G4VHT5_SCHMA Loading...

Putative hepatocellular carcinoma-associated antigen

AlphaFold DB , UniProt , Accession G4VHT5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 585 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	73.1	Confident	86.4	Confident	151 Å²	151	81.5 Å²	81.5	74%	0.744	41%	0.406	S	S	*	.				0	-49.7	0	-65.5	176.1	79.1	0	0	111.8	E3 V4 V5 Q45	M1-E3 VanDerWaalsContact C-N 3.34Å; M1-E3 PolarHBondContact O-N 3.34Å; M1-V4 PolarHBondContact O-N 3.46Å; M1-V5 PolarHBondContact O-N 3.19Å; M1-Q45 HydrophobicContact CE-CB 3.91Å; M1-Q45 WeakPolarHBondContact CE-O 3.28Å
2	A	82.3	Confident	86.5	Confident	52 Å²	52	75.1 Å²	75.1	43%	0.43	37%	0.374	S	S	.	.	H	α-helix	trans	-58.2	-40.6	178.5	0	0	0	0	0	113.5	V4 V5 E6	A2-V4 VanDerWaalsContact C-N 3.31Å; A2-V4 PolarHBondContact O-N 3.25Å; A2-V5 WeakPolarHBondContact O-CA 3.47Å; A2-V5 WeakPolarHBondContact O-CB 3.36Å; A2-V5 PolarHBondContact O-N 3.2Å; A2-E6 PolarHBondContact O-N 3.03Å
3	E	88.2	Confident	86.7	Confident	151 Å²	151	74.8 Å²	74.8	71%	0.706	38%	0.379	S	S	*	.	H	α-helix	trans	-57.4	-38.7	179	-64.7	176	-176.8	0	0	114	M1 V5 R7	M1-E3 VanDerWaalsContact C-N 3.34Å; M1-E3 PolarHBondContact O-N 3.34Å; E3-V5 VanDerWaalsContact C-N 3.33Å; E3-R7 VanDerWaalsContact O-CB 3.3Å; E3-R7 WeakPolarHBondContact O-CB 2.99Å; E3-R7 PolarHBondContact O-N 3.43Å
4	V	86.8	Confident	86.8	Confident	57 Å²	57	72 Å²	72	35%	0.345	38%	0.378	S	S	.	.	H	α-helix	trans	-68.7	-37.2	178	178.6	0	0	0	0	110.6	M1 A2 N8	M1-V4 PolarHBondContact O-N 3.46Å; A2-V4 VanDerWaalsContact C-N 3.31Å; A2-V4 PolarHBondContact O-N 3.25Å; V4-N8 VanDerWaalsContact O-CG 3.25Å; V4-N8 PolarHBondContact O-N 3.24Å; V4-N8 VanDerWaalsContact O-N 3.13Å; V4-N8 PolarHBondContact O-ND2 3.45Å
5	V	85.8	Confident	87.1	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-65.5	-50.4	176.4	173.7	0	0	0	0	110	M1 A2 E3 R7 N8 L9 E41 Y42 Q45	M1-V5 PolarHBondContact O-N 3.19Å; A2-V5 WeakPolarHBondContact O-CA 3.47Å; A2-V5 WeakPolarHBondContact O-CB 3.36Å; A2-V5 PolarHBondContact O-N 3.2Å; E3-V5 VanDerWaalsContact C-N 3.33Å; V5-R7 PolarHBondContact O-N 3.34Å; V5-N8 PolarHBondContact O-N 2.97Å; V5-L9 HydrophobicContact CG1-CD1 4.09Å; V5-L9 WeakPolarHBondContact O-CG 3.36Å; V5-L9 PolarHBondContact O-N 2.68Å; V5-E41 HydrophobicContact CB-CB 4.47Å; V5-E41 HydrophobicContact CG1-CB 3.79Å; V5-E41 HydrophobicContact CG2-CB 4.33Å; V5-Y42 HydrophobicContact CB-CE1 4.48Å; V5-Y42 HydrophobicContact CG1-CD2 4.12Å; V5-Y42 HydrophobicContact CG1-CE1 4.42Å; V5-Y42 HydrophobicContact CG1-CE2 3.93Å; V5-Y42 HydrophobicContact CG1-CG 4.44Å; V5-Y42 HydrophobicContact CG2-CD1 4.05Å; V5-Y42 HydrophobicContact CG2-CE1 4.16Å; V5-Y42 HydrophobicContact CG2-CG 4.42Å; V5-Q45 HydrophobicContact CG2-CG 3.63Å
6	E	89	Confident	87.3	Confident	63 Å²	63	64.9 Å²	64.9	29%	0.294	34%	0.34	S	S	.	.	H	α-helix	trans	-65.2	-39.8	-179.1	-65.1	-54.9	134.8	0	0	111.7	A2 N8 L9 E10 R38	A2-E6 PolarHBondContact O-N 3.03Å; E6-N8 PolarHBondContact O-N 3.45Å; E6-L9 CarbonylContact O-C 3.54Å; E6-L9 WeakPolarHBondContact O-CA 3.46Å; E6-L9 WeakPolarHBondContact O-CB 3.5Å; E6-L9 PolarHBondContact O-N 3.39Å; E6-E10 WeakPolarHBondContact O-CG 3.37Å; E6-E10 PolarHBondContact O-N 3.27Å; E6-R38 IonicContact OE1-CZ 3.67Å; E6-R38 IonicContact OE1-NE 2.84Å; E6-R38 IonicContact OE1-NH2 3.66Å; E6-R38 IonicContact OE2-NH2 2.87Å; E6-R38 PolarHBondContact OE2-NH2 3.18Å
7	R	89.8	Confident	87.4	Confident	144 Å²	144	66.5 Å²	66.5	54%	0.543	35%	0.348	S	S	.	.	H	α-helix	trans	-58.2	-44.3	173	-170.2	-174.7	-59.4	153.2	3.2	112.7	E3 V5 L9 E10 D11	E3-R7 VanDerWaalsContact O-CB 3.3Å; E3-R7 WeakPolarHBondContact O-CB 2.99Å; E3-R7 PolarHBondContact O-N 3.43Å; V5-R7 PolarHBondContact O-N 3.34Å; R7-L9 PolarHBondContact O-N 3.39Å; R7-E10 WeakPolarHBondContact O-CB 3.25Å; R7-E10 PolarHBondContact O-N 3.11Å; R7-D11 PolarHBondContact O-N 2.69Å
8	N	88.5	Confident	87.6	Confident	23 Å²	23	64.9 Å²	64.9	12%	0.123	34%	0.339	C	S	.	.	H	α-helix	trans	-65.8	-29.7	176.8	-72	-15.3	0	0	0	112.2	V4 V5 E6 E41	V4-N8 VanDerWaalsContact O-CG 3.25Å; V4-N8 PolarHBondContact O-N 3.24Å; V4-N8 VanDerWaalsContact O-N 3.13Å; V4-N8 PolarHBondContact O-ND2 3.45Å; V5-N8 PolarHBondContact O-N 2.97Å; E6-N8 PolarHBondContact O-N 3.45Å; N8-E41 HydrophobicContact CB-CG 4.43Å; N8-E41 PolarHBondContact ND2-OE2 3.06Å
9	L	88.2	Confident	87.7	Confident	12 Å²	12	61.7 Å²	61.7	6%	0.063	32%	0.322	C	S	.	.	H	α-helix	trans	-75.2	-38.3	174.6	-68.3	173.6	0	0	0	111.5	V5 E6 R7 D11 S12 V13 R37 R38	V5-L9 HydrophobicContact CG1-CD1 4.09Å; V5-L9 WeakPolarHBondContact O-CG 3.36Å; V5-L9 PolarHBondContact O-N 2.68Å; E6-L9 CarbonylContact O-C 3.54Å; E6-L9 WeakPolarHBondContact O-CA 3.46Å; E6-L9 WeakPolarHBondContact O-CB 3.5Å; E6-L9 PolarHBondContact O-N 3.39Å; R7-L9 PolarHBondContact O-N 3.39Å; L9-D11 VanDerWaalsContact C-N 3.31Å; L9-D11 PolarHBondContact O-N 3.49Å; L9-S12 WeakPolarHBondContact O-CA 3.45Å; L9-S12 WeakPolarHBondContact O-CB 2.95Å; L9-S12 PolarHBondContact O-N 3.3Å; L9-S12 PolarHBondContact O-OG 3.03Å; L9-V13 PolarHBondContact O-N 2.94Å; L9-R37 HydrophobicContact CD2-CB 4.01Å; L9-R38 HydrophobicContact CD1-CB 3.87Å; L9-R38 HydrophobicContact CD1-CG 4Å; L9-R38 HydrophobicContact CD2-CB 4.38Å
10	E	90.7	Very high	87.6	Confident	130 Å²	130	66.2 Å²	66.2	61%	0.607	34%	0.335	S	S	*	.	H	α-helix	trans	-57.1	-43	174.2	-75.1	171.7	-179.2	0	0	111.7	E6 R7 S12 V13	E6-E10 WeakPolarHBondContact O-CG 3.37Å; E6-E10 PolarHBondContact O-N 3.27Å; R7-E10 WeakPolarHBondContact O-CB 3.25Å; R7-E10 PolarHBondContact O-N 3.11Å; E10-S12 PolarHBondContact O-N 2.82Å; E10-S12 VanDerWaalsContact O-N 3.08Å; E10-V13 VanDerWaalsContact O-CB 3.28Å; E10-V13 WeakPolarHBondContact O-CB 3.48Å; E10-V13 WeakPolarHBondContact O-CG2 3.47Å; E10-V13 PolarHBondContact O-N 3.12Å
11	D	88.1	Confident	87.6	Confident	114 Å²	114	69.5 Å²	69.5	61%	0.61	35%	0.347	S	S	*	.	H	α-helix	trans	-56.6	-27.6	174	-74.1	-17.6	0	0	0	112.7	R7 L9	R7-D11 PolarHBondContact O-N 2.69Å; L9-D11 VanDerWaalsContact C-N 3.31Å; L9-D11 PolarHBondContact O-N 3.49Å
12	S	87	Confident	88.2	Confident	4 Å²	4	62.4 Å²	62.4	3%	0.028	31%	0.312	C	S	.	.	H	α-helix	trans	-86.1	-13.2	178.7	81.4	0	0	0	0	114.1	L9 E10 G14 E15 I16 R91	L9-S12 WeakPolarHBondContact O-CA 3.45Å; L9-S12 WeakPolarHBondContact O-CB 2.95Å; L9-S12 PolarHBondContact O-N 3.3Å; L9-S12 PolarHBondContact O-OG 3.03Å; E10-S12 PolarHBondContact O-N 2.82Å; E10-S12 VanDerWaalsContact O-N 3.08Å; S12-G14 VanDerWaalsContact C-N 3.32Å; S12-G14 PolarHBondContact O-N 3.43Å; S12-E15 WeakPolarHBondContact O-CB 3.41Å; S12-E15 PolarHBondContact O-N 3.31Å; S12-I16 WeakPolarHBondContact O-CG1 3.5Å; S12-I16 PolarHBondContact O-N 3.46Å; S12-R91 VanDerWaalsContact CB-NH2 3.27Å
13	V	89.3	Confident	88.2	Confident	72 Å²	72	68.6 Å²	68.6	44%	0.436	33%	0.329	S	S	.	.	H	α-helix	trans	-61.4	-42.1	-177.6	174.3	0	0	0	0	110.9	L9 E10 E15 I16 L17	L9-V13 PolarHBondContact O-N 2.94Å; E10-V13 VanDerWaalsContact O-CB 3.28Å; E10-V13 WeakPolarHBondContact O-CB 3.48Å; E10-V13 WeakPolarHBondContact O-CG2 3.47Å; E10-V13 PolarHBondContact O-N 3.12Å; V13-E15 VanDerWaalsContact C-N 3.33Å; V13-E15 PolarHBondContact O-N 3.28Å; V13-I16 PolarHBondContact O-N 3.06Å; V13-L17 HydrophobicContact CG1-CD1 4.04Å; V13-L17 HydrophobicContact CG1-CG 4.27Å; V13-L17 WeakPolarHBondContact O-CG 3.47Å; V13-L17 PolarHBondContact O-N 2.86Å
14	G	88.8	Confident	87.9	Confident	35 Å²	35	61.9 Å²	61.9	36%	0.361	30%	0.298	S	S	.	.	H	α-helix	trans	-56	-47.6	176.5	0	0	0	0	0	111.9	S12 L17 H18	S12-G14 VanDerWaalsContact C-N 3.32Å; S12-G14 PolarHBondContact O-N 3.43Å; G14-L17 PolarHBondContact O-N 2.95Å; G14-H18 PolarHBondContact O-N 3.11Å; G14-H18 PolarHBondContact O-ND1 3.41Å
15	E	90.4	Very high	87.9	Confident	5 Å²	5	60 Å²	60	2%	0.023	29%	0.286	C	S	.	.	H	α-helix	trans	-59.5	-47.7	176.6	-177.1	-164	113	0	0	111.8	S12 V13 L17 H18 I19 R37 I84 S87 I88 R91	S12-E15 WeakPolarHBondContact O-CB 3.41Å; S12-E15 PolarHBondContact O-N 3.31Å; V13-E15 VanDerWaalsContact C-N 3.33Å; V13-E15 PolarHBondContact O-N 3.28Å; E15-L17 VanDerWaalsContact C-N 3.34Å; E15-L17 PolarHBondContact O-N 2.98Å; E15-H18 PolarHBondContact O-N 3.35Å; E15-H18 VanDerWaalsContact O-N 3.14Å; E15-I19 HydrophobicContact CG-CD1 4.01Å; E15-I19 WeakPolarHBondContact O-CG1 3.3Å; E15-I19 PolarHBondContact O-N 3.45Å; E15-R37 IonicContact OE1-CZ 3.79Å; E15-R37 VanDerWaalsContact OE1-CZ 3.24Å; E15-R37 IonicContact OE1-NH1 3.52Å; E15-R37 PolarHBondContact OE1-NH1 3.23Å; E15-R37 IonicContact OE1-NH2 2.93Å; E15-R37 PolarHBondContact OE1-NH2 3.28Å; E15-R37 IonicContact OE2-NH2 3.71Å; E15-I84 HydrophobicContact CG-CB 4.48Å; E15-I84 HydrophobicContact CG-CG2 4.04Å; E15-S87 VanDerWaalsContact OE2-CB 3.22Å; E15-S87 WeakPolarHBondContact OE2-CB 3.34Å; E15-S87 PolarHBondContact OE2-OG 3.21Å; E15-I88 HydrophobicContact CG-CG1 4.4Å; E15-I88 WeakPolarHBondContact OE1-CG1 3.32Å; E15-I88 WeakPolarHBondContact OE2-CG1 3.27Å; E15-I88 PolarHBondContact OE2-N 3.04Å; E15-R91 IonicContact OE1-NH1 3.54Å; E15-R91 IonicContact OE2-CZ 2.89Å; E15-R91 IonicContact OE2-NH1 3.56Å; E15-R91 PolarHBondContact OE2-NH1 3.25Å; E15-R91 IonicContact OE2-NH2 3.83Å; E15-R91 PolarHBondContact OE2-NH2 3.03Å
16	I	90.7	Very high	88	Confident	26 Å²	26	64.9 Å²	64.9	13%	0.133	31%	0.312	C	S	.	.	H	α-helix	trans	-62.7	-40.4	-178.6	-68.8	160.5	0	0	0	111.6	S12 V13 H18 I19 R20 I30 V34	S12-I16 WeakPolarHBondContact O-CG1 3.5Å; S12-I16 PolarHBondContact O-N 3.46Å; V13-I16 PolarHBondContact O-N 3.06Å; I16-H18 VanDerWaalsContact C-N 3.32Å; I16-H18 PolarHBondContact O-N 2.7Å; I16-I19 PolarHBondContact O-N 3.31Å; I16-R20 WeakPolarHBondContact O-CB 3.26Å; I16-R20 PolarHBondContact O-N 3.22Å; I16-I30 HydrophobicContact CG2-CG2 3.44Å; I16-I30 VanDerWaalsContact CG2-CG2 3.44Å; I16-V34 HydrophobicContact CD1-CG2 3.48Å; I16-V34 VanDerWaalsContact CD1-CG2 3.48Å
17	L	89.9	Confident	88	Confident	91 Å²	91	69.6 Å²	69.6	48%	0.476	33%	0.327	S	S	.	.	H	α-helix	trans	-61.8	-40.6	175.4	-71.5	173.9	0	0	0	111.7	V13 G14 E15 R20 K21	V13-L17 HydrophobicContact CG1-CD1 4.04Å; V13-L17 HydrophobicContact CG1-CG 4.27Å; V13-L17 WeakPolarHBondContact O-CG 3.47Å; V13-L17 PolarHBondContact O-N 2.86Å; G14-L17 PolarHBondContact O-N 2.95Å; E15-L17 VanDerWaalsContact C-N 3.34Å; E15-L17 PolarHBondContact O-N 2.98Å; L17-R20 PolarHBondContact O-N 3.21Å; L17-K21 WeakPolarHBondContact O-CB 2.88Å; L17-K21 VanDerWaalsContact O-CG 3.31Å; L17-K21 WeakPolarHBondContact O-CG 3.44Å; L17-K21 PolarHBondContact O-N 3.43Å
18	H	90.3	Very high	88.1	Confident	38 Å²	38	68.4 Å²	68.4	18%	0.176	33%	0.33	C	S	.	.	H	α-helix	trans	-67.7	-40.2	175.6	-67.5	100.6	0	0	0	111.9	G14 E15 I16 R20 K21 A22 Y80 K83 I84	G14-H18 PolarHBondContact O-N 3.11Å; G14-H18 PolarHBondContact O-ND1 3.41Å; E15-H18 PolarHBondContact O-N 3.35Å; E15-H18 VanDerWaalsContact O-N 3.14Å; I16-H18 VanDerWaalsContact C-N 3.32Å; I16-H18 PolarHBondContact O-N 2.7Å; H18-R20 VanDerWaalsContact C-N 3.33Å; H18-R20 PolarHBondContact O-N 3.24Å; H18-K21 PolarHBondContact O-N 3.19Å; H18-A22 WeakPolarHBondContact O-CB 3.49Å; H18-A22 PolarHBondContact O-N 3.23Å; H18-Y80 HydrophobicContact CB-CD2 4.41Å; H18-Y80 HydrophobicContact CB-CG 4.27Å; H18-Y80 AromaticContact CD2-CD1 3.47Å; H18-Y80 VanDerWaalsContact CD2-CD1 3.47Å; H18-Y80 WeakPolarHBondContact CD2-CD1 3.01Å; H18-Y80 AromaticContact CD2-CE1 3.93Å; H18-Y80 AromaticContact CD2-CG 3.56Å; H18-K83 WeakPolarHBondContact NE2-CD 2.95Å; H18-I84 HydrophobicContact CB-CD1 3.91Å; H18-I84 HydrophobicContact CB-CG1 3.78Å
19	I	88.6	Confident	88.2	Confident	4 Å²	4	70.1 Å²	70.1	2%	0.021	34%	0.338	C	S	.	.	H	α-helix	trans	-60.3	-44.4	175.3	-70	170.2	0	0	0	110.7	E15 I16 A22 K23 F25 I30 L68 I84	E15-I19 HydrophobicContact CG-CD1 4.01Å; E15-I19 WeakPolarHBondContact O-CG1 3.3Å; E15-I19 PolarHBondContact O-N 3.45Å; I16-I19 PolarHBondContact O-N 3.31Å; I19-A22 PolarHBondContact O-N 3.46Å; I19-K23 PolarHBondContact O-N 2.94Å; I19-F25 HydrophobicContact CG2-CB 3.97Å; I19-F25 HydrophobicContact CG2-CD2 3.42Å; I19-F25 VanDerWaalsContact CG2-CD2 3.42Å; I19-F25 HydrophobicContact CG2-CE2 4.3Å; I19-F25 HydrophobicContact CG2-CG 4.04Å; I19-I30 HydrophobicContact CG2-CD1 4.47Å; I19-I30 HydrophobicContact CG2-CG1 4.5Å; I19-L68 HydrophobicContact CD1-CD2 4.47Å; I19-L68 HydrophobicContact CG1-CD2 4.35Å; I19-I84 HydrophobicContact CD1-CG2 4.12Å; I19-I84 HydrophobicContact CG1-CD1 3.72Å; I19-I84 HydrophobicContact CG1-CG1 4.03Å; I19-I84 HydrophobicContact CG1-CG2 4.01Å
20	R	87.5	Confident	88.4	Confident	152 Å²	152	70.3 Å²	70.3	57%	0.574	34%	0.338	S	S	*	.	H	α-helix	trans	-63.6	-43.9	176.9	-173.6	174.7	178.2	168.9	-2.8	112	I16 L17 H18 A22 K23 I30	I16-R20 WeakPolarHBondContact O-CB 3.26Å; I16-R20 PolarHBondContact O-N 3.22Å; L17-R20 PolarHBondContact O-N 3.21Å; H18-R20 VanDerWaalsContact C-N 3.33Å; H18-R20 PolarHBondContact O-N 3.24Å; R20-A22 VanDerWaalsContact C-N 3.31Å; R20-A22 PolarHBondContact O-N 3.37Å; R20-K23 PolarHBondContact O-N 3.2Å; R20-K23 VanDerWaalsContact O-N 3.08Å; R20-I30 HydrophobicContact CB-CD1 3.96Å; R20-I30 HydrophobicContact CG-CD1 4.34Å
21	K	87.5	Confident	88.5	Confident	135 Å²	135	68.3 Å²	68.3	59%	0.587	33%	0.332	S	S	*	.	H	α-helix	trans	-63	-37.2	176.4	-75.6	178.1	179.9	-174.6	0	112.4	L17 H18 K23 Y80	L17-K21 WeakPolarHBondContact O-CB 2.88Å; L17-K21 VanDerWaalsContact O-CG 3.31Å; L17-K21 WeakPolarHBondContact O-CG 3.44Å; L17-K21 PolarHBondContact O-N 3.43Å; H18-K21 PolarHBondContact O-N 3.19Å; K21-K23 PolarHBondContact O-N 3.39Å; K21-Y80 HydrophobicContact CB-CE2 4.14Å
22	A	85.4	Confident	88.8	Confident	2 Å²	2	67.6 Å²	67.6	2%	0.017	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-6.7	175.5	0	0	0	0	0	113.4	H18 I19 R20 L24	H18-A22 WeakPolarHBondContact O-CB 3.49Å; H18-A22 PolarHBondContact O-N 3.23Å; I19-A22 PolarHBondContact O-N 3.46Å; R20-A22 VanDerWaalsContact C-N 3.31Å; R20-A22 PolarHBondContact O-N 3.37Å; A22-L24 HydrophobicContact CB-CD1 3.94Å; A22-L24 HydrophobicContact CB-CG 3.82Å; A22-L24 PolarHBondContact O-N 3.04Å; A22-L24 VanDerWaalsContact O-N 3.08Å
23	K	82.6	Confident	89	Confident	183 Å²	183	68.4 Å²	68.4	80%	0.796	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	26.1	-178.3	-59.2	-176.6	178.5	-178.3	0	114.1	I19 R20 K21 F25	I19-K23 PolarHBondContact O-N 2.94Å; R20-K23 PolarHBondContact O-N 3.2Å; R20-K23 VanDerWaalsContact O-N 3.08Å; K21-K23 PolarHBondContact O-N 3.39Å; K23-F25 VanDerWaalsContact C-N 3.34Å
24	L	81.3	Confident	89.2	Confident	9 Å²	9	67 Å²	67	5%	0.047	32%	0.32	C	S	.	.			trans	-76.2	-23.1	-179	-65.7	173.3	0	0	0	112.9	A22 L68 R71 R72	A22-L24 HydrophobicContact CB-CD1 3.94Å; A22-L24 HydrophobicContact CB-CG 3.82Å; A22-L24 PolarHBondContact O-N 3.04Å; A22-L24 VanDerWaalsContact O-N 3.08Å; L24-L68 HydrophobicContact CD1-CD2 3.97Å; L24-R71 WeakPolarHBondContact O-CD 3.5Å; L24-R71 PolarHBondContact O-NH1 2.93Å; L24-R72 HydrophobicContact CD1-CG 3.96Å; L24-R72 HydrophobicContact CD2-CG 4.01Å
25	F	86.8	Confident	89.5	Confident	19 Å²	19	73.7 Å²	73.7	8%	0.083	34%	0.335	C	S	.	.	S	Bend	trans	-132.1	145.4	-179.6	-73	-97	0	0	0	110.4	I19 K23 E29 I30 I33 L67 L68	I19-F25 HydrophobicContact CG2-CB 3.97Å; I19-F25 HydrophobicContact CG2-CD2 3.42Å; I19-F25 VanDerWaalsContact CG2-CD2 3.42Å; I19-F25 HydrophobicContact CG2-CE2 4.3Å; I19-F25 HydrophobicContact CG2-CG 4.04Å; K23-F25 VanDerWaalsContact C-N 3.34Å; F25-E29 WeakPolarHBondContact CA-OE2 3.39Å; F25-E29 HydrophobicContact CB-CB 4.39Å; F25-E29 HydrophobicContact CD1-CB 3.97Å; F25-E29 WeakPolarHBondContact CD1-OE2 3.48Å; F25-I30 HydrophobicContact CB-CD1 4.24Å; F25-I30 HydrophobicContact CB-CG1 3.74Å; F25-I33 HydrophobicContact CD1-CD1 3.99Å; F25-I33 HydrophobicContact CE1-CD1 4.02Å; F25-I33 HydrophobicContact CG-CD1 4.49Å; F25-L67 HydrophobicContact CZ-CB 4.3Å; F25-L68 HydrophobicContact CD2-CD2 4.34Å; F25-L68 HydrophobicContact CE2-CD2 3.51Å; F25-L68 HydrophobicContact CE2-CG 3.76Å; F25-L68 HydrophobicContact CZ-CD2 4.39Å; F25-L68 HydrophobicContact CZ-CG 4.15Å
26	N	88.4	Confident	89.7	Confident	102 Å²	102	78.5 Å²	78.5	55%	0.545	36%	0.355	S	S	.	.			trans	-73	158.6	172	-164.6	6	0	0	0	110.4	L28 E29 I30	N26-L28 PolarHBondContact O-N 2.99Å; N26-E29 HydrophobicContact CB-CG 4.21Å; N26-E29 PolarHBondContact N-OE2 3.16Å; N26-E29 PolarHBondContact O-N 3.36Å; N26-E29 VanDerWaalsContact O-N 3.16Å; N26-I30 WeakPolarHBondContact O-CG1 3.34Å; N26-I30 PolarHBondContact O-N 3.24Å
27	R	88.7	Confident	89.9	Confident	162 Å²	162	77.3 Å²	77.3	61%	0.611	35%	0.349	S	S	*	.	H	α-helix	trans	-56.7	-38.6	179.1	-173.5	178.6	179.3	-178.8	-2.2	112.1	I30 N31	R27-I30 PolarHBondContact O-N 3.32Å; R27-N31 VanDerWaalsContact O-CG 3.23Å; R27-N31 PolarHBondContact O-N 3.42Å; R27-N31 PolarHBondContact O-OD1 3.41Å
28	L	91.3	Very high	90.1	Very high	118 Å²	118	78.2 Å²	78.2	62%	0.618	35%	0.346	S	S	*	.	H	α-helix	trans	-63.5	-47.1	177.5	-62.9	179.1	0	0	0	111.6	N26 I30 N31 E32	N26-L28 PolarHBondContact O-N 2.99Å; L28-I30 VanDerWaalsContact C-N 3.34Å; L28-I30 PolarHBondContact O-N 3.07Å; L28-N31 WeakPolarHBondContact O-CB 3.5Å; L28-N31 PolarHBondContact O-N 3.13Å; L28-N31 VanDerWaalsContact O-N 3.16Å; L28-E32 WeakPolarHBondContact O-CG 3.15Å; L28-E32 PolarHBondContact O-N 3.34Å
29	E	91.5	Very high	90.3	Very high	60 Å²	60	82.1 Å²	82.1	28%	0.28	36%	0.364	S	S	.	.	H	α-helix	trans	-65.5	-38.1	179.4	-56.7	175.5	137.9	0	0	111.9	F25 N26 N31 E32 I33 R71	F25-E29 WeakPolarHBondContact CA-OE2 3.39Å; F25-E29 HydrophobicContact CB-CB 4.39Å; F25-E29 HydrophobicContact CD1-CB 3.97Å; F25-E29 WeakPolarHBondContact CD1-OE2 3.48Å; N26-E29 HydrophobicContact CB-CG 4.21Å; N26-E29 PolarHBondContact N-OE2 3.16Å; N26-E29 PolarHBondContact O-N 3.36Å; N26-E29 VanDerWaalsContact O-N 3.16Å; E29-N31 VanDerWaalsContact C-N 3.33Å; E29-N31 PolarHBondContact O-N 3.01Å; E29-E32 WeakPolarHBondContact O-CB 3.3Å; E29-E32 PolarHBondContact O-N 2.98Å; E29-I33 WeakPolarHBondContact O-CG1 3.39Å; E29-I33 PolarHBondContact O-N 3.41Å; E29-R71 IonicContact OE1-CZ 2.86Å; E29-R71 IonicContact OE1-NH1 3.99Å; E29-R71 PolarHBondContact OE1-NH1 3.43Å; E29-R71 IonicContact OE1-NH2 2.72Å; E29-R71 PolarHBondContact OE1-NH2 3.14Å; E29-R71 IonicContact OE2-CZ 3.28Å; E29-R71 IonicContact OE2-NH1 3.6Å; E29-R71 PolarHBondContact OE2-NH1 2.81Å; E29-R71 IonicContact OE2-NH2 3.85Å; E29-R71 PolarHBondContact OE2-NH2 2.78Å
30	I	92.1	Very high	90.6	Very high	15 Å²	15	82.9 Å²	82.9	8%	0.077	37%	0.368	C	S	.	.	H	α-helix	trans	-60.2	-45.9	173.5	-69.1	171.5	0	0	0	110.1	I16 I19 R20 F25 N26 R27 L28 E32 I33 V34	I16-I30 HydrophobicContact CG2-CG2 3.44Å; I16-I30 VanDerWaalsContact CG2-CG2 3.44Å; I19-I30 HydrophobicContact CG2-CD1 4.47Å; I19-I30 HydrophobicContact CG2-CG1 4.5Å; R20-I30 HydrophobicContact CB-CD1 3.96Å; R20-I30 HydrophobicContact CG-CD1 4.34Å; F25-I30 HydrophobicContact CB-CD1 4.24Å; F25-I30 HydrophobicContact CB-CG1 3.74Å; N26-I30 WeakPolarHBondContact O-CG1 3.34Å; N26-I30 PolarHBondContact O-N 3.24Å; R27-I30 PolarHBondContact O-N 3.32Å; L28-I30 VanDerWaalsContact C-N 3.34Å; L28-I30 PolarHBondContact O-N 3.07Å; I30-E32 VanDerWaalsContact C-N 3.28Å; I30-E32 PolarHBondContact O-N 3.26Å; I30-I33 PolarHBondContact O-N 2.88Å; I30-V34 WeakPolarHBondContact O-CG2 3.35Å; I30-V34 PolarHBondContact O-N 2.91Å
31	N	92.9	Very high	90.9	Very high	88 Å²	88	75.7 Å²	75.7	47%	0.471	34%	0.341	S	S	.	.	H	α-helix	trans	-62.4	-37.2	176.9	-69.3	-12.4	0	0	0	111.5	R27 L28 E29 V34 R35	R27-N31 VanDerWaalsContact O-CG 3.23Å; R27-N31 PolarHBondContact O-N 3.42Å; R27-N31 PolarHBondContact O-OD1 3.41Å; L28-N31 WeakPolarHBondContact O-CB 3.5Å; L28-N31 PolarHBondContact O-N 3.13Å; L28-N31 VanDerWaalsContact O-N 3.16Å; E29-N31 VanDerWaalsContact C-N 3.33Å; E29-N31 PolarHBondContact O-N 3.01Å; N31-V34 PolarHBondContact O-N 2.98Å; N31-R35 WeakPolarHBondContact O-CB 3.35Å; N31-R35 PolarHBondContact O-N 3.34Å
32	E	93	Very high	91.3	Very high	100 Å²	100	74.4 Å²	74.4	47%	0.467	33%	0.333	S	S	.	.	H	α-helix	trans	-65.1	-41.6	174.4	-72.5	-172.3	175.8	0	0	112.9	L28 E29 I30 V34 R35 K36	L28-E32 WeakPolarHBondContact O-CG 3.15Å; L28-E32 PolarHBondContact O-N 3.34Å; E29-E32 WeakPolarHBondContact O-CB 3.3Å; E29-E32 PolarHBondContact O-N 2.98Å; I30-E32 VanDerWaalsContact C-N 3.28Å; I30-E32 PolarHBondContact O-N 3.26Å; E32-V34 VanDerWaalsContact C-N 3.34Å; E32-R35 PolarHBondContact O-N 3.44Å; E32-K36 WeakPolarHBondContact O-CB 3.4Å; E32-K36 WeakPolarHBondContact O-CG 3.39Å; E32-K36 PolarHBondContact O-N 2.85Å
33	I	92.9	Very high	91.6	Very high	21 Å²	21	74.6 Å²	74.6	11%	0.108	33%	0.334	C	S	.	.	H	α-helix	trans	-59.7	-47.6	175.1	-69.5	165.2	0	0	0	109.7	F25 E29 I30 R35 K36 R37 I64	F25-I33 HydrophobicContact CD1-CD1 3.99Å; F25-I33 HydrophobicContact CE1-CD1 4.02Å; F25-I33 HydrophobicContact CG-CD1 4.49Å; E29-I33 WeakPolarHBondContact O-CG1 3.39Å; E29-I33 PolarHBondContact O-N 3.41Å; I30-I33 PolarHBondContact O-N 2.88Å; I33-R35 PolarHBondContact O-N 3.14Å; I33-K36 PolarHBondContact O-N 3Å; I33-R37 HydrophobicContact CG2-CG 4.46Å; I33-R37 WeakPolarHBondContact O-CB 3.32Å; I33-R37 VanDerWaalsContact O-CG 3.31Å; I33-R37 WeakPolarHBondContact O-CG 3.5Å; I33-R37 PolarHBondContact O-N 2.99Å; I33-I64 HydrophobicContact CG2-CD1 3.97Å
34	V	93.2	Very high	92.1	Very high	42 Å²	42	66 Å²	66	26%	0.255	30%	0.297	S	S	.	.	H	α-helix	trans	-60.6	-45	177	174.1	0	0	0	0	111	I16 I30 N31 E32 R37 R38	I16-V34 HydrophobicContact CD1-CG2 3.48Å; I16-V34 VanDerWaalsContact CD1-CG2 3.48Å; I30-V34 WeakPolarHBondContact O-CG2 3.35Å; I30-V34 PolarHBondContact O-N 2.91Å; N31-V34 PolarHBondContact O-N 2.98Å; E32-V34 VanDerWaalsContact C-N 3.34Å; V34-R37 PolarHBondContact O-N 3.23Å; V34-R38 WeakPolarHBondContact O-CB 3.5Å; V34-R38 PolarHBondContact O-N 2.82Å
35	R	94.1	Very high	92.5	Very high	175 Å²	175	67.5 Å²	67.5	66%	0.66	30%	0.304	S	S	*	.	H	α-helix	trans	-60.8	-47	178.4	-171.4	178.6	76.2	114.1	-4.1	111.9	N31 E32 I33 R38 H39	N31-R35 WeakPolarHBondContact O-CB 3.35Å; N31-R35 PolarHBondContact O-N 3.34Å; E32-R35 PolarHBondContact O-N 3.44Å; I33-R35 PolarHBondContact O-N 3.14Å; R35-R38 PolarHBondContact O-N 3Å; R35-H39 PolarHBondContact O-N 3.19Å
36	K	94.5	Very high	92.6	Very high	106 Å²	106	70.7 Å²	70.7	46%	0.461	32%	0.318	S	S	.	.	H	α-helix	trans	-63	-45.9	177.5	-74.9	177.3	178.8	171.5	0	111.1	E32 I33 R38 H39 H40	E32-K36 WeakPolarHBondContact O-CB 3.4Å; E32-K36 WeakPolarHBondContact O-CG 3.39Å; E32-K36 PolarHBondContact O-N 2.85Å; I33-K36 PolarHBondContact O-N 3Å; K36-R38 PolarHBondContact O-N 2.95Å; K36-H39 WeakPolarHBondContact O-CB 3.45Å; K36-H39 PolarHBondContact O-N 3.49Å; K36-H40 PolarHBondContact O-CD2 3.1Å; K36-H40 PolarHBondContact O-N 3.44Å
37	R	95	Very high	92.6	Very high	2 Å²	2	77.3 Å²	77.3	1%	0.008	34%	0.335	C	S	.	.	H	α-helix	trans	-58.6	-47.4	176.2	-77.1	178	170.3	168.3	1.3	112.1	L9 E15 I33 V34 H39 H40 E41 Y57 E61	L9-R37 HydrophobicContact CD2-CB 4.01Å; E15-R37 IonicContact OE1-CZ 3.79Å; E15-R37 VanDerWaalsContact OE1-CZ 3.24Å; E15-R37 IonicContact OE1-NH1 3.52Å; E15-R37 PolarHBondContact OE1-NH1 3.23Å; E15-R37 IonicContact OE1-NH2 2.93Å; E15-R37 PolarHBondContact OE1-NH2 3.28Å; E15-R37 IonicContact OE2-NH2 3.71Å; I33-R37 HydrophobicContact CG2-CG 4.46Å; I33-R37 WeakPolarHBondContact O-CB 3.32Å; I33-R37 VanDerWaalsContact O-CG 3.31Å; I33-R37 WeakPolarHBondContact O-CG 3.5Å; I33-R37 PolarHBondContact O-N 2.99Å; V34-R37 PolarHBondContact O-N 3.23Å; R37-H39 VanDerWaalsContact C-N 3.33Å; R37-H39 PolarHBondContact O-N 2.97Å; R37-H40 PolarHBondContact O-N 2.83Å; R37-E41 WeakPolarHBondContact O-CG 3.42Å; R37-E41 PolarHBondContact O-N 3.07Å; R37-Y57 HydrophobicContact CG-CE2 4.26Å; R37-E61 WeakPolarHBondContact CG-OE1 3.44Å; R37-E61 IonicContact CZ-OE1 3.43Å; R37-E61 IonicContact CZ-OE2 3.15Å; R37-E61 IonicContact NE-OE1 2.93Å; R37-E61 PolarHBondContact NE-OE1 2.7Å; R37-E61 IonicContact NE-OE2 2.66Å; R37-E61 IonicContact NH2-OE1 3.79Å; R37-E61 IonicContact NH2-OE2 3.63Å; R37-E61 PolarHBondContact NH2-OE2 2.88Å
38	R	94.1	Very high	92.7	Very high	109 Å²	109	75.6 Å²	75.6	41%	0.411	34%	0.338	S	S	.	.	H	α-helix	trans	-57.2	-46.7	175.6	179.3	176.5	-77.1	172.3	-3.2	111.3	E6 L9 V34 R35 K36 H40 E41 Y42	E6-R38 IonicContact OE1-CZ 3.67Å; E6-R38 IonicContact OE1-NE 2.84Å; E6-R38 IonicContact OE1-NH2 3.66Å; E6-R38 IonicContact OE2-NH2 2.87Å; E6-R38 PolarHBondContact OE2-NH2 3.18Å; L9-R38 HydrophobicContact CD1-CB 3.87Å; L9-R38 HydrophobicContact CD1-CG 4Å; L9-R38 HydrophobicContact CD2-CB 4.38Å; V34-R38 WeakPolarHBondContact O-CB 3.5Å; V34-R38 PolarHBondContact O-N 2.82Å; R35-R38 PolarHBondContact O-N 3Å; K36-R38 PolarHBondContact O-N 2.95Å; R38-H40 VanDerWaalsContact C-N 3.35Å; R38-H40 PolarHBondContact O-N 3.06Å; R38-E41 PolarHBondContact O-N 3.18Å; R38-Y42 HydrophobicContact CG-CD2 3.71Å; R38-Y42 HydrophobicContact CG-CE2 3.51Å; R38-Y42 WeakPolarHBondContact O-CD2 3.45Å; R38-Y42 PolarHBondContact O-N 2.87Å
39	H	94.9	Very high	92.6	Very high	120 Å²	120	73.3 Å²	73.3	56%	0.556	32%	0.323	S	S	*	.	H	α-helix	trans	-60.3	-41.9	177.6	179.4	75.8	0	0	0	113	R35 K36 R37 S43	R35-H39 PolarHBondContact O-N 3.19Å; K36-H39 WeakPolarHBondContact O-CB 3.45Å; K36-H39 PolarHBondContact O-N 3.49Å; R37-H39 VanDerWaalsContact C-N 3.33Å; R37-H39 PolarHBondContact O-N 2.97Å; H39-S43 WeakPolarHBondContact O-CB 3.38Å; H39-S43 PolarHBondContact O-N 3.26Å; H39-S43 PolarHBondContact O-OG 3.11Å
