH 3.39Å; G46-Y48 VanDerWaalsContact O-CD2 3.3Å; G46-Y48 WeakPolarHBondContact O-CD2 3.4Å; G46-Y48 WeakPolarHBondContact O-CE2 3.24Å
47	E	94.6	Very high	94.1	Very high	89 Å²	89	65.6 Å²	65.6	42%	0.416	33%	0.332	S	S	.	.			trans	-95.9	104.4	176.4	-65.7	178.6	-151.9	0	0	110.2	N42 R45 Q50	N42-E47 CarbonylContact C-O 3.48Å; N42-E47 HydrophobicContact CB-CB 4.03Å; N42-E47 WeakPolarHBondContact O-CB 3.5Å; N42-E47 PolarHBondContact O-N 3.36Å; R45-E47 VanDerWaalsContact C-N 3.34Å; R45-E47 HydrophobicContact CB-CG 4.25Å; E47-Q50 PolarHBondContact O-OE1 3.24Å
48	Y	93.5	Very high	93.8	Very high	15 Å²	15	68.8 Å²	68.8	6%	0.059	34%	0.34	C	S	.	.			trans	-104.2	1.8	-173	-50.2	-68.9	0	0	0	114.5	L43 G46 Q50 F51 L54 K58 L63 I68	L43-Y48 HydrophobicContact CD2-CD1 3.58Å; L43-Y48 HydrophobicContact CD2-CE1 3.98Å; G46-Y48 WeakPolarHBondContact CA-OH 3.39Å; G46-Y48 VanDerWaalsContact O-CD2 3.3Å; G46-Y48 WeakPolarHBondContact O-CD2 3.4Å; G46-Y48 WeakPolarHBondContact O-CE2 3.24Å; Y48-Q50 PolarHBondContact O-N 3.46Å; Y48-F51 CarbonylContact O-C 3.49Å; Y48-F51 WeakPolarHBondContact O-CA 3.48Å; Y48-F51 PolarHBondContact O-N 2.97Å; Y48-F51 VanDerWaalsContact O-O 3.13Å; Y48-L54 HydrophobicContact CD1-CB 4.33Å; Y48-K58 HydrophobicContact CD2-CB 3.87Å; Y48-K58 HydrophobicContact CD2-CG 3.82Å; Y48-K58 HydrophobicContact CE2-CB 4.08Å; Y48-K58 HydrophobicContact CE2-CD 3.91Å; Y48-K58 HydrophobicContact CE2-CG 3.68Å; Y48-L63 HydrophobicContact CD1-CD2 4.03Å; Y48-L63 HydrophobicContact CD2-CD2 4.27Å; Y48-L63 HydrophobicContact CE1-CD2 3.54Å; Y48-L63 HydrophobicContact CE2-CD2 3.81Å; Y48-L63 HydrophobicContact CG-CD2 4.37Å; Y48-L63 VanDerWaalsContact CZ-CD2 3.41Å; Y48-I68 HydrophobicContact CE1-CD1 4.2Å; Y48-I68 HydrophobicContact CE1-CG1 4.24Å; Y48-I68 WeakPolarHBondContact OH-CD1 3.14Å
49	R	93.7	Very high	93.5	Very high	217 Å²	217	71.4 Å²	71.4	82%	0.819	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-26.8	-171.4	-65.3	-179	-176.8	164.5	1.7	114.3	F51	R49-F51 VanDerWaalsContact C-N 3.26Å; R49-F51 PolarHBondContact O-N 2.85Å
50	Q	94.1	Very high	93.3	Very high	52 Å²	52	77 Å²	77	24%	0.243	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-13.8	177.1	-55	90.2	-9	0	0	113.5	K7 F39 N42 E47 Y48	K7-Q50 WeakPolarHBondContact CE-O 3.09Å; K7-Q50 PolarHBondContact NZ-O 3.19Å; F39-Q50 HydrophobicContact CD1-CB 4.1Å; F39-Q50 HydrophobicContact CD1-CG 4.03Å; F39-Q50 HydrophobicContact CE1-CB 4.01Å; F39-Q50 HydrophobicContact CE1-CG 3.91Å; N42-Q50 PolarHBondContact ND2-NE2 3.09Å; E47-Q50 PolarHBondContact O-OE1 3.24Å; Y48-Q50 PolarHBondContact O-N 3.46Å
51	F	94.2	Very high	92.9	Very high	0 Å²	0	74.6 Å²	74.6	0%	0	39%	0.392	C	S	.	.			trans	-124.4	83.7	-177.5	-61.7	-78.7	0	0	0	109.4	D3 K7 F39 L43 Y48 R49 N53 L54 D55 L75	D3-F51 HydrophobicContact CB-CB 4.39Å; D3-F51 HydrophobicContact CB-CD1 3.66Å; D3-F51 VanDerWaalsContact OD2-CA 3.25Å; D3-F51 WeakPolarHBondContact OD2-CA 3.49Å; K7-F51 HydrophobicContact CD-CE1 4.3Å; F39-F51 HydrophobicContact CB-CE2 3.84Å; F39-F51 HydrophobicContact CB-CZ 3.82Å; F39-F51 HydrophobicContact CD1-CE2 4.46Å; F39-F51 HydrophobicContact CD2-CZ 4.01Å; F39-F51 HydrophobicContact CG-CE2 4.09Å; F39-F51 AromaticContact CG-CZ 3.88Å; F39-F51 HydrophobicContact CG-CZ 3.88Å; L43-F51 HydrophobicContact CD1-CE2 4.22Å; L43-F51 HydrophobicContact CD2-CD2 3.88Å; L43-F51 HydrophobicContact CD2-CE2 4.11Å; L43-F51 HydrophobicContact CG-CD2 4.44Å; L43-F51 HydrophobicContact CG-CE2 4.16Å; Y48-F51 CarbonylContact O-C 3.49Å; Y48-F51 WeakPolarHBondContact O-CA 3.48Å; Y48-F51 PolarHBondContact O-N 2.97Å; Y48-F51 VanDerWaalsContact O-O 3.13Å; R49-F51 VanDerWaalsContact C-N 3.26Å; R49-F51 PolarHBondContact O-N 2.85Å; F51-N53 PolarHBondContact O-N 3.35Å; F51-N53 VanDerWaalsContact O-N 3.11Å; F51-L54 HydrophobicContact CB-CB 3.87Å; F51-L54 HydrophobicContact CB-CD1 3.86Å; F51-L54 HydrophobicContact CB-CG 4Å; F51-L54 HydrophobicContact CD2-CD1 4.3Å; F51-L54 HydrophobicContact CG-CD1 4.08Å; F51-L54 WeakPolarHBondContact O-CA 3.42Å; F51-L54 WeakPolarHBondContact O-CB 3.04Å; F51-L54 PolarHBondContact O-N 3.48Å; F51-D55 PolarHBondContact O-N 3.44Å; F51-L75 HydrophobicContact CZ-CD1 4.35Å; F51-L75 HydrophobicContact CZ-CD2 4.39Å
52	P	93.7	Very high	92.3	Very high	70 Å²	70	71 Å²	71	46%	0.455	39%	0.385	S	S	.	.	H	α-helix	trans	-50.7	-38.4	-176.1	-29	35.8	0	0	0	114	L54 D55 D56	P52-L54 PolarHBondContact O-N 2.83Å; P52-D55 PolarHBondContact O-N 3.34Å; P52-D56 WeakPolarHBondContact O-CB 3.47Å; P52-D56 VanDerWaalsContact O-CG 3.28Å; P52-D56 PolarHBondContact O-N 3.35Å
53	N	91.7	Very high	91.7	Very high	86 Å²	86	71 Å²	71	46%	0.46	39%	0.385	S	S	.	.	H	α-helix	trans	-67.5	-35.3	178.8	-71.6	-63.2	0	0	0	112.4	S2 D3 F51 L57	S2-N53 PolarHBondContact OG-ND2 3.21Å; D3-N53 PolarHBondContact OD1-ND2 3.06Å; D3-N53 WeakPolarHBondContact OD2-CB 3.25Å; D3-N53 PolarHBondContact OD2-N 2.82Å; F51-N53 PolarHBondContact O-N 3.35Å; F51-N53 VanDerWaalsContact O-N 3.11Å; N53-L57 WeakPolarHBondContact O-CB 3.04Å; N53-L57 PolarHBondContact O-N 3.09Å; N53-L57 VanDerWaalsContact O-N 3.12Å
54	L	91.7	Very high	91.5	Very high	5 Å²	5	76.4 Å²	76.4	3%	0.026	41%	0.413	C	S	.	.	H	α-helix	trans	-74	-39	173.9	-71.4	-177.2	0	0	0	112	L43 Y48 F51 P52 D56 L57 K58 L63 V67 F71	L43-L54 HydrophobicContact CD2-CD1 3.8Å; Y48-L54 HydrophobicContact CD1-CB 4.33Å; F51-L54 HydrophobicContact CB-CB 3.87Å; F51-L54 HydrophobicContact CB-CD1 3.86Å; F51-L54 HydrophobicContact CB-CG 4Å; F51-L54 HydrophobicContact CD2-CD1 4.3Å; F51-L54 HydrophobicContact CG-CD1 4.08Å; F51-L54 WeakPolarHBondContact O-CA 3.42Å; F51-L54 WeakPolarHBondContact O-CB 3.04Å; F51-L54 PolarHBondContact O-N 3.48Å; P52-L54 PolarHBondContact O-N 2.83Å; L54-D56 VanDerWaalsContact C-N 3.34Å; L54-L57 PolarHBondContact O-N 3.3Å; L54-K58 WeakPolarHBondContact O-CB 3.5Å; L54-K58 PolarHBondContact O-N 3.12Å; L54-L63 HydrophobicContact CD2-CD1 3.86Å; L54-V67 HydrophobicContact CD2-CG1 4.22Å; L54-F71 HydrophobicContact CD1-CD1 3.68Å; L54-F71 HydrophobicContact CD1-CD2 4.3Å; L54-F71 HydrophobicContact CD1-CE1 3.65Å; L54-F71 HydrophobicContact CD1-CE2 4.29Å; L54-F71 HydrophobicContact CD1-CG 3.97Å; L54-F71 HydrophobicContact CD1-CZ 3.92Å; L54-F71 HydrophobicContact CD2-CD2 4.11Å; L54-F71 HydrophobicContact CD2-CE1 4.27Å; L54-F71 HydrophobicContact CD2-CE2 3.63Å; L54-F71 HydrophobicContact CD2-CZ 3.66Å; L54-F71 HydrophobicContact CG-CD1 4.48Å; L54-F71 HydrophobicContact CG-CE1 3.99Å; L54-F71 HydrophobicContact CG-CE2 4.26Å; L54-F71 HydrophobicContact CG-CZ 3.82Å
55	D	93.3	Very high	91.4	Very high	38 Å²	38	79 Å²	79	20%	0.203	41%	0.412	C	S	.	.	H	α-helix	trans	-62.3	-43.6	177.8	-165.3	54.7	0	0	0	110.9	F51 P52 K58 K59	F51-D55 PolarHBondContact O-N 3.44Å; P52-D55 PolarHBondContact O-N 3.34Å; D55-K58 WeakPolarHBondContact O-CB 3.41Å; D55-K58 PolarHBondContact O-N 3.32Å; D55-K59 WeakPolarHBondContact O-CG 3.49Å; D55-K59 PolarHBondContact O-N 3.47Å; D55-K59 WeakPolarHBondContact OD2-CE 3.4Å; D55-K59 IonicContact OD2-NZ 2.67Å; D55-K59 PolarHBondContact OD2-NZ 3.29Å
56	D	92.6	Very high	91.3	Very high	77 Å²	77	75.9 Å²	75.9	41%	0.412	41%	0.408	S	S	.	.	H	α-helix	trans	-67.8	-40.5	175.8	-70	-16.1	0	0	0	111.8	P52 L54 K58 K59 N60	P52-D56 WeakPolarHBondContact O-CB 3.47Å; P52-D56 VanDerWaalsContact O-CG 3.28Å; P52-D56 PolarHBondContact O-N 3.35Å; L54-D56 VanDerWaalsContact C-N 3.34Å; D56-K58 VanDerWaalsContact C-N 3.27Å; D56-K58 PolarHBondContact O-N 3.41Å; D56-K59 PolarHBondContact O-N 3.35Å; D56-K59 IonicContact OD1-NZ 3.3Å; D56-K59 PolarHBondContact OD1-NZ 3.4Å; D56-N60 WeakPolarHBondContact O-CB 3.35Å; D56-N60 VanDerWaalsContact O-CG 3.3Å; D56-N60 PolarHBondContact O-N 3.33Å; D56-N60 PolarHBondContact O-ND2 2.96Å
57	L	91	Very high	91.1	Very high	64 Å²	64	76.5 Å²	76.5	34%	0.335	41%	0.405	S	S	.	.	H	α-helix	trans	-61.5	-37.5	174	-172.5	62.4	0	0	0	111.7	N53 L54 G61 G62 L63	N53-L57 WeakPolarHBondContact O-CB 3.04Å; N53-L57 PolarHBondContact O-N 3.09Å; N53-L57 VanDerWaalsContact O-N 3.12Å; L54-L57 PolarHBondContact O-N 3.3Å; L57-G61 PolarHBondContact O-N 2.89Å; L57-G62 PolarHBondContact O-N 2.67Å; L57-L63 HydrophobicContact CD2-CB 4.43Å; L57-L63 HydrophobicContact CD2-CD1 3.78Å; L57-L63 HydrophobicContact CG-CB 4.14Å; L57-L63 HydrophobicContact CG-CD1 4.33Å; L57-L63 PolarHBondContact O-N 3.49Å
58	K	91	Very high	91	Very high	110 Å²	110	73.3 Å²	73.3	48%	0.478	39%	0.39	S	S	.	.	H	α-helix	trans	-66	-46.8	174.9	-179.3	61	176.6	-179.7	0	111.9	Y48 L54 D55 D56 N60 G61 L63	Y48-K58 HydrophobicContact CD2-CB 3.87Å; Y48-K58 HydrophobicContact CD2-CG 3.82Å; Y48-K58 HydrophobicContact CE2-CB 4.08Å; Y48-K58 HydrophobicContact CE2-CD 3.91Å; Y48-K58 HydrophobicContact CE2-CG 3.68Å; L54-K58 WeakPolarHBondContact O-CB 3.5Å; L54-K58 PolarHBondContact O-N 3.12Å; D55-K58 WeakPolarHBondContact O-CB 3.41Å; D55-K58 PolarHBondContact O-N 3.32Å; D56-K58 VanDerWaalsContact C-N 3.27Å; D56-K58 PolarHBondContact O-N 3.41Å; K58-N60 PolarHBondContact O-N 2.82Å; K58-G61 PolarHBondContact O-N 3Å; K58-L63 HydrophobicContact CB-CB 4.23Å; K58-L63 HydrophobicContact CB-CD2 3.95Å; K58-L63 HydrophobicContact CD-CB 4.2Å; K58-L63 HydrophobicContact CD-CD2 4.13Å; K58-L63 HydrophobicContact CG-CD2 4.49Å
59	K	91.8	Very high	90.9	Very high	136 Å²	136	79.3 Å²	79.3	59%	0.591	41%	0.413	S	S	*	.	H	α-helix	trans	-59.7	-36	178.3	-71.9	169.5	-164.8	152.6	0	112.2	D55 D56 G61	D55-K59 WeakPolarHBondContact O-CG 3.49Å; D55-K59 PolarHBondContact O-N 3.47Å; D55-K59 WeakPolarHBondContact OD2-CE 3.4Å; D55-K59 IonicContact OD2-NZ 2.67Å; D55-K59 PolarHBondContact OD2-NZ 3.29Å; D56-K59 PolarHBondContact O-N 3.35Å; D56-K59 IonicContact OD1-NZ 3.3Å; D56-K59 PolarHBondContact OD1-NZ 3.4Å; K59-G61 PolarHBondContact O-N 2.94Å
60	N	92.5	Very high	90.8	Very high	135 Å²	135	71.5 Å²	71.5	72%	0.722	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	4.7	178.1	-64.9	-36	0	0	0	113.6	D56 K58 G62	D56-N60 WeakPolarHBondContact O-CB 3.35Å; D56-N60 VanDerWaalsContact O-CG 3.3Å; D56-N60 PolarHBondContact O-N 3.33Å; D56-N60 PolarHBondContact O-ND2 2.96Å; K58-N60 PolarHBondContact O-N 2.82Å; N60-G62 PolarHBondContact O-N 3.11Å
61	G	86.8	Confident	90.7	Very high	70 Å²	70	69.9 Å²	69.9	72%	0.722	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.1	9.5	179.2	0	0	0	0	0	114.9	L57 K58 K59	L57-G61 PolarHBondContact O-N 2.89Å; K58-G61 PolarHBondContact O-N 3Å; K59-G61 PolarHBondContact O-N 2.94Å