40	H	95.7	Very high	92.7	Very high	21 Å²	21	76.4 Å²	76.4	10%	0.097	33%	0.332	C	S	.	.	H	α-helix	trans	-67.2	-43.5	175.8	-69.8	-54.7	0	0	0	112.4	K36 R37 R38 Y42 S43 L44 Y57 T60	K36-H40 PolarHBondContact O-CD2 3.1Å; K36-H40 PolarHBondContact O-N 3.44Å; R37-H40 PolarHBondContact O-N 2.83Å; R38-H40 VanDerWaalsContact C-N 3.35Å; R38-H40 PolarHBondContact O-N 3.06Å; H40-Y42 PolarHBondContact O-N 2.9Å; H40-S43 CarbonylContact O-C 3.57Å; H40-S43 WeakPolarHBondContact O-CA 3.38Å; H40-S43 WeakPolarHBondContact O-CB 3.46Å; H40-S43 PolarHBondContact O-N 3.05Å; H40-L44 WeakPolarHBondContact O-CG 3.28Å; H40-L44 PolarHBondContact O-N 3.37Å; H40-Y57 HydrophobicContact CB-CD1 3.81Å; H40-Y57 HydrophobicContact CB-CD2 3.5Å; H40-Y57 VanDerWaalsContact CB-CD2 3.5Å; H40-Y57 HydrophobicContact CB-CE1 4.19Å; H40-Y57 HydrophobicContact CB-CE2 3.9Å; H40-Y57 HydrophobicContact CB-CG 3.46Å; H40-Y57 VanDerWaalsContact CB-CG 3.46Å; H40-Y57 AromaticContact CD2-CD2 3.68Å; H40-Y57 AromaticContact CG-CD2 3.66Å; H40-Y57 AromaticContact CG-CG 3.85Å; H40-T60 PolarHBondContact CD2-OG1 3.07Å; H40-T60 VanDerWaalsContact NE2-CG2 3.27Å; H40-T60 WeakPolarHBondContact NE2-CG2 3.35Å; H40-T60 PolarHBondContact NE2-OG1 3.34Å
41	E	94	Very high	92.8	Very high	1 Å²	1	77.6 Å²	77.6	1%	0.005	34%	0.338	C	S	.	.	H	α-helix	trans	-61.4	-42.3	177	-73.1	-70.3	168.8	0	0	111.4	V5 N8 R37 R38 S43 L44 Q45 Y57 R94	V5-E41 HydrophobicContact CB-CB 4.47Å; V5-E41 HydrophobicContact CG1-CB 3.79Å; V5-E41 HydrophobicContact CG2-CB 4.33Å; N8-E41 HydrophobicContact CB-CG 4.43Å; N8-E41 PolarHBondContact ND2-OE2 3.06Å; R37-E41 WeakPolarHBondContact O-CG 3.42Å; R37-E41 PolarHBondContact O-N 3.07Å; R38-E41 PolarHBondContact O-N 3.18Å; E41-S43 VanDerWaalsContact C-N 3.34Å; E41-S43 PolarHBondContact O-N 2.76Å; E41-L44 PolarHBondContact O-N 3.47Å; E41-Q45 WeakPolarHBondContact O-CG 3.27Å; E41-Q45 PolarHBondContact O-N 3.13Å; E41-Y57 HydrophobicContact CG-CE1 4.2Å; E41-Y57 WeakPolarHBondContact OE1-CE1 3.16Å; E41-Y57 PolarHBondContact OE1-OH 2.87Å; E41-R94 IonicContact OE1-CZ 3.76Å; E41-R94 IonicContact OE1-NH1 2.68Å; E41-R94 IonicContact OE1-NH2 3.42Å; E41-R94 PolarHBondContact OE1-NH2 2.96Å
42	Y	94.4	Very high	92.9	Very high	108 Å²	108	79.2 Å²	79.2	42%	0.424	35%	0.346	S	S	.	.	H	α-helix	trans	-62.3	-39.4	170.7	-81.7	-66.7	0	0	0	112.8	V5 R38 H40 L44 Q45 K46	V5-Y42 HydrophobicContact CB-CE1 4.48Å; V5-Y42 HydrophobicContact CG1-CD2 4.12Å; V5-Y42 HydrophobicContact CG1-CE1 4.42Å; V5-Y42 HydrophobicContact CG1-CE2 3.93Å; V5-Y42 HydrophobicContact CG1-CG 4.44Å; V5-Y42 HydrophobicContact CG2-CD1 4.05Å; V5-Y42 HydrophobicContact CG2-CE1 4.16Å; V5-Y42 HydrophobicContact CG2-CG 4.42Å; R38-Y42 HydrophobicContact CG-CD2 3.71Å; R38-Y42 HydrophobicContact CG-CE2 3.51Å; R38-Y42 WeakPolarHBondContact O-CD2 3.45Å; R38-Y42 PolarHBondContact O-N 2.87Å; H40-Y42 PolarHBondContact O-N 2.9Å; Y42-L44 VanDerWaalsContact C-N 3.29Å; Y42-L44 PolarHBondContact O-N 2.94Å; Y42-Q45 PolarHBondContact O-N 3.3Å; Y42-Q45 VanDerWaalsContact O-N 3.1Å; Y42-K46 PolarHBondContact O-N 3.32Å
43	S	93.3	Very high	93	Very high	6 Å²	6	75.1 Å²	75.1	4%	0.042	33%	0.327	C	S	.	.	H	α-helix	trans	-63	-35.5	176.8	-66.1	0	0	0	0	112.5	H39 H40 E41 Q45 K46	H39-S43 WeakPolarHBondContact O-CB 3.38Å; H39-S43 PolarHBondContact O-N 3.26Å; H39-S43 PolarHBondContact O-OG 3.11Å; H40-S43 CarbonylContact O-C 3.57Å; H40-S43 WeakPolarHBondContact O-CA 3.38Å; H40-S43 WeakPolarHBondContact O-CB 3.46Å; H40-S43 PolarHBondContact O-N 3.05Å; E41-S43 VanDerWaalsContact C-N 3.34Å; E41-S43 PolarHBondContact O-N 2.76Å; S43-Q45 VanDerWaalsContact C-N 3.3Å; S43-Q45 PolarHBondContact O-N 3.04Å; S43-K46 WeakPolarHBondContact O-CB 3.37Å; S43-K46 WeakPolarHBondContact O-CD 3.3Å; S43-K46 VanDerWaalsContact O-CG 3.29Å; S43-K46 WeakPolarHBondContact O-CG 3.37Å; S43-K46 PolarHBondContact O-N 3.48Å
44	L	91.8	Very high	93.1	Very high	3 Å²	3	74.3 Å²	74.3	2%	0.016	32%	0.323	C	S	.	.	H	α-helix	trans	-72.7	-21.5	174.2	-67.1	-170.9	0	0	0	113.9	H40 E41 Y42 K49 D53 Y54 Y57 L95	H40-L44 WeakPolarHBondContact O-CG 3.28Å; H40-L44 PolarHBondContact O-N 3.37Å; E41-L44 PolarHBondContact O-N 3.47Å; Y42-L44 VanDerWaalsContact C-N 3.29Å; Y42-L44 PolarHBondContact O-N 2.94Å; L44-K49 WeakPolarHBondContact O-CD 3.48Å; L44-K49 WeakPolarHBondContact O-CE 3.36Å; L44-D53 HydrophobicContact CD2-CB 4.2Å; L44-Y54 HydrophobicContact CD1-CD1 4.15Å; L44-Y54 HydrophobicContact CD1-CE1 3.96Å; L44-Y54 HydrophobicContact CD2-CD1 3.63Å; L44-Y54 HydrophobicContact CD2-CD2 3.81Å; L44-Y54 HydrophobicContact CD2-CE1 3.71Å; L44-Y54 HydrophobicContact CD2-CE2 3.89Å; L44-Y54 HydrophobicContact CD2-CG 3.67Å; L44-Y54 HydrophobicContact CG-CE1 4.43Å; L44-Y57 HydrophobicContact CD1-CD1 3.74Å; L44-Y57 HydrophobicContact CD1-CE1 4.24Å; L44-Y57 HydrophobicContact CG-CD1 4.45Å; L44-L95 HydrophobicContact CD1-CD2 3.57Å
45	Q	90.3	Very high	93.2	Very high	40 Å²	40	74 Å²	74	19%	0.187	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-4.8	174.6	-61.7	-50.4	-34.6	0	0	113.4	M1 V5 E41 Y42 S43	M1-Q45 HydrophobicContact CE-CB 3.91Å; M1-Q45 WeakPolarHBondContact CE-O 3.28Å; V5-Q45 HydrophobicContact CG2-CG 3.63Å; E41-Q45 WeakPolarHBondContact O-CG 3.27Å; E41-Q45 PolarHBondContact O-N 3.13Å; Y42-Q45 PolarHBondContact O-N 3.3Å; Y42-Q45 VanDerWaalsContact O-N 3.1Å; S43-Q45 VanDerWaalsContact C-N 3.3Å; S43-Q45 PolarHBondContact O-N 3.04Å
46	K	89.6	Confident	93.3	Very high	86 Å²	86	67.8 Å²	67.8	37%	0.374	31%	0.306	S	S	.	.	S	Bend	trans	-51.5	146.9	174	-70.3	172.5	-177.1	164.6	0	111.1	Y42 S43 N48 K49 D53	Y42-K46 PolarHBondContact O-N 3.32Å; S43-K46 WeakPolarHBondContact O-CB 3.37Å; S43-K46 WeakPolarHBondContact O-CD 3.3Å; S43-K46 VanDerWaalsContact O-CG 3.29Å; S43-K46 WeakPolarHBondContact O-CG 3.37Å; S43-K46 PolarHBondContact O-N 3.48Å; K46-N48 VanDerWaalsContact C-N 3.29Å; K46-N48 PolarHBondContact O-N 2.87Å; K46-K49 WeakPolarHBondContact O-CG 3.43Å; K46-D53 IonicContact NZ-OD1 3.93Å
47	R	87.7	Confident	93.5	Very high	240 Å²	240	62.9 Å²	62.9	91%	0.906	29%	0.285	S	S	*	.	S	Bend	trans	-54.2	-47.4	178.2	-176.3	174.8	-179.8	148	-0.3	111.4
48	N	89.6	Confident	93.5	Very high	127 Å²	127	63 Å²	63	68%	0.679	29%	0.286	S	S	*	.	S	Bend	trans	-96.5	99.9	174.2	-64.6	-11	0	0	0	109	K46	K46-N48 VanDerWaalsContact C-N 3.29Å; K46-N48 PolarHBondContact O-N 2.87Å
49	K	91	Very high	93.6	Very high	69 Å²	69	61.1 Å²	61.1	30%	0.3	29%	0.289	S	S	.	.			trans	-79.6	130.9	177.1	-58.9	-176.9	-176.4	-171.7	0	108.9	L44 K46 Y54 F103	L44-K49 WeakPolarHBondContact O-CD 3.48Å; L44-K49 WeakPolarHBondContact O-CE 3.36Å; K46-K49 WeakPolarHBondContact O-CG 3.43Å; K49-Y54 HydrophobicContact CB-CE2 4.45Å; K49-F103 WeakPolarHBondContact O-CZ 3.36Å
50	R	93.7	Very high	93.6	Very high	126 Å²	126	56.9 Å²	56.9	48%	0.475	27%	0.272	S	S	.	.			trans	-117.6	149.6	179.7	-54.6	173.7	-64.5	174.5	6.1	110.2	L52 D53 Y54	R50-L52 PolarHBondContact O-N 2.83Å; R50-D53 WeakPolarHBondContact CB-OD2 3.45Å; R50-D53 IonicContact CZ-OD1 3.3Å; R50-D53 IonicContact CZ-OD2 2.72Å; R50-D53 IonicContact NE-OD1 2.77Å; R50-D53 IonicContact NE-OD2 3.52Å; R50-D53 PolarHBondContact NE-OD2 3.35Å; R50-D53 IonicContact NH2-OD1 3.51Å; R50-D53 PolarHBondContact NH2-OD1 2.91Å; R50-D53 IonicContact NH2-OD2 3.79Å; R50-D53 PolarHBondContact NH2-OD2 3.47Å; R50-D53 PolarHBondContact O-N 3.46Å; R50-D53 VanDerWaalsContact O-N 3.12Å; R50-Y54 WeakPolarHBondContact O-CD2 3.31Å
51	I	93.7	Very high	93.6	Very high	39 Å²	39	55.9 Å²	55.9	20%	0.2	27%	0.267	C	S	.	.	H	α-helix	trans	-55.5	-41.1	174.6	-61	170.5	0	0	0	110.2	D53 Y54 D55 L99 F103 L109	I51-D53 VanDerWaalsContact C-N 3.29Å; I51-D53 PolarHBondContact O-N 3.37Å; I51-Y54 WeakPolarHBondContact O-CB 3.44Å; I51-Y54 PolarHBondContact O-N 3.43Å; I51-Y54 VanDerWaalsContact O-N 3.08Å; I51-D55 PolarHBondContact O-N 3.37Å; I51-L99 HydrophobicContact CB-CD1 4.39Å; I51-L99 HydrophobicContact CG1-CD1 4.31Å; I51-L99 HydrophobicContact CG2-CD1 4.12Å; I51-F103 HydrophobicContact CD1-CB 4.47Å; I51-F103 HydrophobicContact CD1-CD1 3.98Å; I51-F103 HydrophobicContact CD1-CE1 4.37Å; I51-F103 HydrophobicContact CD1-CG 4.1Å; I51-F103 HydrophobicContact CG1-CB 4.45Å; I51-F103 HydrophobicContact CG1-CD1 3.71Å; I51-F103 HydrophobicContact CG1-CD2 3.73Å; I51-F103 HydrophobicContact CG1-CE1 3.76Å; I51-F103 HydrophobicContact CG1-CE2 3.76Å; I51-F103 HydrophobicContact CG1-CG 3.69Å; I51-F103 HydrophobicContact CG1-CZ 3.78Å; I51-L109 HydrophobicContact CD1-CD1 4.12Å; I51-L109 HydrophobicContact CG1-CD1 4.35Å; I51-L109 HydrophobicContact CG2-CD1 4.49Å; I51-L109 HydrophobicContact CG2-CD2 4.06Å
52	L	94.7	Very high	93.6	Very high	122 Å²	122	58.7 Å²	58.7	64%	0.639	28%	0.281	S	S	*	.	H	α-helix	trans	-57.5	-36.2	178	-66.6	176.6	0	0	0	113.9	R50 Y54 D55 A56	R50-L52 PolarHBondContact O-N 2.83Å; L52-Y54 VanDerWaalsContact C-N 3.34Å; L52-D55 PolarHBondContact O-N 2.94Å; L52-A56 WeakPolarHBondContact O-CB 3.31Å; L52-A56 PolarHBondContact O-N 3.44Å
53	D	94.8	Very high	93.6	Very high	14 Å²	14	57 Å²	57	8%	0.075	28%	0.282	C	S	.	.	H	α-helix	trans	-69.1	-36.1	179.4	-61.2	-59.6	0	0	0	110.5	L44 K46 R50 I51 Y57	L44-D53 HydrophobicContact CD2-CB 4.2Å; K46-D53 IonicContact NZ-OD1 3.93Å; R50-D53 WeakPolarHBondContact CB-OD2 3.45Å; R50-D53 IonicContact CZ-OD1 3.3Å; R50-D53 IonicContact CZ-OD2 2.72Å; R50-D53 IonicContact NE-OD1 2.77Å; R50-D53 IonicContact NE-OD2 3.52Å; R50-D53 PolarHBondContact NE-OD2 3.35Å; R50-D53 IonicContact NH2-OD1 3.51Å; R50-D53 PolarHBondContact NH2-OD1 2.91Å; R50-D53 IonicContact NH2-OD2 3.79Å; R50-D53 PolarHBondContact NH2-OD2 3.47Å; R50-D53 PolarHBondContact O-N 3.46Å; R50-D53 VanDerWaalsContact O-N 3.12Å; I51-D53 VanDerWaalsContact C-N 3.29Å; I51-D53 PolarHBondContact O-N 3.37Å; D53-Y57 PolarHBondContact O-N 3.3Å
54	Y	95.9	Very high	93.6	Very high	4 Å²	4	57.4 Å²	57.4	2%	0.016	28%	0.284	C	S	.	.	H	α-helix	trans	-69.2	-43.5	171.6	-75	-85.1	0	0	0	112.1	L44 K49 R50 I51 L52 Y57 I58 L95 Q98 L99 F103	L44-Y54 HydrophobicContact CD1-CD1 4.15Å; L44-Y54 HydrophobicContact CD1-CE1 3.96Å; L44-Y54 HydrophobicContact CD2-CD1 3.63Å; L44-Y54 HydrophobicContact CD2-CD2 3.81Å; L44-Y54 HydrophobicContact CD2-CE1 3.71Å; L44-Y54 HydrophobicContact CD2-CE2 3.89Å; L44-Y54 HydrophobicContact CD2-CG 3.67Å; L44-Y54 HydrophobicContact CG-CE1 4.43Å; K49-Y54 HydrophobicContact CB-CE2 4.45Å; R50-Y54 WeakPolarHBondContact O-CD2 3.31Å; I51-Y54 WeakPolarHBondContact O-CB 3.44Å; I51-Y54 PolarHBondContact O-N 3.43Å; I51-Y54 VanDerWaalsContact O-N 3.08Å; L52-Y54 VanDerWaalsContact C-N 3.34Å; Y54-Y57 PolarHBondContact O-N 3.39Å; Y54-I58 WeakPolarHBondContact O-CB 3.33Å; Y54-I58 VanDerWaalsContact O-CG1 3.31Å; Y54-I58 WeakPolarHBondContact O-CG1 3.29Å; Y54-I58 PolarHBondContact O-N 3.48Å; Y54-L95 HydrophobicContact CD1-CD2 4.45Å; Y54-Q98 HydrophobicContact CE1-CB 3.81Å; Y54-L99 HydrophobicContact CD1-CB 4.11Å; Y54-L99 HydrophobicContact CD1-CD1 4.45Å; Y54-L99 HydrophobicContact CD2-CD1 3.68Å; Y54-L99 HydrophobicContact CE2-CD1 4.45Å; Y54-L99 HydrophobicContact CG-CB 4.19Å; Y54-L99 HydrophobicContact CG-CD1 3.69Å; Y54-L99 HydrophobicContact CG-CG 4.44Å; Y54-F103 HydrophobicContact CD2-CE2 4.06Å; Y54-F103 AromaticContact CE2-CE2 3.97Å; Y54-F103 HydrophobicContact CE2-CE2 3.97Å
55	D	95.5	Very high	93.7	Very high	37 Å²	37	58.2 Å²	58.2	20%	0.198	29%	0.288	C	S	.	.	H	α-helix	trans	-64.4	-41.6	-179.2	-75.9	-13.2	0	0	0	112.3	I51 L52 Y57 I58 S59 R112	I51-D55 PolarHBondContact O-N 3.37Å; L52-D55 PolarHBondContact O-N 2.94Å; D55-Y57 VanDerWaalsContact C-N 3.3Å; D55-Y57 PolarHBondContact O-N 3.2Å; D55-I58 PolarHBondContact O-N 3.38Å; D55-S59 VanDerWaalsContact O-CB 3.24Å; D55-S59 WeakPolarHBondContact O-CB 3.36Å; D55-S59 PolarHBondContact O-N 2.88Å; D55-S59 PolarHBondContact O-OG 2.88Å; D55-R112 IonicContact OD1-CZ 3.03Å; D55-R112 IonicContact OD1-NH1 3.62Å; D55-R112 PolarHBondContact OD1-NH1 3.36Å; D55-R112 IonicContact OD1-NH2 3.17Å; D55-R112 PolarHBondContact OD1-NH2 3.46Å; D55-R112 IonicContact OD2-NH1 3.09Å
56	A	96.2	Very high	93.7	Very high	44 Å²	44	62.5 Å²	62.5	36%	0.364	31%	0.306	S	S	.	.	H	α-helix	trans	-58.1	-46.2	172.7	0	0	0	0	0	110.3	L52 S59 T60	L52-A56 WeakPolarHBondContact O-CB 3.31Å; L52-A56 PolarHBondContact O-N 3.44Å; A56-S59 PolarHBondContact O-N 3.31Å; A56-T60 WeakPolarHBondContact O-CG2 3.36Å; A56-T60 PolarHBondContact O-N 3.35Å
57	Y	97.1	Very high	93.8	Very high	2 Å²	2	62.5 Å²	62.5	1%	0.008	31%	0.31	C	S	.	.	H	α-helix	trans	-66.2	-48.2	-179.7	-167.1	-170.7	0	0	0	112.4	R37 H40 E41 L44 D53 Y54 D55 S59 T60 E61 R91 L95	R37-Y57 HydrophobicContact CG-CE2 4.26Å; H40-Y57 HydrophobicContact CB-CD1 3.81Å; H40-Y57 HydrophobicContact CB-CD2 3.5Å; H40-Y57 VanDerWaalsContact CB-CD2 3.5Å; H40-Y57 HydrophobicContact CB-CE1 4.19Å; H40-Y57 HydrophobicContact CB-CE2 3.9Å; H40-Y57 HydrophobicContact CB-CG 3.46Å; H40-Y57 VanDerWaalsContact CB-CG 3.46Å; H40-Y57 AromaticContact CD2-CD2 3.68Å; H40-Y57 AromaticContact CG-CD2 3.66Å; H40-Y57 AromaticContact CG-CG 3.85Å; E41-Y57 HydrophobicContact CG-CE1 4.2Å; E41-Y57 WeakPolarHBondContact OE1-CE1 3.16Å; E41-Y57 PolarHBondContact OE1-OH 2.87Å; L44-Y57 HydrophobicContact CD1-CD1 3.74Å; L44-Y57 HydrophobicContact CD1-CE1 4.24Å; L44-Y57 HydrophobicContact CG-CD1 4.45Å; D53-Y57 PolarHBondContact O-N 3.3Å; Y54-Y57 PolarHBondContact O-N 3.39Å; D55-Y57 VanDerWaalsContact C-N 3.3Å; D55-Y57 PolarHBondContact O-N 3.2Å; Y57-S59 VanDerWaalsContact C-N 3.26Å; Y57-S59 PolarHBondContact O-N 3.34Å; Y57-T60 PolarHBondContact O-N 3.26Å; Y57-T60 VanDerWaalsContact O-N 3.11Å; Y57-T60 PolarHBondContact O-OG1 2.96Å; Y57-E61 HydrophobicContact CD2-CG 3.93Å; Y57-E61 HydrophobicContact CE2-CG 3.67Å; Y57-E61 VanDerWaalsContact CE2-OE1 3.23Å; Y57-E61 WeakPolarHBondContact CE2-OE1 3.48Å; Y57-E61 PolarHBondContact O-N 3.47Å; Y57-R91 WeakPolarHBondContact OH-CD 3.36Å; Y57-L95 HydrophobicContact CD1-CD1 3.52Å; Y57-L95 HydrophobicContact CD1-CD2 3.42Å; Y57-L95 VanDerWaalsContact CD1-CD2 3.42Å; Y57-L95 HydrophobicContact CD1-CG 4.11Å; Y57-L95 HydrophobicContact CD2-CD1 4.33Å; Y57-L95 HydrophobicContact CE1-CD1 3.84Å; Y57-L95 HydrophobicContact CE1-CD2 3.7Å; Y57-L95 HydrophobicContact CE1-CG 4.31Å; Y57-L95 HydrophobicContact CG-CD1 3.79Å; Y57-L95 HydrophobicContact CG-CD2 4.4Å
58	I	96.2	Very high	93.9	Very high	6 Å²	6	51.3 Å²	51.3	3%	0.031	27%	0.268	C	S	.	.	H	α-helix	trans	-55.7	-44.2	175.9	-70.9	166.4	0	0	0	110.3	Y54 D55 T60 E61 I62 L92 L95 L99	Y54-I58 WeakPolarHBondContact O-CB 3.33Å; Y54-I58 VanDerWaalsContact O-CG1 3.31Å; Y54-I58 WeakPolarHBondContact O-CG1 3.29Å; Y54-I58 PolarHBondContact O-N 3.48Å; D55-I58 PolarHBondContact O-N 3.38Å; I58-T60 PolarHBondContact O-N 3.26Å; I58-E61 PolarHBondContact O-N 3.27Å; I58-I62 HydrophobicContact CG2-CD1 3.69Å; I58-I62 HydrophobicContact CG2-CG1 4.38Å; I58-I62 VanDerWaalsContact O-CG1 3.27Å; I58-I62 WeakPolarHBondContact O-CG1 3.28Å; I58-I62 PolarHBondContact O-N 3.48Å; I58-L92 HydrophobicContact CB-CD2 4.47Å; I58-L92 HydrophobicContact CG2-CD2 4.09Å; I58-L95 HydrophobicContact CD1-CB 4.28Å; I58-L95 HydrophobicContact CG1-CB 3.9Å; I58-L95 HydrophobicContact CG1-CD1 4.06Å; I58-L99 HydrophobicContact CD1-CD2 4.3Å
59	S	95.6	Very high	93.9	Very high	68 Å²	68	51.4 Å²	51.4	48%	0.476	26%	0.259	S	S	.	.	H	α-helix	trans	-60.7	-44.2	177.9	-60.4	0	0	0	0	111.7	D55 A56 Y57 I62 T63	D55-S59 VanDerWaalsContact O-CB 3.24Å; D55-S59 WeakPolarHBondContact O-CB 3.36Å; D55-S59 PolarHBondContact O-N 2.88Å; D55-S59 PolarHBondContact O-OG 2.88Å; A56-S59 PolarHBondContact O-N 3.31Å; Y57-S59 VanDerWaalsContact C-N 3.26Å; Y57-S59 PolarHBondContact O-N 3.34Å; S59-I62 PolarHBondContact O-N 2.9Å; S59-T63 WeakPolarHBondContact O-CG2 3.39Å; S59-T63 PolarHBondContact O-N 2.91Å; S59-T63 PolarHBondContact O-OG1 3.27Å
60	T	95.6	Very high	93.8	Very high	32 Å²	32	51.2 Å²	51.2	20%	0.196	27%	0.266	C	S	.	.	H	α-helix	trans	-66	-38.2	176.4	62.1	0	0	0	0	113.7	H40 A56 Y57 I58 I62 T63 I64	H40-T60 PolarHBondContact CD2-OG1 3.07Å; H40-T60 VanDerWaalsContact NE2-CG2 3.27Å; H40-T60 WeakPolarHBondContact NE2-CG2 3.35Å; H40-T60 PolarHBondContact NE2-OG1 3.34Å; A56-T60 WeakPolarHBondContact O-CG2 3.36Å; A56-T60 PolarHBondContact O-N 3.35Å; Y57-T60 PolarHBondContact O-N 3.26Å; Y57-T60 VanDerWaalsContact O-N 3.11Å; Y57-T60 PolarHBondContact O-OG1 2.96Å; I58-T60 PolarHBondContact O-N 3.26Å; T60-I62 VanDerWaalsContact C-N 3.34Å; T60-T63 WeakPolarHBondContact CA-OG1 3.48Å; T60-T63 PolarHBondContact O-N 3.47Å; T60-T63 PolarHBondContact O-OG1 3.1Å; T60-I64 WeakPolarHBondContact O-CD1 3.33Å; T60-I64 WeakPolarHBondContact O-CG1 3.48Å; T60-I64 PolarHBondContact O-N 3.35Å
61	E	95.1	Very high	93.6	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-69.3	-34.9	176.4	-69.2	-65.1	147.7	0	0	111.4	R37 Y57 I58 I64 I65 I88 R91 L92	R37-E61 WeakPolarHBondContact CG-OE1 3.44Å; R37-E61 IonicContact CZ-OE1 3.43Å; R37-E61 IonicContact CZ-OE2 3.15Å; R37-E61 IonicContact NE-OE1 2.93Å; R37-E61 PolarHBondContact NE-OE1 2.7Å; R37-E61 IonicContact NE-OE2 2.66Å; R37-E61 IonicContact NH2-OE1 3.79Å; R37-E61 IonicContact NH2-OE2 3.63Å; R37-E61 PolarHBondContact NH2-OE2 2.88Å; Y57-E61 HydrophobicContact CD2-CG 3.93Å; Y57-E61 HydrophobicContact CE2-CG 3.67Å; Y57-E61 VanDerWaalsContact CE2-OE1 3.23Å; Y57-E61 WeakPolarHBondContact CE2-OE1 3.48Å; Y57-E61 PolarHBondContact O-N 3.47Å; I58-E61 PolarHBondContact O-N 3.27Å; E61-I64 PolarHBondContact O-N 2.93Å; E61-I65 PolarHBondContact O-N 3.39Å; E61-I88 HydrophobicContact CB-CG2 4.25Å; E61-I88 VanDerWaalsContact OE2-CG2 3.31Å; E61-I88 WeakPolarHBondContact OE2-CG2 3.43Å; E61-R91 IonicContact OE2-NH1 2.84Å; E61-R91 PolarHBondContact OE2-NH1 3.38Å; E61-L92 HydrophobicContact CB-CD2 3.63Å; E61-L92 HydrophobicContact CB-CG 4.05Å
62	I	94.6	Very high	93.3	Very high	60 Å²	60	47.6 Å²	47.6	31%	0.308	25%	0.249	S	C	.	.	H	α-helix	trans	-64.2	-43.9	172.3	-69.6	168.5	0	0	0	110.8	I58 S59 T60 I64 I65 K66 L92	I58-I62 HydrophobicContact CG2-CD1 3.69Å; I58-I62 HydrophobicContact CG2-CG1 4.38Å; I58-I62 VanDerWaalsContact O-CG1 3.27Å; I58-I62 WeakPolarHBondContact O-CG1 3.28Å; I58-I62 PolarHBondContact O-N 3.48Å; S59-I62 PolarHBondContact O-N 2.9Å; T60-I62 VanDerWaalsContact C-N 3.34Å; I62-I64 VanDerWaalsContact C-N 3.33Å; I62-I64 PolarHBondContact O-N 3.44Å; I62-I65 PolarHBondContact O-N 2.92Å; I62-K66 HydrophobicContact CG2-CD 4.18Å; I62-K66 HydrophobicContact CG2-CG 4.49Å; I62-K66 WeakPolarHBondContact O-CG 3.42Å; I62-K66 PolarHBondContact O-N 3.38Å; I62-L92 HydrophobicContact CG1-CD1 4.44Å; I62-L92 HydrophobicContact CG1-CD2 4.21Å
63	T	94.8	Very high	92.9	Very high	72 Å²	72	48.7 Å²	48.7	44%	0.442	25%	0.251	S	S	.	.	H	α-helix	trans	-64.4	-38.8	177.3	57.1	0	0	0	0	111.5	S59 T60 K66 L67	S59-T63 WeakPolarHBondContact O-CG2 3.39Å; S59-T63 PolarHBondContact O-N 2.91Å; S59-T63 PolarHBondContact O-OG1 3.27Å; T60-T63 WeakPolarHBondContact CA-OG1 3.48Å; T60-T63 PolarHBondContact O-N 3.47Å; T60-T63 PolarHBondContact O-OG1 3.1Å; T63-K66 PolarHBondContact O-N 2.8Å; T63-L67 WeakPolarHBondContact O-CB 3.48Å; T63-L67 VanDerWaalsContact O-CG 3.3Å; T63-L67 WeakPolarHBondContact O-CG 3.42Å; T63-L67 PolarHBondContact O-N 3.4Å
64	I	93	Very high	92.5	Very high	15 Å²	15	54.8 Å²	54.8	8%	0.077	28%	0.282	C	S	.	.	H	α-helix	trans	-59.8	-47.1	174.1	-68.6	162.5	0	0	0	111.3	I33 T60 E61 I62 K66 L67 L68 I88	I33-I64 HydrophobicContact CG2-CD1 3.97Å; T60-I64 WeakPolarHBondContact O-CD1 3.33Å; T60-I64 WeakPolarHBondContact O-CG1 3.48Å; T60-I64 PolarHBondContact O-N 3.35Å; E61-I64 PolarHBondContact O-N 2.93Å; I62-I64 VanDerWaalsContact C-N 3.33Å; I62-I64 PolarHBondContact O-N 3.44Å; I64-K66 VanDerWaalsContact C-N 3.34Å; I64-K66 PolarHBondContact O-N 2.79Å; I64-L67 PolarHBondContact O-N 3.05Å; I64-L68 HydrophobicContact CG2-CD1 4.01Å; I64-L68 WeakPolarHBondContact O-CB 3.48Å; I64-L68 WeakPolarHBondContact O-CG 3.37Å; I64-L68 PolarHBondContact O-N 2.97Å; I64-I88 HydrophobicContact CG2-CD1 4.19Å
65	I	92.2	Very high	91.8	Very high	19 Å²	19	58.7 Å²	58.7	10%	0.097	31%	0.307	C	S	.	.	H	α-helix	trans	-59.9	-44.4	175.5	-72.3	-178.6	0	0	0	111.2	E61 I62 L68 R69 I88 I89 L92	E61-I65 PolarHBondContact O-N 3.39Å; I62-I65 PolarHBondContact O-N 2.92Å; I65-L68 WeakPolarHBondContact O-CB 3.26Å; I65-L68 PolarHBondContact O-N 3.45Å; I65-R69 WeakPolarHBondContact O-CG 3.4Å; I65-R69 PolarHBondContact O-N 3.1Å; I65-I88 HydrophobicContact CD1-CB 3.9Å; I65-I88 HydrophobicContact CD1-CG2 3.51Å; I65-I88 HydrophobicContact CG1-CB 3.91Å; I65-I88 HydrophobicContact CG1-CD1 3.86Å; I65-I88 HydrophobicContact CG1-CG1 4.49Å; I65-I88 HydrophobicContact CG1-CG2 3.48Å; I65-I88 VanDerWaalsContact CG1-CG2 3.48Å; I65-I89 HydrophobicContact CD1-CG1 4.39Å; I65-L92 HydrophobicContact CD1-CD1 3.68Å
66	K	92.2	Very high	91	Very high	130 Å²	130	64.1 Å²	64.1	57%	0.565	34%	0.336	S	S	*	.	H	α-helix	trans	-60.8	-46.7	179.2	-73.6	177.9	177.6	-175.2	0	111.2	I62 T63 I64 L68 R69 C70	I62-K66 HydrophobicContact CG2-CD 4.18Å; I62-K66 HydrophobicContact CG2-CG 4.49Å; I62-K66 WeakPolarHBondContact O-CG 3.42Å; I62-K66 PolarHBondContact O-N 3.38Å; T63-K66 PolarHBondContact O-N 2.8Å; I64-K66 VanDerWaalsContact C-N 3.34Å; I64-K66 PolarHBondContact O-N 2.79Å; K66-L68 PolarHBondContact O-N 2.87Å; K66-R69 PolarHBondContact O-N 3.37Å; K66-C70 PolarHBondContact O-N 3.29Å; K66-C70 PolarHBondContact O-SG 2.83Å; K66-C70 VanDerWaalsContact O-SG 3.32Å
67	L	91.1	Very high	90.2	Very high	86 Å²	86	63 Å²	63	45%	0.45	32%	0.324	S	S	.	.	H	α-helix	trans	-61	-43.2	176.6	-71.2	171.3	0	0	0	112	F25 T63 I64 R69 C70 R71	F25-L67 HydrophobicContact CZ-CB 4.3Å; T63-L67 WeakPolarHBondContact O-CB 3.48Å; T63-L67 VanDerWaalsContact O-CG 3.3Å; T63-L67 WeakPolarHBondContact O-CG 3.42Å; T63-L67 PolarHBondContact O-N 3.4Å; I64-L67 PolarHBondContact O-N 3.05Å; L67-R69 VanDerWaalsContact C-N 3.3Å; L67-R69 PolarHBondContact O-N 3.43Å; L67-C70 PolarHBondContact O-N 3.2Å; L67-R71 WeakPolarHBondContact O-CG 3.37Å; L67-R71 PolarHBondContact O-N 3.15Å
68	L	90	Very high	89.4	Confident	6 Å²	6	67.5 Å²	67.5	3%	0.031	36%	0.355	C	S	.	.	H	α-helix	trans	-56.4	-44.3	174.2	-86.8	161.8	0	0	0	111.8	I19 L24 F25 I64 I65 K66 R72 I84 I88	I19-L68 HydrophobicContact CD1-CD2 4.47Å; I19-L68 HydrophobicContact CG1-CD2 4.35Å; L24-L68 HydrophobicContact CD1-CD2 3.97Å; F25-L68 HydrophobicContact CD2-CD2 4.34Å; F25-L68 HydrophobicContact CE2-CD2 3.51Å; F25-L68 HydrophobicContact CE2-CG 3.76Å; F25-L68 HydrophobicContact CZ-CD2 4.39Å; F25-L68 HydrophobicContact CZ-CG 4.15Å; I64-L68 HydrophobicContact CG2-CD1 4.01Å; I64-L68 WeakPolarHBondContact O-CB 3.48Å; I64-L68 WeakPolarHBondContact O-CG 3.37Å; I64-L68 PolarHBondContact O-N 2.97Å; I65-L68 WeakPolarHBondContact O-CB 3.26Å; I65-L68 PolarHBondContact O-N 3.45Å; K66-L68 PolarHBondContact O-N 2.87Å; L68-R72 WeakPolarHBondContact O-CB 3.33Å; L68-R72 VanDerWaalsContact O-CG 3.24Å; L68-R72 WeakPolarHBondContact O-CG 3.49Å; L68-R72 PolarHBondContact O-N 2.77Å; L68-R72 VanDerWaalsContact O-N 3.09Å; L68-I84 HydrophobicContact CD1-CG2 3.82Å; L68-I84 HydrophobicContact CD2-CG2 4.26Å; L68-I88 HydrophobicContact CD1-CD1 3.32Å
69	R	89.5	Confident	88.8	Confident	128 Å²	128	73.5 Å²	73.5	48%	0.483	38%	0.378	S	S	.	.	H	α-helix	trans	-66.6	-47.4	178.7	-72.8	177.9	177.8	179.1	-1.3	112.1	I65 K66 L67 R71 R72 Q73 E85	I65-R69 WeakPolarHBondContact O-CG 3.4Å; I65-R69 PolarHBondContact O-N 3.1Å; K66-R69 PolarHBondContact O-N 3.37Å; L67-R69 VanDerWaalsContact C-N 3.3Å; L67-R69 PolarHBondContact O-N 3.43Å; R69-R71 PolarHBondContact O-N 3.13Å; R69-R72 PolarHBondContact O-N 3.06Å; R69-Q73 WeakPolarHBondContact O-CG 3.4Å; R69-Q73 PolarHBondContact O-N 3.33Å; R69-Q73 VanDerWaalsContact O-N 3.07Å; R69-E85 IonicContact CZ-OE1 2.7Å; R69-E85 IonicContact NE-OE1 2.95Å; R69-E85 PolarHBondContact NE-OE1 2.63Å; R69-E85 VanDerWaalsContact NE-OE1 3.14Å; R69-E85 IonicContact NH2-OE1 3.43Å; R69-E85 PolarHBondContact NH2-OE1 2.86Å
70	C	89.1	Confident	88.2	Confident	66 Å²	66	74.8 Å²	74.8	45%	0.446	37%	0.373	S	S	.	.	H	α-helix	trans	-59.4	-45.4	177.9	-64.3	0	0	0	0	111.8	K66 L67 R72 Q73 I74	K66-C70 PolarHBondContact O-N 3.29Å; K66-C70 PolarHBondContact O-SG 2.83Å; K66-C70 VanDerWaalsContact O-SG 3.32Å; L67-C70 PolarHBondContact O-N 3.2Å; C70-R72 PolarHBondContact O-N 3.22Å; C70-Q73 WeakPolarHBondContact O-CB 3.44Å; C70-Q73 PolarHBondContact O-N 2.83Å; C70-I74 WeakPolarHBondContact O-CG1 3.44Å; C70-I74 PolarHBondContact O-N 2.82Å
71	R	89.1	Confident	87.5	Confident	66 Å²	66	76 Å²	76	25%	0.249	38%	0.377	C	S	.	.	H	α-helix	trans	-65.6	-39	179.2	-71.1	-171	-178.8	-177.3	-0.3	112.8	L24 E29 L67 R69 Q73 I74 T75	L24-R71 WeakPolarHBondContact O-CD 3.5Å; L24-R71 PolarHBondContact O-NH1 2.93Å; E29-R71 IonicContact OE1-CZ 2.86Å; E29-R71 IonicContact OE1-NH1 3.99Å; E29-R71 PolarHBondContact OE1-NH1 3.43Å; E29-R71 IonicContact OE1-NH2 2.72Å; E29-R71 PolarHBondContact OE1-NH2 3.14Å; E29-R71 IonicContact OE2-CZ 3.28Å; E29-R71 IonicContact OE2-NH1 3.6Å; E29-R71 PolarHBondContact OE2-NH1 2.81Å; E29-R71 IonicContact OE2-NH2 3.85Å; E29-R71 PolarHBondContact OE2-NH2 2.78Å; L67-R71 WeakPolarHBondContact O-CG 3.37Å; L67-R71 PolarHBondContact O-N 3.15Å; R69-R71 PolarHBondContact O-N 3.13Å; R71-Q73 VanDerWaalsContact C-N 3.31Å; R71-Q73 PolarHBondContact O-N 3.21Å; R71-I74 PolarHBondContact O-N 3Å; R71-I74 VanDerWaalsContact O-N 3.16Å; R71-T75 PolarHBondContact O-N 2.72Å; R71-T75 PolarHBondContact O-OG1 3.42Å; R71-T75 VanDerWaalsContact O-OG1 3.08Å
72	R	87	Confident	87	Confident	22 Å²	22	82.1 Å²	82.1	8%	0.083	41%	0.41	C	S	.	.	H	α-helix	trans	-64	-36	175.9	-76.6	175.6	175.8	-93.5	4	112.7	L24 L68 R69 C70 I74 T75 N76 D77 R79	L24-R72 HydrophobicContact CD1-CG 3.96Å; L24-R72 HydrophobicContact CD2-CG 4.01Å; L68-R72 WeakPolarHBondContact O-CB 3.33Å; L68-R72 VanDerWaalsContact O-CG 3.24Å; L68-R72 WeakPolarHBondContact O-CG 3.49Å; L68-R72 PolarHBondContact O-N 2.77Å; L68-R72 VanDerWaalsContact O-N 3.09Å; R69-R72 PolarHBondContact O-N 3.06Å; C70-R72 PolarHBondContact O-N 3.22Å; R72-I74 VanDerWaalsContact C-N 3.27Å; R72-I74 PolarHBondContact O-N 3.09Å; R72-T75 PolarHBondContact O-N 3.36Å; R72-N76 WeakPolarHBondContact O-CA 3.49Å; R72-N76 PolarHBondContact O-N 2.73Å; R72-D77 PolarHBondContact NH1-O 3.37Å; R72-R79 PolarHBondContact NH1-O 2.98Å; R72-R79 VanDerWaalsContact NH1-O 3.07Å; R72-R79 PolarHBondContact NH2-O 3.34Å
73	Q	85.8	Confident	86.8	Confident	145 Å²	145	85 Å²	85	68%	0.678	42%	0.421	S	S	*	.	H	α-helix	trans	-62.9	-37.2	173.8	-72.5	172.6	-20.5	0	0	111.7	R69 C70 R71	R69-Q73 WeakPolarHBondContact O-CG 3.4Å; R69-Q73 PolarHBondContact O-N 3.33Å; R69-Q73 VanDerWaalsContact O-N 3.07Å; C70-Q73 WeakPolarHBondContact O-CB 3.44Å; C70-Q73 PolarHBondContact O-N 2.83Å; R71-Q73 VanDerWaalsContact C-N 3.31Å; R71-Q73 PolarHBondContact O-N 3.21Å
74	I	86.2	Confident	86.5	Confident	143 Å²	143	81.7 Å²	81.7	73%	0.733	40%	0.4	S	S	*	.	H	α-helix	trans	-73.4	-44.1	178.4	-62.7	164.8	0	0	0	111.2	C70 R71 R72	C70-I74 WeakPolarHBondContact O-CG1 3.44Å; C70-I74 PolarHBondContact O-N 2.82Å; R71-I74 PolarHBondContact O-N 3Å; R71-I74 VanDerWaalsContact O-N 3.16Å; R72-I74 VanDerWaalsContact C-N 3.27Å; R72-I74 PolarHBondContact O-N 3.09Å
75	T	82.8	Confident	86.3	Confident	86 Å²	86	82.9 Å²	82.9	53%	0.528	41%	0.406	S	S	.	.	H	α-helix	trans	-83.8	-12.6	-175.8	-44.7	0	0	0	0	113.5	R71 R72 D77	R71-T75 PolarHBondContact O-N 2.72Å; R71-T75 PolarHBondContact O-OG1 3.42Å; R71-T75 VanDerWaalsContact O-OG1 3.08Å; R72-T75 PolarHBondContact O-N 3.36Å; T75-D77 HydrophobicContact CG2-CB 4.07Å; T75-D77 PolarHBondContact O-N 3.27Å; T75-D77 VanDerWaalsContact O-N 3.16Å
76	N	78.5	Confident	86.3	Confident	150 Å²	150	88.7 Å²	88.7	80%	0.802	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	29.5	-170.8	-82.4	-27.9	0	0	0	114.1	R72	R72-N76 WeakPolarHBondContact O-CA 3.49Å; R72-N76 PolarHBondContact O-N 2.73Å
77	D	78.7	Confident	86.3	Confident	22 Å²	22	83.7 Å²	83.7	12%	0.118	41%	0.412	C	S	.	.			trans	-102.3	114.3	-178.4	-168.8	-4.9	0	0	0	112.1	R72 T75 R79	R72-D77 PolarHBondContact NH1-O 3.37Å; T75-D77 HydrophobicContact CG2-CB 4.07Å; T75-D77 PolarHBondContact O-N 3.27Å; T75-D77 VanDerWaalsContact O-N 3.16Å; D77-R79 VanDerWaalsContact CG-NE 3.34Å; D77-R79 VanDerWaalsContact OD1-CB 3.23Å; D77-R79 WeakPolarHBondContact OD1-CB 3.33Å; D77-R79 WeakPolarHBondContact OD1-CG 3.27Å; D77-R79 PolarHBondContact OD1-N 3.41Å; D77-R79 IonicContact OD1-NE 2.71Å; D77-R79 PolarHBondContact OD1-NE 2.79Å; D77-R79 IonicContact OD2-CZ 2.69Å; D77-R79 IonicContact OD2-NE 3.49Å; D77-R79 PolarHBondContact OD2-NE 3.05Å; D77-R79 IonicContact OD2-NH2 3.48Å; D77-R79 PolarHBondContact OD2-NH2 3.26Å
78	S	81.3	Confident	86.4	Confident	96 Å²	96	79.6 Å²	79.6	67%	0.671	39%	0.39	S	S	*	.			trans	-96.9	5	179	62.2	0	0	0	0	113.9	Y80 L81	S78-Y80 PolarHBondContact O-N 3.15Å; S78-L81 PolarHBondContact O-N 2.91Å
79	R	82.9	Confident	86.5	Confident	132 Å²	132	80.4 Å²	80.4	50%	0.498	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	136.9	-179.1	-70.9	178.9	-64.9	-175.5	0.7	112.3	R72 D77 L81	R72-R79 PolarHBondContact NH1-O 2.98Å; R72-R79 VanDerWaalsContact NH1-O 3.07Å; R72-R79 PolarHBondContact NH2-O 3.34Å; D77-R79 VanDerWaalsContact CG-NE 3.34Å; D77-R79 VanDerWaalsContact OD1-CB 3.23Å; D77-R79 WeakPolarHBondContact OD1-CB 3.33Å; D77-R79 WeakPolarHBondContact OD1-CG 3.27Å; D77-R79 PolarHBondContact OD1-N 3.41Å; D77-R79 IonicContact OD1-NE 2.71Å; D77-R79 PolarHBondContact OD1-NE 2.79Å; D77-R79 IonicContact OD2-CZ 2.69Å; D77-R79 IonicContact OD2-NE 3.49Å; D77-R79 PolarHBondContact OD2-NE 3.05Å; D77-R79 IonicContact OD2-NH2 3.48Å; D77-R79 PolarHBondContact OD2-NH2 3.26Å; R79-L81 PolarHBondContact O-N 3.03Å
80	Y	81.7	Confident	86.7	Confident	94 Å²	94	76.9 Å²	76.9	37%	0.369	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.9	20.9	175.9	-48	-66.5	0	0	0	116.3	H18 K21 S78 D82 K83 I84	H18-Y80 HydrophobicContact CB-CD2 4.41Å; H18-Y80 HydrophobicContact CB-CG 4.27Å; H18-Y80 AromaticContact CD2-CD1 3.47Å; H18-Y80 VanDerWaalsContact CD2-CD1 3.47Å; H18-Y80 WeakPolarHBondContact CD2-CD1 3.01Å; H18-Y80 AromaticContact CD2-CE1 3.93Å; H18-Y80 AromaticContact CD2-CG 3.56Å; K21-Y80 HydrophobicContact CB-CE2 4.14Å; S78-Y80 PolarHBondContact O-N 3.15Å; Y80-D82 VanDerWaalsContact C-N 3.35Å; Y80-D82 PolarHBondContact O-N 3.42Å; Y80-K83 HydrophobicContact CD1-CD 4.4Å; Y80-K83 PolarHBondContact O-N 3.48Å; Y80-K83 VanDerWaalsContact O-N 3.16Å; Y80-I84 PolarHBondContact O-N 3.35Å; Y80-I84 VanDerWaalsContact O-N 3.11Å
81	L	82.4	Confident	87	Confident	57 Å²	57	74.4 Å²	74.4	30%	0.298	37%	0.37	S	S	.	.	H	α-helix	trans	-52.6	-52.5	-176.7	-174.9	146.2	0	0	0	111.6	S78 R79 K83 I84 E85	S78-L81 PolarHBondContact O-N 2.91Å; R79-L81 PolarHBondContact O-N 3.03Å; L81-K83 VanDerWaalsContact C-N 3.28Å; L81-K83 PolarHBondContact O-N 3.49Å; L81-I84 PolarHBondContact O-N 2.91Å; L81-E85 HydrophobicContact CD2-CG 4.32Å; L81-E85 HydrophobicContact CG-CG 4.38Å; L81-E85 WeakPolarHBondContact O-CB 3.09Å; L81-E85 PolarHBondContact O-N 2.64Å
82	D	84.8	Confident	87.3	Confident	129 Å²	129	71.4 Å²	71.4	69%	0.69	36%	0.359	S	S	*	.	H	α-helix	trans	-59.2	-38.6	-178.1	-63.6	-20.1	0	0	0	112.5	Y80 K86	Y80-D82 VanDerWaalsContact C-N 3.35Å; Y80-D82 PolarHBondContact O-N 3.42Å; D82-K86 WeakPolarHBondContact O-CB 3.22Å; D82-K86 PolarHBondContact O-N 2.78Å
83	K	89.1	Confident	87.6	Confident	122 Å²	122	70.7 Å²	70.7	53%	0.53	36%	0.358	S	S	.	.	H	α-helix	trans	-70.8	-43.6	-178.2	-65.2	-174.5	-179.4	-177.7	0	111.5	H18 Y80 L81 S87	H18-K83 WeakPolarHBondContact NE2-CD 2.95Å; Y80-K83 HydrophobicContact CD1-CD 4.4Å; Y80-K83 PolarHBondContact O-N 3.48Å; Y80-K83 VanDerWaalsContact O-N 3.16Å; L81-K83 VanDerWaalsContact C-N 3.28Å; L81-K83 PolarHBondContact O-N 3.49Å; K83-S87 PolarHBondContact O-N 2.87Å
84	I	89.3	Confident	88	Confident	1 Å²	1	66.4 Å²	66.4	1%	0.005	34%	0.335	C	S	.	.	H	α-helix	trans	-70.7	-52.4	-179	-65.9	164.2	0	0	0	110.2	E15 H18 I19 L68 Y80 L81 K86 S87 I88	E15-I84 HydrophobicContact CG-CB 4.48Å; E15-I84 HydrophobicContact CG-CG2 4.04Å; H18-I84 HydrophobicContact CB-CD1 3.91Å; H18-I84 HydrophobicContact CB-CG1 3.78Å; I19-I84 HydrophobicContact CD1-CG2 4.12Å; I19-I84 HydrophobicContact CG1-CD1 3.72Å; I19-I84 HydrophobicContact CG1-CG1 4.03Å; I19-I84 HydrophobicContact CG1-CG2 4.01Å; L68-I84 HydrophobicContact CD1-CG2 3.82Å; L68-I84 HydrophobicContact CD2-CG2 4.26Å; Y80-I84 PolarHBondContact O-N 3.35Å; Y80-I84 VanDerWaalsContact O-N 3.11Å; L81-I84 PolarHBondContact O-N 2.91Å; I84-K86 VanDerWaalsContact C-N 3.35Å; I84-K86 PolarHBondContact O-N 3.01Å; I84-S87 PolarHBondContact O-N 3.32Å; I84-I88 HydrophobicContact CG2-CD1 4.05Å; I84-I88 PolarHBondContact O-N 3.33Å; I84-I88 VanDerWaalsContact O-N 3.14Å
85	E	89.7	Confident	88.5	Confident	41 Å²	41	59.6 Å²	59.6	19%	0.192	30%	0.3	C	S	.	.	H	α-helix	trans	-63.3	-40.9	-179.2	-70.6	-157.2	147.7	0	0	111.4	R69 L81 S87 I88 I89	R69-E85 IonicContact CZ-OE1 2.7Å; R69-E85 IonicContact NE-OE1 2.95Å; R69-E85 PolarHBondContact NE-OE1 2.63Å; R69-E85 VanDerWaalsContact NE-OE1 3.14Å; R69-E85 IonicContact NH2-OE1 3.43Å; R69-E85 PolarHBondContact NH2-OE1 2.86Å; L81-E85 HydrophobicContact CD2-CG 4.32Å; L81-E85 HydrophobicContact CG-CG 4.38Å; L81-E85 WeakPolarHBondContact O-CB 3.09Å; L81-E85 PolarHBondContact O-N 2.64Å; E85-S87 VanDerWaalsContact C-N 3.31Å; E85-S87 PolarHBondContact O-N 3.13Å; E85-I88 PolarHBondContact O-N 3.25Å; E85-I89 HydrophobicContact CB-CD1 4.32Å; E85-I89 VanDerWaalsContact O-CB 3.24Å; E85-I89 WeakPolarHBondContact O-CB 3.48Å; E85-I89 WeakPolarHBondContact O-CD1 3.48Å; E85-I89 WeakPolarHBondContact O-CG1 3.4Å; E85-I89 PolarHBondContact O-N 2.97Å
86	K	91.5	Very high	89.1	Confident	140 Å²	140	55.7 Å²	55.7	61%	0.609	28%	0.276	S	S	*	.	H	α-helix	trans	-60.1	-40.2	176.6	-177.2	179.8	179.5	-176.9	0	112.1	D82 I84 S90	D82-K86 WeakPolarHBondContact O-CB 3.22Å; D82-K86 PolarHBondContact O-N 2.78Å; I84-K86 VanDerWaalsContact C-N 3.35Å; I84-K86 PolarHBondContact O-N 3.01Å; K86-S90 VanDerWaalsContact O-CB 3.23Å; K86-S90 WeakPolarHBondContact O-CB 3.23Å; K86-S90 PolarHBondContact O-N 3.39Å; K86-S90 PolarHBondContact O-OG 2.76Å
87	S	92.2	Very high	89.9	Confident	26 Å²	26	54.6 Å²	54.6	18%	0.182	26%	0.261	C	S	.	.	H	α-helix	trans	-63.3	-51.4	177.5	171.1	0	0	0	0	111.4	E15 K83 I84 E85 I89 S90 R91	E15-S87 VanDerWaalsContact OE2-CB 3.22Å; E15-S87 WeakPolarHBondContact OE2-CB 3.34Å; E15-S87 PolarHBondContact OE2-OG 3.21Å; K83-S87 PolarHBondContact O-N 2.87Å; I84-S87 PolarHBondContact O-N 3.32Å; E85-S87 VanDerWaalsContact C-N 3.31Å; E85-S87 PolarHBondContact O-N 3.13Å; S87-I89 PolarHBondContact O-N 3.46Å; S87-S90 PolarHBondContact O-N 2.9Å; S87-R91 PolarHBondContact O-N 2.83Å; S87-R91 PolarHBondContact OG-NH2 3.43Å
88	I	92.8	Very high	90.6	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-65.9	-42.5	-178.6	-52.3	167.3	0	0	0	111.3	E15 E61 I64 I65 L68 I84 E85 S90 R91 L92	E15-I88 HydrophobicContact CG-CG1 4.4Å; E15-I88 WeakPolarHBondContact OE1-CG1 3.32Å; E15-I88 WeakPolarHBondContact OE2-CG1 3.27Å; E15-I88 PolarHBondContact OE2-N 3.04Å; E61-I88 HydrophobicContact CB-CG2 4.25Å; E61-I88 VanDerWaalsContact OE2-CG2 3.31Å; E61-I88 WeakPolarHBondContact OE2-CG2 3.43Å; I64-I88 HydrophobicContact CG2-CD1 4.19Å; I65-I88 HydrophobicContact CD1-CB 3.9Å; I65-I88 HydrophobicContact CD1-CG2 3.51Å; I65-I88 HydrophobicContact CG1-CB 3.91Å; I65-I88 HydrophobicContact CG1-CD1 3.86Å; I65-I88 HydrophobicContact CG1-CG1 4.49Å; I65-I88 HydrophobicContact CG1-CG2 3.48Å; I65-I88 VanDerWaalsContact CG1-CG2 3.48Å; L68-I88 HydrophobicContact CD1-CD1 3.32Å; I84-I88 HydrophobicContact CG2-CD1 4.05Å; I84-I88 PolarHBondContact O-N 3.33Å; I84-I88 VanDerWaalsContact O-N 3.14Å; E85-I88 PolarHBondContact O-N 3.25Å; I88-S90 VanDerWaalsContact C-N 3.3Å; I88-S90 PolarHBondContact O-N 3.47Å; I88-R91 WeakPolarHBondContact O-CB 3.38Å; I88-R91 PolarHBondContact O-N 3.49Å; I88-L92 HydrophobicContact CG2-CD1 4.37Å; I88-L92 PolarHBondContact O-N 3.34Å
89	I	93.2	Very high	91.3	Very high	23 Å²	23	52.1 Å²	52.1	12%	0.118	24%	0.238	C	C	.	.	H	α-helix	trans	-60.6	-41	175	-70	168.4	0	0	0	110.7	I65 E85 S87 R91 L92 V93 I120	I65-I89 HydrophobicContact CD1-CG1 4.39Å; E85-I89 HydrophobicContact CB-CD1 4.32Å; E85-I89 VanDerWaalsContact O-CB 3.24Å; E85-I89 WeakPolarHBondContact O-CB 3.48Å; E85-I89 WeakPolarHBondContact O-CD1 3.48Å; E85-I89 WeakPolarHBondContact O-CG1 3.4Å; E85-I89 PolarHBondContact O-N 2.97Å; S87-I89 PolarHBondContact O-N 3.46Å; I89-R91 VanDerWaalsContact C-N 3.31Å; I89-R91 PolarHBondContact O-N 3.43Å; I89-L92 PolarHBondContact O-N 2.99Å; I89-V93 HydrophobicContact CG2-CG2 4.35Å; I89-V93 WeakPolarHBondContact O-CB 3.47Å; I89-V93 VanDerWaalsContact O-CG2 3.27Å; I89-V93 WeakPolarHBondContact O-CG2 3.49Å; I89-V93 PolarHBondContact O-N 3.42Å; I89-I120 HydrophobicContact CD1-CG2 4.41Å; I89-I120 HydrophobicContact CG2-CD1 3.75Å; I89-I120 HydrophobicContact CG2-CG2 4.01Å
90	S	93	Very high	91.8	Very high	54 Å²	54	45.9 Å²	45.9	38%	0.378	22%	0.215	S	C	.	.	H	α-helix	trans	-64.4	-38.2	178.3	-60.1	0	0	0	0	111.5	K86 S87 I88 V93 R94	K86-S90 VanDerWaalsContact O-CB 3.23Å; K86-S90 WeakPolarHBondContact O-CB 3.23Å; K86-S90 PolarHBondContact O-N 3.39Å; K86-S90 PolarHBondContact O-OG 2.76Å; S87-S90 PolarHBondContact O-N 2.9Å; I88-S90 VanDerWaalsContact C-N 3.3Å; I88-S90 PolarHBondContact O-N 3.47Å; S90-V93 PolarHBondContact O-N 3.21Å; S90-R94 WeakPolarHBondContact O-CB 3.3Å; S90-R94 PolarHBondContact O-N 3.36Å
91	R	94.1	Very high	92.4	Very high	13 Å²	13	48.6 Å²	48.6	5%	0.049	23%	0.225	C	C	.	.	H	α-helix	trans	-64.6	-48.1	173	-169.6	176.7	-59.3	99.5	12	112.3	S12 E15 Y57 E61 S87 I88 I89 V93 R94 L95	S12-R91 VanDerWaalsContact CB-NH2 3.27Å; E15-R91 IonicContact OE1-NH1 3.54Å; E15-R91 IonicContact OE2-CZ 2.89Å; E15-R91 IonicContact OE2-NH1 3.56Å; E15-R91 PolarHBondContact OE2-NH1 3.25Å; E15-R91 IonicContact OE2-NH2 3.83Å; E15-R91 PolarHBondContact OE2-NH2 3.03Å; Y57-R91 WeakPolarHBondContact OH-CD 3.36Å; E61-R91 IonicContact OE2-NH1 2.84Å; E61-R91 PolarHBondContact OE2-NH1 3.38Å; S87-R91 PolarHBondContact O-N 2.83Å; S87-R91 PolarHBondContact OG-NH2 3.43Å; I88-R91 WeakPolarHBondContact O-CB 3.38Å; I88-R91 PolarHBondContact O-N 3.49Å; I89-R91 VanDerWaalsContact C-N 3.31Å; I89-R91 PolarHBondContact O-N 3.43Å; R91-V93 VanDerWaalsContact C-N 3.32Å; R91-V93 PolarHBondContact O-N 2.92Å; R91-R94 WeakPolarHBondContact O-CA 3.48Å; R91-R94 WeakPolarHBondContact O-CB 3.38Å; R91-R94 PolarHBondContact O-N 3.02Å; R91-R94 VanDerWaalsContact O-N 3.1Å; R91-L95 HydrophobicContact CG-CD1 4.48Å; R91-L95 WeakPolarHBondContact O-CG 3.42Å; R91-L95 PolarHBondContact O-N 3.4Å
92	L	95.5	Very high	92.9	Very high	3 Å²	3	53.1 Å²	53.1	2%	0.016	24%	0.238	C	C	.	.	H	α-helix	trans	-57.8	-43.8	174.9	-76	170.3	0	0	0	112	I58 E61 I62 I65 I88 I89 R94 L95 H96 F116	I58-L92 HydrophobicContact CB-CD2 4.47Å; I58-L92 HydrophobicContact CG2-CD2 4.09Å; E61-L92 HydrophobicContact CB-CD2 3.63Å; E61-L92 HydrophobicContact CB-CG 4.05Å; I62-L92 HydrophobicContact CG1-CD1 4.44Å; I62-L92 HydrophobicContact CG1-CD2 4.21Å; I65-L92 HydrophobicContact CD1-CD1 3.68Å; I88-L92 HydrophobicContact CG2-CD1 4.37Å; I88-L92 PolarHBondContact O-N 3.34Å; I89-L92 PolarHBondContact O-N 2.99Å; L92-R94 VanDerWaalsContact C-N 3.34Å; L92-R94 PolarHBondContact O-N 2.84Å; L92-L95 PolarHBondContact O-N 3.49Å; L92-H96 PolarHBondContact O-CD2 3.34Å; L92-H96 VanDerWaalsContact O-CD2 3.32Å; L92-H96 PolarHBondContact O-N 3.01Å; L92-F116 HydrophobicContact CB-CE1 4.02Å; L92-F116 HydrophobicContact CB-CE2 4.25Å; L92-F116 HydrophobicContact CB-CZ 3.43Å; L92-F116 VanDerWaalsContact CB-CZ 3.43Å; L92-F116 HydrophobicContact CD1-CE2 4.01Å; L92-F116 HydrophobicContact CD1-CZ 3.91Å; L92-F116 HydrophobicContact CG-CZ 4.27Å
93	V	94.7	Very high	93.3	Very high	8 Å²	8	48.9 Å²	48.9	5%	0.048	21%	0.214	C	C	.	.	H	α-helix	trans	-61.3	-42.6	174.6	171.1	0	0	0	0	111.1	I89 S90 R91 R97 F113 F116	I89-V93 HydrophobicContact CG2-CG2 4.35Å; I89-V93 WeakPolarHBondContact O-CB 3.47Å; I89-V93 VanDerWaalsContact O-CG2 3.27Å; I89-V93 WeakPolarHBondContact O-CG2 3.49Å; I89-V93 PolarHBondContact O-N 3.42Å; S90-V93 PolarHBondContact O-N 3.21Å; R91-V93 VanDerWaalsContact C-N 3.32Å; R91-V93 PolarHBondContact O-N 2.92Å; V93-R97 HydrophobicContact CG1-CG 4.4Å; V93-R97 WeakPolarHBondContact O-CB 3.29Å; V93-R97 VanDerWaalsContact O-CG 3.25Å; V93-R97 WeakPolarHBondContact O-CG 3.45Å; V93-R97 PolarHBondContact O-N 3.36Å; V93-F113 HydrophobicContact CG1-CE2 4.47Å; V93-F113 HydrophobicContact CG1-CZ 4.33Å; V93-F116 HydrophobicContact CG2-CE1 3.72Å
94	R	94.4	Very high	93.4	Very high	54 Å²	54	46.8 Å²	46.8	20%	0.204	21%	0.206	C	C	.	.	H	α-helix	trans	-59.1	-46.7	175	176.4	177.5	63.4	80.2	-14.1	111.3	E41 S90 R91 L92 R97 Q98	E41-R94 IonicContact OE1-CZ 3.76Å; E41-R94 IonicContact OE1-NH1 2.68Å; E41-R94 IonicContact OE1-NH2 3.42Å; E41-R94 PolarHBondContact OE1-NH2 2.96Å; S90-R94 WeakPolarHBondContact O-CB 3.3Å; S90-R94 PolarHBondContact O-N 3.36Å; R91-R94 WeakPolarHBondContact O-CA 3.48Å; R91-R94 WeakPolarHBondContact O-CB 3.38Å; R91-R94 PolarHBondContact O-N 3.02Å; R91-R94 VanDerWaalsContact O-N 3.1Å; L92-R94 VanDerWaalsContact C-N 3.34Å; L92-R94 PolarHBondContact O-N 2.84Å; R94-R97 PolarHBondContact O-N 2.97Å; R94-Q98 HydrophobicContact CG-CG 4.46Å; R94-Q98 WeakPolarHBondContact O-CB 3.31Å; R94-Q98 WeakPolarHBondContact O-CG 3.38Å; R94-Q98 PolarHBondContact O-N 2.63Å
95	L	95.7	Very high	93.5	Very high	0 Å²	0	51 Å²	51	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-62.5	-48.8	-179.9	-67.7	174	0	0	0	111.9	L44 Y54 Y57 I58 R91 L92 R97 Q98 L99	L44-L95 HydrophobicContact CD1-CD2 3.57Å; Y54-L95 HydrophobicContact CD1-CD2 4.45Å; Y57-L95 HydrophobicContact CD1-CD1 3.52Å; Y57-L95 HydrophobicContact CD1-CD2 3.42Å; Y57-L95 VanDerWaalsContact CD1-CD2 3.42Å; Y57-L95 HydrophobicContact CD1-CG 4.11Å; Y57-L95 HydrophobicContact CD2-CD1 4.33Å; Y57-L95 HydrophobicContact CE1-CD1 3.84Å; Y57-L95 HydrophobicContact CE1-CD2 3.7Å; Y57-L95 HydrophobicContact CE1-CG 4.31Å; Y57-L95 HydrophobicContact CG-CD1 3.79Å; Y57-L95 HydrophobicContact CG-CD2 4.4Å; I58-L95 HydrophobicContact CD1-CB 4.28Å; I58-L95 HydrophobicContact CG1-CB 3.9Å; I58-L95 HydrophobicContact CG1-CD1 4.06Å; R91-L95 HydrophobicContact CG-CD1 4.48Å; R91-L95 WeakPolarHBondContact O-CG 3.42Å; R91-L95 PolarHBondContact O-N 3.4Å; L92-L95 PolarHBondContact O-N 3.49Å; L95-R97 VanDerWaalsContact C-N 3.33Å; L95-R97 PolarHBondContact O-N 2.62Å; L95-Q98 PolarHBondContact O-N 3.1Å; L95-L99 VanDerWaalsContact O-CB 3.27Å; L95-L99 WeakPolarHBondContact O-CB 3.16Å; L95-L99 PolarHBondContact O-N 2.95Å
96	H	96	Very high	93.7	Very high	5 Å²	5	52.5 Å²	52.5	2%	0.023	24%	0.242	C	C	.	.	H	α-helix	trans	-60.4	-40.8	176	-84.2	-74.1	0	0	0	112.6	L92 L99 C100 F113 F116	L92-H96 PolarHBondContact O-CD2 3.34Å; L92-H96 VanDerWaalsContact O-CD2 3.32Å; L92-H96 PolarHBondContact O-N 3.01Å; H96-L99 PolarHBondContact O-N 2.95Å; H96-C100 PolarHBondContact O-N 3.3Å; H96-C100 PolarHBondContact O-SG 3.33Å; H96-F113 HydrophobicContact CB-CB 4.25Å; H96-F113 HydrophobicContact CB-CD1 4.33Å; H96-F113 HydrophobicContact CB-CD2 3.26Å; H96-F113 HydrophobicContact CB-CE2 3.54Å; H96-F113 HydrophobicContact CB-CG 3.71Å; H96-F113 HydrophobicContact CB-CZ 4.2Å; H96-F113 AromaticContact CG-CD2 3.69Å; H96-F116 AromaticContact CD2-CD1 3.75Å; H96-F116 AromaticContact CD2-CE1 3.99Å
97	R	94.7	Very high	93.7	Very high	126 Å²	126	48.1 Å²	48.1	48%	0.475	23%	0.225	S	C	.	.	H	α-helix	trans	-62.7	-47.4	176.1	-76.6	176.7	178.2	-175.3	-0.7	112.1	V93 R94 L95 L99 C100 Y101 F113	V93-R97 HydrophobicContact CG1-CG 4.4Å; V93-R97 WeakPolarHBondContact O-CB 3.29Å; V93-R97 VanDerWaalsContact O-CG 3.25Å; V93-R97 WeakPolarHBondContact O-CG 3.45Å; V93-R97 PolarHBondContact O-N 3.36Å; R94-R97 PolarHBondContact O-N 2.97Å; L95-R97 VanDerWaalsContact C-N 3.33Å; L95-R97 PolarHBondContact O-N 2.62Å; R97-L99 VanDerWaalsContact C-N 3.29Å; R97-L99 PolarHBondContact O-N 2.92Å; R97-C100 PolarHBondContact O-N 3.06Å; R97-Y101 VanDerWaalsContact O-CB 3.25Å; R97-Y101 WeakPolarHBondContact O-CB 3.38Å; R97-Y101 PolarHBondContact O-N 3.09Å; R97-F113 HydrophobicContact CG-CE1 3.75Å; R97-F113 HydrophobicContact CG-CZ 3.6Å
98	Q	94.5	Very high	93.7	Very high	67 Å²	67	51.6 Å²	51.6	31%	0.313	24%	0.242	S	C	.	.	H	α-helix	trans	-61.2	-42.1	177.6	-74.2	176.7	-10.6	0	0	111.1	Y54 R94 L95 R102	Y54-Q98 HydrophobicContact CE1-CB 3.81Å; R94-Q98 HydrophobicContact CG-CG 4.46Å; R94-Q98 WeakPolarHBondContact O-CB 3.31Å; R94-Q98 WeakPolarHBondContact O-CG 3.38Å; R94-Q98 PolarHBondContact O-N 2.63Å; L95-Q98 PolarHBondContact O-N 3.1Å; Q98-R102 WeakPolarHBondContact O-CB 3.44Å; Q98-R102 WeakPolarHBondContact O-CG 3.48Å; Q98-R102 PolarHBondContact O-N 2.88Å; Q98-R102 VanDerWaalsContact O-N 3.1Å
99	L	94.8	Very high	93.8	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.1	-52	177.9	-179.1	69.3	0	0	0	111.6	I51 Y54 I58 L95 H96 R97 Y101 R102 F103 L109	I51-L99 HydrophobicContact CB-CD1 4.39Å; I51-L99 HydrophobicContact CG1-CD1 4.31Å; I51-L99 HydrophobicContact CG2-CD1 4.12Å; Y54-L99 HydrophobicContact CD1-CB 4.11Å; Y54-L99 HydrophobicContact CD1-CD1 4.45Å; Y54-L99 HydrophobicContact CD2-CD1 3.68Å; Y54-L99 HydrophobicContact CE2-CD1 4.45Å; Y54-L99 HydrophobicContact CG-CB 4.19Å; Y54-L99 HydrophobicContact CG-CD1 3.69Å; Y54-L99 HydrophobicContact CG-CG 4.44Å; I58-L99 HydrophobicContact CD1-CD2 4.3Å; L95-L99 VanDerWaalsContact O-CB 3.27Å; L95-L99 WeakPolarHBondContact O-CB 3.16Å; L95-L99 PolarHBondContact O-N 2.95Å; H96-L99 PolarHBondContact O-N 2.95Å; R97-L99 VanDerWaalsContact C-N 3.29Å; R97-L99 PolarHBondContact O-N 2.92Å; L99-Y101 PolarHBondContact O-N 3.07Å; L99-R102 PolarHBondContact O-N 3.15Å; L99-F103 HydrophobicContact CD1-CD2 3.42Å; L99-F103 VanDerWaalsContact CD1-CD2 3.42Å; L99-F103 HydrophobicContact CD1-CE2 3.74Å; L99-F103 HydrophobicContact CD1-CG 4.48Å; L99-F103 HydrophobicContact CG-CD2 4.34Å; L99-F103 WeakPolarHBondContact O-CB 3.29Å; L99-F103 WeakPolarHBondContact O-CD2 3.39Å; L99-F103 PolarHBondContact O-N 3.03Å; L99-L109 HydrophobicContact CD1-CD1 4.14Å; L99-L109 HydrophobicContact CD2-CD1 4.35Å; L99-L109 HydrophobicContact CD2-CD2 3.96Å; L99-L109 HydrophobicContact CG-CD1 3.98Å; L99-L109 HydrophobicContact CG-CD2 4.49Å
100	C	94.2	Very high	93.9	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.007	24%	0.239	C	C	.	.	H	α-helix	trans	-64.5	-39.3	179.7	-60.8	0	0	0	0	112.3	H96 R97 R102 F103 Q104 W110	H96-C100 PolarHBondContact O-N 3.3Å; H96-C100 PolarHBondContact O-SG 3.33Å; R97-C100 PolarHBondContact O-N 3.06Å; C100-R102 VanDerWaalsContact C-N 3.31Å; C100-R102 PolarHBondContact O-N 3.43Å; C100-F103 CarbonylContact O-C 3.37Å; C100-Q104 WeakPolarHBondContact O-CA 3.27Å; C100-Q104 VanDerWaalsContact O-CG 3.27Å; C100-Q104 WeakPolarHBondContact O-CG 3.49Å; C100-Q104 PolarHBondContact O-N 3.48Å; C100-W110 HydrophobicContact CB-CD2 3.85Å; C100-W110 HydrophobicContact CB-CE3 3.75Å; C100-W110 HydrophobicContact CB-CH2 3.77Å; C100-W110 HydrophobicContact CB-CZ2 3.84Å; C100-W110 HydrophobicContact CB-CZ3 3.72Å; C100-W110 WeakPolarHBondContact O-CZ2 3.38Å
101	Y	93.4	Very high	93.9	Very high	151 Å²	151	52.3 Å²	52.3	59%	0.592	24%	0.239	S	C	*	.	H	α-helix	trans	-65.6	-32.9	179	177.8	-99.2	0	0	0	112.9	R97 L99 Q104	R97-Y101 VanDerWaalsContact O-CB 3.25Å; R97-Y101 WeakPolarHBondContact O-CB 3.38Å; R97-Y101 PolarHBondContact O-N 3.09Å; L99-Y101 PolarHBondContact O-N 3.07Å; Y101-Q104 VanDerWaalsContact O-CG 3.27Å; Y101-Q104 WeakPolarHBondContact O-CG 3.49Å; Y101-Q104 PolarHBondContact O-NE2 3.45Å
102	R	92.6	Very high	93.9	Very high	152 Å²	152	55.7 Å²	55.7	57%	0.574	25%	0.252	S	S	*	.	H	α-helix	trans	-84.1	-41.1	179.1	-67.3	-66.9	-176.4	-178.7	-1	112.2	Q98 L99 C100	Q98-R102 WeakPolarHBondContact O-CB 3.44Å; Q98-R102 WeakPolarHBondContact O-CG 3.48Å; Q98-R102 PolarHBondContact O-N 2.88Å; Q98-R102 VanDerWaalsContact O-N 3.1Å; L99-R102 PolarHBondContact O-N 3.15Å; C100-R102 VanDerWaalsContact C-N 3.31Å; C100-R102 PolarHBondContact O-N 3.43Å
103	F	94	Very high	93.9	Very high	40 Å²	40	55.8 Å²	55.8	18%	0.175	25%	0.252	C	S	.	.			trans	-108.3	57.2	-175.8	-59.9	-74.8	0	0	0	110.2	K49 I51 Y54 L99 C100 S105 H106 L109	K49-F103 WeakPolarHBondContact O-CZ 3.36Å; I51-F103 HydrophobicContact CD1-CB 4.47Å; I51-F103 HydrophobicContact CD1-CD1 3.98Å; I51-F103 HydrophobicContact CD1-CE1 4.37Å; I51-F103 HydrophobicContact CD1-CG 4.1Å; I51-F103 HydrophobicContact CG1-CB 4.45Å; I51-F103 HydrophobicContact CG1-CD1 3.71Å; I51-F103 HydrophobicContact CG1-CD2 3.73Å; I51-F103 HydrophobicContact CG1-CE1 3.76Å; I51-F103 HydrophobicContact CG1-CE2 3.76Å; I51-F103 HydrophobicContact CG1-CG 3.69Å; I51-F103 HydrophobicContact CG1-CZ 3.78Å; Y54-F103 HydrophobicContact CD2-CE2 4.06Å; Y54-F103 AromaticContact CE2-CE2 3.97Å; Y54-F103 HydrophobicContact CE2-CE2 3.97Å; L99-F103 HydrophobicContact CD1-CD2 3.42Å; L99-F103 VanDerWaalsContact CD1-CD2 3.42Å; L99-F103 HydrophobicContact CD1-CE2 3.74Å; L99-F103 HydrophobicContact CD1-CG 4.48Å; L99-F103 HydrophobicContact CG-CD2 4.34Å; L99-F103 WeakPolarHBondContact O-CB 3.29Å; L99-F103 WeakPolarHBondContact O-CD2 3.39Å; L99-F103 PolarHBondContact O-N 3.03Å; C100-F103 CarbonylContact O-C 3.37Å; F103-S105 VanDerWaalsContact C-N 3.26Å; F103-S105 PolarHBondContact O-N 3.12Å; F103-H106 PolarHBondContact O-N 3.3Å; F103-L109 HydrophobicContact CB-CD1 3.54Å; F103-L109 HydrophobicContact CG-CD1 4.3Å
104	Q	92	Very high	93.9	Very high	77 Å²	77	55.6 Å²	55.6	36%	0.36	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-31.6	-171.8	-67.4	-177.7	23.3	0	0	113.2	C100 Y101 H106 W110 I136 H137	C100-Q104 WeakPolarHBondContact O-CA 3.27Å; C100-Q104 VanDerWaalsContact O-CG 3.27Å; C100-Q104 WeakPolarHBondContact O-CG 3.49Å; C100-Q104 PolarHBondContact O-N 3.48Å; Y101-Q104 VanDerWaalsContact O-CG 3.27Å; Y101-Q104 WeakPolarHBondContact O-CG 3.49Å; Y101-Q104 PolarHBondContact O-NE2 3.45Å; Q104-H106 PolarHBondContact O-N 2.96Å; Q104-W110 HydrophobicContact CG-CZ2 4.28Å; Q104-W110 PolarHBondContact O-NE1 3.15Å; Q104-I136 HydrophobicContact CB-CD1 4.11Å; Q104-I136 HydrophobicContact CB-CG2 4.48Å; Q104-I136 HydrophobicContact CG-CD1 4.21Å; Q104-H137 PolarHBondContact O-CE1 3.45Å; Q104-H137 PolarHBondContact O-NE2 3.46Å
105	S	90.6	Very high	93.8	Very high	91 Å²	91	58.7 Å²	58.7	64%	0.636	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-21.1	178.6	53.2	0	0	0	0	114	F103 L107 H137	F103-S105 VanDerWaalsContact C-N 3.26Å; F103-S105 PolarHBondContact O-N 3.12Å; S105-L107 PolarHBondContact O-N 3.31Å; S105-H137 PolarHBondContact O-CE1 3.09Å; S105-H137 VanDerWaalsContact O-CE1 3.29Å
106	H	92.8	Very high	93.7	Very high	72 Å²	72	60.1 Å²	60.1	33%	0.333	27%	0.274	S	S	.	.			trans	-90.9	95.4	-173.9	-73.2	-83.4	0	0	0	111.2	F103 Q104 D108 L109	F103-H106 PolarHBondContact O-N 3.3Å; Q104-H106 PolarHBondContact O-N 2.96Å; H106-D108 VanDerWaalsContact C-N 3.26Å; H106-D108 WeakPolarHBondContact CA-OD1 3.48Å; H106-D108 VanDerWaalsContact CB-OD1 3.27Å; H106-D108 WeakPolarHBondContact CB-OD1 3.43Å; H106-D108 IonicContact CG-OD1 3.44Å; H106-D108 IonicContact ND1-OD1 2.71Å; H106-D108 PolarHBondContact O-N 3.37Å; H106-L109 HydrophobicContact CB-CB 4.38Å; H106-L109 HydrophobicContact CB-CD1 3.53Å; H106-L109 HydrophobicContact CB-CG 3.68Å; H106-L109 PolarHBondContact O-N 3.25Å
107	L	92	Very high	93.5	Very high	48 Å²	48	59.9 Å²	59.9	25%	0.251	27%	0.273	S	S	.	.	H	α-helix	trans	-59.4	-35.5	179.9	-178.9	62.1	0	0	0	112.9	S105 L109 W110 M111 V133 H137 L144	S105-L107 PolarHBondContact O-N 3.31Å; L107-L109 VanDerWaalsContact C-N 3.26Å; L107-L109 PolarHBondContact O-N 2.91Å; L107-W110 WeakPolarHBondContact O-CB 3.43Å; L107-W110 PolarHBondContact O-N 2.84Å; L107-W110 VanDerWaalsContact O-N 3.14Å; L107-M111 HydrophobicContact CD1-CG 4.43Å; L107-M111 HydrophobicContact CG-CG 4.27Å; L107-M111 WeakPolarHBondContact O-CG 3.48Å; L107-M111 PolarHBondContact O-N 2.87Å; L107-V133 HydrophobicContact CD1-CG1 4.04Å; L107-H137 HydrophobicContact CD1-CB 4.36Å; L107-L144 HydrophobicContact CD1-CD1 3.69Å; L107-L144 HydrophobicContact CD1-CD2 3.97Å; L107-L144 HydrophobicContact CD1-CG 4.49Å; L107-L144 HydrophobicContact CD2-CD1 4.17Å; L107-L144 HydrophobicContact CD2-CD2 4.19Å