62	G	84.3	Confident	90.7	Very high	35 Å²	35	70.7 Å²	70.7	36%	0.361	39%	0.389	S	S	.	.			trans	-93.1	-1	-175.6	0	0	0	0	0	114.9	L57 N60 L64	L57-G62 PolarHBondContact O-N 2.67Å; N60-G62 PolarHBondContact O-N 3.11Å; G62-L64 PolarHBondContact O-N 3.45Å
63	L	84.9	Confident	90.7	Very high	17 Å²	17	71.1 Å²	71.1	9%	0.089	39%	0.388	C	S	.	.			trans	-82.9	105.3	-175.5	-172.6	64.6	0	0	0	111	Y48 L54 L57 K58 V67 I68	Y48-L63 HydrophobicContact CD1-CD2 4.03Å; Y48-L63 HydrophobicContact CD2-CD2 4.27Å; Y48-L63 HydrophobicContact CE1-CD2 3.54Å; Y48-L63 HydrophobicContact CE2-CD2 3.81Å; Y48-L63 HydrophobicContact CG-CD2 4.37Å; Y48-L63 VanDerWaalsContact CZ-CD2 3.41Å; L54-L63 HydrophobicContact CD2-CD1 3.86Å; L57-L63 HydrophobicContact CD2-CB 4.43Å; L57-L63 HydrophobicContact CD2-CD1 3.78Å; L57-L63 HydrophobicContact CG-CB 4.14Å; L57-L63 HydrophobicContact CG-CD1 4.33Å; L57-L63 PolarHBondContact O-N 3.49Å; K58-L63 HydrophobicContact CB-CB 4.23Å; K58-L63 HydrophobicContact CB-CD2 3.95Å; K58-L63 HydrophobicContact CD-CB 4.2Å; K58-L63 HydrophobicContact CD-CD2 4.13Å; K58-L63 HydrophobicContact CG-CD2 4.49Å; L63-V67 HydrophobicContact CD1-CB 4.16Å; L63-V67 HydrophobicContact CD1-CG1 3.91Å; L63-I68 HydrophobicContact CD1-CG1 4.01Å; L63-I68 HydrophobicContact CD2-CD1 3.78Å; L63-I68 HydrophobicContact CD2-CG1 3.79Å; L63-I68 HydrophobicContact CG-CD1 3.94Å; L63-I68 HydrophobicContact CG-CG1 3.82Å
64	L	88.1	Confident	90.8	Very high	115 Å²	115	70.4 Å²	70.4	60%	0.602	38%	0.381	S	S	*	.			trans	-82.3	147	175.1	-56.7	176.1	0	0	0	111.3	G62 D66 V67 I68	G62-L64 PolarHBondContact O-N 3.45Å; L64-D66 PolarHBondContact O-N 2.92Å; L64-V67 HydrophobicContact CB-CG2 4.19Å; L64-V67 WeakPolarHBondContact O-CB 3.42Å; L64-V67 PolarHBondContact O-N 2.71Å; L64-I68 PolarHBondContact O-N 3.45Å
65	D	89.6	Confident	91	Very high	121 Å²	121	70.3 Å²	70.3	65%	0.647	38%	0.381	S	S	*	.	H	α-helix	trans	-58.6	-33.8	177.8	-68.7	-18.4	0	0	0	112.6	V67 I68 R69	D65-V67 VanDerWaalsContact C-N 3.3Å; D65-V67 PolarHBondContact O-N 3.26Å; D65-I68 PolarHBondContact O-N 2.86Å; D65-R69 PolarHBondContact O-N 2.96Å
66	D	91.2	Very high	91.1	Very high	108 Å²	108	69.2 Å²	69.2	58%	0.578	38%	0.376	S	S	*	.	H	α-helix	trans	-66.7	-31.9	177.1	-68.2	-23.9	0	0	0	112.6	L64 R69 S70	L64-D66 PolarHBondContact O-N 2.92Å; D66-R69 PolarHBondContact O-N 3.22Å; D66-R69 IonicContact OD1-CZ 3.9Å; D66-R69 IonicContact OD1-NH1 2.77Å; D66-R69 PolarHBondContact OD1-NH1 3.11Å; D66-S70 WeakPolarHBondContact O-CB 3.32Å; D66-S70 PolarHBondContact O-N 3.2Å
67	V	88.8	Confident	91.3	Very high	46 Å²	46	71.6 Å²	71.6	28%	0.279	39%	0.387	S	S	.	.	H	α-helix	trans	-67.5	-44.1	173.9	176.4	0	0	0	0	109.7	L54 L63 L64 D65 R69 S70 F71	L54-V67 HydrophobicContact CD2-CG1 4.22Å; L63-V67 HydrophobicContact CD1-CB 4.16Å; L63-V67 HydrophobicContact CD1-CG1 3.91Å; L64-V67 HydrophobicContact CB-CG2 4.19Å; L64-V67 WeakPolarHBondContact O-CB 3.42Å; L64-V67 PolarHBondContact O-N 2.71Å; D65-V67 VanDerWaalsContact C-N 3.3Å; D65-V67 PolarHBondContact O-N 3.26Å; V67-R69 VanDerWaalsContact C-N 3.35Å; V67-R69 PolarHBondContact O-N 2.96Å; V67-S70 PolarHBondContact O-N 2.92Å; V67-F71 HydrophobicContact CG1-CD2 4.05Å; V67-F71 HydrophobicContact CG1-CE2 4.07Å; V67-F71 WeakPolarHBondContact O-CD2 3.3Å; V67-F71 PolarHBondContact O-N 3.45Å
68	I	91.7	Very high	91.5	Very high	22 Å²	22	70.1 Å²	70.1	11%	0.113	38%	0.379	C	S	.	.	H	α-helix	trans	-61.6	-45.8	177	-60	166.4	0	0	0	110.1	L43 Y48 L63 L64 D65 S70 F71 C72	L43-I68 HydrophobicContact CB-CG2 4.43Å; Y48-I68 HydrophobicContact CE1-CD1 4.2Å; Y48-I68 HydrophobicContact CE1-CG1 4.24Å; Y48-I68 WeakPolarHBondContact OH-CD1 3.14Å; L63-I68 HydrophobicContact CD1-CG1 4.01Å; L63-I68 HydrophobicContact CD2-CD1 3.78Å; L63-I68 HydrophobicContact CD2-CG1 3.79Å; L63-I68 HydrophobicContact CG-CD1 3.94Å; L63-I68 HydrophobicContact CG-CG1 3.82Å; L64-I68 PolarHBondContact O-N 3.45Å; D65-I68 PolarHBondContact O-N 2.86Å; I68-S70 PolarHBondContact O-N 3.41Å; I68-F71 PolarHBondContact O-N 2.93Å; I68-C72 PolarHBondContact O-N 2.97Å; I68-C72 PolarHBondContact O-SG 2.94Å
69	R	92.8	Very high	91.8	Very high	142 Å²	142	67.4 Å²	67.4	54%	0.536	37%	0.367	S	S	.	.	H	α-helix	trans	-57.6	-49.3	176.8	-172	178.1	-62.1	117.6	5.6	111.1	D65 D66 V67 F71 C72 D73	D65-R69 PolarHBondContact O-N 2.96Å; D66-R69 PolarHBondContact O-N 3.22Å; D66-R69 IonicContact OD1-CZ 3.9Å; D66-R69 IonicContact OD1-NH1 2.77Å; D66-R69 PolarHBondContact OD1-NH1 3.11Å; V67-R69 VanDerWaalsContact C-N 3.35Å; V67-R69 PolarHBondContact O-N 2.96Å; R69-F71 VanDerWaalsContact C-N 3.31Å; R69-F71 PolarHBondContact O-N 2.94Å; R69-C72 WeakPolarHBondContact O-CB 3.31Å; R69-C72 PolarHBondContact O-N 3.16Å; R69-C72 VanDerWaalsContact O-N 3.11Å; R69-D73 VanDerWaalsContact O-CG 3.25Å; R69-D73 PolarHBondContact O-N 3.13Å
70	S	91.2	Very high	92.1	Very high	53 Å²	53	67.1 Å²	67.1	37%	0.371	37%	0.368	S	S	.	.	H	α-helix	trans	-58	-41.6	176.7	179.9	0	0	0	0	112.4	D66 V67 I68 D73 H74	D66-S70 WeakPolarHBondContact O-CB 3.32Å; D66-S70 PolarHBondContact O-N 3.2Å; V67-S70 PolarHBondContact O-N 2.92Å; I68-S70 PolarHBondContact O-N 3.41Å; S70-D73 PolarHBondContact O-N 3.24Å; S70-H74 WeakPolarHBondContact O-CB 3.31Å; S70-H74 VanDerWaalsContact O-CG 3.27Å; S70-H74 PolarHBondContact O-N 3.09Å; S70-H74 PolarHBondContact O-ND1 2.61Å; S70-H74 PolarHBondContact OG-CE1 2.86Å; S70-H74 PolarHBondContact OG-ND1 2.83Å
71	F	92.1	Very high	92.4	Very high	17 Å²	17	63.9 Å²	63.9	8%	0.075	35%	0.351	C	S	.	.	H	α-helix	trans	-64.7	-43.4	174.6	-94.7	-103	0	0	0	112.5	M1 L43 L54 V67 I68 R69 D73 H74 L75	M1-F71 HydrophobicContact CG-CZ 4.44Å; M1-F71 HydrophobicContact SD-CD1 4.3Å; M1-F71 HydrophobicContact SD-CE1 4.1Å; M1-F71 HydrophobicContact SD-CE2 4.38Å; M1-F71 HydrophobicContact SD-CZ 4.19Å; L43-F71 HydrophobicContact CD1-CB 3.88Å; L54-F71 HydrophobicContact CD1-CD1 3.68Å; L54-F71 HydrophobicContact CD1-CD2 4.3Å; L54-F71 HydrophobicContact CD1-CE1 3.65Å; L54-F71 HydrophobicContact CD1-CE2 4.29Å; L54-F71 HydrophobicContact CD1-CG 3.97Å; L54-F71 HydrophobicContact CD1-CZ 3.92Å; L54-F71 HydrophobicContact CD2-CD2 4.11Å; L54-F71 HydrophobicContact CD2-CE1 4.27Å; L54-F71 HydrophobicContact CD2-CE2 3.63Å; L54-F71 HydrophobicContact CD2-CZ 3.66Å; L54-F71 HydrophobicContact CG-CD1 4.48Å; L54-F71 HydrophobicContact CG-CE1 3.99Å; L54-F71 HydrophobicContact CG-CE2 4.26Å; L54-F71 HydrophobicContact CG-CZ 3.82Å; V67-F71 HydrophobicContact CG1-CD2 4.05Å; V67-F71 HydrophobicContact CG1-CE2 4.07Å; V67-F71 WeakPolarHBondContact O-CD2 3.3Å; V67-F71 PolarHBondContact O-N 3.45Å; I68-F71 PolarHBondContact O-N 2.93Å; R69-F71 VanDerWaalsContact C-N 3.31Å; R69-F71 PolarHBondContact O-N 2.94Å; F71-D73 VanDerWaalsContact C-N 3.32Å; F71-D73 PolarHBondContact O-N 3.02Å; F71-H74 PolarHBondContact O-N 3.37Å; F71-L75 VanDerWaalsContact O-CG 3.3Å; F71-L75 WeakPolarHBondContact O-CG 3.36Å; F71-L75 PolarHBondContact O-N 3.46Å
72	C	94	Very high	92.9	Very high	17 Å²	17	60.6 Å²	60.6	12%	0.115	32%	0.317	C	S	.	.	H	α-helix	trans	-60.2	-41.8	175.3	-75.7	0	0	0	0	112	R40 I68 R69 L75 S76	R40-C72 HydrophobicContact CG-CB 4.3Å; I68-C72 PolarHBondContact O-N 2.97Å; I68-C72 PolarHBondContact O-SG 2.94Å; R69-C72 WeakPolarHBondContact O-CB 3.31Å; R69-C72 PolarHBondContact O-N 3.16Å; R69-C72 VanDerWaalsContact O-N 3.11Å; C72-L75 PolarHBondContact O-N 3.49Å; C72-S76 PolarHBondContact O-N 3.06Å; C72-S76 PolarHBondContact O-OG 3.29Å
73	D	94.2	Very high	93.5	Very high	80 Å²	80	60.9 Å²	60.9	43%	0.428	31%	0.313	S	S	.	.	H	α-helix	trans	-65.6	-46.5	178	-65.2	-20.5	0	0	0	110.7	R69 S70 F71 L75 S76 M77	R69-D73 VanDerWaalsContact O-CG 3.25Å; R69-D73 PolarHBondContact O-N 3.13Å; S70-D73 PolarHBondContact O-N 3.24Å; F71-D73 VanDerWaalsContact C-N 3.32Å; F71-D73 PolarHBondContact O-N 3.02Å; D73-L75 PolarHBondContact O-N 3.25Å; D73-S76 WeakPolarHBondContact O-CB 3.5Å; D73-S76 PolarHBondContact O-N 3.36Å; D73-M77 WeakPolarHBondContact O-CG 3.33Å; D73-M77 PolarHBondContact O-N 3.43Å
74	H	93.4	Very high	94.2	Very high	71 Å²	71	66 Å²	66	33%	0.329	34%	0.337	S	S	.	.	H	α-helix	trans	-59.9	-41.8	175.2	-71.5	130.3	0	0	0	113	M1 S70 F71 S76 M77 L78	M1-H74 HydrophobicContact CE-CB 3.87Å; M1-H74 VanDerWaalsContact CE-CG 3.47Å; M1-H74 WeakPolarHBondContact CE-ND1 3.42Å; S70-H74 WeakPolarHBondContact O-CB 3.31Å; S70-H74 VanDerWaalsContact O-CG 3.27Å; S70-H74 PolarHBondContact O-N 3.09Å; S70-H74 PolarHBondContact O-ND1 2.61Å; S70-H74 PolarHBondContact OG-CE1 2.86Å; S70-H74 PolarHBondContact OG-ND1 2.83Å; F71-H74 PolarHBondContact O-N 3.37Å; H74-S76 PolarHBondContact O-N 3.03Å; H74-M77 PolarHBondContact O-N 3.21Å; H74-L78 VanDerWaalsContact O-CB 3.3Å; H74-L78 WeakPolarHBondContact O-CB 3.34Å; H74-L78 PolarHBondContact O-N 2.95Å
75	L	95.6	Very high	94.6	Very high	2 Å²	2	66.9 Å²	66.9	1%	0.01	33%	0.332	C	S	.	.	H	α-helix	trans	-62.3	-34.8	175.3	-73.2	173.5	0	0	0	111.8	L4 L36 F39 R40 L43 F51 F71 C72 D73 H79	L4-L75 HydrophobicContact CD1-CD2 3.73Å; L4-L75 HydrophobicContact CD2-CD2 4.26Å; L36-L75 HydrophobicContact CD2-CD2 3.86Å; F39-L75 HydrophobicContact CB-CD1 3.86Å; F39-L75 HydrophobicContact CB-CD2 4.38Å; F39-L75 HydrophobicContact CD2-CD2 4.49Å; R40-L75 HydrophobicContact CB-CB 4.44Å; R40-L75 HydrophobicContact CB-CD1 4.17Å; L43-L75 HydrophobicContact CD1-CD1 3.62Å; F51-L75 HydrophobicContact CZ-CD1 4.35Å; F51-L75 HydrophobicContact CZ-CD2 4.39Å; F71-L75 VanDerWaalsContact O-CG 3.3Å; F71-L75 WeakPolarHBondContact O-CG 3.36Å; F71-L75 PolarHBondContact O-N 3.46Å; C72-L75 PolarHBondContact O-N 3.49Å; D73-L75 PolarHBondContact O-N 3.25Å; L75-H79 VanDerWaalsContact O-CB 3.23Å; L75-H79 WeakPolarHBondContact O-CB 3.3Å; L75-H79 PolarHBondContact O-N 3.41Å
76	S	96.2	Very high	95	Very high	16 Å²	16	63.2 Å²	63.2	11%	0.112	31%	0.309	C	S	.	.	H	α-helix	trans	-70.6	-48.3	178.7	-51	0	0	0	0	111.4	R40 C72 D73 H74 L78 H79 E80	R40-S76 WeakPolarHBondContact CD-OG 3.48Å; R40-S76 PolarHBondContact NE-OG 2.91Å; R40-S76 PolarHBondContact NH1-OG 2.9Å; C72-S76 PolarHBondContact O-N 3.06Å; C72-S76 PolarHBondContact O-OG 3.29Å; D73-S76 WeakPolarHBondContact O-CB 3.5Å; D73-S76 PolarHBondContact O-N 3.36Å; H74-S76 PolarHBondContact O-N 3.03Å; S76-L78 VanDerWaalsContact C-N 3.32Å; S76-L78 PolarHBondContact O-N 3.29Å; S76-H79 WeakPolarHBondContact O-CB 3.48Å; S76-H79 PolarHBondContact O-N 2.97Å; S76-E80 WeakPolarHBondContact O-CG 3.44Å; S76-E80 PolarHBondContact O-N 3.32Å