108	D	93	Very high	93.3	Very high	98 Å²	98	57.4 Å²	57.4	52%	0.524	27%	0.265	S	S	.	.	H	α-helix	trans	-56.3	-38.5	177.2	60.6	-52.6	0	0	0	112.6	H106 M111 R112	H106-D108 VanDerWaalsContact C-N 3.26Å; H106-D108 WeakPolarHBondContact CA-OD1 3.48Å; H106-D108 VanDerWaalsContact CB-OD1 3.27Å; H106-D108 WeakPolarHBondContact CB-OD1 3.43Å; H106-D108 IonicContact CG-OD1 3.44Å; H106-D108 IonicContact ND1-OD1 2.71Å; H106-D108 PolarHBondContact O-N 3.37Å; D108-M111 PolarHBondContact O-N 2.76Å; D108-R112 WeakPolarHBondContact O-CB 3.28Å; D108-R112 PolarHBondContact O-N 3.34Å
109	L	94	Very high	93	Very high	2 Å²	2	59.4 Å²	59.4	1%	0.01	28%	0.277	C	S	.	.	H	α-helix	trans	-66.7	-40.7	178.1	-57.1	-179.4	0	0	0	111.7	I51 L99 F103 H106 L107 R112 F113	I51-L109 HydrophobicContact CD1-CD1 4.12Å; I51-L109 HydrophobicContact CG1-CD1 4.35Å; I51-L109 HydrophobicContact CG2-CD1 4.49Å; I51-L109 HydrophobicContact CG2-CD2 4.06Å; L99-L109 HydrophobicContact CD1-CD1 4.14Å; L99-L109 HydrophobicContact CD2-CD1 4.35Å; L99-L109 HydrophobicContact CD2-CD2 3.96Å; L99-L109 HydrophobicContact CG-CD1 3.98Å; L99-L109 HydrophobicContact CG-CD2 4.49Å; F103-L109 HydrophobicContact CB-CD1 3.54Å; F103-L109 HydrophobicContact CG-CD1 4.3Å; H106-L109 HydrophobicContact CB-CB 4.38Å; H106-L109 HydrophobicContact CB-CD1 3.53Å; H106-L109 HydrophobicContact CB-CG 3.68Å; H106-L109 PolarHBondContact O-N 3.25Å; L107-L109 VanDerWaalsContact C-N 3.26Å; L107-L109 PolarHBondContact O-N 2.91Å; L109-R112 PolarHBondContact O-N 2.96Å; L109-F113 PolarHBondContact O-N 3.24Å
110	W	95.1	Very high	92.7	Very high	13 Å²	13	61.3 Å²	61.3	5%	0.049	29%	0.287	C	S	.	.	H	α-helix	trans	-64.9	-45.3	175.2	-66.1	102.7	0	0	0	111.6	C100 Q104 L107 R112 F113 I114 I129 N132 V133 I136 H137	C100-W110 HydrophobicContact CB-CD2 3.85Å; C100-W110 HydrophobicContact CB-CE3 3.75Å; C100-W110 HydrophobicContact CB-CH2 3.77Å; C100-W110 HydrophobicContact CB-CZ2 3.84Å; C100-W110 HydrophobicContact CB-CZ3 3.72Å; C100-W110 WeakPolarHBondContact O-CZ2 3.38Å; Q104-W110 HydrophobicContact CG-CZ2 4.28Å; Q104-W110 PolarHBondContact O-NE1 3.15Å; L107-W110 WeakPolarHBondContact O-CB 3.43Å; L107-W110 PolarHBondContact O-N 2.84Å; L107-W110 VanDerWaalsContact O-N 3.14Å; W110-R112 VanDerWaalsContact C-N 3.33Å; W110-R112 PolarHBondContact O-N 3.03Å; W110-F113 PolarHBondContact O-N 3.28Å; W110-F113 VanDerWaalsContact O-N 3.09Å; W110-I114 WeakPolarHBondContact O-CG1 3.3Å; W110-I114 PolarHBondContact O-N 3.48Å; W110-I129 HydrophobicContact CE3-CG2 3.86Å; W110-I129 HydrophobicContact CZ3-CG2 4.32Å; W110-N132 HydrophobicContact CH2-CB 4.06Å; W110-N132 HydrophobicContact CZ3-CB 3.95Å; W110-V133 HydrophobicContact CB-CG2 3.53Å; W110-V133 HydrophobicContact CD2-CG2 3.61Å; W110-V133 HydrophobicContact CE3-CG2 3.52Å; W110-V133 HydrophobicContact CG-CG2 3.64Å; W110-V133 HydrophobicContact CZ3-CG2 4.36Å; W110-I136 HydrophobicContact CH2-CD1 4.08Å; W110-I136 HydrophobicContact CZ2-CD1 3.51Å; W110-H137 AromaticContact CD1-NE2 3.88Å; W110-H137 AromaticContact NE1-NE2 3.84Å
111	M	94.8	Very high	92.3	Very high	77 Å²	77	66.7 Å²	66.7	38%	0.379	32%	0.316	S	S	.	.	H	α-helix	trans	-61.7	-41.7	177.6	-66.4	-51.9	-67.8	0	0	111.7	L107 D108 F113 I114 H115 W130 L144	L107-M111 HydrophobicContact CD1-CG 4.43Å; L107-M111 HydrophobicContact CG-CG 4.27Å; L107-M111 WeakPolarHBondContact O-CG 3.48Å; L107-M111 PolarHBondContact O-N 2.87Å; D108-M111 PolarHBondContact O-N 2.76Å; M111-F113 VanDerWaalsContact C-N 3.31Å; M111-F113 PolarHBondContact O-N 3.47Å; M111-I114 PolarHBondContact O-N 3.32Å; M111-I114 HydrophobicContact SD-CD1 4.17Å; M111-H115 WeakPolarHBondContact O-CB 3.4Å; M111-H115 PolarHBondContact O-N 2.99Å; M111-W130 HydrophobicContact CE-CH2 4.26Å; M111-W130 HydrophobicContact SD-CH2 4.2Å; M111-L144 HydrophobicContact SD-CD2 4.36Å
112	R	93.9	Very high	92	Very high	84 Å²	84	63.4 Å²	63.4	32%	0.317	30%	0.302	S	S	.	.	H	α-helix	trans	-61.3	-39.8	173.2	-171.6	173.5	63.9	168.3	5.1	111.8	D55 D108 L109 W110 H115 F116	D55-R112 IonicContact OD1-CZ 3.03Å; D55-R112 IonicContact OD1-NH1 3.62Å; D55-R112 PolarHBondContact OD1-NH1 3.36Å; D55-R112 IonicContact OD1-NH2 3.17Å; D55-R112 PolarHBondContact OD1-NH2 3.46Å; D55-R112 IonicContact OD2-NH1 3.09Å; D108-R112 WeakPolarHBondContact O-CB 3.28Å; D108-R112 PolarHBondContact O-N 3.34Å; L109-R112 PolarHBondContact O-N 2.96Å; W110-R112 VanDerWaalsContact C-N 3.33Å; W110-R112 PolarHBondContact O-N 3.03Å; R112-H115 PolarHBondContact O-N 3.33Å; R112-F116 WeakPolarHBondContact O-CB 3.42Å; R112-F116 PolarHBondContact O-N 3.31Å
113	F	95.4	Very high	91.7	Very high	5 Å²	5	57 Å²	57	2%	0.022	28%	0.279	C	S	.	.	H	α-helix	trans	-70	-38.8	177.8	-174.5	-151	0	0	0	112.9	V93 H96 R97 L109 W110 M111 F116 C117 I129	V93-F113 HydrophobicContact CG1-CE2 4.47Å; V93-F113 HydrophobicContact CG1-CZ 4.33Å; H96-F113 HydrophobicContact CB-CB 4.25Å; H96-F113 HydrophobicContact CB-CD1 4.33Å; H96-F113 HydrophobicContact CB-CD2 3.26Å; H96-F113 HydrophobicContact CB-CE2 3.54Å; H96-F113 HydrophobicContact CB-CG 3.71Å; H96-F113 HydrophobicContact CB-CZ 4.2Å; H96-F113 AromaticContact CG-CD2 3.69Å; R97-F113 HydrophobicContact CG-CE1 3.75Å; R97-F113 HydrophobicContact CG-CZ 3.6Å; L109-F113 PolarHBondContact O-N 3.24Å; W110-F113 PolarHBondContact O-N 3.28Å; W110-F113 VanDerWaalsContact O-N 3.09Å; M111-F113 VanDerWaalsContact C-N 3.31Å; M111-F113 PolarHBondContact O-N 3.47Å; F113-F116 HydrophobicContact CD2-CD1 4.12Å; F113-F116 HydrophobicContact CE2-CD1 4.26Å; F113-F116 PolarHBondContact O-N 2.91Å; F113-C117 WeakPolarHBondContact CE2-SG 3.33Å; F113-C117 WeakPolarHBondContact O-CB 3.45Å; F113-C117 PolarHBondContact O-N 3.33Å; F113-C117 PolarHBondContact O-SG 3.33Å; F113-I129 HydrophobicContact CD1-CD1 3.44Å; F113-I129 VanDerWaalsContact CD1-CD1 3.44Å; F113-I129 HydrophobicContact CD1-CG1 3.79Å; F113-I129 HydrophobicContact CD1-CG2 4.22Å; F113-I129 HydrophobicContact CD2-CD1 4.23Å; F113-I129 HydrophobicContact CE1-CD1 3.3Å; F113-I129 HydrophobicContact CE1-CG1 3.57Å; F113-I129 HydrophobicContact CE2-CD1 4.12Å; F113-I129 HydrophobicContact CG-CD1 3.92Å; F113-I129 HydrophobicContact CZ-CD1 3.66Å; F113-I129 HydrophobicContact CZ-CG1 4.32Å
114	I	93.9	Very high	91.4	Very high	4 Å²	4	59.8 Å²	59.8	2%	0.021	30%	0.295	C	S	.	.	H	α-helix	trans	-60.2	-48	172.2	-71.7	167.2	0	0	0	109.9	W110 M111 F116 C117 K118 V126 I129 W130 V133	W110-I114 WeakPolarHBondContact O-CG1 3.3Å; W110-I114 PolarHBondContact O-N 3.48Å; M111-I114 PolarHBondContact O-N 3.32Å; M111-I114 HydrophobicContact SD-CD1 4.17Å; I114-F116 PolarHBondContact O-N 2.89Å; I114-C117 PolarHBondContact O-N 3.18Å; I114-K118 HydrophobicContact CG2-CD 4.38Å; I114-K118 WeakPolarHBondContact O-CG 3.16Å; I114-K118 PolarHBondContact O-N 2.71Å; I114-V126 HydrophobicContact CG2-CG1 3.98Å; I114-I129 HydrophobicContact CD1-CG2 4.01Å; I114-I129 HydrophobicContact CG1-CB 4.18Å; I114-I129 HydrophobicContact CG1-CG2 3.49Å; I114-I129 VanDerWaalsContact CG1-CG2 3.49Å; I114-W130 HydrophobicContact CD1-CD2 3.85Å; I114-W130 HydrophobicContact CD1-CE3 3.98Å; I114-W130 HydrophobicContact CD1-CH2 3.99Å; I114-W130 HydrophobicContact CD1-CZ2 3.88Å; I114-W130 HydrophobicContact CD1-CZ3 4.05Å; I114-W130 HydrophobicContact CG2-CZ2 4.28Å; I114-V133 HydrophobicContact CD1-CG2 4.37Å
115	H	93.1	Very high	91.3	Very high	120 Å²	120	56.8 Å²	56.8	56%	0.556	28%	0.283	S	S	*	.	H	α-helix	trans	-59.7	-46.5	178.4	-176.7	81.6	0	0	0	111.7	M111 R112 C117 K118 I119	M111-H115 WeakPolarHBondContact O-CB 3.4Å; M111-H115 PolarHBondContact O-N 2.99Å; R112-H115 PolarHBondContact O-N 3.33Å; H115-C117 PolarHBondContact O-N 3.35Å; H115-K118 WeakPolarHBondContact O-CB 3.41Å; H115-K118 PolarHBondContact O-N 3.12Å; H115-I119 WeakPolarHBondContact NE2-CD1 3.02Å; H115-I119 WeakPolarHBondContact O-CG1 3.22Å; H115-I119 PolarHBondContact O-N 3.2Å
116	F	93.1	Very high	91.3	Very high	29 Å²	29	52.5 Å²	52.5	13%	0.127	25%	0.252	C	S	.	.	H	α-helix	trans	-58.1	-46.1	174.5	174.8	-111.2	0	0	0	112.6	L92 V93 H96 R112 F113 I114 K118 I119 I120	L92-F116 HydrophobicContact CB-CE1 4.02Å; L92-F116 HydrophobicContact CB-CE2 4.25Å; L92-F116 HydrophobicContact CB-CZ 3.43Å; L92-F116 VanDerWaalsContact CB-CZ 3.43Å; L92-F116 HydrophobicContact CD1-CE2 4.01Å; L92-F116 HydrophobicContact CD1-CZ 3.91Å; L92-F116 HydrophobicContact CG-CZ 4.27Å; V93-F116 HydrophobicContact CG2-CE1 3.72Å; H96-F116 AromaticContact CD2-CD1 3.75Å; H96-F116 AromaticContact CD2-CE1 3.99Å; R112-F116 WeakPolarHBondContact O-CB 3.42Å; R112-F116 PolarHBondContact O-N 3.31Å; F113-F116 HydrophobicContact CD2-CD1 4.12Å; F113-F116 HydrophobicContact CE2-CD1 4.26Å; F113-F116 PolarHBondContact O-N 2.91Å; I114-F116 PolarHBondContact O-N 2.89Å; F116-K118 VanDerWaalsContact C-N 3.32Å; F116-K118 PolarHBondContact O-N 3.45Å; F116-I119 PolarHBondContact O-N 3.25Å; F116-I120 HydrophobicContact CD1-CD1 3.84Å; F116-I120 HydrophobicContact CD2-CD1 3.93Å; F116-I120 HydrophobicContact CE1-CD1 3.32Å; F116-I120 HydrophobicContact CE2-CD1 3.41Å; F116-I120 VanDerWaalsContact CE2-CD1 3.41Å; F116-I120 HydrophobicContact CE2-CG1 4.27Å; F116-I120 HydrophobicContact CG-CD1 4.13Å; F116-I120 HydrophobicContact CZ-CD1 3.08Å; F116-I120 HydrophobicContact CZ-CG1 4.34Å; F116-I120 WeakPolarHBondContact O-CG1 3.47Å; F116-I120 PolarHBondContact O-N 2.62Å
117	C	92.4	Very high	91.2	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.007	25%	0.246	C	C	.	.	H	α-helix	trans	-66.1	-32.7	177.8	-69.8	0	0	0	0	113	F113 I114 H115 I120 N121 R122 V126 I129	F113-C117 WeakPolarHBondContact CE2-SG 3.33Å; F113-C117 WeakPolarHBondContact O-CB 3.45Å; F113-C117 PolarHBondContact O-N 3.33Å; F113-C117 PolarHBondContact O-SG 3.33Å; I114-C117 PolarHBondContact O-N 3.18Å; H115-C117 PolarHBondContact O-N 3.35Å; C117-I120 PolarHBondContact O-N 3.05Å; C117-N121 PolarHBondContact O-N 3.45Å; C117-R122 PolarHBondContact O-N 3.49Å; C117-V126 HydrophobicContact CB-CG2 3.42Å; C117-V126 VanDerWaalsContact CB-CG2 3.42Å; C117-I129 HydrophobicContact CB-CD1 4.32Å; C117-I129 VanDerWaalsContact SG-CD1 3.53Å
118	K	89.1	Confident	91.3	Very high	73 Å²	73	54.6 Å²	54.6	32%	0.317	26%	0.258	S	S	.	.	H	α-helix	trans	-62.2	-45.8	171.7	-79.4	-178.5	166.1	-173.7	0	111.1	I114 H115 F116 I120 N121 V126 Y151	I114-K118 HydrophobicContact CG2-CD 4.38Å; I114-K118 WeakPolarHBondContact O-CG 3.16Å; I114-K118 PolarHBondContact O-N 2.71Å; H115-K118 WeakPolarHBondContact O-CB 3.41Å; H115-K118 PolarHBondContact O-N 3.12Å; F116-K118 VanDerWaalsContact C-N 3.32Å; F116-K118 PolarHBondContact O-N 3.45Å; K118-I120 VanDerWaalsContact C-N 3.3Å; K118-I120 PolarHBondContact O-N 3.5Å; K118-N121 PolarHBondContact O-N 2.69Å; K118-V126 HydrophobicContact CG-CG2 4.29Å; K118-Y151 VanDerWaalsContact CE-CD2 3.44Å; K118-Y151 HydrophobicContact CG-CE2 4.22Å
119	I	89.3	Confident	91.3	Very high	110 Å²	110	50.3 Å²	50.3	56%	0.564	24%	0.235	S	C	*	.	H	α-helix	trans	-59.7	-40.6	177.6	-67.7	166.5	0	0	0	111.6	H115 F116 N121	H115-I119 WeakPolarHBondContact NE2-CD1 3.02Å; H115-I119 WeakPolarHBondContact O-CG1 3.22Å; H115-I119 PolarHBondContact O-N 3.2Å; F116-I119 PolarHBondContact O-N 3.25Å; I119-N121 PolarHBondContact O-N 3.15Å
120	I	88.5	Confident	91.4	Very high	40 Å²	40	50.4 Å²	50.4	21%	0.205	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	0.1	179.7	-55.2	161	0	0	0	112	I89 F116 C117 K118 R122	I89-I120 HydrophobicContact CD1-CG2 4.41Å; I89-I120 HydrophobicContact CG2-CD1 3.75Å; I89-I120 HydrophobicContact CG2-CG2 4.01Å; F116-I120 HydrophobicContact CD1-CD1 3.84Å; F116-I120 HydrophobicContact CD2-CD1 3.93Å; F116-I120 HydrophobicContact CE1-CD1 3.32Å; F116-I120 HydrophobicContact CE2-CD1 3.41Å; F116-I120 VanDerWaalsContact CE2-CD1 3.41Å; F116-I120 HydrophobicContact CE2-CG1 4.27Å; F116-I120 HydrophobicContact CG-CD1 4.13Å; F116-I120 HydrophobicContact CZ-CD1 3.08Å; F116-I120 HydrophobicContact CZ-CG1 4.34Å; F116-I120 WeakPolarHBondContact O-CG1 3.47Å; F116-I120 PolarHBondContact O-N 2.62Å; C117-I120 PolarHBondContact O-N 3.05Å; K118-I120 VanDerWaalsContact C-N 3.3Å; K118-I120 PolarHBondContact O-N 3.5Å; I120-R122 HydrophobicContact CB-CG 4.37Å; I120-R122 HydrophobicContact CG2-CG 3.91Å; I120-R122 PolarHBondContact O-N 3.01Å
121	N	85.1	Confident	91.3	Very high	114 Å²	114	53 Å²	53	61%	0.61	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	30.5	-175.6	-61.7	-60	0	0	0	113.7	C117 K118 I119 H123	C117-N121 PolarHBondContact O-N 3.45Å; K118-N121 PolarHBondContact O-N 2.69Å; I119-N121 PolarHBondContact O-N 3.15Å; N121-H123 PolarHBondContact O-CD2 3.21Å; N121-H123 PolarHBondContact O-N 3.33Å
122	R	87	Confident	91.2	Very high	82 Å²	82	52.8 Å²	52.8	31%	0.309	25%	0.25	S	S	.	.			trans	-92.1	69.3	177.7	-74	-177.6	-178.3	-165.7	3.2	111.2	C117 I120 L124 S125 V126	C117-R122 PolarHBondContact O-N 3.49Å; I120-R122 HydrophobicContact CB-CG 4.37Å; I120-R122 HydrophobicContact CG2-CG 3.91Å; I120-R122 PolarHBondContact O-N 3.01Å; R122-L124 PolarHBondContact O-N 3.31Å; R122-S125 WeakPolarHBondContact O-CB 3.5Å; R122-S125 PolarHBondContact O-N 3.47Å; R122-S125 VanDerWaalsContact O-N 3.09Å; R122-V126 PolarHBondContact O-N 3.03Å
123	H	86.3	Confident	91.2	Very high	17 Å²	17	48.8 Å²	48.8	8%	0.079	24%	0.235	C	C	.	.	H	α-helix	trans	-62.1	-38.8	-171.3	-63.3	-75.2	0	0	0	114.7	N121 S125 V126 V127 Y151 S159 R162	N121-H123 PolarHBondContact O-CD2 3.21Å; N121-H123 PolarHBondContact O-N 3.33Å; H123-S125 PolarHBondContact O-N 3.2Å; H123-V126 WeakPolarHBondContact O-CB 3.28Å; H123-V126 PolarHBondContact O-N 2.94Å; H123-V127 PolarHBondContact O-N 2.7Å; H123-Y151 VanDerWaalsContact CA-OH 3.31Å; H123-Y151 WeakPolarHBondContact CA-OH 3.47Å; H123-Y151 WeakPolarHBondContact CB-OH 3.3Å; H123-Y151 AromaticContact ND1-CZ 3.89Å; H123-Y151 PolarHBondContact ND1-OH 3.29Å; H123-S159 VanDerWaalsContact CB-OG 3.24Å; H123-S159 WeakPolarHBondContact CB-OG 3.46Å; H123-S159 WeakPolarHBondContact CD2-CB 3.47Å; H123-S159 PolarHBondContact CD2-OG 2.8Å; H123-S159 VanDerWaalsContact CG-CB 3.41Å; H123-S159 VanDerWaalsContact CG-OG 3.31Å; H123-R162 PolarHBondContact NE2-NH2 2.98Å
124	L	87.4	Confident	91.2	Very high	99 Å²	99	49 Å²	49	52%	0.518	24%	0.236	S	C	.	.	H	α-helix	trans	-60.5	-33.9	175.8	-67.2	176.6	0	0	0	112.5	R122 R128	R122-L124 PolarHBondContact O-N 3.31Å; L124-R128 PolarHBondContact O-N 3.45Å
125	S	89.6	Confident	91.1	Very high	14 Å²	14	56.3 Å²	56.3	10%	0.098	27%	0.271	C	S	.	.	H	α-helix	trans	-70.1	-39.4	174.1	-64.6	0	0	0	0	111.2	R122 H123 V127 R128 I129	R122-S125 WeakPolarHBondContact O-CB 3.5Å; R122-S125 PolarHBondContact O-N 3.47Å; R122-S125 VanDerWaalsContact O-N 3.09Å; H123-S125 PolarHBondContact O-N 3.2Å; S125-V127 PolarHBondContact O-N 2.95Å; S125-R128 PolarHBondContact O-N 2.98Å; S125-R128 PolarHBondContact OG-NH2 2.95Å; S125-R128 VanDerWaalsContact OG-NH2 3.15Å; S125-I129 WeakPolarHBondContact O-CD1 3.41Å; S125-I129 WeakPolarHBondContact O-CG1 3.42Å; S125-I129 PolarHBondContact O-N 3.12Å
126	V	92.3	Very high	91	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-61.6	-43.3	176.3	179.8	0	0	0	0	111.4	I114 C117 K118 R122 H123 R128 I129 W130 Y151	I114-V126 HydrophobicContact CG2-CG1 3.98Å; C117-V126 HydrophobicContact CB-CG2 3.42Å; C117-V126 VanDerWaalsContact CB-CG2 3.42Å; K118-V126 HydrophobicContact CG-CG2 4.29Å; R122-V126 PolarHBondContact O-N 3.03Å; H123-V126 WeakPolarHBondContact O-CB 3.28Å; H123-V126 PolarHBondContact O-N 2.94Å; V126-R128 PolarHBondContact O-N 3.32Å; V126-I129 PolarHBondContact O-N 3.43Å; V126-W130 VanDerWaalsContact O-CD1 3.31Å; V126-W130 PolarHBondContact O-N 2.89Å; V126-Y151 HydrophobicContact CB-CE1 3.93Å; V126-Y151 HydrophobicContact CB-CE2 4.28Å; V126-Y151 VanDerWaalsContact CB-OH 3.31Å; V126-Y151 WeakPolarHBondContact CB-OH 3.48Å; V126-Y151 HydrophobicContact CG1-CD1 4.05Å; V126-Y151 HydrophobicContact CG1-CD2 4.13Å; V126-Y151 HydrophobicContact CG1-CE1 3.54Å; V126-Y151 HydrophobicContact CG1-CE2 3.62Å; V126-Y151 HydrophobicContact CG1-CG 4.33Å
127	V	90.9	Very high	90.9	Very high	35 Å²	35	53 Å²	53	21%	0.212	26%	0.257	C	S	.	.	H	α-helix	trans	-59	-47.9	176.3	175.2	0	0	0	0	111	H123 S125 I129 W130 N131 Y151	H123-V127 PolarHBondContact O-N 2.7Å; S125-V127 PolarHBondContact O-N 2.95Å; V127-I129 VanDerWaalsContact C-N 3.3Å; V127-I129 PolarHBondContact O-N 3.03Å; V127-W130 WeakPolarHBondContact O-CB 3.46Å; V127-W130 PolarHBondContact O-N 3.09Å; V127-N131 PolarHBondContact O-N 3.38Å; V127-N131 PolarHBondContact O-OD1 3Å; V127-Y151 HydrophobicContact CG2-CE1 3.94Å
128	R	92.3	Very high	90.8	Very high	129 Å²	129	53 Å²	53	49%	0.487	26%	0.257	S	S	.	.	H	α-helix	trans	-61.3	-38.4	175.7	-72.4	-174.8	-66.6	-114.3	-3.6	113	L124 S125 V126 N131 N132	L124-R128 PolarHBondContact O-N 3.45Å; S125-R128 PolarHBondContact O-N 2.98Å; S125-R128 PolarHBondContact OG-NH2 2.95Å; S125-R128 VanDerWaalsContact OG-NH2 3.15Å; V126-R128 PolarHBondContact O-N 3.32Å; R128-N131 PolarHBondContact O-N 3.31Å; R128-N132 VanDerWaalsContact O-CG 3.32Å; R128-N132 PolarHBondContact O-N 2.84Å; R128-N132 VanDerWaalsContact O-N 3.11Å; R128-N132 PolarHBondContact O-OD1 3.15Å
129	I	94	Very high	90.7	Very high	9 Å²	9	58 Å²	58	5%	0.046	27%	0.274	C	S	.	.	H	α-helix	trans	-65.9	-43.1	177.3	-64.7	158.1	0	0	0	109.8	W110 F113 I114 C117 S125 V126 V127 N131 N132 V133	W110-I129 HydrophobicContact CE3-CG2 3.86Å; W110-I129 HydrophobicContact CZ3-CG2 4.32Å; F113-I129 HydrophobicContact CD1-CD1 3.44Å; F113-I129 VanDerWaalsContact CD1-CD1 3.44Å; F113-I129 HydrophobicContact CD1-CG1 3.79Å; F113-I129 HydrophobicContact CD1-CG2 4.22Å; F113-I129 HydrophobicContact CD2-CD1 4.23Å; F113-I129 HydrophobicContact CE1-CD1 3.3Å; F113-I129 HydrophobicContact CE1-CG1 3.57Å; F113-I129 HydrophobicContact CE2-CD1 4.12Å; F113-I129 HydrophobicContact CG-CD1 3.92Å; F113-I129 HydrophobicContact CZ-CD1 3.66Å; F113-I129 HydrophobicContact CZ-CG1 4.32Å; I114-I129 HydrophobicContact CD1-CG2 4.01Å; I114-I129 HydrophobicContact CG1-CB 4.18Å; I114-I129 HydrophobicContact CG1-CG2 3.49Å; I114-I129 VanDerWaalsContact CG1-CG2 3.49Å; C117-I129 HydrophobicContact CB-CD1 4.32Å; C117-I129 VanDerWaalsContact SG-CD1 3.53Å; S125-I129 WeakPolarHBondContact O-CD1 3.41Å; S125-I129 WeakPolarHBondContact O-CG1 3.42Å; S125-I129 PolarHBondContact O-N 3.12Å; V126-I129 PolarHBondContact O-N 3.43Å; V127-I129 VanDerWaalsContact C-N 3.3Å; V127-I129 PolarHBondContact O-N 3.03Å; I129-N131 VanDerWaalsContact C-N 3.35Å; I129-N131 PolarHBondContact O-N 3.09Å; I129-N132 PolarHBondContact O-N 3.03Å; I129-V133 HydrophobicContact CG2-CG2 4.07Å; I129-V133 WeakPolarHBondContact O-CB 3.3Å; I129-V133 WeakPolarHBondContact O-CG2 3.4Å; I129-V133 PolarHBondContact O-N 3.39Å
130	W	94.9	Very high	90.7	Very high	4 Å²	4	58 Å²	58	2%	0.015	28%	0.28	C	S	.	.	H	α-helix	trans	-56.9	-47.2	173.9	-81.6	124.1	0	0	0	111.9	M111 I114 V126 V127 N132 V133 L134 L144 A147 A148 Y151	M111-W130 HydrophobicContact CE-CH2 4.26Å; M111-W130 HydrophobicContact SD-CH2 4.2Å; I114-W130 HydrophobicContact CD1-CD2 3.85Å; I114-W130 HydrophobicContact CD1-CE3 3.98Å; I114-W130 HydrophobicContact CD1-CH2 3.99Å; I114-W130 HydrophobicContact CD1-CZ2 3.88Å; I114-W130 HydrophobicContact CD1-CZ3 4.05Å; I114-W130 HydrophobicContact CG2-CZ2 4.28Å; V126-W130 VanDerWaalsContact O-CD1 3.31Å; V126-W130 PolarHBondContact O-N 2.89Å; V127-W130 WeakPolarHBondContact O-CB 3.46Å; V127-W130 PolarHBondContact O-N 3.09Å; W130-N132 VanDerWaalsContact C-N 3.3Å; W130-N132 PolarHBondContact O-N 3.22Å; W130-V133 HydrophobicContact CE3-CB 4.5Å; W130-V133 HydrophobicContact CE3-CG1 4.35Å; W130-V133 HydrophobicContact CZ3-CG1 4.4Å; W130-V133 PolarHBondContact O-N 2.92Å; W130-V133 VanDerWaalsContact O-N 3.09Å; W130-L134 WeakPolarHBondContact O-CB 3.32Å; W130-L134 VanDerWaalsContact O-CG 3.24Å; W130-L134 WeakPolarHBondContact O-CG 3.34Å; W130-L134 PolarHBondContact O-N 3.24Å; W130-L144 HydrophobicContact CZ3-CB 4.42Å; W130-L144 HydrophobicContact CZ3-CD2 4.16Å; W130-A147 HydrophobicContact CH2-CB 3.58Å; W130-A147 HydrophobicContact CZ2-CB 4.1Å; W130-A147 HydrophobicContact CZ3-CB 4.29Å; W130-A148 HydrophobicContact CB-CB 4.32Å; W130-A148 HydrophobicContact CD2-CB 3.86Å; W130-A148 HydrophobicContact CE3-CB 3.87Å; W130-A148 HydrophobicContact CG-CB 4.08Å; W130-A148 HydrophobicContact CZ3-CB 4.45Å; W130-Y151 AromaticContact CD1-CD1 3.81Å; W130-Y151 AromaticContact NE1-CD1 3.83Å; W130-Y151 AromaticContact NE1-CG 3.63Å
131	N	93.4	Very high	90.9	Very high	68 Å²	68	59.1 Å²	59.1	36%	0.364	28%	0.284	S	S	.	.	H	α-helix	trans	-57.4	-44.3	177.6	-64.9	-2.2	0	0	0	111.8	V127 R128 I129 L134 Q135	V127-N131 PolarHBondContact O-N 3.38Å; V127-N131 PolarHBondContact O-OD1 3Å; R128-N131 PolarHBondContact O-N 3.31Å; I129-N131 VanDerWaalsContact C-N 3.35Å; I129-N131 PolarHBondContact O-N 3.09Å; N131-L134 PolarHBondContact O-N 3.46Å; N131-Q135 VanDerWaalsContact O-CG 3.24Å; N131-Q135 WeakPolarHBondContact O-CG 3.37Å; N131-Q135 PolarHBondContact O-N 2.88Å
132	N	93.6	Very high	91.2	Very high	71 Å²	71	54.9 Å²	54.9	38%	0.38	26%	0.262	S	S	.	.	H	α-helix	trans	-65.4	-40.5	176.3	-65.3	-0.3	0	0	0	112.2	W110 R128 I129 W130 Q135 I136	W110-N132 HydrophobicContact CH2-CB 4.06Å; W110-N132 HydrophobicContact CZ3-CB 3.95Å; R128-N132 VanDerWaalsContact O-CG 3.32Å; R128-N132 PolarHBondContact O-N 2.84Å; R128-N132 VanDerWaalsContact O-N 3.11Å; R128-N132 PolarHBondContact O-OD1 3.15Å; I129-N132 PolarHBondContact O-N 3.03Å; W130-N132 VanDerWaalsContact C-N 3.3Å; W130-N132 PolarHBondContact O-N 3.22Å; N132-Q135 PolarHBondContact O-N 3.48Å; N132-I136 WeakPolarHBondContact O-CD1 3.49Å; N132-I136 WeakPolarHBondContact O-CG1 3.48Å; N132-I136 PolarHBondContact O-N 3.17Å
133	V	94.6	Very high	91.4	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-64.5	-43.3	178.7	168.4	0	0	0	0	110.8	L107 W110 I114 I129 W130 I136 H137 L144	L107-V133 HydrophobicContact CD1-CG1 4.04Å; W110-V133 HydrophobicContact CB-CG2 3.53Å; W110-V133 HydrophobicContact CD2-CG2 3.61Å; W110-V133 HydrophobicContact CE3-CG2 3.52Å; W110-V133 HydrophobicContact CG-CG2 3.64Å; W110-V133 HydrophobicContact CZ3-CG2 4.36Å; I114-V133 HydrophobicContact CD1-CG2 4.37Å; I129-V133 HydrophobicContact CG2-CG2 4.07Å; I129-V133 WeakPolarHBondContact O-CB 3.3Å; I129-V133 WeakPolarHBondContact O-CG2 3.4Å; I129-V133 PolarHBondContact O-N 3.39Å; W130-V133 HydrophobicContact CE3-CB 4.5Å; W130-V133 HydrophobicContact CE3-CG1 4.35Å; W130-V133 HydrophobicContact CZ3-CG1 4.4Å; W130-V133 PolarHBondContact O-N 2.92Å; W130-V133 VanDerWaalsContact O-N 3.09Å; V133-I136 PolarHBondContact O-N 3.46Å; V133-H137 WeakPolarHBondContact O-CA 3Å; V133-H137 WeakPolarHBondContact O-CB 3.36Å; V133-H137 PolarHBondContact O-N 2.84Å; V133-L144 HydrophobicContact CG1-CD1 3.94Å
134	L	93.7	Very high	91.8	Very high	9 Å²	9	58.6 Å²	58.6	5%	0.047	28%	0.276	C	S	.	.	H	α-helix	trans	-68.8	-35.6	179.4	-66.1	172.4	0	0	0	111.7	W130 N131 I136 G138 L144 W145 A148 L244	W130-L134 WeakPolarHBondContact O-CB 3.32Å; W130-L134 VanDerWaalsContact O-CG 3.24Å; W130-L134 WeakPolarHBondContact O-CG 3.34Å; W130-L134 PolarHBondContact O-N 3.24Å; N131-L134 PolarHBondContact O-N 3.46Å; L134-I136 VanDerWaalsContact C-N 3.28Å; L134-I136 PolarHBondContact O-N 3.04Å; L134-G138 WeakPolarHBondContact O-CA 3.24Å; L134-G138 PolarHBondContact O-N 2.78Å; L134-L144 HydrophobicContact CD2-CB 3.85Å; L134-W145 HydrophobicContact CB-CH2 3.96Å; L134-W145 HydrophobicContact CB-CZ2 4.04Å; L134-W145 HydrophobicContact CB-CZ3 4.29Å; L134-W145 HydrophobicContact CD1-CD2 4.35Å; L134-W145 HydrophobicContact CD1-CE3 3.76Å; L134-W145 HydrophobicContact CD1-CH2 4.29Å; L134-W145 HydrophobicContact CD1-CZ3 3.77Å; L134-W145 HydrophobicContact CD2-CD2 3.68Å; L134-W145 HydrophobicContact CD2-CE3 3.97Å; L134-W145 HydrophobicContact CD2-CG 3.94Å; L134-W145 HydrophobicContact CD2-CZ2 4.31Å; L134-W145 HydrophobicContact CD2-CZ3 4.45Å; L134-W145 HydrophobicContact CG-CD2 4.46Å; L134-W145 HydrophobicContact CG-CE3 4.33Å; L134-W145 HydrophobicContact CG-CZ3 4.39Å; L134-A148 HydrophobicContact CD1-CB 3.85Å; L134-L244 HydrophobicContact CD1-CD2 3.74Å
135	Q	92.2	Very high	92.2	Very high	159 Å²	159	54 Å²	54	74%	0.743	25%	0.252	S	S	*	.	H	α-helix	trans	-61.3	-35.5	173	-76.3	172.7	-1.1	0	0	113	N131 N132	N131-Q135 VanDerWaalsContact O-CG 3.24Å; N131-Q135 WeakPolarHBondContact O-CG 3.37Å; N131-Q135 PolarHBondContact O-N 2.88Å; N132-Q135 PolarHBondContact O-N 3.48Å
136	I	91	Very high	92.4	Very high	61 Å²	61	54.5 Å²	54.5	31%	0.313	25%	0.253	S	S	.	.	H	α-helix	trans	-91.6	-46.5	-175.9	-61.2	161.9	0	0	0	111.6	Q104 W110 N132 V133 L134	Q104-I136 HydrophobicContact CB-CD1 4.11Å; Q104-I136 HydrophobicContact CB-CG2 4.48Å; Q104-I136 HydrophobicContact CG-CD1 4.21Å; W110-I136 HydrophobicContact CH2-CD1 4.08Å; W110-I136 HydrophobicContact CZ2-CD1 3.51Å; N132-I136 WeakPolarHBondContact O-CD1 3.49Å; N132-I136 WeakPolarHBondContact O-CG1 3.48Å; N132-I136 PolarHBondContact O-N 3.17Å; V133-I136 PolarHBondContact O-N 3.46Å; L134-I136 VanDerWaalsContact C-N 3.28Å; L134-I136 PolarHBondContact O-N 3.04Å
137	H	92.1	Very high	92.5	Very high	17 Å²	17	56.4 Å²	56.4	8%	0.079	27%	0.269	C	S	.	.	H	α-helix	trans	-110.4	-2.7	-170	-65.4	-72.1	0	0	0	113.9	Q104 S105 L107 W110 V133 R139 T140 E141 L144	Q104-H137 PolarHBondContact O-CE1 3.45Å; Q104-H137 PolarHBondContact O-NE2 3.46Å; S105-H137 PolarHBondContact O-CE1 3.09Å; S105-H137 VanDerWaalsContact O-CE1 3.29Å; L107-H137 HydrophobicContact CD1-CB 4.36Å; W110-H137 AromaticContact CD1-NE2 3.88Å; W110-H137 AromaticContact NE1-NE2 3.84Å; V133-H137 WeakPolarHBondContact O-CA 3Å; V133-H137 WeakPolarHBondContact O-CB 3.36Å; V133-H137 PolarHBondContact O-N 2.84Å; H137-R139 VanDerWaalsContact C-N 3.27Å; H137-R139 PolarHBondContact O-N 2.84Å; H137-T140 PolarHBondContact O-N 3.4Å; H137-T140 VanDerWaalsContact O-N 3.09Å; H137-E141 PolarHBondContact O-N 2.92Å; H137-L144 HydrophobicContact CB-CD1 3.49Å; H137-L144 VanDerWaalsContact CB-CD1 3.49Å