77	M	96.3	Very high	95.3	Very high	127 Å²	127	63.3 Å²	63.3	63%	0.626	30%	0.304	S	S	*	.	H	α-helix	trans	-59.5	-44	175.3	-67.7	178.2	68.7	0	0	111.3	D73 H74 E80 D81	D73-M77 WeakPolarHBondContact O-CG 3.33Å; D73-M77 PolarHBondContact O-N 3.43Å; H74-M77 PolarHBondContact O-N 3.21Å; M77-E80 PolarHBondContact O-N 2.91Å; M77-D81 VanDerWaalsContact O-CB 3.31Å; M77-D81 WeakPolarHBondContact O-CB 3.43Å; M77-D81 PolarHBondContact O-N 3.02Å
78	L	95.5	Very high	95.7	Very high	33 Å²	33	68.7 Å²	68.7	17%	0.173	33%	0.326	C	S	.	.	H	α-helix	trans	-65.7	-40	177.4	-178.4	61.9	0	0	0	111.8	L4 F32 L36 H74 S76 M82	L4-L78 HydrophobicContact CD1-CD2 3.98Å; L4-L78 HydrophobicContact CD2-CD2 4.1Å; L4-L78 HydrophobicContact CG-CD2 4.21Å; F32-L78 HydrophobicContact CE1-CD2 4.43Å; L36-L78 HydrophobicContact CD1-CB 4.38Å; L36-L78 HydrophobicContact CD1-CD2 4.11Å; L36-L78 HydrophobicContact CD1-CG 3.85Å; L36-L78 HydrophobicContact CD2-CD2 3.85Å; L36-L78 HydrophobicContact CD2-CG 4.48Å; H74-L78 VanDerWaalsContact O-CB 3.3Å; H74-L78 WeakPolarHBondContact O-CB 3.34Å; H74-L78 PolarHBondContact O-N 2.95Å; S76-L78 VanDerWaalsContact C-N 3.32Å; S76-L78 PolarHBondContact O-N 3.29Å; L78-M82 HydrophobicContact CD1-CG 3.98Å; L78-M82 HydrophobicContact CG-CG 4.28Å; L78-M82 WeakPolarHBondContact O-CB 3.49Å; L78-M82 WeakPolarHBondContact O-CG 3.45Å; L78-M82 PolarHBondContact O-N 3.06Å
79	H	97.8	Very high	96	Very high	52 Å²	52	69.5 Å²	69.5	24%	0.241	33%	0.33	C	S	.	.	H	α-helix	trans	-60.2	-48.6	175.3	172	-74.9	0	0	0	111.1	I33 L36 S37 L75 S76 M82 C83	I33-H79 WeakPolarHBondContact CG2-NE2 3.23Å; L36-H79 HydrophobicContact CB-CB 4.26Å; L36-H79 HydrophobicContact CD1-CB 4.1Å; S37-H79 PolarHBondContact OG-CD2 2.85Å; S37-H79 PolarHBondContact OG-NE2 3.07Å; L75-H79 VanDerWaalsContact O-CB 3.23Å; L75-H79 WeakPolarHBondContact O-CB 3.3Å; L75-H79 PolarHBondContact O-N 3.41Å; S76-H79 WeakPolarHBondContact O-CB 3.48Å; S76-H79 PolarHBondContact O-N 2.97Å; H79-M82 PolarHBondContact O-N 3.39Å; H79-C83 VanDerWaalsContact CE1-SG 3.59Å; H79-C83 WeakPolarHBondContact O-CB 3.33Å; H79-C83 PolarHBondContact O-N 2.87Å; H79-C83 PolarHBondContact O-SG 3.4Å; H79-C83 VanDerWaalsContact O-SG 3.35Å
80	E	98.2	Very high	96.2	Very high	130 Å²	130	64.8 Å²	64.8	61%	0.607	32%	0.316	S	S	*	.	H	α-helix	trans	-61	-47.3	177.7	-72	171.5	-167.9	0	0	112.2	S76 M77 M82 C83 E84	S76-E80 WeakPolarHBondContact O-CG 3.44Å; S76-E80 PolarHBondContact O-N 3.32Å; M77-E80 PolarHBondContact O-N 2.91Å; E80-M82 PolarHBondContact O-N 3.33Å; E80-C83 PolarHBondContact O-N 2.93Å; E80-E84 PolarHBondContact O-N 3.41Å
81	D	97.7	Very high	96.5	Very high	68 Å²	68	66.1 Å²	66.1	36%	0.364	33%	0.325	S	S	.	.	H	α-helix	trans	-59.4	-44.1	176.4	167.6	66.3	0	0	0	112.1	M77 E84 R85	M77-D81 VanDerWaalsContact O-CB 3.31Å; M77-D81 WeakPolarHBondContact O-CB 3.43Å; M77-D81 PolarHBondContact O-N 3.02Å; D81-E84 PolarHBondContact O-N 3.02Å; D81-R85 WeakPolarHBondContact O-CB 3.48Å; D81-R85 PolarHBondContact O-N 3.38Å; D81-R85 IonicContact OD1-CZ 3.68Å; D81-R85 IonicContact OD1-NE 3.93Å; D81-R85 IonicContact OD1-NH2 2.83Å; D81-R85 PolarHBondContact OD1-NH2 3.4Å; D81-R85 IonicContact OD2-CZ 3.3Å; D81-R85 VanDerWaalsContact OD2-CZ 3.3Å; D81-R85 IonicContact OD2-NH1 3.73Å; D81-R85 IonicContact OD2-NH2 2.61Å; D81-R85 PolarHBondContact OD2-NH2 3.47Å
82	M	97.1	Very high	96.7	Very high	0 Å²	0	67.6 Å²	67.6	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-67.3	-40.1	177.7	-70.2	-67.9	-73.6	0	0	112.1	F8 M11 F32 I33 L78 H79 E80 Y86	F8-M82 HydrophobicContact CE2-CE 4.32Å; F8-M82 HydrophobicContact CE2-SD 3.95Å; M11-M82 HydrophobicContact CE-CE 3.54Å; M11-M82 HydrophobicContact SD-CE 4.39Å; F32-M82 HydrophobicContact CD1-CE 3.84Å; F32-M82 HydrophobicContact CE1-CE 4.21Å; I33-M82 HydrophobicContact CD1-CB 4.05Å; I33-M82 HydrophobicContact CG1-CB 3.81Å; L78-M82 HydrophobicContact CD1-CG 3.98Å; L78-M82 HydrophobicContact CG-CG 4.28Å; L78-M82 WeakPolarHBondContact O-CB 3.49Å; L78-M82 WeakPolarHBondContact O-CG 3.45Å; L78-M82 PolarHBondContact O-N 3.06Å; H79-M82 PolarHBondContact O-N 3.39Å; E80-M82 PolarHBondContact O-N 3.33Å; M82-Y86 HydrophobicContact CE-CD2 4.05Å; M82-Y86 HydrophobicContact CE-CE2 3.61Å; M82-Y86 WeakPolarHBondContact O-CD2 3.36Å; M82-Y86 PolarHBondContact O-N 3.12Å; M82-Y86 VanDerWaalsContact O-N 3.09Å; M82-Y86 HydrophobicContact SD-CD2 4.3Å; M82-Y86 HydrophobicContact SD-CE2 3.87Å
83	C	98.2	Very high	96.7	Very high	42 Å²	42	72.8 Å²	72.8	28%	0.284	36%	0.364	S	S	.	.	H	α-helix	trans	-60.2	-44.6	174.6	-79.4	0	0	0	0	111.9	H79 E80 K87	H79-C83 VanDerWaalsContact CE1-SG 3.59Å; H79-C83 WeakPolarHBondContact O-CB 3.33Å; H79-C83 PolarHBondContact O-N 2.87Å; H79-C83 PolarHBondContact O-SG 3.4Å; H79-C83 VanDerWaalsContact O-SG 3.35Å; E80-C83 PolarHBondContact O-N 2.93Å; C83-K87 WeakPolarHBondContact O-CA 3.48Å; C83-K87 PolarHBondContact O-N 2.91Å; C83-K87 VanDerWaalsContact O-N 3.08Å
84	E	98.5	Very high	96.6	Very high	125 Å²	125	70.5 Å²	70.5	58%	0.584	35%	0.351	S	S	*	.	H	α-helix	trans	-71.2	-47.4	179.5	-174.1	57.1	-153.1	0	0	111.3	E80 D81 Y86 K87	E80-E84 PolarHBondContact O-N 3.41Å; D81-E84 PolarHBondContact O-N 3.02Å; E84-Y86 VanDerWaalsContact C-N 3.27Å; E84-Y86 PolarHBondContact O-N 2.91Å; E84-K87 VanDerWaalsContact O-CB 3.26Å; E84-K87 WeakPolarHBondContact O-CB 3.45Å; E84-K87 PolarHBondContact O-N 3.02Å
85	R	97.3	Very high	96.4	Very high	132 Å²	132	69.9 Å²	69.9	50%	0.498	35%	0.354	S	S	.	.	H	α-helix	trans	-58.6	-37.8	-178.8	-173.7	-178.3	-59.3	156.8	6.6	113	D81	D81-R85 WeakPolarHBondContact O-CB 3.48Å; D81-R85 PolarHBondContact O-N 3.38Å; D81-R85 IonicContact OD1-CZ 3.68Å; D81-R85 IonicContact OD1-NE 3.93Å; D81-R85 IonicContact OD1-NH2 2.83Å; D81-R85 PolarHBondContact OD1-NH2 3.4Å; D81-R85 IonicContact OD2-CZ 3.3Å; D81-R85 VanDerWaalsContact OD2-CZ 3.3Å; D81-R85 IonicContact OD2-NH1 3.73Å; D81-R85 IonicContact OD2-NH2 2.61Å; D81-R85 PolarHBondContact OD2-NH2 3.47Å
86	Y	97.1	Very high	96.1	Very high	44 Å²	44	75.2 Å²	75.2	17%	0.173	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	15.7	-178.2	-66.9	-84.9	0	0	0	113.5	L15 V29 M82 E84 H88 I89 L90	L15-Y86 HydrophobicContact CD1-CE1 4.5Å; V29-Y86 HydrophobicContact CB-CD1 4.48Å; V29-Y86 HydrophobicContact CB-CG 4.4Å; V29-Y86 HydrophobicContact CG1-CD1 4.1Å; V29-Y86 HydrophobicContact CG1-CD2 3.72Å; V29-Y86 HydrophobicContact CG1-CE2 4.38Å; V29-Y86 HydrophobicContact CG1-CG 3.55Å; V29-Y86 HydrophobicContact CG2-CD1 3.72Å; V29-Y86 HydrophobicContact CG2-CD2 4.3Å; V29-Y86 HydrophobicContact CG2-CE1 3.72Å; V29-Y86 HydrophobicContact CG2-CE2 4.3Å; V29-Y86 HydrophobicContact CG2-CG 4.02Å; M82-Y86 HydrophobicContact CE-CD2 4.05Å; M82-Y86 HydrophobicContact CE-CE2 3.61Å; M82-Y86 WeakPolarHBondContact O-CD2 3.36Å; M82-Y86 PolarHBondContact O-N 3.12Å; M82-Y86 VanDerWaalsContact O-N 3.09Å; M82-Y86 HydrophobicContact SD-CD2 4.3Å; M82-Y86 HydrophobicContact SD-CE2 3.87Å; E84-Y86 VanDerWaalsContact C-N 3.27Å; E84-Y86 PolarHBondContact O-N 2.91Å; Y86-H88 VanDerWaalsContact C-N 3.29Å; Y86-H88 PolarHBondContact O-N 3.47Å; Y86-H88 VanDerWaalsContact O-N 3.14Å; Y86-I89 HydrophobicContact CD1-CG1 4.37Å; Y86-I89 WeakPolarHBondContact O-CA 3.11Å; Y86-I89 WeakPolarHBondContact O-CB 3.3Å; Y86-I89 PolarHBondContact O-N 3.29Å; Y86-L90 WeakPolarHBondContact O-CG 3.46Å; Y86-L90 PolarHBondContact O-N 3.39Å
87	K	98.2	Very high	95.8	Very high	110 Å²	110	81.6 Å²	81.6	48%	0.478	40%	0.404	S	S	.	.	H	α-helix	trans	-46.8	-48.2	-176.6	-179.4	177.7	-177.7	173.3	0	113.7	C83 E84 L90 S91	C83-K87 WeakPolarHBondContact O-CA 3.48Å; C83-K87 PolarHBondContact O-N 2.91Å; C83-K87 VanDerWaalsContact O-N 3.08Å; E84-K87 VanDerWaalsContact O-CB 3.26Å; E84-K87 WeakPolarHBondContact O-CB 3.45Å; E84-K87 PolarHBondContact O-N 3.02Å; K87-L90 PolarHBondContact O-N 3.29Å; K87-S91 WeakPolarHBondContact O-CB 3.16Å; K87-S91 PolarHBondContact O-N 3.48Å; K87-S91 PolarHBondContact O-OG 3.48Å
88	H	97.6	Very high	95.4	Very high	159 Å²	159	78.1 Å²	78.1	74%	0.736	39%	0.39	S	S	*	.	H	α-helix	trans	-67.6	-36.2	179.8	-65.6	-66.9	0	0	0	113.5	Y86 S91 M92	Y86-H88 VanDerWaalsContact C-N 3.29Å; Y86-H88 PolarHBondContact O-N 3.47Å; Y86-H88 VanDerWaalsContact O-N 3.14Å; H88-S91 PolarHBondContact O-OG 3.2Å; H88-M92 PolarHBondContact O-N 2.91Å
89	I	96.7	Very high	95.1	Very high	39 Å²	39	81.8 Å²	81.8	20%	0.2	41%	0.409	C	S	.	.	H	α-helix	trans	-70.2	-41.2	176.3	-63.1	-62.3	0	0	0	110	L22 T25 K26 Y86 M92	L22-I89 HydrophobicContact CD2-CD1 3.82Å; T25-I89 HydrophobicContact CG2-CG2 4.08Å; K26-I89 HydrophobicContact CB-CG2 3.79Å; K26-I89 WeakPolarHBondContact CD-O 3.4Å; K26-I89 HydrophobicContact CG-CG2 4.38Å; K26-I89 WeakPolarHBondContact CG-O 3.2Å; Y86-I89 HydrophobicContact CD1-CG1 4.37Å; Y86-I89 WeakPolarHBondContact O-CA 3.11Å; Y86-I89 WeakPolarHBondContact O-CB 3.3Å; Y86-I89 PolarHBondContact O-N 3.29Å; I89-M92 WeakPolarHBondContact O-CB 3.43Å; I89-M92 PolarHBondContact O-N 3.43Å
90	L	97.6	Very high	94.6	Very high	43 Å²	43	82.7 Å²	82.7	23%	0.225	42%	0.416	C	S	.	.	H	α-helix	trans	-67.3	-37.8	178.8	-67.1	169.3	0	0	0	111.8	K26 V29 K30 I33 Y86 K87 M92	K26-L90 WeakPolarHBondContact CE-O 3.44Å; K26-L90 PolarHBondContact NZ-O 3.04Å; V29-L90 HydrophobicContact CG1-CD2 4.2Å; K30-L90 HydrophobicContact CB-CD2 4.03Å; I33-L90 HydrophobicContact CD1-CD1 3.63Å; I33-L90 HydrophobicContact CD1-CD2 4.22Å; Y86-L90 WeakPolarHBondContact O-CG 3.46Å; Y86-L90 PolarHBondContact O-N 3.39Å; K87-L90 PolarHBondContact O-N 3.29Å; L90-M92 VanDerWaalsContact C-N 3.29Å; L90-M92 PolarHBondContact O-N 3.35Å
91	S	97.2	Very high	93.9	Very high	82 Å²	82	80.6 Å²	80.6	57%	0.573	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-6.8	179.2	72.5	0	0	0	0	114.4	K87 H88 T93	K87-S91 WeakPolarHBondContact O-CB 3.16Å; K87-S91 PolarHBondContact O-N 3.48Å; K87-S91 PolarHBondContact O-OG 3.48Å; H88-S91 PolarHBondContact O-OG 3.2Å; S91-T93 PolarHBondContact O-N 3.11Å
92	M	95.8	Very high	93.3	Very high	47 Å²	47	84.5 Å²	84.5	23%	0.232	43%	0.427	C	S	.	.			trans	-65.1	117.4	-179.8	-178.3	-179.7	62.7	0	0	111	L22 K26 H88 I89 L90 I94	L22-M92 HydrophobicContact CB-CE 3.75Å; L22-M92 HydrophobicContact CB-SD 3.85Å; L22-M92 HydrophobicContact CD1-SD 4.1Å; K26-M92 HydrophobicContact CB-CE 4.19Å; K26-M92 HydrophobicContact CD-CE 4.18Å; K26-M92 PolarHBondContact NZ-O 2.68Å; H88-M92 PolarHBondContact O-N 2.91Å; I89-M92 WeakPolarHBondContact O-CB 3.43Å; I89-M92 PolarHBondContact O-N 3.43Å; L90-M92 VanDerWaalsContact C-N 3.29Å; L90-M92 PolarHBondContact O-N 3.35Å; M92-I94 HydrophobicContact CE-CD1 4.24Å; M92-I94 HydrophobicContact CE-CG1 4.03Å; M92-I94 PolarHBondContact O-N 3.33Å