138	G	88.8	Confident	92.6	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.01	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-27.4	-172.4	0	0	0	0	0	114.6	L134 W145 N252	L134-G138 WeakPolarHBondContact O-CA 3.24Å; L134-G138 PolarHBondContact O-N 2.78Å; G138-W145 PolarHBondContact O-NE1 3.01Å; G138-N252 PolarHBondContact O-ND2 3.37Å
139	R	88.5	Confident	92.7	Very high	179 Å²	179	48.8 Å²	48.8	68%	0.675	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-29.4	173.9	-169.5	176.4	179.8	83.8	-0.5	112.9	H137 N252	H137-R139 VanDerWaalsContact C-N 3.27Å; H137-R139 PolarHBondContact O-N 2.84Å; R139-N252 PolarHBondContact O-OD1 2.92Å
140	T	89.4	Confident	92.6	Very high	111 Å²	111	50.1 Å²	50.1	68%	0.681	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-40.9	-175.9	-49.4	0	0	0	0	111.7	H137	H137-T140 PolarHBondContact O-N 3.4Å; H137-T140 VanDerWaalsContact O-N 3.09Å
141	E	91.4	Very high	92.5	Very high	62 Å²	62	50.1 Å²	50.1	29%	0.29	25%	0.25	S	S	.	.			trans	-127.1	92.6	-174.2	-173.1	67.9	-146.1	0	0	110.7	H137 R143 L144	H137-E141 PolarHBondContact O-N 2.92Å; E141-R143 HydrophobicContact CG-CB 4.23Å; E141-R143 PolarHBondContact O-N 3.21Å; E141-R143 VanDerWaalsContact O-N 3.1Å; E141-R143 WeakPolarHBondContact OE1-CB 3.11Å; E141-R143 WeakPolarHBondContact OE1-CD 3.47Å; E141-R143 VanDerWaalsContact OE1-CG 3.29Å; E141-R143 WeakPolarHBondContact OE1-CG 3.21Å; E141-R143 IonicContact OE1-NE 3.43Å; E141-R143 IonicContact OE1-NH1 3.8Å; E141-L144 HydrophobicContact CB-CD1 3.84Å; E141-L144 HydrophobicContact CB-CG 3.93Å; E141-L144 HydrophobicContact CG-CD1 4.26Å; E141-L144 HydrophobicContact CG-CG 3.84Å; E141-L144 WeakPolarHBondContact O-CB 3.4Å; E141-L144 PolarHBondContact O-N 3.48Å; E141-L144 VanDerWaalsContact O-N 3.07Å
142	P	91	Very high	92.4	Very high	25 Å²	25	47.6 Å²	47.6	16%	0.162	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-28.5	179.2	-27.1	34.6	0	0	0	113.8	L144 W145 N252 C255 L258	P142-L144 PolarHBondContact O-N 3.37Å; P142-L144 VanDerWaalsContact O-N 3.14Å; P142-W145 WeakPolarHBondContact O-CB 3.49Å; P142-W145 PolarHBondContact O-N 2.84Å; P142-W145 VanDerWaalsContact O-N 3.12Å; P142-N252 HydrophobicContact CB-CB 4.27Å; P142-N252 HydrophobicContact CG-CB 3.86Å; P142-C255 HydrophobicContact CB-CB 3.88Å; P142-C255 WeakPolarHBondContact CB-SG 3.37Å; P142-C255 HydrophobicContact CG-CB 4.05Å; P142-L258 HydrophobicContact CB-CD1 3.96Å; P142-L258 HydrophobicContact CB-CG 4.27Å
143	R	92.4	Very high	92.1	Very high	167 Å²	167	46.1 Å²	46.1	63%	0.63	23%	0.228	S	C	*	.	H	α-helix	trans	-61.2	-22.2	179.2	-59	-174.8	-176.1	147.6	-6.2	113.1	E141 I146 A147 L257	E141-R143 HydrophobicContact CG-CB 4.23Å; E141-R143 PolarHBondContact O-N 3.21Å; E141-R143 VanDerWaalsContact O-N 3.1Å; E141-R143 WeakPolarHBondContact OE1-CB 3.11Å; E141-R143 WeakPolarHBondContact OE1-CD 3.47Å; E141-R143 VanDerWaalsContact OE1-CG 3.29Å; E141-R143 WeakPolarHBondContact OE1-CG 3.21Å; E141-R143 IonicContact OE1-NE 3.43Å; E141-R143 IonicContact OE1-NH1 3.8Å; R143-I146 PolarHBondContact O-N 3.47Å; R143-A147 PolarHBondContact O-N 3.14Å; R143-L257 HydrophobicContact CG-CD2 4.43Å
144	L	94	Very high	91.7	Very high	10 Å²	10	51 Å²	51	5%	0.052	25%	0.25	C	S	.	.	H	α-helix	trans	-67.3	-36.6	176.6	-62.8	175.7	0	0	0	112.2	L107 M111 W130 V133 L134 H137 E141 P142 I146 A147 A148	L107-L144 HydrophobicContact CD1-CD1 3.69Å; L107-L144 HydrophobicContact CD1-CD2 3.97Å; L107-L144 HydrophobicContact CD1-CG 4.49Å; L107-L144 HydrophobicContact CD2-CD1 4.17Å; L107-L144 HydrophobicContact CD2-CD2 4.19Å; M111-L144 HydrophobicContact SD-CD2 4.36Å; W130-L144 HydrophobicContact CZ3-CB 4.42Å; W130-L144 HydrophobicContact CZ3-CD2 4.16Å; V133-L144 HydrophobicContact CG1-CD1 3.94Å; L134-L144 HydrophobicContact CD2-CB 3.85Å; H137-L144 HydrophobicContact CB-CD1 3.49Å; H137-L144 VanDerWaalsContact CB-CD1 3.49Å; E141-L144 HydrophobicContact CB-CD1 3.84Å; E141-L144 HydrophobicContact CB-CG 3.93Å; E141-L144 HydrophobicContact CG-CD1 4.26Å; E141-L144 HydrophobicContact CG-CG 3.84Å; E141-L144 WeakPolarHBondContact O-CB 3.4Å; E141-L144 PolarHBondContact O-N 3.48Å; E141-L144 VanDerWaalsContact O-N 3.07Å; P142-L144 PolarHBondContact O-N 3.37Å; P142-L144 VanDerWaalsContact O-N 3.14Å; L144-I146 VanDerWaalsContact C-N 3.31Å; L144-I146 PolarHBondContact O-N 2.91Å; L144-A147 PolarHBondContact O-N 2.8Å; L144-A148 WeakPolarHBondContact O-CB 3.37Å; L144-A148 PolarHBondContact O-N 3.43Å
145	W	95.7	Very high	91.3	Very high	4 Å²	4	54.2 Å²	54.2	2%	0.015	27%	0.265	C	S	.	.	H	α-helix	trans	-62.4	-41.9	175	-66.6	97.4	0	0	0	111.2	L134 G138 P142 A148 A149 L244 E247 L251 L258	L134-W145 HydrophobicContact CB-CH2 3.96Å; L134-W145 HydrophobicContact CB-CZ2 4.04Å; L134-W145 HydrophobicContact CB-CZ3 4.29Å; L134-W145 HydrophobicContact CD1-CD2 4.35Å; L134-W145 HydrophobicContact CD1-CE3 3.76Å; L134-W145 HydrophobicContact CD1-CH2 4.29Å; L134-W145 HydrophobicContact CD1-CZ3 3.77Å; L134-W145 HydrophobicContact CD2-CD2 3.68Å; L134-W145 HydrophobicContact CD2-CE3 3.97Å; L134-W145 HydrophobicContact CD2-CG 3.94Å; L134-W145 HydrophobicContact CD2-CZ2 4.31Å; L134-W145 HydrophobicContact CD2-CZ3 4.45Å; L134-W145 HydrophobicContact CG-CD2 4.46Å; L134-W145 HydrophobicContact CG-CE3 4.33Å; L134-W145 HydrophobicContact CG-CZ3 4.39Å; G138-W145 PolarHBondContact O-NE1 3.01Å; P142-W145 WeakPolarHBondContact O-CB 3.49Å; P142-W145 PolarHBondContact O-N 2.84Å; P142-W145 VanDerWaalsContact O-N 3.12Å; W145-A148 PolarHBondContact O-N 3.44Å; W145-A149 WeakPolarHBondContact O-CB 3.42Å; W145-A149 PolarHBondContact O-N 2.93Å; W145-L244 HydrophobicContact CE3-CB 4.17Å; W145-L244 HydrophobicContact CE3-CD2 4.07Å; W145-L244 HydrophobicContact CZ3-CD2 3.83Å; W145-E247 HydrophobicContact CH2-CB 4.08Å; W145-E247 HydrophobicContact CH2-CG 3.6Å; W145-E247 HydrophobicContact CZ2-CG 4.38Å; W145-E247 HydrophobicContact CZ3-CB 3.85Å; W145-E247 HydrophobicContact CZ3-CG 3.88Å; W145-E247 WeakPolarHBondContact CZ3-OE2 3.4Å; W145-L251 HydrophobicContact CH2-CD1 4.29Å; W145-L251 HydrophobicContact CZ2-CD1 3.51Å; W145-L258 HydrophobicContact CB-CD2 3.81Å
146	I	93.8	Very high	90.8	Very high	23 Å²	23	47.3 Å²	47.3	12%	0.118	24%	0.237	C	C	.	.	H	α-helix	trans	-62.4	-48.4	176	-58.3	172.1	0	0	0	110.3	R143 L144 A148 A149 A150 L257 L258 E261	R143-I146 PolarHBondContact O-N 3.47Å; L144-I146 VanDerWaalsContact C-N 3.31Å; L144-I146 PolarHBondContact O-N 2.91Å; I146-A148 VanDerWaalsContact C-N 3.3Å; I146-A148 PolarHBondContact O-N 2.86Å; I146-A149 PolarHBondContact O-N 3.4Å; I146-A150 VanDerWaalsContact O-CB 3.28Å; I146-A150 WeakPolarHBondContact O-CB 3.26Å; I146-A150 PolarHBondContact O-N 3.17Å; I146-L257 HydrophobicContact CD1-CB 4.09Å; I146-L257 HydrophobicContact CD1-CD2 3.39Å; I146-L257 HydrophobicContact CD1-CG 3.41Å; I146-L257 VanDerWaalsContact CD1-CG 3.41Å; I146-L258 HydrophobicContact CD1-CD2 4.13Å; I146-L258 HydrophobicContact CG1-CD2 3.58Å; I146-E261 HydrophobicContact CB-CG 4.43Å; I146-E261 HydrophobicContact CD1-CG 3.94Å; I146-E261 HydrophobicContact CG1-CB 4.45Å; I146-E261 HydrophobicContact CG1-CG 3.97Å; I146-E261 HydrophobicContact CG2-CG 3.7Å
147	A	94.2	Very high	90.5	Very high	40 Å²	40	44.5 Å²	44.5	33%	0.331	22%	0.223	S	C	.	.	H	α-helix	trans	-63.1	-37.5	179.6	0	0	0	0	0	112.3	W130 R143 L144 Y151	W130-A147 HydrophobicContact CH2-CB 3.58Å; W130-A147 HydrophobicContact CZ2-CB 4.1Å; W130-A147 HydrophobicContact CZ3-CB 4.29Å; R143-A147 PolarHBondContact O-N 3.14Å; L144-A147 PolarHBondContact O-N 2.8Å; A147-Y151 WeakPolarHBondContact O-CB 3.45Å; A147-Y151 PolarHBondContact O-N 2.84Å
148	A	93.9	Very high	90.2	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-66.7	-49.9	174.4	0	0	0	0	0	111.3	W130 L134 L144 W145 I146 A150 Y151 H152 L244	W130-A148 HydrophobicContact CB-CB 4.32Å; W130-A148 HydrophobicContact CD2-CB 3.86Å; W130-A148 HydrophobicContact CE3-CB 3.87Å; W130-A148 HydrophobicContact CG-CB 4.08Å; W130-A148 HydrophobicContact CZ3-CB 4.45Å; L134-A148 HydrophobicContact CD1-CB 3.85Å; L144-A148 WeakPolarHBondContact O-CB 3.37Å; L144-A148 PolarHBondContact O-N 3.43Å; W145-A148 PolarHBondContact O-N 3.44Å; I146-A148 VanDerWaalsContact C-N 3.3Å; I146-A148 PolarHBondContact O-N 2.86Å; A148-A150 PolarHBondContact O-N 3.46Å; A148-Y151 WeakPolarHBondContact O-CA 3.26Å; A148-Y151 WeakPolarHBondContact O-CB 3.16Å; A148-Y151 PolarHBondContact O-N 2.87Å; A148-H152 PolarHBondContact O-CD2 3.21Å; A148-H152 VanDerWaalsContact O-CD2 3.29Å; A148-H152 PolarHBondContact O-N 3.48Å; A148-L244 HydrophobicContact CB-CD1 4.1Å
149	A	94.2	Very high	90	Very high	5 Å²	5	50.6 Å²	50.6	4%	0.041	25%	0.248	C	C	.	.	H	α-helix	trans	-57.4	-47.7	177.1	0	0	0	0	0	111.8	W145 I146 Y151 H152 L153 A241 L244 I245	W145-A149 WeakPolarHBondContact O-CB 3.42Å; W145-A149 PolarHBondContact O-N 2.93Å; I146-A149 PolarHBondContact O-N 3.4Å; A149-Y151 VanDerWaalsContact C-N 3.27Å; A149-Y151 PolarHBondContact O-N 3.47Å; A149-H152 PolarHBondContact O-N 3.13Å; A149-H152 VanDerWaalsContact O-N 3.16Å; A149-L153 PolarHBondContact O-N 2.89Å; A149-A241 HydrophobicContact CB-CB 3.96Å; A149-L244 HydrophobicContact CB-CB 4.46Å; A149-I245 HydrophobicContact CB-CD1 3.98Å; A149-I245 HydrophobicContact CB-CG1 3.77Å
150	A	92.5	Very high	89.8	Confident	37 Å²	37	46.8 Å²	46.8	31%	0.306	24%	0.236	S	C	.	.	H	α-helix	trans	-60	-36.9	175	0	0	0	0	0	112.2	I146 A148 L153 H154	I146-A150 VanDerWaalsContact O-CB 3.28Å; I146-A150 WeakPolarHBondContact O-CB 3.26Å; I146-A150 PolarHBondContact O-N 3.17Å; A148-A150 PolarHBondContact O-N 3.46Å; A150-L153 PolarHBondContact O-N 3.47Å; A150-H154 WeakPolarHBondContact O-CB 3.43Å; A150-H154 PolarHBondContact O-CD2 2.83Å; A150-H154 PolarHBondContact O-N 3.4Å
151	Y	92.6	Very high	89.7	Confident	4 Å²	4	41.5 Å²	41.5	2%	0.016	20%	0.203	C	C	.	.	H	α-helix	trans	-63.9	-44.9	175.3	177.4	-95.3	0	0	0	112.2	K118 H123 V126 V127 W130 A147 A148 A149 L153 H155 G156	K118-Y151 VanDerWaalsContact CE-CD2 3.44Å; K118-Y151 HydrophobicContact CG-CE2 4.22Å; H123-Y151 VanDerWaalsContact CA-OH 3.31Å; H123-Y151 WeakPolarHBondContact CA-OH 3.47Å; H123-Y151 WeakPolarHBondContact CB-OH 3.3Å; H123-Y151 AromaticContact ND1-CZ 3.89Å; H123-Y151 PolarHBondContact ND1-OH 3.29Å; V126-Y151 HydrophobicContact CB-CE1 3.93Å; V126-Y151 HydrophobicContact CB-CE2 4.28Å; V126-Y151 VanDerWaalsContact CB-OH 3.31Å; V126-Y151 WeakPolarHBondContact CB-OH 3.48Å; V126-Y151 HydrophobicContact CG1-CD1 4.05Å; V126-Y151 HydrophobicContact CG1-CD2 4.13Å; V126-Y151 HydrophobicContact CG1-CE1 3.54Å; V126-Y151 HydrophobicContact CG1-CE2 3.62Å; V126-Y151 HydrophobicContact CG1-CG 4.33Å; V127-Y151 HydrophobicContact CG2-CE1 3.94Å; W130-Y151 AromaticContact CD1-CD1 3.81Å; W130-Y151 AromaticContact NE1-CD1 3.83Å; W130-Y151 AromaticContact NE1-CG 3.63Å; A147-Y151 WeakPolarHBondContact O-CB 3.45Å; A147-Y151 PolarHBondContact O-N 2.84Å; A148-Y151 WeakPolarHBondContact O-CA 3.26Å; A148-Y151 WeakPolarHBondContact O-CB 3.16Å; A148-Y151 PolarHBondContact O-N 2.87Å; A149-Y151 VanDerWaalsContact C-N 3.27Å; A149-Y151 PolarHBondContact O-N 3.47Å; Y151-L153 VanDerWaalsContact C-N 3.32Å; Y151-L153 PolarHBondContact O-N 3.36Å; Y151-H155 HydrophobicContact CD2-CB 3.77Å; Y151-H155 AromaticContact CD2-CD2 3.64Å; Y151-H155 HydrophobicContact CE2-CB 3.5Å; Y151-H155 VanDerWaalsContact CE2-CB 3.5Å; Y151-H155 AromaticContact CE2-CG 3.97Å; Y151-H155 HydrophobicContact CG-CB 4.5Å; Y151-H155 PolarHBondContact O-N 2.97Å; Y151-G156 PolarHBondContact O-N 3.09Å
152	H	90.4	Very high	89.5	Confident	15 Å²	15	44.2 Å²	44.2	7%	0.069	21%	0.211	C	C	.	.	I	π-helix	trans	-59.7	-43.4	176.1	-82.6	-105.8	0	0	0	111.2	A148 A149 G156 V157	A148-H152 PolarHBondContact O-CD2 3.21Å; A148-H152 VanDerWaalsContact O-CD2 3.29Å; A148-H152 PolarHBondContact O-N 3.48Å; A149-H152 PolarHBondContact O-N 3.13Å; A149-H152 VanDerWaalsContact O-N 3.16Å; H152-G156 WeakPolarHBondContact O-CA 3.26Å; H152-G156 PolarHBondContact O-N 3.46Å; H152-V157 WeakPolarHBondContact O-CG2 3.36Å; H152-V157 PolarHBondContact O-N 3.31Å
153	L	88.1	Confident	89.2	Confident	39 Å²	39	47.4 Å²	47.4	20%	0.204	22%	0.224	C	C	.	.	I	π-helix	trans	-69.4	-41.3	-178.1	-166.9	65.1	0	0	0	113.8	A149 A150 Y151 V157 I238	A149-L153 PolarHBondContact O-N 2.89Å; A150-L153 PolarHBondContact O-N 3.47Å; Y151-L153 VanDerWaalsContact C-N 3.32Å; Y151-L153 PolarHBondContact O-N 3.36Å; L153-V157 WeakPolarHBondContact O-CG2 3.34Å; L153-I238 HydrophobicContact CD1-CG1 4.44Å
154	H	86	Confident	88.7	Confident	102 Å²	102	43.1 Å²	43.1	47%	0.472	21%	0.214	S	C	.	.	I	π-helix	trans	-97.3	-36.7	-173.1	-64.7	-53.9	0	0	0	115	A150 R158	A150-H154 WeakPolarHBondContact O-CB 3.43Å; A150-H154 PolarHBondContact O-CD2 2.83Å; A150-H154 PolarHBondContact O-N 3.4Å; H154-R158 WeakPolarHBondContact O-CD 3.42Å; H154-R158 WeakPolarHBondContact O-CG 3.24Å; H154-R158 PolarHBondContact O-NH1 2.86Å
155	H	85.5	Confident	88.3	Confident	77 Å²	77	43.1 Å²	43.1	36%	0.356	21%	0.213	S	C	.	.	I	π-helix	trans	-110.5	-40.3	-174.7	-61.6	-71.5	0	0	0	111.7	Y151 R158 S159	Y151-H155 HydrophobicContact CD2-CB 3.77Å; Y151-H155 AromaticContact CD2-CD2 3.64Å; Y151-H155 HydrophobicContact CE2-CB 3.5Å; Y151-H155 VanDerWaalsContact CE2-CB 3.5Å; Y151-H155 AromaticContact CE2-CG 3.97Å; Y151-H155 HydrophobicContact CG-CB 4.5Å; Y151-H155 PolarHBondContact O-N 2.97Å; H155-R158 PolarHBondContact O-N 3.08Å; H155-S159 WeakPolarHBondContact O-CB 3.2Å; H155-S159 PolarHBondContact O-N 3.47Å
156	G	82.2	Confident	87.9	Confident	15 Å²	15	51.5 Å²	51.5	16%	0.155	25%	0.245	C	C	.	.	I	π-helix	trans	-57.8	-51.3	178.1	0	0	0	0	0	112.1	Y151 H152 R158 S159 K160	Y151-G156 PolarHBondContact O-N 3.09Å; H152-G156 WeakPolarHBondContact O-CA 3.26Å; H152-G156 PolarHBondContact O-N 3.46Å; G156-R158 PolarHBondContact O-N 3.39Å; G156-S159 PolarHBondContact O-N 3.43Å; G156-K160 PolarHBondContact O-N 2.89Å
157	V	83.9	Confident	87.4	Confident	2 Å²	2	56.4 Å²	56.4	1%	0.012	27%	0.267	C	S	.	.	H	α-helix	trans	-52.4	-54.4	176.6	-174.3	0	0	0	0	111.5	H152 L153 S159 K160 A161 W230 A233 H234 A237	H152-V157 WeakPolarHBondContact O-CG2 3.36Å; H152-V157 PolarHBondContact O-N 3.31Å; L153-V157 WeakPolarHBondContact O-CG2 3.34Å; V157-S159 VanDerWaalsContact C-N 3.27Å; V157-S159 PolarHBondContact O-N 2.95Å; V157-K160 PolarHBondContact O-N 3.06Å; V157-A161 VanDerWaalsContact O-CB 3.29Å; V157-A161 WeakPolarHBondContact O-CB 3.38Å; V157-A161 PolarHBondContact O-N 3.36Å; V157-W230 HydrophobicContact CG1-CE3 3.91Å; V157-W230 HydrophobicContact CG1-CZ3 3.87Å; V157-A233 HydrophobicContact CG1-CB 3.81Å; V157-H234 HydrophobicContact CG1-CB 4.43Å; V157-A237 HydrophobicContact CB-CB 4.5Å; V157-A237 HydrophobicContact CG2-CB 3.19Å
158	R	85.4	Confident	86.8	Confident	125 Å²	125	56.7 Å²	56.7	47%	0.472	26%	0.261	S	S	.	.	H	α-helix	trans	-63.4	-37.4	-174.9	-57.2	-168.9	168.9	122.8	-14	111.5	H154 H155 G156 R162 W230	H154-R158 WeakPolarHBondContact O-CD 3.42Å; H154-R158 WeakPolarHBondContact O-CG 3.24Å; H154-R158 PolarHBondContact O-NH1 2.86Å; H155-R158 PolarHBondContact O-N 3.08Å; G156-R158 PolarHBondContact O-N 3.39Å; R158-R162 WeakPolarHBondContact O-CB 3.37Å; R158-R162 WeakPolarHBondContact O-CG 3.28Å; R158-R162 PolarHBondContact O-N 3.23Å; R158-R162 PolarHBondContact O-NE 2.97Å; R158-W230 HydrophobicContact CB-CH2 3.77Å; R158-W230 HydrophobicContact CB-CZ3 4.17Å; R158-W230 HydrophobicContact CG-CH2 3.65Å; R158-W230 HydrophobicContact CG-CZ3 3.81Å
159	S	85.1	Confident	86.3	Confident	20 Å²	20	60.1 Å²	60.1	14%	0.14	28%	0.279	C	S	.	.	H	α-helix	trans	-65.2	-52.2	175.6	-172.3	0	0	0	0	112.1	H123 H155 G156 V157 A161 R162 E163	H123-S159 VanDerWaalsContact CB-OG 3.24Å; H123-S159 WeakPolarHBondContact CB-OG 3.46Å; H123-S159 WeakPolarHBondContact CD2-CB 3.47Å; H123-S159 PolarHBondContact CD2-OG 2.8Å; H123-S159 VanDerWaalsContact CG-CB 3.41Å; H123-S159 VanDerWaalsContact CG-OG 3.31Å; H155-S159 WeakPolarHBondContact O-CB 3.2Å; H155-S159 PolarHBondContact O-N 3.47Å; G156-S159 PolarHBondContact O-N 3.43Å; V157-S159 VanDerWaalsContact C-N 3.27Å; V157-S159 PolarHBondContact O-N 2.95Å; S159-A161 VanDerWaalsContact C-N 3.33Å; S159-A161 PolarHBondContact O-N 3.46Å; S159-R162 PolarHBondContact O-N 2.88Å; S159-E163 WeakPolarHBondContact O-CB 3.5Å; S159-E163 PolarHBondContact O-N 2.75Å
160	K	84.8	Confident	86	Confident	99 Å²	99	66.5 Å²	66.5	43%	0.43	31%	0.306	S	S	.	.	H	α-helix	trans	-62.7	-41.5	-177.6	-168.4	173.7	-174.3	179	0	111.1	G156 V157 E163 N164	G156-K160 PolarHBondContact O-N 2.89Å; V157-K160 PolarHBondContact O-N 3.06Å; K160-E163 PolarHBondContact O-N 3.36Å; K160-N164 PolarHBondContact O-N 2.94Å; K160-N164 VanDerWaalsContact O-N 3.12Å; K160-N164 PolarHBondContact O-ND2 3.26Å
161	A	86.3	Confident	85.7	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-60.6	-48.4	174	0	0	0	0	0	111.8	V157 S159 E163 N164 L165 W230 A233	V157-A161 VanDerWaalsContact O-CB 3.29Å; V157-A161 WeakPolarHBondContact O-CB 3.38Å; V157-A161 PolarHBondContact O-N 3.36Å; S159-A161 VanDerWaalsContact C-N 3.33Å; S159-A161 PolarHBondContact O-N 3.46Å; A161-E163 PolarHBondContact O-N 3.37Å; A161-N164 PolarHBondContact O-N 2.83Å; A161-L165 WeakPolarHBondContact O-CB 3.49Å; A161-L165 WeakPolarHBondContact O-CD1 3.47Å; A161-L165 VanDerWaalsContact O-CG 3.25Å; A161-L165 WeakPolarHBondContact O-CG 3.34Å; A161-L165 PolarHBondContact O-N 3.48Å; A161-W230 HydrophobicContact CB-CD2 3.59Å; A161-W230 HydrophobicContact CB-CE3 3.7Å; A161-W230 HydrophobicContact CB-CG 4.18Å; A161-W230 HydrophobicContact CB-CH2 4.07Å; A161-W230 HydrophobicContact CB-CZ2 3.95Å; A161-W230 HydrophobicContact CB-CZ3 3.95Å; A161-A233 HydrophobicContact CB-CB 4.04Å
162	R	86.9	Confident	85.3	Confident	120 Å²	120	72.9 Å²	72.9	45%	0.453	33%	0.328	S	S	.	.	H	α-helix	trans	-62	-41.7	177.5	-76.6	-177.2	-62.2	-140.9	7.1	112.6	H123 R158 S159 L165 R166	H123-R162 PolarHBondContact NE2-NH2 2.98Å; R158-R162 WeakPolarHBondContact O-CB 3.37Å; R158-R162 WeakPolarHBondContact O-CG 3.28Å; R158-R162 PolarHBondContact O-N 3.23Å; R158-R162 PolarHBondContact O-NE 2.97Å; S159-R162 PolarHBondContact O-N 2.88Å; R162-L165 PolarHBondContact O-N 3.29Å; R162-R166 WeakPolarHBondContact O-CG 3.31Å; R162-R166 PolarHBondContact O-N 2.8Å; R162-R166 VanDerWaalsContact O-N 3.1Å
163	E	85	Confident	85.3	Confident	91 Å²	91	74.4 Å²	74.4	43%	0.425	34%	0.341	S	S	.	.	H	α-helix	trans	-58.8	-48.3	177.8	-175.3	168.6	-164.7	0	0	111.6	S159 K160 A161 L165 R166	S159-E163 WeakPolarHBondContact O-CB 3.5Å; S159-E163 PolarHBondContact O-N 2.75Å; K160-E163 PolarHBondContact O-N 3.36Å; A161-E163 PolarHBondContact O-N 3.37Å; E163-L165 PolarHBondContact O-N 2.85Å; E163-R166 WeakPolarHBondContact O-CB 3.28Å; E163-R166 PolarHBondContact O-N 3.4Å
164	N	82	Confident	85.4	Confident	78 Å²	78	75.5 Å²	75.5	42%	0.417	35%	0.347	S	S	.	.	H	α-helix	trans	-63.3	-30.9	176.1	-67.4	-15.8	0	0	0	112.6	K160 A161 T229	K160-N164 PolarHBondContact O-N 2.94Å; K160-N164 VanDerWaalsContact O-N 3.12Å; K160-N164 PolarHBondContact O-ND2 3.26Å; A161-N164 PolarHBondContact O-N 2.83Å; N164-T229 HydrophobicContact CB-CG2 4.25Å
165	L	85.7	Confident	85.4	Confident	9 Å²	9	72.2 Å²	72.2	5%	0.047	33%	0.333	C	S	.	.	H	α-helix	trans	-82.7	-14	-178.7	-71.7	165.6	0	0	0	114.7	A161 R162 E163 H167 F168 D169 R226 T229	A161-L165 WeakPolarHBondContact O-CB 3.49Å; A161-L165 WeakPolarHBondContact O-CD1 3.47Å; A161-L165 VanDerWaalsContact O-CG 3.25Å; A161-L165 WeakPolarHBondContact O-CG 3.34Å; A161-L165 PolarHBondContact O-N 3.48Å; R162-L165 PolarHBondContact O-N 3.29Å; E163-L165 PolarHBondContact O-N 2.85Å; L165-H167 PolarHBondContact O-N 3.21Å; L165-F168 HydrophobicContact CD2-CD2 4.1Å; L165-F168 PolarHBondContact O-N 3.43Å; L165-F168 VanDerWaalsContact O-N 3.1Å; L165-D169 PolarHBondContact O-N 3.19Å; L165-R226 HydrophobicContact CD1-CB 4.44Å; L165-R226 HydrophobicContact CD1-CG 3.83Å; L165-R226 HydrophobicContact CD2-CB 3.93Å; L165-R226 HydrophobicContact CD2-CG 4.23Å; L165-T229 HydrophobicContact CD2-CG2 4.46Å; L165-T229 WeakPolarHBondContact CD2-OG1 3.24Å
166	R	86.4	Confident	85.6	Confident	181 Å²	181	72 Å²	72	68%	0.683	33%	0.334	S	S	*	.	H	α-helix	trans	-56.6	-38	179.9	-76.5	172.9	-174	-116	1.9	113	R162 E163 D169 K170	R162-R166 WeakPolarHBondContact O-CG 3.31Å; R162-R166 PolarHBondContact O-N 2.8Å; R162-R166 VanDerWaalsContact O-N 3.1Å; E163-R166 WeakPolarHBondContact O-CB 3.28Å; E163-R166 PolarHBondContact O-N 3.4Å; R166-D169 PolarHBondContact O-N 3.17Å; R166-K170 WeakPolarHBondContact O-CB 3.49Å; R166-K170 PolarHBondContact O-N 3.21Å
167	H	84.1	Confident	86.1	Confident	126 Å²	126	77 Å²	77	58%	0.583	35%	0.351	S	S	*	.	H	α-helix	trans	-61.1	-47.3	177.9	174.8	-88.6	0	0	0	111.2	L165 K170 Q171	L165-H167 PolarHBondContact O-N 3.21Å; H167-K170 PolarHBondContact O-N 3.23Å; H167-Q171 PolarHBondContact O-N 2.95Å
168	F	81	Confident	86.3	Confident	46 Å²	46	79.7 Å²	79.7	20%	0.202	37%	0.368	C	S	.	.	H	α-helix	trans	-66.9	-41.2	178.8	-66.5	-70.7	0	0	0	112.4	L165 K170 Q171 K172 M222 E225	L165-F168 HydrophobicContact CD2-CD2 4.1Å; L165-F168 PolarHBondContact O-N 3.43Å; L165-F168 VanDerWaalsContact O-N 3.1Å; F168-K170 VanDerWaalsContact C-N 3.28Å; F168-K170 PolarHBondContact O-N 3.39Å; F168-Q171 PolarHBondContact O-N 2.88Å; F168-K172 WeakPolarHBondContact O-CB 3.18Å; F168-K172 PolarHBondContact O-N 2.93Å; F168-M222 HydrophobicContact CB-CE 4.06Å; F168-M222 HydrophobicContact CB-CG 4.14Å; F168-M222 HydrophobicContact CD1-CG 4.45Å; F168-E225 HydrophobicContact CE1-CB 4.31Å; F168-E225 HydrophobicContact CE1-CG 4.15Å; F168-E225 HydrophobicContact CE2-CB 4.12Å; F168-E225 HydrophobicContact CE2-CG 4.48Å; F168-E225 HydrophobicContact CZ-CB 3.9Å; F168-E225 HydrophobicContact CZ-CG 3.81Å
169	D	84.3	Confident	86.5	Confident	72 Å²	72	78.8 Å²	78.8	39%	0.385	36%	0.364	S	S	.	.	H	α-helix	trans	-63.9	-36.2	175.9	-69.5	-27.5	0	0	0	111.4	L165 R166 S173 R226	L165-D169 PolarHBondContact O-N 3.19Å; R166-D169 PolarHBondContact O-N 3.17Å; D169-S173 WeakPolarHBondContact O-CB 3.4Å; D169-S173 PolarHBondContact O-N 3.4Å; D169-R226 IonicContact OD1-NH2 3.27Å; D169-R226 PolarHBondContact OD1-NH2 3Å
170	K	87.8	Confident	86.8	Confident	139 Å²	139	85.3 Å²	85.3	60%	0.604	39%	0.39	S	S	*	.	H	α-helix	trans	-66.2	-48.9	173.4	-173.1	-177.9	177.1	-171.1	0	111.6	R166 H167 F168 K172 S173 D174	R166-K170 WeakPolarHBondContact O-CB 3.49Å; R166-K170 PolarHBondContact O-N 3.21Å; H167-K170 PolarHBondContact O-N 3.23Å; F168-K170 VanDerWaalsContact C-N 3.28Å; F168-K170 PolarHBondContact O-N 3.39Å; K170-K172 VanDerWaalsContact C-N 3.29Å; K170-K172 PolarHBondContact O-N 3.11Å; K170-S173 WeakPolarHBondContact O-CB 3.41Å; K170-S173 PolarHBondContact O-N 3.4Å; K170-S173 VanDerWaalsContact O-N 3.11Å; K170-D174 VanDerWaalsContact O-CG 3.3Å; K170-D174 PolarHBondContact O-N 2.95Å
171	Q	86	Confident	87	Confident	82 Å²	82	88.4 Å²	88.4	38%	0.383	40%	0.399	S	S	.	.	H	α-helix	trans	-54.8	-45.7	176.2	-175.5	-176.7	5	0	0	111.3	H167 F168 D174 L175	H167-Q171 PolarHBondContact O-N 2.95Å; F168-Q171 PolarHBondContact O-N 2.88Å; Q171-D174 PolarHBondContact O-N 2.91Å; Q171-L175 WeakPolarHBondContact O-CG 3.31Å; Q171-L175 PolarHBondContact O-N 2.68Å
172	K	85.2	Confident	87.1	Confident	92 Å²	92	89 Å²	89	40%	0.4	40%	0.402	S	S	.	.	H	α-helix	trans	-61.9	-46.7	174.9	-174.2	179.8	178.5	176.8	0	112.6	F168 K170 D174 L175 L176 M222	F168-K172 WeakPolarHBondContact O-CB 3.18Å; F168-K172 PolarHBondContact O-N 2.93Å; K170-K172 VanDerWaalsContact C-N 3.29Å; K170-K172 PolarHBondContact O-N 3.11Å; K172-D174 VanDerWaalsContact C-N 3.26Å; K172-D174 PolarHBondContact O-N 3.2Å; K172-L175 PolarHBondContact O-N 2.99Å; K172-L176 HydrophobicContact CG-CD1 4.28Å; K172-L176 WeakPolarHBondContact O-CG 3.48Å; K172-L176 PolarHBondContact O-N 3.41Å; K172-M222 HydrophobicContact CB-CE 3.95Å; K172-M222 HydrophobicContact CB-SD 3.61Å; K172-M222 HydrophobicContact CD-CE 3.81Å; K172-M222 HydrophobicContact CD-SD 3.73Å; K172-M222 HydrophobicContact CG-CE 4.47Å; K172-M222 HydrophobicContact CG-SD 4.03Å
173	S	89.4	Confident	87.1	Confident	48 Å²	48	87.2 Å²	87.2	34%	0.336	40%	0.401	S	S	.	.	H	α-helix	trans	-57.9	-41.9	177.1	160.9	0	0	0	0	111.2	D169 K170 L176 K177	D169-S173 WeakPolarHBondContact O-CB 3.4Å; D169-S173 PolarHBondContact O-N 3.4Å; K170-S173 WeakPolarHBondContact O-CB 3.41Å; K170-S173 PolarHBondContact O-N 3.4Å; K170-S173 VanDerWaalsContact O-N 3.11Å; S173-L176 PolarHBondContact O-N 2.88Å; S173-K177 WeakPolarHBondContact O-CG 3.28Å; S173-K177 PolarHBondContact O-N 3.33Å; S173-K177 WeakPolarHBondContact OG-CE 3.27Å
174	D	90.3	Very high	87.2	Confident	61 Å²	61	85.7 Å²	85.7	33%	0.326	40%	0.401	S	S	.	.	H	α-helix	trans	-70.8	-40	-177.7	-66.1	-22	0	0	0	111.4	K170 Q171 K172 L176 K177 T178	K170-D174 VanDerWaalsContact O-CG 3.3Å; K170-D174 PolarHBondContact O-N 2.95Å; Q171-D174 PolarHBondContact O-N 2.91Å; K172-D174 VanDerWaalsContact C-N 3.26Å; K172-D174 PolarHBondContact O-N 3.2Å; D174-L176 VanDerWaalsContact C-N 3.3Å; D174-L176 PolarHBondContact O-N 3.14Å; D174-K177 WeakPolarHBondContact O-CB 3.48Å; D174-K177 PolarHBondContact O-N 3.32Å; D174-K177 VanDerWaalsContact O-N 3.12Å; D174-K177 IonicContact OD1-NZ 3.91Å; D174-K177 PolarHBondContact OD1-NZ 3.42Å; D174-T178 PolarHBondContact O-N 2.87Å