93	T	94.9	Very high	92.3	Very high	126 Å²	126	87.8 Å²	87.8	77%	0.773	45%	0.448	S	S	*	.			trans	-72.1	127.9	170.7	-56.9	0	0	0	0	109.6	S91	S91-T93 PolarHBondContact O-N 3.11Å
94	I	91.7	Very high	90.8	Very high	32 Å²	32	88.6 Å²	88.6	16%	0.164	45%	0.453	C	S	.	.			trans	-104.8	117.2	172.8	-58.1	166.9	0	0	0	106.1	I23 K26 M92 V98 L99	I23-I94 HydrophobicContact CB-CD1 4.22Å; I23-I94 HydrophobicContact CD1-CG2 4.13Å; I23-I94 HydrophobicContact CG1-CD1 3.93Å; I23-I94 HydrophobicContact CG1-CG1 4.25Å; I23-I94 HydrophobicContact CG1-CG2 4.22Å; I23-I94 HydrophobicContact CG2-CD1 3.98Å; K26-I94 HydrophobicContact CD-CD1 3.8Å; K26-I94 HydrophobicContact CD-CG1 4.42Å; M92-I94 HydrophobicContact CE-CD1 4.24Å; M92-I94 HydrophobicContact CE-CG1 4.03Å; M92-I94 PolarHBondContact O-N 3.33Å; I94-V98 HydrophobicContact CG2-CB 4.1Å; I94-V98 HydrophobicContact CG2-CG1 4.31Å; I94-L99 HydrophobicContact CG2-CD1 4.31Å; I94-L99 HydrophobicContact CG2-CD2 3.98Å; I94-L99 HydrophobicContact CG2-CG 3.85Å
95	P	90.4	Very high	89.1	Confident	58 Å²	58	87.4 Å²	87.4	38%	0.377	45%	0.45	S	S	.	.			trans	-62.6	144.5	175.3	-20.2	31.1	0	0	0	111.6	W97 V98	P95-W97 VanDerWaalsContact C-N 3.29Å; P95-W97 VanDerWaalsContact CB-CD1 3.45Å; P95-W97 HydrophobicContact CB-CG 4.3Å; P95-W97 VanDerWaalsContact CB-NE1 3.29Å; P95-W97 PolarHBondContact O-N 3.25Å; P95-V98 HydrophobicContact CB-CG2 4.06Å; P95-V98 HydrophobicContact CG-CG2 4.1Å; P95-V98 WeakPolarHBondContact O-CB 3.44Å; P95-V98 PolarHBondContact O-N 3.38Å
96	D	88.7	Confident	87.4	Confident	114 Å²	114	85.8 Å²	85.8	61%	0.61	47%	0.465	S	S	*	.	H	α-helix	trans	-59.6	-38.5	-176.2	-65.1	-33.4	0	0	0	112.6	V98 L99 D100	D96-V98 PolarHBondContact O-N 2.7Å; D96-V98 VanDerWaalsContact O-N 3.08Å; D96-L99 PolarHBondContact O-N 3.37Å; D96-D100 PolarHBondContact O-N 2.93Å
97	W	89.4	Confident	85.6	Confident	150 Å²	150	92.4 Å²	92.4	57%	0.568	50%	0.498	S	S	*	.	H	α-helix	trans	-59.4	-22.8	176.1	70.3	-97.9	0	0	0	114	P95 D100 P101	P95-W97 VanDerWaalsContact C-N 3.29Å; P95-W97 VanDerWaalsContact CB-CD1 3.45Å; P95-W97 HydrophobicContact CB-CG 4.3Å; P95-W97 VanDerWaalsContact CB-NE1 3.29Å; P95-W97 PolarHBondContact O-N 3.25Å; W97-D100 WeakPolarHBondContact CA-O 3.34Å; W97-D100 CarbonylContact O-C 3.54Å; W97-P101 VanDerWaalsContact O-CA 3.25Å; W97-P101 WeakPolarHBondContact O-CA 3.38Å
98	V	88.7	Confident	83.7	Confident	55 Å²	55	90.8 Å²	90.8	33%	0.333	50%	0.497	S	S	.	.	H	α-helix	trans	-78	-30.8	176.9	-175.9	0	0	0	0	111.1	I23 I94 P95 D96	I23-V98 HydrophobicContact CD1-CG1 3.4Å; I94-V98 HydrophobicContact CG2-CB 4.1Å; I94-V98 HydrophobicContact CG2-CG1 4.31Å; P95-V98 HydrophobicContact CB-CG2 4.06Å; P95-V98 HydrophobicContact CG-CG2 4.1Å; P95-V98 WeakPolarHBondContact O-CB 3.44Å; P95-V98 PolarHBondContact O-N 3.38Å; D96-V98 PolarHBondContact O-N 2.7Å; D96-V98 VanDerWaalsContact O-N 3.08Å
99	L	87.8	Confident	81.7	Confident	110 Å²	110	92.1 Å²	92.1	58%	0.576	50%	0.504	S	S	*	.	H	α-helix	trans	-84.3	-42.1	176.4	-63.6	177	0	0	0	111.3	I23 I94 D96	I23-L99 HydrophobicContact CG2-CD2 4Å; I94-L99 HydrophobicContact CG2-CD1 4.31Å; I94-L99 HydrophobicContact CG2-CD2 3.98Å; I94-L99 HydrophobicContact CG2-CG 3.85Å; D96-L99 PolarHBondContact O-N 3.37Å
100	D	87.7	Confident	79.9	Confident	71 Å²	71	94.1 Å²	94.1	38%	0.38	52%	0.517	S	S	.	.			trans	-140.8	102.6	175.3	-179.2	-3.6	0	0	0	109.8	D96 W97 F102 T103	D96-D100 PolarHBondContact O-N 2.93Å; W97-D100 WeakPolarHBondContact CA-O 3.34Å; W97-D100 CarbonylContact O-C 3.54Å; D100-F102 PolarHBondContact O-N 3.24Å; D100-F102 WeakPolarHBondContact OD1-CB 3.38Å; D100-F102 PolarHBondContact OD1-N 3.34Å; D100-T103 HydrophobicContact CB-CG2 3.7Å; D100-T103 PolarHBondContact O-N 3.28Å; D100-T103 VanDerWaalsContact O-N 3.12Å; D100-T103 PolarHBondContact O-OG1 2.97Å; D100-T103 WeakPolarHBondContact OD2-CG2 3.4Å
101	P	84.2	Confident	78	Confident	86 Å²	86	96.5 Å²	96.5	56%	0.558	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-20.8	179.7	-26.2	34.9	0	0	0	114.8	W97	W97-P101 VanDerWaalsContact O-CA 3.25Å; W97-P101 WeakPolarHBondContact O-CA 3.38Å
102	F	84.6	Confident	76.2	Confident	149 Å²	149	101.2 Å²	101.2	65%	0.654	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-10.9	-176.4	-58.2	-79.2	0	0	0	113.4	D100 C104 L105	D100-F102 PolarHBondContact O-N 3.24Å; D100-F102 WeakPolarHBondContact OD1-CB 3.38Å; D100-F102 PolarHBondContact OD1-N 3.34Å; F102-C104 VanDerWaalsContact C-N 3.27Å; F102-C104 PolarHBondContact O-N 3.34Å; F102-L105 HydrophobicContact CB-CD1 4.42Å; F102-L105 HydrophobicContact CD1-CD1 3.66Å; F102-L105 HydrophobicContact CE1-CD1 4.49Å; F102-L105 PolarHBondContact O-N 3.49Å
103	T	76.5	Confident	74.4	Confident	69 Å²	69	108.3 Å²	108.3	42%	0.423	58%	0.579	S	S	.	*	G	3₁₀ helix	trans	-63	-31.2	177.3	49.5	0	0	0	0	113.2	D100 L105	D100-T103 HydrophobicContact CB-CG2 3.7Å; D100-T103 PolarHBondContact O-N 3.28Å; D100-T103 VanDerWaalsContact O-N 3.12Å; D100-T103 PolarHBondContact O-OG1 2.97Å; D100-T103 WeakPolarHBondContact OD2-CG2 3.4Å; T103-L105 VanDerWaalsContact C-N 3.32Å; T103-L105 PolarHBondContact O-N 2.96Å
104	C	65.8	Low	73.1	Confident	59 Å²	59	110 Å²	110	40%	0.399	58%	0.578	S	S	.	*	G	3₁₀ helix	trans	-78.6	-9	178	-76.2	0	0	0	0	114.6	F102 A106 E107	F102-C104 VanDerWaalsContact C-N 3.27Å; F102-C104 PolarHBondContact O-N 3.34Å; C104-A106 VanDerWaalsContact C-N 3.27Å; C104-A106 PolarHBondContact O-N 3.42Å; C104-E107 PolarHBondContact O-N 2.87Å
105	L	63.3	Low	72	Confident	100 Å²	100	117 Å²	117	52%	0.524	61%	0.61	S	S	.	*	G	3₁₀ helix	trans	-74.1	-16.4	-175.7	-66.1	-177	0	0	0	113.7	F102 T103 E107 V108	F102-L105 HydrophobicContact CB-CD1 4.42Å; F102-L105 HydrophobicContact CD1-CD1 3.66Å; F102-L105 HydrophobicContact CE1-CD1 4.49Å; F102-L105 PolarHBondContact O-N 3.49Å; T103-L105 VanDerWaalsContact C-N 3.32Å; T103-L105 PolarHBondContact O-N 2.96Å; L105-E107 PolarHBondContact O-N 2.88Å; L105-V108 PolarHBondContact O-N 3.22Å
106	A	62.3	Low	70.9	Confident	99 Å²	99	121.7 Å²	121.7	82%	0.818	63%	0.632	S	S	*	*	G	3₁₀ helix	trans	-65.4	-22.8	177.2	0	0	0	0	0	113.2	C104	C104-A106 VanDerWaalsContact C-N 3.27Å; C104-A106 PolarHBondContact O-N 3.42Å
107	E	59.1	Low	70.2	Confident	183 Å²	183	127.4 Å²	127.4	86%	0.855	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-92.4	-15.4	178.1	-68.2	-175	170.9	0	0	113.3	C104 L105 E109	C104-E107 PolarHBondContact O-N 2.87Å; L105-E107 PolarHBondContact O-N 2.88Å; E107-E109 VanDerWaalsContact C-N 3.29Å; E107-E109 PolarHBondContact O-N 3.43Å; E107-E109 VanDerWaalsContact O-N 3.13Å
108	V	58.2	Low	69.2	Low	75 Å²	75	126.3 Å²	126.3	46%	0.455	66%	0.664	S	S	.	*			trans	-89.1	78.3	172.8	-164.8	0	0	0	0	106.8	L105 V110	L105-V108 PolarHBondContact O-N 3.22Å; V108-V110 HydrophobicContact CB-CG2 4.24Å; V108-V110 HydrophobicContact CG1-CG2 3.57Å; V108-V110 WeakPolarHBondContact O-CG2 3.42Å; V108-V110 PolarHBondContact O-N 3.27Å
109	E	55.6	Low	68.2	Low	188 Å²	188	130.1 Å²	130.1	88%	0.879	68%	0.682	S	S	*	*			trans	-61.4	92.9	155.7	-166.7	174.7	-158.9	0	0	105.7	E107 A111	E107-E109 VanDerWaalsContact C-N 3.29Å; E107-E109 PolarHBondContact O-N 3.43Å; E107-E109 VanDerWaalsContact O-N 3.13Å; E109-A111 VanDerWaalsContact C-N 3.28Å; E109-A111 PolarHBondContact O-N 3.23Å
110	V	58.5	Low	67.1	Low	80 Å²	80	131.2 Å²	131.2	49%	0.485	69%	0.688	S	S	.	*			trans	-65.6	91.4	-174.7	171.4	0	0	0	0	108.1	V108 Y112	V108-V110 HydrophobicContact CB-CG2 4.24Å; V108-V110 HydrophobicContact CG1-CG2 3.57Å; V108-V110 WeakPolarHBondContact O-CG2 3.42Å; V108-V110 PolarHBondContact O-N 3.27Å; V110-Y112 HydrophobicContact CB-CD2 4.26Å; V110-Y112 HydrophobicContact CB-CE2 4.38Å; V110-Y112 HydrophobicContact CG1-CD1 4.23Å; V110-Y112 HydrophobicContact CG1-CD2 2.86Å; V110-Y112 HydrophobicContact CG1-CE2 3.29Å; V110-Y112 HydrophobicContact CG1-CG 3.33Å; V110-Y112 HydrophobicContact CG2-CD2 4.48Å; V110-Y112 HydrophobicContact CG2-CE2 4.12Å; V110-Y112 PolarHBondContact O-N 3.01Å
111	A	57.1	Low	65.9	Low	94 Å²	94	134.7 Å²	134.7	78%	0.777	71%	0.706	S	S	*	*			trans	-75.1	54.9	157.2	0	0	0	0	0	109.4	E109 K113	E109-A111 VanDerWaalsContact C-N 3.28Å; E109-A111 PolarHBondContact O-N 3.23Å; A111-K113 VanDerWaalsContact C-N 3.31Å; A111-K113 PolarHBondContact O-N 3.49Å; A111-K113 VanDerWaalsContact O-N 3.11Å
112	Y	60.5	Low	64.7	Low	181 Å²	181	137.8 Å²	137.8	71%	0.71	72%	0.715	S	S	*	*			trans	-76.8	94.5	159.5	-67.9	-40.3	0	0	0	106.8	V110 E114	V110-Y112 HydrophobicContact CB-CD2 4.26Å; V110-Y112 HydrophobicContact CB-CE2 4.38Å; V110-Y112 HydrophobicContact CG1-CD1 4.23Å; V110-Y112 HydrophobicContact CG1-CD2 2.86Å; V110-Y112 HydrophobicContact CG1-CE2 3.29Å; V110-Y112 HydrophobicContact CG1-CG 3.33Å; V110-Y112 HydrophobicContact CG2-CD2 4.48Å; V110-Y112 HydrophobicContact CG2-CE2 4.12Å; V110-Y112 PolarHBondContact O-N 3.01Å; Y112-E114 PolarHBondContact O-N 2.93Å; Y112-E114 VanDerWaalsContact O-N 3.14Å
113	K	58.5	Low	63.4	Low	196 Å²	196	137 Å²	137	85%	0.852	72%	0.719	S	S	*	*			trans	-70.2	93.4	149.1	-75.3	-174.6	176	-177	0	106.1	A111 E115	A111-K113 VanDerWaalsContact C-N 3.31Å; A111-K113 PolarHBondContact O-N 3.49Å; A111-K113 VanDerWaalsContact O-N 3.11Å; K113-E115 VanDerWaalsContact C-N 3.32Å; K113-E115 PolarHBondContact O-N 3.43Å
114	E	66.3	Low	62.5	Low	160 Å²	160	141.9 Å²	141.9	75%	0.748	74%	0.74	S	S	*	*			trans	-65	99.6	160	-72	-178.7	159.8	0	0	106.9	Y112 L116	Y112-E114 PolarHBondContact O-N 2.93Å; Y112-E114 VanDerWaalsContact O-N 3.14Å; E114-L116 PolarHBondContact O-N 2.89Å
115	E	69.5	Low	62.2	Low	180 Å²	180	148.2 Å²	148.2	84%	0.841	77%	0.766	S	S	*	*			trans	-71.1	91.7	157.7	-83.1	-176.7	170.3	0	0	106.9	K113 I117	K113-E115 VanDerWaalsContact C-N 3.32Å; K113-E115 PolarHBondContact O-N 3.43Å; E115-I117 PolarHBondContact O-N 2.77Å
116	L	67.2	Low	62.1	Low	157 Å²	157	152.3 Å²	152.3	82%	0.822	79%	0.787	S	S	*	*			trans	-67.5	108.8	159.3	-77.2	163.6	0	0	0	106.9	E114	E114-L116 PolarHBondContact O-N 2.89Å
117	I	73	Confident	62.1	Low	234 Å²	234	157.1 Å²	157.1	100%	1.2	78%	0.784	S	S	*	*			trans	-60.1	0	168.7	-55.6	172.7	0	0	0	109.4	E115	E115-I117 PolarHBondContact O-N 2.77Å

Retrieved 117 of 117 residues in 76.2 ms (Link to these results)

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