175	L	86	Confident	87.3	Confident	33 Å²	33	84.8 Å²	84.8	17%	0.173	39%	0.394	C	S	.	.	H	α-helix	trans	-62.8	-33.6	170.6	-68.3	173.7	0	0	0	113.3	Q171 K172 K177 T178 R179 L215 A218	Q171-L175 WeakPolarHBondContact O-CG 3.31Å; Q171-L175 PolarHBondContact O-N 2.68Å; K172-L175 PolarHBondContact O-N 2.99Å; L175-K177 VanDerWaalsContact C-N 3.34Å; L175-T178 WeakPolarHBondContact CA-OG1 3.4Å; L175-T178 PolarHBondContact O-OG1 2.82Å; L175-R179 WeakPolarHBondContact O-CB 3Å; L175-R179 PolarHBondContact O-N 3.47Å; L175-R179 VanDerWaalsContact O-N 3.11Å; L175-L215 HydrophobicContact CB-CD2 3.34Å; L175-L215 HydrophobicContact CB-CG 3.94Å; L175-L215 HydrophobicContact CD1-CD2 4.05Å; L175-L215 HydrophobicContact CD1-CG 4.48Å; L175-L215 HydrophobicContact CG-CD2 4.33Å; L175-A218 HydrophobicContact CD1-CB 3.86Å
176	L	89.6	Confident	87.1	Confident	73 Å²	73	87.3 Å²	87.3	38%	0.382	40%	0.403	S	S	.	.	H	α-helix	trans	-70.6	-31.9	174.3	-73.3	172.5	0	0	0	112.1	K172 S173 D174 K180 L215	K172-L176 HydrophobicContact CG-CD1 4.28Å; K172-L176 WeakPolarHBondContact O-CG 3.48Å; K172-L176 PolarHBondContact O-N 3.41Å; S173-L176 PolarHBondContact O-N 2.88Å; D174-L176 VanDerWaalsContact C-N 3.3Å; D174-L176 PolarHBondContact O-N 3.14Å; L176-K180 WeakPolarHBondContact O-CG 3.5Å; L176-K180 PolarHBondContact O-N 3.04Å; L176-K180 VanDerWaalsContact O-N 3.17Å; L176-L215 HydrophobicContact CD2-CD2 4.23Å; L176-L215 HydrophobicContact CG-CD2 4.34Å
177	K	92.1	Very high	86.9	Confident	120 Å²	120	83.2 Å²	83.2	52%	0.522	39%	0.393	S	S	.	.	H	α-helix	trans	-70.9	-43.9	174.2	-69.5	169.4	-166.8	159.7	0	111.5	S173 D174 L175 R179 K180 R181	S173-K177 WeakPolarHBondContact O-CG 3.28Å; S173-K177 PolarHBondContact O-N 3.33Å; S173-K177 WeakPolarHBondContact OG-CE 3.27Å; D174-K177 WeakPolarHBondContact O-CB 3.48Å; D174-K177 PolarHBondContact O-N 3.32Å; D174-K177 VanDerWaalsContact O-N 3.12Å; D174-K177 IonicContact OD1-NZ 3.91Å; D174-K177 PolarHBondContact OD1-NZ 3.42Å; L175-K177 VanDerWaalsContact C-N 3.34Å; K177-R179 VanDerWaalsContact C-N 3.33Å; K177-R179 PolarHBondContact O-N 3.02Å; K177-K180 PolarHBondContact O-N 2.91Å; K177-R181 PolarHBondContact O-N 3.36Å
178	T	88.7	Confident	86.8	Confident	58 Å²	58	81.9 Å²	81.9	36%	0.356	39%	0.389	S	S	.	.	H	α-helix	trans	-59.9	-45	176.8	56.9	0	0	0	0	110.7	D174 L175 K180 R181 L182	D174-T178 PolarHBondContact O-N 2.87Å; L175-T178 WeakPolarHBondContact CA-OG1 3.4Å; L175-T178 PolarHBondContact O-OG1 2.82Å; T178-K180 PolarHBondContact O-N 3.48Å; T178-R181 WeakPolarHBondContact O-CB 3.49Å; T178-R181 PolarHBondContact O-N 2.91Å; T178-L182 WeakPolarHBondContact O-CG 3.32Å; T178-L182 PolarHBondContact O-N 3.2Å
179	R	89.1	Confident	86.4	Confident	107 Å²	107	81.2 Å²	81.2	40%	0.404	39%	0.388	S	S	.	.	H	α-helix	trans	-57	-45.9	174	-178.7	-178.3	179.2	160.1	10.3	113.2	L175 K177 R181 L182 L183 L215	L175-R179 WeakPolarHBondContact O-CB 3Å; L175-R179 PolarHBondContact O-N 3.47Å; L175-R179 VanDerWaalsContact O-N 3.11Å; K177-R179 VanDerWaalsContact C-N 3.33Å; K177-R179 PolarHBondContact O-N 3.02Å; R179-R181 VanDerWaalsContact C-N 3.32Å; R179-R181 PolarHBondContact O-N 3.36Å; R179-L182 PolarHBondContact O-N 3.28Å; R179-L183 WeakPolarHBondContact O-CB 3.46Å; R179-L183 PolarHBondContact O-N 3.17Å; R179-L215 HydrophobicContact CB-CD1 4.23Å
180	K	91.4	Very high	85.9	Confident	156 Å²	156	82.6 Å²	82.6	68%	0.678	40%	0.395	S	S	*	.	H	α-helix	trans	-62.4	-40.5	178.6	-77	179.6	-179.5	-171.6	0	111.8	L176 K177 T178 L183 S184	L176-K180 WeakPolarHBondContact O-CG 3.5Å; L176-K180 PolarHBondContact O-N 3.04Å; L176-K180 VanDerWaalsContact O-N 3.17Å; K177-K180 PolarHBondContact O-N 2.91Å; T178-K180 PolarHBondContact O-N 3.48Å; K180-L183 PolarHBondContact O-N 3.48Å; K180-S184 PolarHBondContact O-N 3.1Å; K180-S184 PolarHBondContact O-OG 3.03Å
181	R	90.7	Very high	85.1	Confident	165 Å²	165	84.9 Å²	84.9	62%	0.623	40%	0.399	S	S	*	.	H	α-helix	trans	-61.7	-51.4	176	177.7	-177.7	171.4	-172.1	-5.1	111.3	K177 T178 R179 L183 S184 E185	K177-R181 PolarHBondContact O-N 3.36Å; T178-R181 WeakPolarHBondContact O-CB 3.49Å; T178-R181 PolarHBondContact O-N 2.91Å; R179-R181 VanDerWaalsContact C-N 3.32Å; R179-R181 PolarHBondContact O-N 3.36Å; R181-L183 VanDerWaalsContact C-N 3.28Å; R181-L183 PolarHBondContact O-N 3.19Å; R181-S184 PolarHBondContact O-N 3.47Å; R181-S184 PolarHBondContact O-OG 3.47Å; R181-E185 WeakPolarHBondContact CG-OE1 3.47Å; R181-E185 IonicContact CZ-OE1 2.77Å; R181-E185 IonicContact NE-OE1 3.34Å; R181-E185 PolarHBondContact NE-OE1 3.4Å; R181-E185 IonicContact NH2-OE1 3.62Å; R181-E185 PolarHBondContact NH2-OE1 3.36Å; R181-E185 VanDerWaalsContact NH2-OE1 3.15Å; R181-E185 PolarHBondContact O-N 3.33Å
182	L	86.7	Confident	84.1	Confident	12 Å²	12	86.9 Å²	86.9	6%	0.063	41%	0.409	C	S	.	.	H	α-helix	trans	-61	-38.5	178.9	-69.7	173.4	0	0	0	112.2	T178 R179 S184 E185 Y186 L204 E207 L208 N211	T178-L182 WeakPolarHBondContact O-CG 3.32Å; T178-L182 PolarHBondContact O-N 3.2Å; R179-L182 PolarHBondContact O-N 3.28Å; L182-S184 VanDerWaalsContact C-N 3.33Å; L182-S184 PolarHBondContact O-N 3.38Å; L182-E185 PolarHBondContact O-N 2.85Å; L182-Y186 VanDerWaalsContact O-CB 3.28Å; L182-Y186 WeakPolarHBondContact O-CB 3.25Å; L182-Y186 PolarHBondContact O-N 3.04Å; L182-L204 HydrophobicContact CD2-CD2 3.76Å; L182-E207 HydrophobicContact CD1-CB 4.3Å; L182-E207 HydrophobicContact CD2-CB 4.49Å; L182-E207 WeakPolarHBondContact CD2-OE2 3.32Å; L182-L208 HydrophobicContact CB-CD2 3.38Å; L182-L208 HydrophobicContact CB-CG 3.82Å; L182-L208 HydrophobicContact CD1-CD2 4.12Å; L182-L208 HydrophobicContact CD1-CG 4.42Å; L182-L208 HydrophobicContact CG-CD2 4.41Å; L182-N211 HydrophobicContact CD1-CB 4.41Å; L182-N211 WeakPolarHBondContact CD1-ND2 3.22Å
183	L	87.8	Confident	83.2	Confident	83 Å²	83	86.4 Å²	86.4	44%	0.435	42%	0.422	S	S	.	.	H	α-helix	trans	-64.4	-37.4	174.8	-173.9	64.3	0	0	0	112	R179 K180 R181 M187	R179-L183 WeakPolarHBondContact O-CB 3.46Å; R179-L183 PolarHBondContact O-N 3.17Å; K180-L183 PolarHBondContact O-N 3.48Å; R181-L183 VanDerWaalsContact C-N 3.28Å; R181-L183 PolarHBondContact O-N 3.19Å; L183-M187 WeakPolarHBondContact O-CB 3.43Å; L183-M187 WeakPolarHBondContact O-CG 3.41Å; L183-M187 PolarHBondContact O-N 3.41Å
184	S	87.4	Confident	82.3	Confident	59 Å²	59	87.5 Å²	87.5	41%	0.413	43%	0.43	S	S	.	.	H	α-helix	trans	-70.3	-38.5	175.7	58.7	0	0	0	0	113.2	K180 R181 L182 M187 I188	K180-S184 PolarHBondContact O-N 3.1Å; K180-S184 PolarHBondContact O-OG 3.03Å; R181-S184 PolarHBondContact O-N 3.47Å; R181-S184 PolarHBondContact O-OG 3.47Å; L182-S184 VanDerWaalsContact C-N 3.33Å; L182-S184 PolarHBondContact O-N 3.38Å; S184-M187 PolarHBondContact O-N 2.86Å; S184-I188 WeakPolarHBondContact O-CD1 3.29Å; S184-I188 VanDerWaalsContact O-CG1 3.31Å; S184-I188 WeakPolarHBondContact O-CG1 3.36Å; S184-I188 PolarHBondContact O-N 3.42Å; S184-I188 VanDerWaalsContact O-N 3.16Å
185	E	83.2	Confident	81.2	Confident	58 Å²	58	93.3 Å²	93.3	27%	0.271	45%	0.452	S	S	.	.	H	α-helix	trans	-65.6	-45.1	176.3	-72.3	168.1	178	0	0	110.3	R181 L182 M187 I188 L189 L204	R181-E185 WeakPolarHBondContact CG-OE1 3.47Å; R181-E185 IonicContact CZ-OE1 2.77Å; R181-E185 IonicContact NE-OE1 3.34Å; R181-E185 PolarHBondContact NE-OE1 3.4Å; R181-E185 IonicContact NH2-OE1 3.62Å; R181-E185 PolarHBondContact NH2-OE1 3.36Å; R181-E185 VanDerWaalsContact NH2-OE1 3.15Å; R181-E185 PolarHBondContact O-N 3.33Å; L182-E185 PolarHBondContact O-N 2.85Å; E185-M187 PolarHBondContact O-N 3Å; E185-I188 PolarHBondContact O-N 3.32Å; E185-L189 PolarHBondContact O-N 3.05Å; E185-L189 VanDerWaalsContact O-N 3.12Å; E185-L204 HydrophobicContact CB-CD1 4.26Å
186	Y	81.7	Confident	80.2	Confident	63 Å²	63	94.9 Å²	94.9	25%	0.247	47%	0.469	C	S	.	.	H	α-helix	trans	-55.6	-47.4	171.8	175.9	-101	0	0	0	112.4	L182 I188 L189 D190 I201 M205 L208	L182-Y186 VanDerWaalsContact O-CB 3.28Å; L182-Y186 WeakPolarHBondContact O-CB 3.25Å; L182-Y186 PolarHBondContact O-N 3.04Å; Y186-I188 VanDerWaalsContact C-N 3.27Å; Y186-I188 PolarHBondContact O-N 3.46Å; Y186-L189 PolarHBondContact O-N 3.37Å; Y186-D190 WeakPolarHBondContact O-CB 3.46Å; Y186-D190 PolarHBondContact O-N 3.16Å; Y186-I201 HydrophobicContact CD2-CG2 4.36Å; Y186-I201 HydrophobicContact CE2-CG2 4Å; Y186-M205 HydrophobicContact CD2-CG 4.24Å; Y186-M205 HydrophobicContact CE2-CG 3.86Å; Y186-M205 HydrophobicContact CE2-SD 4.2Å; Y186-L208 HydrophobicContact CG-CD1 4.42Å
187	M	82.1	Confident	79.2	Confident	95 Å²	95	94 Å²	94	47%	0.468	46%	0.463	S	S	.	.	H	α-helix	trans	-65.7	-23.1	179.8	-75.5	-76.9	-163.5	0	0	114.5	L183 S184 E185 R191	L183-M187 WeakPolarHBondContact O-CB 3.43Å; L183-M187 WeakPolarHBondContact O-CG 3.41Å; L183-M187 PolarHBondContact O-N 3.41Å; S184-M187 PolarHBondContact O-N 2.86Å; E185-M187 PolarHBondContact O-N 3Å; M187-R191 PolarHBondContact O-NE 2.95Å
188	I	81.3	Confident	78.3	Confident	98 Å²	98	94.4 Å²	94.4	50%	0.503	47%	0.465	S	S	.	.	H	α-helix	trans	-82	-45.9	176.9	-68.9	163.8	0	0	0	109.8	S184 E185 Y186 D190 R191	S184-I188 WeakPolarHBondContact O-CD1 3.29Å; S184-I188 VanDerWaalsContact O-CG1 3.31Å; S184-I188 WeakPolarHBondContact O-CG1 3.36Å; S184-I188 PolarHBondContact O-N 3.42Å; S184-I188 VanDerWaalsContact O-N 3.16Å; E185-I188 PolarHBondContact O-N 3.32Å; Y186-I188 VanDerWaalsContact C-N 3.27Å; Y186-I188 PolarHBondContact O-N 3.46Å; I188-D190 VanDerWaalsContact C-N 3.34Å; I188-D190 PolarHBondContact O-N 3.45Å; I188-R191 WeakPolarHBondContact O-CB 3.43Å; I188-R191 PolarHBondContact O-N 3.27Å
189	L	73.1	Confident	77.7	Confident	32 Å²	32	98.3 Å²	98.3	17%	0.168	48%	0.48	C	S	.	.	H	α-helix	trans	-67.2	-33.3	179.6	-72.3	164.4	0	0	0	112.5	E185 Y186 R191 H192 E197 I201 L204	E185-L189 PolarHBondContact O-N 3.05Å; E185-L189 VanDerWaalsContact O-N 3.12Å; Y186-L189 PolarHBondContact O-N 3.37Å; L189-R191 PolarHBondContact O-N 3.33Å; L189-R191 VanDerWaalsContact O-N 3.13Å; L189-H192 CarbonylContact O-C 3.59Å; L189-H192 PolarHBondContact O-N 2.88Å; L189-E197 HydrophobicContact CD2-CB 4.49Å; L189-E197 HydrophobicContact CD2-CG 4.3Å; L189-I201 HydrophobicContact CB-CD1 4.23Å; L189-I201 HydrophobicContact CB-CG1 3.82Å; L189-L204 HydrophobicContact CD1-CD1 3.27Å
190	D	74	Confident	77.2	Confident	100 Å²	100	98 Å²	98	54%	0.535	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-22.4	174.8	-162.4	41.4	0	0	0	112.9	Y186 I188	Y186-D190 WeakPolarHBondContact O-CB 3.46Å; Y186-D190 PolarHBondContact O-N 3.16Å; I188-D190 VanDerWaalsContact C-N 3.34Å; I188-D190 PolarHBondContact O-N 3.45Å
191	R	71.9	Confident	76.6	Confident	187 Å²	187	91.6 Å²	91.6	71%	0.706	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-25.5	178	-62.4	179.9	-158.5	166.9	3.2	114.3	M187 I188 L189	M187-R191 PolarHBondContact O-NE 2.95Å; I188-R191 WeakPolarHBondContact O-CB 3.43Å; I188-R191 PolarHBondContact O-N 3.27Å; L189-R191 PolarHBondContact O-N 3.33Å; L189-R191 VanDerWaalsContact O-N 3.13Å
192	H	64.4	Low	76.3	Confident	125 Å²	125	88.6 Å²	88.6	58%	0.579	45%	0.452	S	S	*	.	S	Bend	trans	-122.1	96.4	-177.5	-62.2	-72	0	0	0	106.9	L189 E197	L189-H192 CarbonylContact O-C 3.59Å; L189-H192 PolarHBondContact O-N 2.88Å; H192-E197 VanDerWaalsContact O-CD 3.26Å
193	A	67	Low	76.2	Confident	81 Å²	81	94 Å²	94	67%	0.669	48%	0.477	S	S	*	.			trans	-114.9	87.2	-167	0	0	0	0	0	112.7
194	S	70.3	Confident	76.1	Confident	72 Å²	72	91 Å²	91	50%	0.503	46%	0.461	S	S	.	.			trans	-94.7	167.6	164.3	-172.5	0	0	0	0	110.9	A196 E197 K198	S194-A196 PolarHBondContact O-N 3.23Å; S194-E197 WeakPolarHBondContact CA-OE2 3.41Å; S194-E197 WeakPolarHBondContact CB-OE2 3.39Å; S194-E197 PolarHBondContact N-OE2 3.24Å; S194-E197 PolarHBondContact O-N 3.45Å; S194-K198 PolarHBondContact O-N 3.38Å
195	K	67	Low	75.9	Confident	182 Å²	182	91.5 Å²	91.5	79%	0.791	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-34.6	-175.9	-71.7	-179	-179.4	176.3	0	113.7	K198	K195-K198 PolarHBondContact O-N 3.41Å
196	A	65.7	Low	76.2	Confident	66 Å²	66	93.4 Å²	93.4	55%	0.545	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-37.9	175.7	0	0	0	0	0	111.5	S194 K198 Q199	S194-A196 PolarHBondContact O-N 3.23Å; A196-K198 PolarHBondContact O-N 3.46Å; A196-Q199 PolarHBondContact O-N 3.12Å
197	E	68.4	Low	76.5	Confident	54 Å²	54	94.8 Å²	94.8	25%	0.252	48%	0.476	S	S	.	.	H	α-helix	trans	-67.7	-21.7	-179.7	-67.4	160.8	159	0	0	112.4	L189 H192 S194 Q199 E200 I201	L189-E197 HydrophobicContact CD2-CB 4.49Å; L189-E197 HydrophobicContact CD2-CG 4.3Å; H192-E197 VanDerWaalsContact O-CD 3.26Å; S194-E197 WeakPolarHBondContact CA-OE2 3.41Å; S194-E197 WeakPolarHBondContact CB-OE2 3.39Å; S194-E197 PolarHBondContact N-OE2 3.24Å; S194-E197 PolarHBondContact O-N 3.45Å; E197-Q199 VanDerWaalsContact C-N 3.31Å; E197-Q199 PolarHBondContact O-N 3.04Å; E197-E200 PolarHBondContact O-N 2.96Å; E197-I201 WeakPolarHBondContact O-CB 3.48Å; E197-I201 WeakPolarHBondContact O-CG1 3.13Å; E197-I201 PolarHBondContact O-N 3.1Å
198	K	72	Confident	76.7	Confident	129 Å²	129	92 Å²	92	56%	0.561	46%	0.462	S	S	*	.	H	α-helix	trans	-63.9	-33.4	173.2	-68	-174.8	179.4	-174.6	0	113.4	S194 K195 A196 N202	S194-K198 PolarHBondContact O-N 3.38Å; K195-K198 PolarHBondContact O-N 3.41Å; A196-K198 PolarHBondContact O-N 3.46Å; K198-N202 PolarHBondContact O-N 3.32Å; K198-N202 PolarHBondContact O-ND2 2.94Å
199	Q	76.8	Confident	77.1	Confident	141 Å²	141	92.5 Å²	92.5	66%	0.659	46%	0.461	S	S	*	.	H	α-helix	trans	-69.5	-46.3	176.1	-71.5	-179.7	-20.9	0	0	109.9	A196 E197 I201 N202 E203	A196-Q199 PolarHBondContact O-N 3.12Å; E197-Q199 VanDerWaalsContact C-N 3.31Å; E197-Q199 PolarHBondContact O-N 3.04Å; Q199-I201 VanDerWaalsContact C-N 3.34Å; Q199-I201 PolarHBondContact O-N 3.23Å; Q199-N202 PolarHBondContact O-N 3.18Å; Q199-E203 WeakPolarHBondContact O-CG 3.34Å; Q199-E203 PolarHBondContact O-N 3.34Å
200	E	78.8	Confident	77.8	Confident	99 Å²	99	97 Å²	97	46%	0.463	48%	0.481	S	S	.	.	H	α-helix	trans	-60.4	-40.5	175.6	-62.7	-179.8	178.7	0	0	112.3	E197 N202 E203 L204	E197-E200 PolarHBondContact O-N 2.96Å; E200-N202 PolarHBondContact O-N 3.42Å; E200-E203 PolarHBondContact O-N 2.97Å; E200-L204 WeakPolarHBondContact O-CG 3.32Å; E200-L204 PolarHBondContact O-N 3.37Å
201	I	79.4	Confident	78.4	Confident	22 Å²	22	93.8 Å²	93.8	11%	0.113	46%	0.464	C	S	.	.	H	α-helix	trans	-61.6	-43.7	175.2	-71.5	165	0	0	0	111.2	Y186 L189 E197 Q199 L204 M205	Y186-I201 HydrophobicContact CD2-CG2 4.36Å; Y186-I201 HydrophobicContact CE2-CG2 4Å; L189-I201 HydrophobicContact CB-CD1 4.23Å; L189-I201 HydrophobicContact CB-CG1 3.82Å; E197-I201 WeakPolarHBondContact O-CB 3.48Å; E197-I201 WeakPolarHBondContact O-CG1 3.13Å; E197-I201 PolarHBondContact O-N 3.1Å; Q199-I201 VanDerWaalsContact C-N 3.34Å; Q199-I201 PolarHBondContact O-N 3.23Å; I201-L204 PolarHBondContact O-N 2.98Å; I201-M205 HydrophobicContact CG2-CG 4.45Å; I201-M205 HydrophobicContact CG2-SD 4.25Å; I201-M205 WeakPolarHBondContact O-CB 3.34Å; I201-M205 VanDerWaalsContact O-CG 3.31Å; I201-M205 WeakPolarHBondContact O-CG 3.28Å; I201-M205 PolarHBondContact O-N 2.9Å
202	N	83.6	Confident	79.1	Confident	102 Å²	102	87.6 Å²	87.6	55%	0.545	44%	0.443	S	S	.	.	H	α-helix	trans	-65.1	-41.1	178.6	-77.9	-22.1	0	0	0	111.7	K198 Q199 E200 M205 E206	K198-N202 PolarHBondContact O-N 3.32Å; K198-N202 PolarHBondContact O-ND2 2.94Å; Q199-N202 PolarHBondContact O-N 3.18Å; E200-N202 PolarHBondContact O-N 3.42Å; N202-M205 PolarHBondContact O-N 3.44Å; N202-E206 PolarHBondContact O-N 3.14Å
203	E	85.5	Confident	80.2	Confident	127 Å²	127	85 Å²	85	59%	0.593	44%	0.436	S	S	*	.	H	α-helix	trans	-60.2	-47.9	174.7	-70.9	174.4	-176.9	0	0	111	Q199 E200 M205 E206 E207	Q199-E203 WeakPolarHBondContact O-CG 3.34Å; Q199-E203 PolarHBondContact O-N 3.34Å; E200-E203 PolarHBondContact O-N 2.97Å; E203-M205 VanDerWaalsContact C-N 3.31Å; E203-M205 PolarHBondContact O-N 2.88Å; E203-E206 PolarHBondContact O-N 2.87Å; E203-E207 WeakPolarHBondContact O-CG 3.34Å; E203-E207 PolarHBondContact O-N 2.83Å
204	L	85.5	Confident	81.1	Confident	20 Å²	20	83.1 Å²	83.1	11%	0.105	42%	0.417	C	S	.	.	H	α-helix	trans	-62.2	-35.9	175.6	-74.2	173.4	0	0	0	113.3	L182 E185 L189 E200 I201 E207 L208	L182-L204 HydrophobicContact CD2-CD2 3.76Å; E185-L204 HydrophobicContact CB-CD1 4.26Å; L189-L204 HydrophobicContact CD1-CD1 3.27Å; E200-L204 WeakPolarHBondContact O-CG 3.32Å; E200-L204 PolarHBondContact O-N 3.37Å; I201-L204 PolarHBondContact O-N 2.98Å; L204-E207 PolarHBondContact O-N 3Å; L204-L208 WeakPolarHBondContact O-CB 3.2Å; L204-L208 WeakPolarHBondContact O-CG 3.46Å; L204-L208 PolarHBondContact O-N 3.33Å
205	M	83.1	Confident	81.7	Confident	69 Å²	69	80.4 Å²	80.4	34%	0.34	40%	0.398	S	S	.	.	H	α-helix	trans	-65.5	-41.4	175.6	-78.8	-176	64.6	0	0	111.9	Y186 I201 N202 E203 L208 K209	Y186-M205 HydrophobicContact CD2-CG 4.24Å; Y186-M205 HydrophobicContact CE2-CG 3.86Å; Y186-M205 HydrophobicContact CE2-SD 4.2Å; I201-M205 HydrophobicContact CG2-CG 4.45Å; I201-M205 HydrophobicContact CG2-SD 4.25Å; I201-M205 WeakPolarHBondContact O-CB 3.34Å; I201-M205 VanDerWaalsContact O-CG 3.31Å; I201-M205 WeakPolarHBondContact O-CG 3.28Å; I201-M205 PolarHBondContact O-N 2.9Å; N202-M205 PolarHBondContact O-N 3.44Å; E203-M205 VanDerWaalsContact C-N 3.31Å; E203-M205 PolarHBondContact O-N 2.88Å; M205-L208 PolarHBondContact O-N 3.43Å; M205-K209 WeakPolarHBondContact O-CG 3.19Å; M205-K209 PolarHBondContact O-N 3.46Å
206	E	88.4	Confident	82.6	Confident	98 Å²	98	75.5 Å²	75.5	46%	0.458	38%	0.38	S	S	.	.	H	α-helix	trans	-66.7	-43.7	174.6	-68.9	-52.6	131.9	0	0	111.1	N202 E203 L208 K209 E210	N202-E206 PolarHBondContact O-N 3.14Å; E203-E206 PolarHBondContact O-N 2.87Å; E206-L208 VanDerWaalsContact C-N 3.3Å; E206-L208 PolarHBondContact O-N 3.32Å; E206-K209 PolarHBondContact O-N 3.33Å; E206-K209 VanDerWaalsContact O-N 3.14Å; E206-K209 IonicContact OE1-NZ 2.78Å; E206-K209 PolarHBondContact OE1-NZ 3.11Å; E206-E210 WeakPolarHBondContact O-CG 3.46Å; E206-E210 PolarHBondContact O-N 2.94Å
207	E	88.5	Confident	83.5	Confident	92 Å²	92	78.7 Å²	78.7	43%	0.43	38%	0.381	S	S	.	.	H	α-helix	trans	-59.1	-39	173.4	-72.3	-171.3	-176.1	0	0	112.6	L182 E203 L204 E210 N211	L182-E207 HydrophobicContact CD1-CB 4.3Å; L182-E207 HydrophobicContact CD2-CB 4.49Å; L182-E207 WeakPolarHBondContact CD2-OE2 3.32Å; E203-E207 WeakPolarHBondContact O-CG 3.34Å; E203-E207 PolarHBondContact O-N 2.83Å; L204-E207 PolarHBondContact O-N 3Å; E207-E210 PolarHBondContact O-N 2.94Å; E207-N211 VanDerWaalsContact O-CB 3.31Å; E207-N211 WeakPolarHBondContact O-CB 3.34Å; E207-N211 PolarHBondContact O-N 3.05Å; E207-N211 PolarHBondContact O-ND2 3.31Å
208	L	87	Confident	84.2	Confident	35 Å²	35	76.5 Å²	76.5	18%	0.183	37%	0.373	C	S	.	.	H	α-helix	trans	-64.9	-42.3	175.5	-84.4	172.4	0	0	0	112.1	L182 Y186 L204 M205 E206 N211 Q212	L182-L208 HydrophobicContact CB-CD2 3.38Å; L182-L208 HydrophobicContact CB-CG 3.82Å; L182-L208 HydrophobicContact CD1-CD2 4.12Å; L182-L208 HydrophobicContact CD1-CG 4.42Å; L182-L208 HydrophobicContact CG-CD2 4.41Å; Y186-L208 HydrophobicContact CG-CD1 4.42Å; L204-L208 WeakPolarHBondContact O-CB 3.2Å; L204-L208 WeakPolarHBondContact O-CG 3.46Å; L204-L208 PolarHBondContact O-N 3.33Å; M205-L208 PolarHBondContact O-N 3.43Å; E206-L208 VanDerWaalsContact C-N 3.3Å; E206-L208 PolarHBondContact O-N 3.32Å; L208-N211 PolarHBondContact O-N 3.01Å; L208-Q212 WeakPolarHBondContact O-CB 3.34Å; L208-Q212 PolarHBondContact O-N 2.97Å
209	K	88.4	Confident	84.8	Confident	109 Å²	109	72.3 Å²	72.3	47%	0.474	36%	0.362	S	S	.	.	H	α-helix	trans	-64	-45.8	175.3	-71.9	171.8	-169.8	166.4	0	110.7	M205 E206 N211 Q212 T213	M205-K209 WeakPolarHBondContact O-CG 3.19Å; M205-K209 PolarHBondContact O-N 3.46Å; E206-K209 PolarHBondContact O-N 3.33Å; E206-K209 VanDerWaalsContact O-N 3.14Å; E206-K209 IonicContact OE1-NZ 2.78Å; E206-K209 PolarHBondContact OE1-NZ 3.11Å; K209-N211 PolarHBondContact O-N 3.5Å; K209-Q212 WeakPolarHBondContact O-CB 3.49Å; K209-Q212 PolarHBondContact O-N 3.41Å; K209-T213 WeakPolarHBondContact O-CG2 3.42Å; K209-T213 PolarHBondContact O-N 2.98Å
210	E	89	Confident	85.1	Confident	128 Å²	128	72.4 Å²	72.4	60%	0.598	36%	0.36	S	S	*	.	H	α-helix	trans	-59.5	-46.3	176.8	-72.8	-171.9	171.9	0	0	111.4	E206 E207 Q212 T213 S214	E206-E210 WeakPolarHBondContact O-CG 3.46Å; E206-E210 PolarHBondContact O-N 2.94Å; E207-E210 PolarHBondContact O-N 2.94Å; E210-Q212 VanDerWaalsContact C-N 3.32Å; E210-Q212 PolarHBondContact O-N 3.23Å; E210-T213 PolarHBondContact O-N 2.95Å; E210-T213 PolarHBondContact O-OG1 3.47Å; E210-S214 WeakPolarHBondContact O-CB 3.29Å; E210-S214 PolarHBondContact O-N 3.05Å; E210-S214 PolarHBondContact O-OG 2.92Å
211	N	86.5	Confident	85.1	Confident	32 Å²	32	72 Å²	72	17%	0.171	36%	0.358	C	S	.	.	H	α-helix	trans	-62.3	-36.1	175.1	-82.3	-64.7	0	0	0	113.2	L182 E207 L208 K209 S214 L215	L182-N211 HydrophobicContact CD1-CB 4.41Å; L182-N211 WeakPolarHBondContact CD1-ND2 3.22Å; E207-N211 VanDerWaalsContact O-CB 3.31Å; E207-N211 WeakPolarHBondContact O-CB 3.34Å; E207-N211 PolarHBondContact O-N 3.05Å; E207-N211 PolarHBondContact O-ND2 3.31Å; L208-N211 PolarHBondContact O-N 3.01Å; K209-N211 PolarHBondContact O-N 3.5Å; N211-S214 WeakPolarHBondContact CA-OG 3.45Å; N211-S214 PolarHBondContact O-OG 3.22Å; N211-L215 VanDerWaalsContact O-CB 3.27Å; N211-L215 WeakPolarHBondContact O-CB 3.4Å; N211-L215 VanDerWaalsContact O-CG 3.28Å; N211-L215 WeakPolarHBondContact O-CG 3.34Å; N211-L215 PolarHBondContact O-N 3.11Å
212	Q	85.5	Confident	85.3	Confident	57 Å²	57	71.6 Å²	71.6	27%	0.266	36%	0.356	S	S	.	.	H	α-helix	trans	-65.4	-45.9	173.7	179	57.3	43.4	0	0	111.2	L208 K209 E210 S214 L215 D216	L208-Q212 WeakPolarHBondContact O-CB 3.34Å; L208-Q212 PolarHBondContact O-N 2.97Å; K209-Q212 WeakPolarHBondContact O-CB 3.49Å; K209-Q212 PolarHBondContact O-N 3.41Å; E210-Q212 VanDerWaalsContact C-N 3.32Å; E210-Q212 PolarHBondContact O-N 3.23Å; Q212-S214 VanDerWaalsContact C-N 3.32Å; Q212-S214 PolarHBondContact O-N 3.21Å; Q212-L215 WeakPolarHBondContact O-CB 3.47Å; Q212-L215 PolarHBondContact O-N 3.03Å; Q212-D216 PolarHBondContact NE2-OD1 3.4Å; Q212-D216 PolarHBondContact NE2-OD2 3.4Å; Q212-D216 PolarHBondContact O-N 3.2Å
213	T	87.6	Confident	85.3	Confident	71 Å²	71	71.2 Å²	71.2	44%	0.436	36%	0.357	S	S	.	.	H	α-helix	trans	-66.3	-34.8	178.3	68.5	0	0	0	0	112.4	K209 E210 D216 K217	K209-T213 WeakPolarHBondContact O-CG2 3.42Å; K209-T213 PolarHBondContact O-N 2.98Å; E210-T213 PolarHBondContact O-N 2.95Å; E210-T213 PolarHBondContact O-OG1 3.47Å; T213-D216 PolarHBondContact O-N 2.95Å; T213-K217 WeakPolarHBondContact O-CB 3.42Å; T213-K217 VanDerWaalsContact O-CG 3.29Å; T213-K217 WeakPolarHBondContact O-CG 3.35Å; T213-K217 PolarHBondContact O-N 2.98Å
214	S	85.7	Confident	85.1	Confident	40 Å²	40	68.6 Å²	68.6	28%	0.28	34%	0.342	S	S	.	.	H	α-helix	trans	-69.9	-39.8	175.8	75.9	0	0	0	0	111.2	E210 N211 Q212 K217 A218	E210-S214 WeakPolarHBondContact O-CB 3.29Å; E210-S214 PolarHBondContact O-N 3.05Å; E210-S214 PolarHBondContact O-OG 2.92Å; N211-S214 WeakPolarHBondContact CA-OG 3.45Å; N211-S214 PolarHBondContact O-OG 3.22Å; Q212-S214 VanDerWaalsContact C-N 3.32Å; Q212-S214 PolarHBondContact O-N 3.21Å; S214-K217 PolarHBondContact O-N 2.98Å; S214-A218 WeakPolarHBondContact O-CB 3.35Å; S214-A218 PolarHBondContact O-N 3.39Å
215	L	84.7	Confident	85	Confident	16 Å²	16	69.8 Å²	69.8	8%	0.084	35%	0.347	C	S	.	.	H	α-helix	trans	-59.2	-44.4	170.9	-84.7	168.6	0	0	0	112.2	L175 L176 R179 N211 Q212 A218 A219	L175-L215 HydrophobicContact CB-CD2 3.34Å; L175-L215 HydrophobicContact CB-CG 3.94Å; L175-L215 HydrophobicContact CD1-CD2 4.05Å; L175-L215 HydrophobicContact CD1-CG 4.48Å; L175-L215 HydrophobicContact CG-CD2 4.33Å; L176-L215 HydrophobicContact CD2-CD2 4.23Å; L176-L215 HydrophobicContact CG-CD2 4.34Å; R179-L215 HydrophobicContact CB-CD1 4.23Å; N211-L215 VanDerWaalsContact O-CB 3.27Å; N211-L215 WeakPolarHBondContact O-CB 3.4Å; N211-L215 VanDerWaalsContact O-CG 3.28Å; N211-L215 WeakPolarHBondContact O-CG 3.34Å; N211-L215 PolarHBondContact O-N 3.11Å; Q212-L215 WeakPolarHBondContact O-CB 3.47Å; Q212-L215 PolarHBondContact O-N 3.03Å; L215-A218 PolarHBondContact O-N 3.31Å; L215-A219 VanDerWaalsContact O-CB 3.28Å; L215-A219 WeakPolarHBondContact O-CB 3.47Å; L215-A219 PolarHBondContact O-N 2.87Å
216	D	85.3	Confident	85.2	Confident	78 Å²	78	71.7 Å²	71.7	42%	0.417	35%	0.35	S	S	.	.	H	α-helix	trans	-69	-39	-179.7	-70.9	-30	0	0	0	112.3	Q212 T213 K220	Q212-D216 PolarHBondContact NE2-OD1 3.4Å; Q212-D216 PolarHBondContact NE2-OD2 3.4Å; Q212-D216 PolarHBondContact O-N 3.2Å; T213-D216 PolarHBondContact O-N 2.95Å; D216-K220 WeakPolarHBondContact O-CG 3.49Å; D216-K220 PolarHBondContact O-N 3.48Å; D216-K220 VanDerWaalsContact O-N 3.14Å
217	K	85	Confident	85.2	Confident	133 Å²	133	74.8 Å²	74.8	58%	0.578	36%	0.358	S	S	*	.	H	α-helix	trans	-63.2	-49.6	172	-73.3	171.1	-174.8	170	0	110.6	T213 S214 A219 K220 E221	T213-K217 WeakPolarHBondContact O-CB 3.42Å; T213-K217 VanDerWaalsContact O-CG 3.29Å; T213-K217 WeakPolarHBondContact O-CG 3.35Å; T213-K217 PolarHBondContact O-N 2.98Å; S214-K217 PolarHBondContact O-N 2.98Å; K217-A219 VanDerWaalsContact C-N 3.32Å; K217-A219 PolarHBondContact O-N 3.11Å; K217-K220 PolarHBondContact O-N 3.44Å; K217-E221 WeakPolarHBondContact O-CB 3.47Å; K217-E221 WeakPolarHBondContact O-CG 3.41Å; K217-E221 PolarHBondContact O-N 2.94Å
218	A	82.6	Confident	85.1	Confident	9 Å²	9	70.5 Å²	70.5	7%	0.074	34%	0.338	C	S	.	.	H	α-helix	trans	-59.3	-41.4	177.4	0	0	0	0	0	111.6	L175 S214 L215 K220 E221 M222	L175-A218 HydrophobicContact CD1-CB 3.86Å; S214-A218 WeakPolarHBondContact O-CB 3.35Å; S214-A218 PolarHBondContact O-N 3.39Å; L215-A218 PolarHBondContact O-N 3.31Å; A218-K220 PolarHBondContact O-N 3.47Å; A218-E221 PolarHBondContact O-N 3.4Å; A218-M222 VanDerWaalsContact O-CB 3.24Å; A218-M222 WeakPolarHBondContact O-CB 3.48Å; A218-M222 WeakPolarHBondContact O-CG 3.33Å; A218-M222 PolarHBondContact O-N 2.96Å
219	A	84.2	Confident	85.1	Confident	40 Å²	40	69.2 Å²	69.2	33%	0.331	33%	0.331	S	S	.	.	H	α-helix	trans	-63	-42.5	177.7	0	0	0	0	0	112.5	L215 K217 M222 V223	L215-A219 VanDerWaalsContact O-CB 3.28Å; L215-A219 WeakPolarHBondContact O-CB 3.47Å; L215-A219 PolarHBondContact O-N 2.87Å; K217-A219 VanDerWaalsContact C-N 3.32Å; K217-A219 PolarHBondContact O-N 3.11Å; A219-M222 PolarHBondContact O-N 2.87Å; A219-V223 WeakPolarHBondContact O-CG2 3.3Å; A219-V223 PolarHBondContact O-N 3.35Å; A219-V223 VanDerWaalsContact O-N 3.09Å
220	K	82.3	Confident	85.3	Confident	144 Å²	144	67.2 Å²	67.2	63%	0.626	32%	0.321	S	S	*	.	H	α-helix	trans	-66.2	-45.2	176.1	-71.4	173.6	-176.5	175.5	0	111.7	D216 K217 A218 M222 V223 R224	D216-K220 WeakPolarHBondContact O-CG 3.49Å; D216-K220 PolarHBondContact O-N 3.48Å; D216-K220 VanDerWaalsContact O-N 3.14Å; K217-K220 PolarHBondContact O-N 3.44Å; A218-K220 PolarHBondContact O-N 3.47Å; K220-M222 VanDerWaalsContact C-N 3.32Å; K220-M222 PolarHBondContact O-N 3.2Å; K220-V223 PolarHBondContact O-N 3.39Å; K220-R224 WeakPolarHBondContact O-CG 3.4Å; K220-R224 PolarHBondContact O-N 3.17Å
221	E	80.3	Confident	85.4	Confident	91 Å²	91	61.2 Å²	61.2	43%	0.425	29%	0.293	S	S	.	.	H	α-helix	trans	-61.3	-41.5	175.6	-72.7	170.6	-175.8	0	0	111.1	K217 A218 V223 R224 E225	K217-E221 WeakPolarHBondContact O-CB 3.47Å; K217-E221 WeakPolarHBondContact O-CG 3.41Å; K217-E221 PolarHBondContact O-N 2.94Å; A218-E221 PolarHBondContact O-N 3.4Å; E221-V223 PolarHBondContact O-N 3.41Å; E221-R224 PolarHBondContact O-N 3.25Å; E221-E225 WeakPolarHBondContact O-CB 3.24Å; E221-E225 PolarHBondContact O-N 3.12Å
222	M	81.8	Confident	85.6	Confident	13 Å²	13	62.3 Å²	62.3	6%	0.064	30%	0.295	C	S	.	.	H	α-helix	trans	-62.3	-41.1	176.1	-79	-178.3	76	0	0	113.4	F168 K172 A218 A219 K220 R224 R226	F168-M222 HydrophobicContact CB-CE 4.06Å; F168-M222 HydrophobicContact CB-CG 4.14Å; F168-M222 HydrophobicContact CD1-CG 4.45Å; K172-M222 HydrophobicContact CB-CE 3.95Å; K172-M222 HydrophobicContact CB-SD 3.61Å; K172-M222 HydrophobicContact CD-CE 3.81Å; K172-M222 HydrophobicContact CD-SD 3.73Å; K172-M222 HydrophobicContact CG-CE 4.47Å; K172-M222 HydrophobicContact CG-SD 4.03Å; A218-M222 VanDerWaalsContact O-CB 3.24Å; A218-M222 WeakPolarHBondContact O-CB 3.48Å; A218-M222 WeakPolarHBondContact O-CG 3.33Å; A218-M222 PolarHBondContact O-N 2.96Å; A219-M222 PolarHBondContact O-N 2.87Å; K220-M222 VanDerWaalsContact C-N 3.32Å; K220-M222 PolarHBondContact O-N 3.2Å; M222-R224 VanDerWaalsContact C-N 3.28Å; M222-R224 PolarHBondContact O-N 3.49Å; M222-R226 WeakPolarHBondContact O-CB 3.34Å; M222-R226 PolarHBondContact O-N 2.87Å
223	V	84.4	Confident	85.9	Confident	94 Å²	94	59.7 Å²	59.7	57%	0.57	28%	0.283	S	S	*	.	H	α-helix	trans	-63.1	-39.5	177.7	170.5	0	0	0	0	110.6	A219 K220 E221 R227	A219-V223 WeakPolarHBondContact O-CG2 3.3Å; A219-V223 PolarHBondContact O-N 3.35Å; A219-V223 VanDerWaalsContact O-N 3.09Å; K220-V223 PolarHBondContact O-N 3.39Å; E221-V223 PolarHBondContact O-N 3.41Å; V223-R227 PolarHBondContact O-N 2.88Å; V223-R227 VanDerWaalsContact O-N 3.17Å
224	R	81.9	Confident	86.2	Confident	72 Å²	72	58.5 Å²	58.5	27%	0.272	27%	0.273	S	S	.	.	H	α-helix	trans	-69.2	-53	178	-69.6	176.8	170	153.2	2.7	112.3	K220 E221 M222 R226 R227 L228 E312	K220-R224 WeakPolarHBondContact O-CG 3.4Å; K220-R224 PolarHBondContact O-N 3.17Å; E221-R224 PolarHBondContact O-N 3.25Å; M222-R224 VanDerWaalsContact C-N 3.28Å; M222-R224 PolarHBondContact O-N 3.49Å; R224-R226 VanDerWaalsContact C-N 3.28Å; R224-R226 PolarHBondContact O-N 3.1Å; R224-R227 WeakPolarHBondContact O-CB 3.12Å; R224-R227 PolarHBondContact O-N 3.07Å; R224-L228 PolarHBondContact O-N 3.02Å; R224-E312 IonicContact CZ-OE1 3.45Å; R224-E312 VanDerWaalsContact CZ-OE1 3.22Å; R224-E312 IonicContact NE-OE1 3.14Å; R224-E312 PolarHBondContact NE-OE1 3.34Å; R224-E312 VanDerWaalsContact NE-OE1 3.14Å; R224-E312 IonicContact NH2-OE1 3.14Å; R224-E312 PolarHBondContact NH2-OE1 3.48Å
225	E	83.4	Confident	86.5	Confident	45 Å²	45	56.8 Å²	56.8	21%	0.21	26%	0.26	C	S	.	.	H	α-helix	trans	-61.7	-37	177.9	-78.9	-62.6	154.3	0	0	111.7	F168 E221 R227 L228 T229	F168-E225 HydrophobicContact CE1-CB 4.31Å; F168-E225 HydrophobicContact CE1-CG 4.15Å; F168-E225 HydrophobicContact CE2-CB 4.12Å; F168-E225 HydrophobicContact CE2-CG 4.48Å; F168-E225 HydrophobicContact CZ-CB 3.9Å; F168-E225 HydrophobicContact CZ-CG 3.81Å; E221-E225 WeakPolarHBondContact O-CB 3.24Å; E221-E225 PolarHBondContact O-N 3.12Å; E225-R227 PolarHBondContact O-N 3.05Å; E225-L228 PolarHBondContact O-N 2.89Å; E225-T229 WeakPolarHBondContact O-CB 3.24Å; E225-T229 VanDerWaalsContact O-CG2 3.26Å; E225-T229 WeakPolarHBondContact O-CG2 3.48Å; E225-T229 PolarHBondContact O-N 3.3Å; E225-T229 PolarHBondContact O-OG1 2.94Å
226	R	86.8	Confident	86.9	Confident	109 Å²	109	58.5 Å²	58.5	41%	0.411	27%	0.269	S	S	.	.	H	α-helix	trans	-57.2	-48.9	170.6	-176.2	175	-67.2	-173.9	-3	111.2	L165 D169 M222 R224 L228 T229 W230	L165-R226 HydrophobicContact CD1-CB 4.44Å; L165-R226 HydrophobicContact CD1-CG 3.83Å; L165-R226 HydrophobicContact CD2-CB 3.93Å; L165-R226 HydrophobicContact CD2-CG 4.23Å; D169-R226 IonicContact OD1-NH2 3.27Å; D169-R226 PolarHBondContact OD1-NH2 3Å; M222-R226 WeakPolarHBondContact O-CB 3.34Å; M222-R226 PolarHBondContact O-N 2.87Å; R224-R226 VanDerWaalsContact C-N 3.28Å; R224-R226 PolarHBondContact O-N 3.1Å; R226-L228 PolarHBondContact O-N 3.1Å; R226-T229 WeakPolarHBondContact CA-OG1 3.49Å; R226-T229 PolarHBondContact O-N 3.31Å; R226-T229 PolarHBondContact O-OG1 3.14Å; R226-W230 WeakPolarHBondContact O-CB 3.42Å; R226-W230 PolarHBondContact O-N 3.01Å
227	R	87.5	Confident	87.2	Confident	162 Å²	162	55.1 Å²	55.1	61%	0.611	25%	0.252	S	S	*	.	H	α-helix	trans	-59.3	-48.2	177.2	-166.8	-176.8	-63	-157.3	-1	111.7	V223 R224 E225 W230 D231	V223-R227 PolarHBondContact O-N 2.88Å; V223-R227 VanDerWaalsContact O-N 3.17Å; R224-R227 WeakPolarHBondContact O-CB 3.12Å; R224-R227 PolarHBondContact O-N 3.07Å; E225-R227 PolarHBondContact O-N 3.05Å; R227-W230 PolarHBondContact O-N 3.29Å; R227-D231 VanDerWaalsContact O-CG 3.26Å; R227-D231 PolarHBondContact O-N 3Å
228	L	86.9	Confident	87.6	Confident	2 Å²	2	49 Å²	49	1%	0.01	23%	0.226	C	C	.	.	H	α-helix	trans	-63	-44.1	179.9	-71.8	171.9	0	0	0	113.2	R224 E225 R226 W230 D231 R232 E315 F319	R224-L228 PolarHBondContact O-N 3.02Å; E225-L228 PolarHBondContact O-N 2.89Å; R226-L228 PolarHBondContact O-N 3.1Å; L228-W230 VanDerWaalsContact C-N 3.33Å; L228-W230 PolarHBondContact O-N 3.3Å; L228-D231 PolarHBondContact O-N 2.86Å; L228-R232 WeakPolarHBondContact O-CB 3.45Å; L228-R232 VanDerWaalsContact O-CG 3.28Å; L228-R232 WeakPolarHBondContact O-CG 3.38Å; L228-R232 PolarHBondContact O-N 3.03Å; L228-E315 HydrophobicContact CD1-CB 4.08Å; L228-E315 HydrophobicContact CD1-CG 4.28Å; L228-E315 WeakPolarHBondContact CD1-OE2 3.29Å; L228-F319 HydrophobicContact CD2-CB 4.4Å
229	T	88.5	Confident	88.2	Confident	8 Å²	8	51.6 Å²	51.6	5%	0.049	23%	0.233	C	C	.	.	H	α-helix	trans	-63.5	-39	177.4	49.1	0	0	0	0	112.1	N164 L165 E225 R226 A233	N164-T229 HydrophobicContact CB-CG2 4.25Å; L165-T229 HydrophobicContact CD2-CG2 4.46Å; L165-T229 WeakPolarHBondContact CD2-OG1 3.24Å; E225-T229 WeakPolarHBondContact O-CB 3.24Å; E225-T229 VanDerWaalsContact O-CG2 3.26Å; E225-T229 WeakPolarHBondContact O-CG2 3.48Å; E225-T229 PolarHBondContact O-N 3.3Å; E225-T229 PolarHBondContact O-OG1 2.94Å; R226-T229 WeakPolarHBondContact CA-OG1 3.49Å; R226-T229 PolarHBondContact O-N 3.31Å; R226-T229 PolarHBondContact O-OG1 3.14Å; T229-A233 VanDerWaalsContact O-CB 3.3Å; T229-A233 WeakPolarHBondContact O-CB 3.45Å; T229-A233 PolarHBondContact O-N 2.87Å
230	W	91.2	Very high	88.6	Confident	68 Å²	68	54.2 Å²	54.2	26%	0.258	24%	0.239	S	C	.	.	H	α-helix	trans	-64.1	-46.9	172.5	-85.7	105.8	0	0	0	112	V157 R158 A161 R226 R227 L228 R232 A233 H234	V157-W230 HydrophobicContact CG1-CE3 3.91Å; V157-W230 HydrophobicContact CG1-CZ3 3.87Å; R158-W230 HydrophobicContact CB-CH2 3.77Å; R158-W230 HydrophobicContact CB-CZ3 4.17Å; R158-W230 HydrophobicContact CG-CH2 3.65Å; R158-W230 HydrophobicContact CG-CZ3 3.81Å; A161-W230 HydrophobicContact CB-CD2 3.59Å; A161-W230 HydrophobicContact CB-CE3 3.7Å; A161-W230 HydrophobicContact CB-CG 4.18Å; A161-W230 HydrophobicContact CB-CH2 4.07Å; A161-W230 HydrophobicContact CB-CZ2 3.95Å; A161-W230 HydrophobicContact CB-CZ3 3.95Å; R226-W230 WeakPolarHBondContact O-CB 3.42Å; R226-W230 PolarHBondContact O-N 3.01Å; R227-W230 PolarHBondContact O-N 3.29Å; L228-W230 VanDerWaalsContact C-N 3.33Å; L228-W230 PolarHBondContact O-N 3.3Å; W230-R232 PolarHBondContact O-N 3.48Å; W230-A233 PolarHBondContact O-N 2.91Å; W230-A233 VanDerWaalsContact O-N 3.15Å; W230-H234 AromaticContact CE3-NE2 3.81Å; W230-H234 WeakPolarHBondContact O-CB 3.31Å; W230-H234 PolarHBondContact O-CD2 3.24Å; W230-H234 VanDerWaalsContact O-CD2 3.24Å; W230-H234 PolarHBondContact O-N 3.33Å
231	D	91.2	Very high	89.3	Confident	2 Å²	2	47.4 Å²	47.4	1%	0.011	21%	0.209	C	C	.	.	H	α-helix	trans	-63.5	-41.7	179.9	-66.2	-20.7	0	0	0	111.3	R227 L228 A233 H234 L235 F272 R276 R280 F319	R227-D231 VanDerWaalsContact O-CG 3.26Å; R227-D231 PolarHBondContact O-N 3Å; L228-D231 PolarHBondContact O-N 2.86Å; D231-A233 VanDerWaalsContact C-N 3.33Å; D231-A233 PolarHBondContact O-N 3.34Å; D231-H234 PolarHBondContact O-N 3.04Å; D231-L235 WeakPolarHBondContact O-CB 3.47Å; D231-L235 PolarHBondContact O-N 3.09Å; D231-F272 HydrophobicContact CB-CE2 4.48Å; D231-F272 HydrophobicContact CB-CZ 4.41Å; D231-R276 WeakPolarHBondContact OD1-CD 3.41Å; D231-R276 IonicContact OD1-CZ 3.22Å; D231-R276 IonicContact OD1-NE 2.81Å; D231-R276 IonicContact OD1-NH1 3.14Å; D231-R276 PolarHBondContact OD1-NH1 3.23Å; D231-R280 IonicContact OD2-CZ 3.52Å; D231-R280 IonicContact OD2-NE 3.43Å; D231-R280 PolarHBondContact OD2-NE 2.78Å; D231-R280 IonicContact OD2-NH2 3.69Å; D231-R280 PolarHBondContact OD2-NH2 3.26Å; D231-F319 HydrophobicContact CB-CE2 3.82Å; D231-F319 HydrophobicContact CB-CZ 4.04Å
232	R	91.1	Very high	90	Very high	54 Å²	54	45.6 Å²	45.6	20%	0.204	20%	0.199	C	C	.	.	H	α-helix	trans	-62.4	-38.8	172.9	-71.5	175.9	-174.1	149.8	8.6	112.3	L228 W230 N236 F319 L322	L228-R232 WeakPolarHBondContact O-CB 3.45Å; L228-R232 VanDerWaalsContact O-CG 3.28Å; L228-R232 WeakPolarHBondContact O-CG 3.38Å; L228-R232 PolarHBondContact O-N 3.03Å; W230-R232 PolarHBondContact O-N 3.48Å; R232-N236 PolarHBondContact O-N 3.37Å; R232-N236 PolarHBondContact O-ND2 3.09Å; R232-F319 HydrophobicContact CG-CD2 3.82Å; R232-F319 HydrophobicContact CG-CE2 3.9Å; R232-L322 HydrophobicContact CG-CD1 4.05Å
233	A	91.2	Very high	90.6	Very high	3 Å²	3	49.9 Å²	49.9	3%	0.025	22%	0.219	C	C	.	.	H	α-helix	trans	-69.3	-40	177.7	0	0	0	0	0	111.5	V157 A161 T229 W230 D231 A237	V157-A233 HydrophobicContact CG1-CB 3.81Å; A161-A233 HydrophobicContact CB-CB 4.04Å; T229-A233 VanDerWaalsContact O-CB 3.3Å; T229-A233 WeakPolarHBondContact O-CB 3.45Å; T229-A233 PolarHBondContact O-N 2.87Å; W230-A233 PolarHBondContact O-N 2.91Å; W230-A233 VanDerWaalsContact O-N 3.15Å; D231-A233 VanDerWaalsContact C-N 3.33Å; D231-A233 PolarHBondContact O-N 3.34Å; A233-A237 WeakPolarHBondContact O-CB 3.29Å; A233-A237 PolarHBondContact O-N 3.01Å; A233-A237 VanDerWaalsContact O-N 3.08Å
234	H	93.4	Very high	91.1	Very high	46 Å²	46	45.7 Å²	45.7	21%	0.213	19%	0.193	C	C	.	.	H	α-helix	trans	-64.9	-48.6	176.4	-88.4	-74.4	0	0	0	111.8	V157 W230 D231 N236 A237 I238 F272	V157-H234 HydrophobicContact CG1-CB 4.43Å; W230-H234 AromaticContact CE3-NE2 3.81Å; W230-H234 WeakPolarHBondContact O-CB 3.31Å; W230-H234 PolarHBondContact O-CD2 3.24Å; W230-H234 VanDerWaalsContact O-CD2 3.24Å; W230-H234 PolarHBondContact O-N 3.33Å; D231-H234 PolarHBondContact O-N 3.04Å; H234-N236 VanDerWaalsContact C-N 3.34Å; H234-N236 PolarHBondContact O-N 3.33Å; H234-A237 PolarHBondContact O-N 3.45Å; H234-I238 WeakPolarHBondContact O-CG1 3.3Å; H234-I238 PolarHBondContact O-N 3.03Å; H234-F272 HydrophobicContact CB-CD2 4.2Å; H234-F272 HydrophobicContact CB-CE2 3.67Å; H234-F272 HydrophobicContact CB-CZ 4.15Å
235	L	92.7	Very high	91.8	Very high	3 Å²	3	42.5 Å²	42.5	2%	0.016	18%	0.181	C	C	.	.	H	α-helix	trans	-55	-49.7	177.3	178.8	64.6	0	0	0	111.5	D231 A237 I238 R239 F272 F273 V323	D231-L235 WeakPolarHBondContact O-CB 3.47Å; D231-L235 PolarHBondContact O-N 3.09Å; L235-A237 VanDerWaalsContact C-N 3.29Å; L235-A237 PolarHBondContact O-N 3.32Å; L235-I238 PolarHBondContact O-N 2.82Å; L235-R239 WeakPolarHBondContact O-CG 3.44Å; L235-R239 PolarHBondContact O-N 3.2Å; L235-R239 VanDerWaalsContact O-N 3.12Å; L235-F272 HydrophobicContact CB-CE1 4.12Å; L235-F272 HydrophobicContact CB-CZ 4.2Å; L235-F272 HydrophobicContact CD1-CE1 4.2Å; L235-F273 HydrophobicContact CD1-CE2 4.21Å; L235-F273 HydrophobicContact CD1-CZ 3.78Å; L235-V323 HydrophobicContact CD2-CG2 3.94Å
236	N	92.3	Very high	92.3	Very high	53 Å²	53	43.4 Å²	43.4	28%	0.283	19%	0.19	S	C	.	.	H	α-helix	trans	-61.1	-37.9	177.2	-74.4	-44.8	0	0	0	112.5	R232 H234 R239 E240	R232-N236 PolarHBondContact O-N 3.37Å; R232-N236 PolarHBondContact O-ND2 3.09Å; H234-N236 VanDerWaalsContact C-N 3.34Å; H234-N236 PolarHBondContact O-N 3.33Å; N236-R239 WeakPolarHBondContact O-CB 3.43Å; N236-R239 PolarHBondContact O-N 3.37Å; N236-E240 VanDerWaalsContact O-CG 3.28Å; N236-E240 WeakPolarHBondContact O-CG 3.21Å; N236-E240 PolarHBondContact O-N 3.42Å
237	A	93	Very high	92.7	Very high	6 Å²	6	41.9 Å²	41.9	5%	0.05	19%	0.187	C	C	.	.	H	α-helix	trans	-74.3	-30.5	-179.2	0	0	0	0	0	113.2	V157 A233 H234 L235 R239 A241	V157-A237 HydrophobicContact CB-CB 4.5Å; V157-A237 HydrophobicContact CG2-CB 3.19Å; A233-A237 WeakPolarHBondContact O-CB 3.29Å; A233-A237 PolarHBondContact O-N 3.01Å; A233-A237 VanDerWaalsContact O-N 3.08Å; H234-A237 PolarHBondContact O-N 3.45Å; L235-A237 VanDerWaalsContact C-N 3.29Å; L235-A237 PolarHBondContact O-N 3.32Å; A237-R239 VanDerWaalsContact C-N 3.33Å; A237-A241 WeakPolarHBondContact O-CB 3.47Å; A237-A241 PolarHBondContact O-N 2.78Å
238	I	93.9	Very high	93	Very high	5 Å²	5	34.2 Å²	34.2	3%	0.026	16%	0.158	C	C	.	.	H	α-helix	trans	-61	-45.8	168.3	-67.3	165.2	0	0	0	109.3	L153 H234 L235 A241 R242 L265 A269 F272	L153-I238 HydrophobicContact CD1-CG1 4.44Å; H234-I238 WeakPolarHBondContact O-CG1 3.3Å; H234-I238 PolarHBondContact O-N 3.03Å; L235-I238 PolarHBondContact O-N 2.82Å; I238-A241 PolarHBondContact O-N 3.18Å; I238-R242 VanDerWaalsContact O-CB 3.27Å; I238-R242 WeakPolarHBondContact O-CB 3.49Å; I238-R242 PolarHBondContact O-N 2.99Å; I238-L265 HydrophobicContact CG2-CD2 4.36Å; I238-A269 HydrophobicContact CD1-CB 4.43Å; I238-A269 HydrophobicContact CG2-CB 3.86Å; I238-F272 HydrophobicContact CD1-CB 4.02Å; I238-F272 HydrophobicContact CD1-CD1 3.76Å; I238-F272 HydrophobicContact CD1-CE1 4.42Å; I238-F272 HydrophobicContact CD1-CG 3.9Å
239	R	94	Very high	93.3	Very high	63 Å²	63	35.3 Å²	35.3	24%	0.238	16%	0.164	C	C	.	.	H	α-helix	trans	-60.5	-48.9	177.1	-68.3	175.5	-179.3	170.7	-0.3	112.7	L235 N236 A237 R242 H243 L322 T324 E325	L235-R239 WeakPolarHBondContact O-CG 3.44Å; L235-R239 PolarHBondContact O-N 3.2Å; L235-R239 VanDerWaalsContact O-N 3.12Å; N236-R239 WeakPolarHBondContact O-CB 3.43Å; N236-R239 PolarHBondContact O-N 3.37Å; A237-R239 VanDerWaalsContact C-N 3.33Å; R239-R242 PolarHBondContact O-N 3.44Å; R239-H243 WeakPolarHBondContact O-CB 2.97Å; R239-H243 PolarHBondContact O-N 3.3Å; R239-L322 PolarHBondContact NH1-O 3.46Å; R239-L322 PolarHBondContact NH2-O 3.47Å; R239-T324 PolarHBondContact NH2-OG1 3.14Å; R239-E325 IonicContact CZ-OE1 2.83Å; R239-E325 IonicContact CZ-OE2 3.6Å; R239-E325 IonicContact NE-OE1 3.07Å; R239-E325 PolarHBondContact NE-OE1 3.23Å; R239-E325 IonicContact NE-OE2 3.75Å; R239-E325 VanDerWaalsContact NH2-CD 3.35Å; R239-E325 IonicContact NH2-OE1 3.79Å; R239-E325 PolarHBondContact NH2-OE1 3.28Å; R239-E325 IonicContact NH2-OE2 3.63Å; R239-E325 PolarHBondContact NH2-OE2 3.15Å
240	E	93.6	Very high	93.5	Very high	95 Å²	95	39.1 Å²	39.1	44%	0.444	19%	0.191	S	C	.	.	H	α-helix	trans	-63.3	-44.3	178.4	-68.7	-65.9	154.4	0	0	111.7	N236 H243 L244	N236-E240 VanDerWaalsContact O-CG 3.28Å; N236-E240 WeakPolarHBondContact O-CG 3.21Å; N236-E240 PolarHBondContact O-N 3.42Å; E240-H243 PolarHBondContact O-N 3.23Å; E240-L244 WeakPolarHBondContact O-CB 3.42Å; E240-L244 VanDerWaalsContact O-CG 3.24Å; E240-L244 WeakPolarHBondContact O-CG 3.44Å; E240-L244 PolarHBondContact O-N 3Å
241	A	95.7	Very high	93.6	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.008	19%	0.193	C	C	.	.	H	α-helix	trans	-67.2	-39.2	178.5	0	0	0	0	0	111.8	A149 A237 I238 L244 I245 L265	A149-A241 HydrophobicContact CB-CB 3.96Å; A237-A241 WeakPolarHBondContact O-CB 3.47Å; A237-A241 PolarHBondContact O-N 2.78Å; I238-A241 PolarHBondContact O-N 3.18Å; A241-L244 PolarHBondContact O-N 3.24Å; A241-I245 VanDerWaalsContact O-CG1 3.26Å; A241-I245 WeakPolarHBondContact O-CG1 3.43Å; A241-I245 PolarHBondContact O-N 2.67Å; A241-L265 HydrophobicContact CB-CD1 3.28Å
242	R	95.4	Very high	93.6	Very high	54 Å²	54	39.6 Å²	39.6	20%	0.204	20%	0.198	C	C	.	.	H	α-helix	trans	-59.4	-51.3	171.8	-173	-175.1	-70	144.5	-4.9	110.8	I238 R239 L244 I245 T246 L262 L265 E266	I238-R242 VanDerWaalsContact O-CB 3.27Å; I238-R242 WeakPolarHBondContact O-CB 3.49Å; I238-R242 PolarHBondContact O-N 2.99Å; R239-R242 PolarHBondContact O-N 3.44Å; R242-L244 PolarHBondContact O-N 3.4Å; R242-I245 PolarHBondContact O-N 3.33Å; R242-T246 HydrophobicContact CG-CG2 4.3Å; R242-T246 WeakPolarHBondContact O-CG2 3.37Å; R242-T246 PolarHBondContact O-N 2.97Å; R242-T246 PolarHBondContact O-OG1 3.3Å; R242-L262 HydrophobicContact CG-CD1 4.4Å; R242-L265 HydrophobicContact CB-CD2 3.77Å; R242-L265 HydrophobicContact CG-CD2 4.22Å; R242-E266 IonicContact CZ-OE1 3.6Å; R242-E266 IonicContact CZ-OE2 3.65Å; R242-E266 IonicContact NE-OE1 3.64Å; R242-E266 PolarHBondContact NE-OE1 2.99Å; R242-E266 IonicContact NE-OE2 2.73Å; R242-E266 IonicContact NH2-OE1 3.39Å; R242-E266 PolarHBondContact NH2-OE1 3.4Å; R242-E266 IonicContact NH2-OE2 2.65Å; R242-E266 PolarHBondContact NH2-OE2 3.21Å
243	H	94.9	Very high	93.5	Very high	103 Å²	103	40 Å²	40	48%	0.477	21%	0.208	S	C	.	.	H	α-helix	trans	-53.2	-52.1	177.8	172.8	-84.7	0	0	0	111.4	R239 E240 I245 T246 E247	R239-H243 WeakPolarHBondContact O-CB 2.97Å; R239-H243 PolarHBondContact O-N 3.3Å; E240-H243 PolarHBondContact O-N 3.23Å; H243-I245 PolarHBondContact O-N 3.01Å; H243-T246 WeakPolarHBondContact CA-OG1 3.1Å; H243-T246 PolarHBondContact O-N 3.14Å; H243-T246 PolarHBondContact O-OG1 2.83Å; H243-E247 IonicContact CE1-OE2 2.72Å; H243-E247 PolarHBondContact CE1-OE2 3.46Å; H243-E247 IonicContact ND1-OE2 3.64Å; H243-E247 WeakPolarHBondContact O-CB 3.43Å; H243-E247 PolarHBondContact O-N 2.88Å
244	L	95.1	Very high	93.3	Very high	6 Å²	6	46.7 Å²	46.7	3%	0.031	24%	0.239	C	C	.	.	H	α-helix	trans	-59.9	-43.7	178.8	-70.5	172.9	0	0	0	112.2	L134 W145 A148 A149 E240 A241 R242 G248	L134-L244 HydrophobicContact CD1-CD2 3.74Å; W145-L244 HydrophobicContact CE3-CB 4.17Å; W145-L244 HydrophobicContact CE3-CD2 4.07Å; W145-L244 HydrophobicContact CZ3-CD2 3.83Å; A148-L244 HydrophobicContact CB-CD1 4.1Å; A149-L244 HydrophobicContact CB-CB 4.46Å; E240-L244 WeakPolarHBondContact O-CB 3.42Å; E240-L244 VanDerWaalsContact O-CG 3.24Å; E240-L244 WeakPolarHBondContact O-CG 3.44Å; E240-L244 PolarHBondContact O-N 3Å; A241-L244 PolarHBondContact O-N 3.24Å; R242-L244 PolarHBondContact O-N 3.4Å; L244-G248 PolarHBondContact O-N 3.46Å
245	I	95.6	Very high	93.2	Very high	4 Å²	4	45.7 Å²	45.7	2%	0.021	24%	0.237	C	C	.	.	H	α-helix	trans	-67.2	-43.1	178.9	-66.6	169.3	0	0	0	110.5	A149 A241 R242 H243 E247 G248 I249 L258 E261 L262 L265	A149-I245 HydrophobicContact CB-CD1 3.98Å; A149-I245 HydrophobicContact CB-CG1 3.77Å; A241-I245 VanDerWaalsContact O-CG1 3.26Å; A241-I245 WeakPolarHBondContact O-CG1 3.43Å; A241-I245 PolarHBondContact O-N 2.67Å; R242-I245 PolarHBondContact O-N 3.33Å; H243-I245 PolarHBondContact O-N 3.01Å; I245-E247 PolarHBondContact O-N 3.31Å; I245-G248 PolarHBondContact O-N 3.2Å; I245-I249 HydrophobicContact CG2-CD1 3.77Å; I245-I249 HydrophobicContact CG2-CG1 4.32Å; I245-I249 VanDerWaalsContact O-CG1 3.26Å; I245-I249 WeakPolarHBondContact O-CG1 3.35Å; I245-I249 PolarHBondContact O-N 2.82Å; I245-L258 WeakPolarHBondContact CG2-O 3.37Å; I245-E261 HydrophobicContact CD1-CB 4.21Å; I245-L262 HydrophobicContact CG2-CB 3.74Å; I245-L262 HydrophobicContact CG2-CD1 4.13Å; I245-L262 HydrophobicContact CG2-CG 4.44Å; I245-L265 HydrophobicContact CD1-CB 4.27Å; I245-L265 HydrophobicContact CD1-CD1 4.07Å
246	T	94.5	Very high	93	Very high	65 Å²	65	47.2 Å²	47.2	40%	0.399	25%	0.245	S	C	.	.	H	α-helix	trans	-64.9	-38.7	178.7	51.6	0	0	0	0	112.9	R242 H243 I249 S250 L262	R242-T246 HydrophobicContact CG-CG2 4.3Å; R242-T246 WeakPolarHBondContact O-CG2 3.37Å; R242-T246 PolarHBondContact O-N 2.97Å; R242-T246 PolarHBondContact O-OG1 3.3Å; H243-T246 WeakPolarHBondContact CA-OG1 3.1Å; H243-T246 PolarHBondContact O-N 3.14Å; H243-T246 PolarHBondContact O-OG1 2.83Å; T246-I249 PolarHBondContact O-N 3.14Å; T246-S250 PolarHBondContact O-N 3.45Å; T246-L262 HydrophobicContact CG2-CD1 4.47Å
247	E	94.4	Very high	93	Very high	77 Å²	77	47.6 Å²	47.6	36%	0.36	25%	0.246	S	C	.	.	H	α-helix	trans	-68.1	-39.1	173.4	-170.4	-177.1	177.5	0	0	111	W145 H243 I245 I249 S250 L251	W145-E247 HydrophobicContact CH2-CB 4.08Å; W145-E247 HydrophobicContact CH2-CG 3.6Å; W145-E247 HydrophobicContact CZ2-CG 4.38Å; W145-E247 HydrophobicContact CZ3-CB 3.85Å; W145-E247 HydrophobicContact CZ3-CG 3.88Å; W145-E247 WeakPolarHBondContact CZ3-OE2 3.4Å; H243-E247 IonicContact CE1-OE2 2.72Å; H243-E247 PolarHBondContact CE1-OE2 3.46Å; H243-E247 IonicContact ND1-OE2 3.64Å; H243-E247 WeakPolarHBondContact O-CB 3.43Å; H243-E247 PolarHBondContact O-N 2.88Å; I245-E247 PolarHBondContact O-N 3.31Å; E247-I249 VanDerWaalsContact C-N 3.33Å; E247-I249 PolarHBondContact O-N 3.44Å; E247-S250 PolarHBondContact O-N 2.66Å; E247-S250 PolarHBondContact O-OG 3.13Å; E247-L251 WeakPolarHBondContact O-CG 3.43Å; E247-L251 PolarHBondContact O-N 3.31Å; E247-L251 VanDerWaalsContact O-N 3.14Å
248	G	94.3	Very high	93	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-60.3	-42.3	172	0	0	0	0	0	112.7	L244 I245 L251 N252 L258	L244-G248 PolarHBondContact O-N 3.46Å; I245-G248 PolarHBondContact O-N 3.2Å; G248-L251 PolarHBondContact O-N 3.27Å; G248-N252 WeakPolarHBondContact O-CB 3.38Å; G248-N252 PolarHBondContact O-N 3.37Å; G248-N252 PolarHBondContact O-ND2 3.08Å; G248-L258 VanDerWaalsContact C-CD1 3.42Å; G248-L258 WeakPolarHBondContact O-CD1 3.42Å
249	I	93.2	Very high	93	Very high	26 Å²	26	48.2 Å²	48.2	13%	0.133	25%	0.248	C	C	.	.	H	α-helix	trans	-67	-41.6	178.1	-71.6	166.5	0	0	0	110.5	I245 T246 E247 L251 N252 P253 L258 H259 L262	I245-I249 HydrophobicContact CG2-CD1 3.77Å; I245-I249 HydrophobicContact CG2-CG1 4.32Å; I245-I249 VanDerWaalsContact O-CG1 3.26Å; I245-I249 WeakPolarHBondContact O-CG1 3.35Å; I245-I249 PolarHBondContact O-N 2.82Å; T246-I249 PolarHBondContact O-N 3.14Å; E247-I249 VanDerWaalsContact C-N 3.33Å; E247-I249 PolarHBondContact O-N 3.44Å; I249-L251 VanDerWaalsContact C-N 3.25Å; I249-L251 PolarHBondContact O-N 3.03Å; I249-N252 CarbonylContact O-C 3.43Å; I249-N252 PolarHBondContact O-N 3.4Å; I249-P253 WeakPolarHBondContact O-CA 3.31Å; I249-P253 WeakPolarHBondContact O-CD 3.49Å; I249-L258 HydrophobicContact CD1-CB 4.43Å; I249-L258 HydrophobicContact CG1-CB 3.67Å; I249-L258 HydrophobicContact CG1-CD1 4.32Å; I249-H259 WeakPolarHBondContact CG2-CE1 3.1Å; I249-L262 HydrophobicContact CD1-CB 4.22Å; I249-L262 HydrophobicContact CD1-CD2 3.83Å
250	S	93.4	Very high	92.9	Very high	87 Å²	87	45.3 Å²	45.3	61%	0.608	24%	0.237	S	C	*	.	H	α-helix	trans	-63.9	-34	178.9	72.7	0	0	0	0	112.1	T246 E247	T246-S250 PolarHBondContact O-N 3.45Å; E247-S250 PolarHBondContact O-N 2.66Å; E247-S250 PolarHBondContact O-OG 3.13Å
251	L	92.3	Very high	92.9	Very high	59 Å²	59	43 Å²	43	31%	0.309	23%	0.226	S	C	.	.	H	α-helix	trans	-79.4	-32.9	175.5	-67.8	173.5	0	0	0	113.3	W145 E247 G248 I249	W145-L251 HydrophobicContact CH2-CD1 4.29Å; W145-L251 HydrophobicContact CZ2-CD1 3.51Å; E247-L251 WeakPolarHBondContact O-CG 3.43Å; E247-L251 PolarHBondContact O-N 3.31Å; E247-L251 VanDerWaalsContact O-N 3.14Å; G248-L251 PolarHBondContact O-N 3.27Å; I249-L251 VanDerWaalsContact C-N 3.25Å; I249-L251 PolarHBondContact O-N 3.03Å
252	N	91.5	Very high	92.8	Very high	22 Å²	22	44 Å²	44	12%	0.118	23%	0.231	C	C	.	.			trans	-134.1	66.8	-174.4	-54	-73	0	0	0	111.4	G138 R139 P142 G248 I249 E254 C255 L258	G138-N252 PolarHBondContact O-ND2 3.37Å; R139-N252 PolarHBondContact O-OD1 2.92Å; P142-N252 HydrophobicContact CB-CB 4.27Å; P142-N252 HydrophobicContact CG-CB 3.86Å; G248-N252 WeakPolarHBondContact O-CB 3.38Å; G248-N252 PolarHBondContact O-N 3.37Å; G248-N252 PolarHBondContact O-ND2 3.08Å; I249-N252 CarbonylContact O-C 3.43Å; I249-N252 PolarHBondContact O-N 3.4Å; N252-E254 PolarHBondContact O-N 2.97Å; N252-E254 VanDerWaalsContact O-N 3.13Å; N252-C255 HydrophobicContact CB-CB 4.25Å; N252-C255 WeakPolarHBondContact O-CB 3.4Å; N252-C255 PolarHBondContact O-N 2.99Å; N252-C255 VanDerWaalsContact O-N 3.1Å; N252-L258 HydrophobicContact CB-CD1 4.16Å
253	P	88.9	Confident	92.7	Very high	63 Å²	63	41.4 Å²	41.4	41%	0.409	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-22.8	-174.3	25.4	-34.9	0	0	0	112.7	I249 C255 H259 R346	I249-P253 WeakPolarHBondContact O-CA 3.31Å; I249-P253 WeakPolarHBondContact O-CD 3.49Å; P253-C255 VanDerWaalsContact C-N 3.29Å; P253-C255 PolarHBondContact O-N 3.37Å; P253-H259 PolarHBondContact O-NE2 3.14Å; P253-R346 PolarHBondContact O-NH2 3.49Å
254	E	87.6	Confident	92.6	Very high	142 Å²	142	39.3 Å²	39.3	66%	0.664	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-11.8	179.2	-56.6	-55.6	166.7	0	0	114.7	N252 D256 R346	N252-E254 PolarHBondContact O-N 2.97Å; N252-E254 VanDerWaalsContact O-N 3.13Å; E254-D256 PolarHBondContact O-N 3.47Å; E254-D256 VanDerWaalsContact O-N 3.09Å; E254-R346 PolarHBondContact O-NH2 3.14Å; E254-R346 IonicContact OE2-CZ 3.58Å; E254-R346 IonicContact OE2-NH1 3.63Å; E254-R346 PolarHBondContact OE2-NH1 2.96Å; E254-R346 IonicContact OE2-NH2 3.89Å; E254-R346 PolarHBondContact OE2-NH2 3.41Å; E254-R346 VanDerWaalsContact OE2-NH2 3.09Å
255	C	90.3	Very high	92.5	Very high	26 Å²	26	39.4 Å²	39.4	18%	0.176	21%	0.212	C	C	.	.			trans	-81.1	95.2	-178.5	-174.5	0	0	0	0	110.9	P142 N252 P253 L257 L258 H259	P142-C255 HydrophobicContact CB-CB 3.88Å; P142-C255 WeakPolarHBondContact CB-SG 3.37Å; P142-C255 HydrophobicContact CG-CB 4.05Å; N252-C255 HydrophobicContact CB-CB 4.25Å; N252-C255 WeakPolarHBondContact O-CB 3.4Å; N252-C255 PolarHBondContact O-N 2.99Å; N252-C255 VanDerWaalsContact O-N 3.1Å; P253-C255 VanDerWaalsContact C-N 3.29Å; P253-C255 PolarHBondContact O-N 3.37Å; C255-L257 PolarHBondContact O-N 3.46Å; C255-L257 VanDerWaalsContact O-N 3.11Å; C255-L258 HydrophobicContact CB-CD1 3.96Å; C255-L258 HydrophobicContact CB-CG 4.17Å; C255-L258 PolarHBondContact O-N 3.06Å; C255-L258 VanDerWaalsContact O-N 3.09Å; C255-H259 PolarHBondContact O-CD2 3.47Å
256	D	90	Very high	92.3	Very high	35 Å²	35	39.8 Å²	39.8	19%	0.187	21%	0.214	C	C	.	.	H	α-helix	trans	-57.8	-26.5	176.9	-64.2	-28.9	0	0	0	113.2	E254 L258 H259 L260 R346 W347 N350 M353	E254-D256 PolarHBondContact O-N 3.47Å; E254-D256 VanDerWaalsContact O-N 3.09Å; D256-L258 VanDerWaalsContact C-N 3.34Å; D256-L258 PolarHBondContact O-N 3.02Å; D256-H259 WeakPolarHBondContact O-CB 3.35Å; D256-H259 PolarHBondContact O-N 3.03Å; D256-L260 PolarHBondContact O-N 2.96Å; D256-R346 IonicContact OD1-CZ 2.89Å; D256-R346 IonicContact OD1-NE 2.78Å; D256-R346 PolarHBondContact OD1-NE 3.16Å; D256-R346 IonicContact OD1-NH2 3.59Å; D256-R346 PolarHBondContact OD1-NH2 3.37Å; D256-W347 HydrophobicContact CB-CZ2 3.93Å; D256-W347 VanDerWaalsContact O-CZ2 3.3Å; D256-W347 WeakPolarHBondContact O-CZ2 3.38Å; D256-W347 PolarHBondContact OD1-NE1 3Å; D256-N350 PolarHBondContact OD2-ND2 2.96Å; D256-M353 HydrophobicContact CB-CE 3.82Å; D256-M353 HydrophobicContact CB-CG 4.03Å; D256-M353 HydrophobicContact CB-SD 4.38Å; D256-M353 WeakPolarHBondContact O-CE 3.21Å
257	L	91.3	Very high	92.1	Very high	60 Å²	60	37 Å²	37	31%	0.314	20%	0.196	S	C	.	.	H	α-helix	trans	-66.4	-35.8	178.1	-170.2	66.4	0	0	0	112.3	R143 I146 C255 H259 L260 E261	R143-L257 HydrophobicContact CG-CD2 4.43Å; I146-L257 HydrophobicContact CD1-CB 4.09Å; I146-L257 HydrophobicContact CD1-CD2 3.39Å; I146-L257 HydrophobicContact CD1-CG 3.41Å; I146-L257 VanDerWaalsContact CD1-CG 3.41Å; C255-L257 PolarHBondContact O-N 3.46Å; C255-L257 VanDerWaalsContact O-N 3.11Å; L257-H259 VanDerWaalsContact C-N 3.34Å; L257-L260 HydrophobicContact CD1-CD2 4.35Å; L257-L260 PolarHBondContact O-N 3.38Å; L257-E261 VanDerWaalsContact O-CG 3.32Å; L257-E261 WeakPolarHBondContact O-CG 3.49Å; L257-E261 PolarHBondContact O-N 3.05Å
258	L	92.9	Very high	91.9	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-65.2	-42.6	177.2	-73.7	173.6	0	0	0	111.7	P142 W145 I146 I245 G248 I249 N252 C255 D256 E261 L262	P142-L258 HydrophobicContact CB-CD1 3.96Å; P142-L258 HydrophobicContact CB-CG 4.27Å; W145-L258 HydrophobicContact CB-CD2 3.81Å; I146-L258 HydrophobicContact CD1-CD2 4.13Å; I146-L258 HydrophobicContact CG1-CD2 3.58Å; I245-L258 WeakPolarHBondContact CG2-O 3.37Å; G248-L258 VanDerWaalsContact C-CD1 3.42Å; G248-L258 WeakPolarHBondContact O-CD1 3.42Å; I249-L258 HydrophobicContact CD1-CB 4.43Å; I249-L258 HydrophobicContact CG1-CB 3.67Å; I249-L258 HydrophobicContact CG1-CD1 4.32Å; N252-L258 HydrophobicContact CB-CD1 4.16Å; C255-L258 HydrophobicContact CB-CD1 3.96Å; C255-L258 HydrophobicContact CB-CG 4.17Å; C255-L258 PolarHBondContact O-N 3.06Å; C255-L258 VanDerWaalsContact O-N 3.09Å; D256-L258 VanDerWaalsContact C-N 3.34Å; D256-L258 PolarHBondContact O-N 3.02Å; L258-E261 PolarHBondContact O-N 3.12Å; L258-L262 PolarHBondContact O-N 3.42Å
259	H	93.5	Very high	91.8	Very high	25 Å²	25	37 Å²	37	12%	0.116	20%	0.199	C	C	.	.	H	α-helix	trans	-60.1	-43.1	175.2	-74.7	-52.6	0	0	0	112.2	I249 P253 C255 D256 L257 L262 A263 L343 W347	I249-H259 WeakPolarHBondContact CG2-CE1 3.1Å; P253-H259 PolarHBondContact O-NE2 3.14Å; C255-H259 PolarHBondContact O-CD2 3.47Å; D256-H259 WeakPolarHBondContact O-CB 3.35Å; D256-H259 PolarHBondContact O-N 3.03Å; L257-H259 VanDerWaalsContact C-N 3.34Å; H259-L262 WeakPolarHBondContact O-CB 3.46Å; H259-L262 PolarHBondContact O-N 3.35Å; H259-A263 PolarHBondContact O-N 2.99Å; H259-A263 VanDerWaalsContact O-N 3.12Å; H259-L343 HydrophobicContact CB-CD2 3.52Å; H259-W347 HydrophobicContact CB-CH2 4.2Å; H259-W347 HydrophobicContact CB-CZ2 3.64Å
260	L	92.2	Very high	91.7	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.01	19%	0.193	C	C	.	.	H	α-helix	trans	-63.3	-40.9	173.5	-179.1	66	0	0	0	112.1	D256 L257 L262 A263 K264 W347 M353 L356 L357	D256-L260 PolarHBondContact O-N 2.96Å; L257-L260 HydrophobicContact CD1-CD2 4.35Å; L257-L260 PolarHBondContact O-N 3.38Å; L260-L262 VanDerWaalsContact C-N 3.33Å; L260-A263 PolarHBondContact O-N 2.92Å; L260-K264 WeakPolarHBondContact O-CG 3.38Å; L260-K264 PolarHBondContact O-N 3.18Å; L260-W347 HydrophobicContact CB-CH2 3.91Å; L260-W347 HydrophobicContact CD1-CH2 4.43Å; L260-M353 HydrophobicContact CB-CE 3.64Å; L260-M353 HydrophobicContact CD2-CE 3.78Å; L260-M353 HydrophobicContact CG-CE 4.25Å; L260-L356 HydrophobicContact CD2-CB 3.87Å; L260-L356 HydrophobicContact CD2-CD1 4.09Å; L260-L357 HydrophobicContact CD1-CB 4.08Å; L260-L357 HydrophobicContact CD1-CD1 4.06Å
261	E	93.2	Very high	91.5	Very high	45 Å²	45	34.7 Å²	34.7	21%	0.21	18%	0.18	C	C	.	.	H	α-helix	trans	-69.4	-30.5	177.3	-66.9	-61.8	147	0	0	112.5	I146 I245 L257 L258 K264 L265	I146-E261 HydrophobicContact CB-CG 4.43Å; I146-E261 HydrophobicContact CD1-CG 3.94Å; I146-E261 HydrophobicContact CG1-CB 4.45Å; I146-E261 HydrophobicContact CG1-CG 3.97Å; I146-E261 HydrophobicContact CG2-CG 3.7Å; I245-E261 HydrophobicContact CD1-CB 4.21Å; L257-E261 VanDerWaalsContact O-CG 3.32Å; L257-E261 WeakPolarHBondContact O-CG 3.49Å; L257-E261 PolarHBondContact O-N 3.05Å; L258-E261 PolarHBondContact O-N 3.12Å; E261-K264 PolarHBondContact O-N 3.49Å; E261-K264 IonicContact OE1-NZ 3.73Å; E261-K264 PolarHBondContact OE1-NZ 3.33Å; E261-K264 WeakPolarHBondContact OE2-CD 3.31Å; E261-L265 WeakPolarHBondContact O-CB 3.31Å; E261-L265 PolarHBondContact O-N 3.45Å
262	L	94.9	Very high	91.5	Very high	22 Å²	22	32.4 Å²	32.4	12%	0.115	17%	0.168	C	C	.	.	H	α-helix	trans	-62.4	-46.9	169.9	-174.3	60.5	0	0	0	110.9	R242 I245 T246 I249 L258 H259 L260 K264 L265 E266 V339	R242-L262 HydrophobicContact CG-CD1 4.4Å; I245-L262 HydrophobicContact CG2-CB 3.74Å; I245-L262 HydrophobicContact CG2-CD1 4.13Å; I245-L262 HydrophobicContact CG2-CG 4.44Å; T246-L262 HydrophobicContact CG2-CD1 4.47Å; I249-L262 HydrophobicContact CD1-CB 4.22Å; I249-L262 HydrophobicContact CD1-CD2 3.83Å; L258-L262 PolarHBondContact O-N 3.42Å; H259-L262 WeakPolarHBondContact O-CB 3.46Å; H259-L262 PolarHBondContact O-N 3.35Å; L260-L262 VanDerWaalsContact C-N 3.33Å; L262-K264 PolarHBondContact O-N 3.2Å; L262-L265 WeakPolarHBondContact O-CB 3.44Å; L262-L265 PolarHBondContact O-N 3.29Å; L262-L265 VanDerWaalsContact O-N 3.15Å; L262-E266 PolarHBondContact O-N 2.64Å; L262-V339 HydrophobicContact CD2-CG1 4.35Å; L262-V339 HydrophobicContact CD2-CG2 4.29Å; L262-V339 HydrophobicContact CG-CG1 4.29Å; L262-V339 HydrophobicContact CG-CG2 4.4Å
263	A	92.2	Very high	91.4	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.008	16%	0.162	C	C	.	.	H	α-helix	trans	-59.4	-46.3	176.7	0	0	0	0	0	111.9	H259 L260 L265 E266 I267 V339 L343 L357	H259-A263 PolarHBondContact O-N 2.99Å; H259-A263 VanDerWaalsContact O-N 3.12Å; L260-A263 PolarHBondContact O-N 2.92Å; A263-L265 VanDerWaalsContact C-N 3.29Å; A263-L265 PolarHBondContact O-N 3.13Å; A263-E266 PolarHBondContact O-N 3.03Å; A263-I267 VanDerWaalsContact O-CG1 3.29Å; A263-I267 WeakPolarHBondContact O-CG1 3.21Å; A263-I267 PolarHBondContact O-N 3.38Å; A263-V339 HydrophobicContact CB-CG1 4.04Å; A263-L343 HydrophobicContact CB-CD1 3.78Å; A263-L357 HydrophobicContact CB-CD1 3.99Å
264	K	92.5	Very high	91.4	Very high	58 Å²	58	33.7 Å²	33.7	25%	0.252	16%	0.163	S	C	.	.	H	α-helix	trans	-58.6	-41	174.6	-70.3	172.3	-175.6	171.3	0	112.1	L260 E261 L262 N268 T360	L260-K264 WeakPolarHBondContact O-CG 3.38Å; L260-K264 PolarHBondContact O-N 3.18Å; E261-K264 PolarHBondContact O-N 3.49Å; E261-K264 IonicContact OE1-NZ 3.73Å; E261-K264 PolarHBondContact OE1-NZ 3.33Å; E261-K264 WeakPolarHBondContact OE2-CD 3.31Å; L262-K264 PolarHBondContact O-N 3.2Å; K264-N268 VanDerWaalsContact O-CG 3.29Å; K264-N268 PolarHBondContact O-N 2.87Å; K264-N268 PolarHBondContact O-ND2 3.24Å; K264-N268 VanDerWaalsContact O-ND2 3.12Å; K264-T360 HydrophobicContact CD-CG2 4.08Å; K264-T360 HydrophobicContact CG-CG2 3.78Å
265	L	93.8	Very high	91.4	Very high	9 Å²	9	30.4 Å²	30.4	5%	0.047	15%	0.152	C	C	.	.	H	α-helix	trans	-65	-43.5	177.8	179.3	133.8	0	0	0	111.6	I238 A241 R242 I245 E261 L262 A263 N268 A269	I238-L265 HydrophobicContact CG2-CD2 4.36Å; A241-L265 HydrophobicContact CB-CD1 3.28Å; R242-L265 HydrophobicContact CB-CD2 3.77Å; R242-L265 HydrophobicContact CG-CD2 4.22Å; I245-L265 HydrophobicContact CD1-CB 4.27Å; I245-L265 HydrophobicContact CD1-CD1 4.07Å; E261-L265 WeakPolarHBondContact O-CB 3.31Å; E261-L265 PolarHBondContact O-N 3.45Å; L262-L265 WeakPolarHBondContact O-CB 3.44Å; L262-L265 PolarHBondContact O-N 3.29Å; L262-L265 VanDerWaalsContact O-N 3.15Å; A263-L265 VanDerWaalsContact C-N 3.29Å; A263-L265 PolarHBondContact O-N 3.13Å; L265-N268 PolarHBondContact O-N 3.43Å; L265-A269 WeakPolarHBondContact O-CB 3.49Å; L265-A269 PolarHBondContact O-N 3.48Å
266	E	91.6	Very high	91.3	Very high	11 Å²	11	34 Å²	34	5%	0.051	16%	0.162	C	C	.	.	H	α-helix	trans	-68.5	-34.6	178.1	-64.2	-49.7	149.4	0	0	112.6	R242 L262 A263 A269 L270 V336 V339	R242-E266 IonicContact CZ-OE1 3.6Å; R242-E266 IonicContact CZ-OE2 3.65Å; R242-E266 IonicContact NE-OE1 3.64Å; R242-E266 PolarHBondContact NE-OE1 2.99Å; R242-E266 IonicContact NE-OE2 2.73Å; R242-E266 IonicContact NH2-OE1 3.39Å; R242-E266 PolarHBondContact NH2-OE1 3.4Å; R242-E266 IonicContact NH2-OE2 2.65Å; R242-E266 PolarHBondContact NH2-OE2 3.21Å; L262-E266 PolarHBondContact O-N 2.64Å; A263-E266 PolarHBondContact O-N 3.03Å; E266-A269 WeakPolarHBondContact O-CB 3.41Å; E266-A269 PolarHBondContact O-N 3.12Å; E266-L270 WeakPolarHBondContact O-CB 3.5Å; E266-L270 PolarHBondContact O-N 3.17Å; E266-V336 VanDerWaalsContact C-CG2 3.49Å; E266-V336 HydrophobicContact CB-CG2 3.8Å; E266-V336 WeakPolarHBondContact O-CG2 3.48Å; E266-V339 HydrophobicContact CG-CG2 4.04Å
267	I	90.3	Very high	91.3	Very high	6 Å²	6	32.3 Å²	32.3	3%	0.031	15%	0.153	C	C	.	.	H	α-helix	trans	-61.7	-45.8	171.9	-66.9	162.9	0	0	0	110.4	A263 A269 L270 D271 V336 L361 V364 I368	A263-I267 VanDerWaalsContact O-CG1 3.29Å; A263-I267 WeakPolarHBondContact O-CG1 3.21Å; A263-I267 PolarHBondContact O-N 3.38Å; I267-A269 VanDerWaalsContact C-N 3.29Å; I267-A269 PolarHBondContact O-N 2.95Å; I267-L270 PolarHBondContact O-N 2.66Å; I267-D271 PolarHBondContact O-N 2.84Å; I267-D271 VanDerWaalsContact O-N 3.07Å; I267-V336 HydrophobicContact CG1-CG1 4.02Å; I267-V336 HydrophobicContact CG1-CG2 4.34Å; I267-L361 HydrophobicContact CD1-CD2 3.75Å; I267-V364 HydrophobicContact CG2-CB 4.18Å; I267-V364 HydrophobicContact CG2-CG2 4.04Å; I267-I368 HydrophobicContact CD1-CD1 4.24Å; I267-I368 HydrophobicContact CG1-CD1 4.19Å; I267-I368 HydrophobicContact CG2-CD1 4.23Å
268	N	90.4	Very high	91.1	Very high	78 Å²	78	31.1 Å²	31.1	42%	0.417	15%	0.147	S	C	.	.	H	α-helix	trans	-63.9	-35.5	175.4	-72.2	-34	0	0	0	112.2	K264 L265 F272	K264-N268 VanDerWaalsContact O-CG 3.29Å; K264-N268 PolarHBondContact O-N 2.87Å; K264-N268 PolarHBondContact O-ND2 3.24Å; K264-N268 VanDerWaalsContact O-ND2 3.12Å; L265-N268 PolarHBondContact O-N 3.43Å; N268-F272 PolarHBondContact O-N 3.49Å; N268-F272 VanDerWaalsContact O-N 3.09Å
269	A	91.7	Very high	90.7	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-66	-48.5	175.2	0	0	0	0	0	110.5	I238 L265 E266 I267 D271 F272 F273	I238-A269 HydrophobicContact CD1-CB 4.43Å; I238-A269 HydrophobicContact CG2-CB 3.86Å; L265-A269 WeakPolarHBondContact O-CB 3.49Å; L265-A269 PolarHBondContact O-N 3.48Å; E266-A269 WeakPolarHBondContact O-CB 3.41Å; E266-A269 PolarHBondContact O-N 3.12Å; I267-A269 VanDerWaalsContact C-N 3.29Å; I267-A269 PolarHBondContact O-N 2.95Å; A269-D271 VanDerWaalsContact C-N 3.31Å; A269-D271 PolarHBondContact O-N 3.23Å; A269-F272 WeakPolarHBondContact O-CB 3.44Å; A269-F272 PolarHBondContact O-N 3.01Å; A269-F272 VanDerWaalsContact O-N 3.07Å; A269-F273 VanDerWaalsContact O-CD2 3.26Å; A269-F273 WeakPolarHBondContact O-CD2 3.4Å; A269-F273 PolarHBondContact O-N 2.93Å
270	L	90.7	Very high	90.3	Very high	3 Å²	3	34 Å²	34	2%	0.016	16%	0.164	C	C	.	.	H	α-helix	trans	-52.5	-48	176	168.3	62.8	0	0	0	111.7	E266 I267 F273 R274 I330 V331 V336 I367	E266-L270 WeakPolarHBondContact O-CB 3.5Å; E266-L270 PolarHBondContact O-N 3.17Å; I267-L270 PolarHBondContact O-N 2.66Å; L270-F273 PolarHBondContact O-N 3.15Å; L270-R274 VanDerWaalsContact O-CB 3.3Å; L270-R274 WeakPolarHBondContact O-CB 3.36Å; L270-R274 PolarHBondContact O-N 2.78Å; L270-I330 WeakPolarHBondContact CD1-O 3.41Å; L270-V331 WeakPolarHBondContact CD1-O 3.47Å; L270-V336 HydrophobicContact CB-CG2 4Å; L270-V336 HydrophobicContact CD2-CG2 3.93Å; L270-I367 HydrophobicContact CD1-CG2 3.98Å; L270-I367 HydrophobicContact CD2-CB 4.48Å; L270-I367 HydrophobicContact CD2-CG2 3.62Å; L270-I367 HydrophobicContact CG-CG2 3.48Å; L270-I367 VanDerWaalsContact CG-CG2 3.48Å
271	D	89.8	Confident	89.9	Confident	62 Å²	62	39.1 Å²	39.1	33%	0.332	18%	0.184	S	C	.	.	H	α-helix	trans	-58.6	-48.6	174.5	178.6	55.1	0	0	0	112.2	I267 A269 F273 R274 T275 I367	I267-D271 PolarHBondContact O-N 2.84Å; I267-D271 VanDerWaalsContact O-N 3.07Å; A269-D271 VanDerWaalsContact C-N 3.31Å; A269-D271 PolarHBondContact O-N 3.23Å; D271-F273 PolarHBondContact O-N 3.45Å; D271-R274 PolarHBondContact O-N 2.86Å; D271-T275 WeakPolarHBondContact O-CB 3.32Å; D271-T275 WeakPolarHBondContact O-CG2 3.4Å; D271-T275 PolarHBondContact O-N 2.91Å; D271-T275 PolarHBondContact O-OG1 3.33Å; D271-T275 WeakPolarHBondContact OD1-CG2 3.01Å; D271-I367 HydrophobicContact CB-CD1 3.77Å; D271-I367 WeakPolarHBondContact OD1-CD1 3.5Å
272	F	91.2	Very high	89.4	Confident	11 Å²	11	43.3 Å²	43.3	5%	0.048	20%	0.202	C	C	.	.	H	α-helix	trans	-60.1	-45.2	178.3	173.1	-98.9	0	0	0	112.6	D231 H234 L235 I238 N268 A269 R276 V277	D231-F272 HydrophobicContact CB-CE2 4.48Å; D231-F272 HydrophobicContact CB-CZ 4.41Å; H234-F272 HydrophobicContact CB-CD2 4.2Å; H234-F272 HydrophobicContact CB-CE2 3.67Å; H234-F272 HydrophobicContact CB-CZ 4.15Å; L235-F272 HydrophobicContact CB-CE1 4.12Å; L235-F272 HydrophobicContact CB-CZ 4.2Å; L235-F272 HydrophobicContact CD1-CE1 4.2Å; I238-F272 HydrophobicContact CD1-CB 4.02Å; I238-F272 HydrophobicContact CD1-CD1 3.76Å; I238-F272 HydrophobicContact CD1-CE1 4.42Å; I238-F272 HydrophobicContact CD1-CG 3.9Å; N268-F272 PolarHBondContact O-N 3.49Å; N268-F272 VanDerWaalsContact O-N 3.09Å; A269-F272 WeakPolarHBondContact O-CB 3.44Å; A269-F272 PolarHBondContact O-N 3.01Å; A269-F272 VanDerWaalsContact O-N 3.07Å; F272-R276 HydrophobicContact CD2-CB 4.25Å; F272-R276 HydrophobicContact CD2-CG 4.17Å; F272-R276 HydrophobicContact CE2-CB 4.16Å; F272-R276 HydrophobicContact CE2-CG 4.36Å; F272-R276 WeakPolarHBondContact O-CA 3.13Å; F272-R276 WeakPolarHBondContact O-CB 3.42Å; F272-R276 PolarHBondContact O-N 3.05Å; F272-V277 HydrophobicContact CD1-CG2 4.01Å; F272-V277 HydrophobicContact CE1-CG2 3.57Å; F272-V277 HydrophobicContact CZ-CG2 4.18Å; F272-V277 PolarHBondContact O-N 3.18Å
273	F	91.1	Very high	88.7	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.219	C	C	.	.	I	π-helix	trans	-67	-42	-179.9	-86	-95	0	0	0	111.4	L235 A269 L270 D271 V277 L278 V323 E325 T327 I330 V331	L235-F273 HydrophobicContact CD1-CE2 4.21Å; L235-F273 HydrophobicContact CD1-CZ 3.78Å; A269-F273 VanDerWaalsContact O-CD2 3.26Å; A269-F273 WeakPolarHBondContact O-CD2 3.4Å; A269-F273 PolarHBondContact O-N 2.93Å; L270-F273 PolarHBondContact O-N 3.15Å; D271-F273 PolarHBondContact O-N 3.45Å; F273-V277 HydrophobicContact CB-CB 4.47Å; F273-V277 HydrophobicContact CD1-CB 3.92Å; F273-V277 HydrophobicContact CD1-CG1 3.97Å; F273-V277 HydrophobicContact CD1-CG2 3.89Å; F273-V277 HydrophobicContact CE1-CG1 4.31Å; F273-V277 HydrophobicContact CE1-CG2 4.28Å; F273-V277 HydrophobicContact CG-CB 4.4Å; F273-V277 HydrophobicContact CG-CG2 4.18Å; F273-V277 CarbonylContact O-C 3.6Å; F273-V277 WeakPolarHBondContact O-CB 3.41Å; F273-V277 PolarHBondContact O-N 3.48Å; F273-V277 VanDerWaalsContact O-N 3.15Å; F273-L278 PolarHBondContact O-N 3.09Å; F273-V323 HydrophobicContact CE1-CG1 3.87Å; F273-E325 HydrophobicContact CE1-CB 4.17Å; F273-E325 HydrophobicContact CZ-CB 4.03Å; F273-E325 HydrophobicContact CZ-CG 4.08Å; F273-T327 HydrophobicContact CD1-CG2 4.27Å; F273-T327 HydrophobicContact CE1-CG2 4.23Å; F273-I330 HydrophobicContact CB-CG2 3.8Å; F273-I330 HydrophobicContact CD1-CD1 4.35Å; F273-I330 HydrophobicContact CD1-CG2 4.41Å; F273-I330 HydrophobicContact CD2-CD1 4.31Å; F273-I330 HydrophobicContact CD2-CG2 3.84Å; F273-I330 HydrophobicContact CE1-CD1 4.07Å; F273-I330 HydrophobicContact CE2-CD1 4.03Å; F273-I330 HydrophobicContact CG-CB 4.39Å; F273-I330 HydrophobicContact CG-CD1 4.48Å; F273-I330 HydrophobicContact CG-CG2 3.76Å; F273-I330 HydrophobicContact CZ-CD1 3.91Å; F273-V331 HydrophobicContact CB-CG2 4.11Å
274	R	88.2	Confident	87.9	Confident	112 Å²	112	47.2 Å²	47.2	42%	0.423	22%	0.223	S	C	.	.	I	π-helix	trans	-68.8	-43.8	178.8	-171.3	174.5	179.5	160.5	-6.2	112.8	L270 D271	L270-R274 VanDerWaalsContact O-CB 3.3Å; L270-R274 WeakPolarHBondContact O-CB 3.36Å; L270-R274 PolarHBondContact O-N 2.78Å; D271-R274 PolarHBondContact O-N 2.86Å
275	T	88.1	Confident	86.9	Confident	73 Å²	73	49.2 Å²	49.2	45%	0.448	24%	0.237	S	C	.	.	I	π-helix	trans	-83.6	-31.5	-174.5	59.4	0	0	0	0	113.5	D271 P279	D271-T275 WeakPolarHBondContact O-CB 3.32Å; D271-T275 WeakPolarHBondContact O-CG2 3.4Å; D271-T275 PolarHBondContact O-N 2.91Å; D271-T275 PolarHBondContact O-OG1 3.33Å; D271-T275 WeakPolarHBondContact OD1-CG2 3.01Å; T275-P279 WeakPolarHBondContact O-CG 3.48Å
276	R	88.7	Confident	85.3	Confident	101 Å²	101	50.7 Å²	50.7	38%	0.381	25%	0.246	S	C	.	.	I	π-helix	trans	-118.6	-34.5	-171.3	-51.9	-158.9	-173.9	-175.7	2.7	115.1	D231 F272 R280	D231-R276 WeakPolarHBondContact OD1-CD 3.41Å; D231-R276 IonicContact OD1-CZ 3.22Å; D231-R276 IonicContact OD1-NE 2.81Å; D231-R276 IonicContact OD1-NH1 3.14Å; D231-R276 PolarHBondContact OD1-NH1 3.23Å; F272-R276 HydrophobicContact CD2-CB 4.25Å; F272-R276 HydrophobicContact CD2-CG 4.17Å; F272-R276 HydrophobicContact CE2-CB 4.16Å; F272-R276 HydrophobicContact CE2-CG 4.36Å; F272-R276 WeakPolarHBondContact O-CA 3.13Å; F272-R276 WeakPolarHBondContact O-CB 3.42Å; F272-R276 PolarHBondContact O-N 3.05Å; R276-R280 WeakPolarHBondContact O-CD 3.33Å; R276-R280 WeakPolarHBondContact O-CG 3.43Å
277	V	88.6	Confident	83.7	Confident	0 Å²	0	56 Å²	56	0%	0	28%	0.275	C	S	.	.	I	π-helix	trans	-88.1	-48.5	-176.5	-176.8	0	0	0	0	111	F272 F273 R280 Y281 F319 M320 V323 T327	F272-V277 HydrophobicContact CD1-CG2 4.01Å; F272-V277 HydrophobicContact CE1-CG2 3.57Å; F272-V277 HydrophobicContact CZ-CG2 4.18Å; F272-V277 PolarHBondContact O-N 3.18Å; F273-V277 HydrophobicContact CB-CB 4.47Å; F273-V277 HydrophobicContact CD1-CB 3.92Å; F273-V277 HydrophobicContact CD1-CG1 3.97Å; F273-V277 HydrophobicContact CD1-CG2 3.89Å; F273-V277 HydrophobicContact CE1-CG1 4.31Å; F273-V277 HydrophobicContact CE1-CG2 4.28Å; F273-V277 HydrophobicContact CG-CB 4.4Å; F273-V277 HydrophobicContact CG-CG2 4.18Å; F273-V277 CarbonylContact O-C 3.6Å; F273-V277 WeakPolarHBondContact O-CB 3.41Å; F273-V277 PolarHBondContact O-N 3.48Å; F273-V277 VanDerWaalsContact O-N 3.15Å; V277-R280 WeakPolarHBondContact O-CA 3.35Å; V277-R280 WeakPolarHBondContact O-CB 3.42Å; V277-R280 PolarHBondContact O-N 3.31Å; V277-Y281 PolarHBondContact O-N 3.3Å; V277-F319 HydrophobicContact CG1-CE1 4.48Å; V277-F319 HydrophobicContact CG2-CE1 4.24Å; V277-M320 HydrophobicContact CG1-CE 3.88Å; V277-M320 HydrophobicContact CG1-SD 3.98Å; V277-V323 HydrophobicContact CG1-CG1 4.47Å; V277-V323 HydrophobicContact CG1-CG2 4.29Å; V277-T327 HydrophobicContact CG1-CG2 3.99Å
278	L	86.8	Confident	82	Confident	35 Å²	35	58.2 Å²	58.2	18%	0.183	29%	0.291	C	S	.	.	H	α-helix	trans	-56.2	-44.7	-178.5	-179.5	71.6	0	0	0	113.4	F273 R280 Y281 K282 V331	F273-L278 PolarHBondContact O-N 3.09Å; L278-R280 PolarHBondContact O-N 3.36Å; L278-Y281 WeakPolarHBondContact O-CB 3.49Å; L278-Y281 PolarHBondContact O-N 3.11Å; L278-K282 HydrophobicContact CG-CD 4.48Å; L278-K282 WeakPolarHBondContact O-CG 3.38Å; L278-K282 PolarHBondContact O-N 3.25Å; L278-V331 HydrophobicContact CB-CG2 4.23Å; L278-V331 HydrophobicContact CD1-CG1 4.49Å; L278-V331 HydrophobicContact CD2-CG1 3.94Å
279	P	86.1	Confident	80.1	Confident	55 Å²	55	55.2 Å²	55.2	36%	0.357	28%	0.277	S	S	.	.	H	α-helix	trans	-62.8	-30.2	176.9	-23.4	36	0	0	0	112.9	T275 N283	T275-P279 WeakPolarHBondContact O-CG 3.48Å; P279-N283 WeakPolarHBondContact O-CB 3.49Å; P279-N283 PolarHBondContact O-N 3.39Å; P279-N283 PolarHBondContact O-ND2 2.93Å
280	R	83.9	Confident	78.1	Confident	31 Å²	31	57.7 Å²	57.7	12%	0.117	29%	0.29	C	S	.	.	H	α-helix	trans	-75.1	-39.3	176.7	-63.9	179.1	-179.7	-76.5	5.7	111.6	D231 R276 V277 L278 N283 C284 N316 M320	D231-R280 IonicContact OD2-CZ 3.52Å; D231-R280 IonicContact OD2-NE 3.43Å; D231-R280 PolarHBondContact OD2-NE 2.78Å; D231-R280 IonicContact OD2-NH2 3.69Å; D231-R280 PolarHBondContact OD2-NH2 3.26Å; R276-R280 WeakPolarHBondContact O-CD 3.33Å; R276-R280 WeakPolarHBondContact O-CG 3.43Å; V277-R280 WeakPolarHBondContact O-CA 3.35Å; V277-R280 WeakPolarHBondContact O-CB 3.42Å; V277-R280 PolarHBondContact O-N 3.31Å; L278-R280 PolarHBondContact O-N 3.36Å; R280-N283 CarbonylContact O-C 3.58Å; R280-N283 PolarHBondContact O-N 2.95Å; R280-C284 PolarHBondContact O-N 3.38Å; R280-C284 PolarHBondContact O-SG 3.34Å; R280-N316 HydrophobicContact CB-CB 4.38Å; R280-N316 WeakPolarHBondContact CG-OD1 3.32Å; R280-N316 PolarHBondContact NH1-OD1 3.28Å; R280-M320 HydrophobicContact CB-SD 4.34Å
281	Y	83.4	Confident	76.3	Confident	108 Å²	108	62 Å²	62	42%	0.424	32%	0.317	S	S	.	.	H	α-helix	trans	-58.2	-49.4	174.2	-178	-113.5	0	0	0	110.9	V277 L278 N283 C284 M320	V277-Y281 PolarHBondContact O-N 3.3Å; L278-Y281 WeakPolarHBondContact O-CB 3.49Å; L278-Y281 PolarHBondContact O-N 3.11Å; Y281-N283 PolarHBondContact O-N 3.41Å; Y281-C284 WeakPolarHBondContact O-CB 3.32Å; Y281-C284 PolarHBondContact O-N 3.12Å; Y281-M320 HydrophobicContact CD2-CE 3.91Å; Y281-M320 HydrophobicContact CG-CE 4.39Å
282	K	82.9	Confident	74.6	Confident	134 Å²	134	62.2 Å²	62.2	58%	0.583	32%	0.323	S	S	*	.	H	α-helix	trans	-60.6	-31.2	176.4	-68.3	-178.4	178.6	-174.9	0	113.5	L278	L278-K282 HydrophobicContact CG-CD 4.48Å; L278-K282 WeakPolarHBondContact O-CG 3.38Å; L278-K282 PolarHBondContact O-N 3.25Å
283	N	81.1	Confident	72.7	Confident	90 Å²	90	61.9 Å²	61.9	48%	0.481	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	20	-178.2	-63.9	-15.5	0	0	0	113.4	P279 R280 Y281 N316	P279-N283 WeakPolarHBondContact O-CB 3.49Å; P279-N283 PolarHBondContact O-N 3.39Å; P279-N283 PolarHBondContact O-ND2 2.93Å; R280-N283 CarbonylContact O-C 3.58Å; R280-N283 PolarHBondContact O-N 2.95Å; Y281-N283 PolarHBondContact O-N 3.41Å; N283-N316 PolarHBondContact O-ND2 2.89Å
284	C	74.4	Confident	70.8	Confident	14 Å²	14	66.4 Å²	66.4	10%	0.095	35%	0.346	C	S	.	.			trans	-76.3	-30.9	175.2	-78.5	0	0	0	0	112.5	R280 Y281 K317 M320	R280-C284 PolarHBondContact O-N 3.38Å; R280-C284 PolarHBondContact O-SG 3.34Å; Y281-C284 WeakPolarHBondContact O-CB 3.32Å; Y281-C284 PolarHBondContact O-N 3.12Å; C284-K317 HydrophobicContact CB-CG 4.21Å; C284-K317 WeakPolarHBondContact O-CE 3.47Å; C284-M320 VanDerWaalsContact SG-CG 3.51Å
285	D	71.9	Confident	69.2	Low	100 Å²	100	68.3 Å²	68.3	54%	0.535	36%	0.363	S	S	.	.			trans	-89	119.8	-176.7	-66.5	-30.5	0	0	0	111.4	D287 S288 A289	D285-D287 PolarHBondContact O-N 3.37Å; D285-S288 PolarHBondContact O-N 3.45Å; D285-S288 PolarHBondContact O-OG 3.28Å; D285-A289 PolarHBondContact O-N 3.17Å
286	V	59.5	Low	67.8	Low	40 Å²	40	69.9 Å²	69.9	24%	0.242	38%	0.377	C	S	.	.	H	α-helix	trans	-60.9	-31.9	179.7	-177.6	0	0	0	0	110.8	S288 A289 N290 E310 A313	V286-S288 PolarHBondContact O-N 3.06Å; V286-A289 WeakPolarHBondContact O-CA 3.48Å; V286-A289 WeakPolarHBondContact O-CB 3.29Å; V286-A289 PolarHBondContact O-N 3.48Å; V286-N290 PolarHBondContact O-N 3.37Å; V286-E310 HydrophobicContact CG1-CG 3.96Å; V286-A313 HydrophobicContact CG2-CB 3.81Å
287	D	59.1	Low	66	Low	123 Å²	123	68.2 Å²	68.2	66%	0.658	38%	0.375	S	S	*	.	H	α-helix	trans	-66.8	-35.6	-179.3	-59.4	-36.1	0	0	0	112.5	D285 A289 N290 T291	D285-D287 PolarHBondContact O-N 3.37Å; D287-A289 VanDerWaalsContact C-N 3.3Å; D287-A289 PolarHBondContact O-N 3.05Å; D287-N290 PolarHBondContact O-N 3.09Å; D287-T291 PolarHBondContact O-N 3.32Å; D287-T291 PolarHBondContact O-OG1 2.93Å
288	S	55.3	Low	64.5	Low	53 Å²	53	74.7 Å²	74.7	37%	0.371	41%	0.41	S	S	.	.	H	α-helix	trans	-65.3	-35.8	171.6	75.2	0	0	0	0	111.6	D285 V286 T291 S292	D285-S288 PolarHBondContact O-N 3.45Å; D285-S288 PolarHBondContact O-OG 3.28Å; V286-S288 PolarHBondContact O-N 3.06Å; S288-T291 WeakPolarHBondContact O-CB 3.5Å; S288-T291 PolarHBondContact O-N 3.46Å; S288-S292 PolarHBondContact O-N 3.28Å
289	A	49.3	Very low	63.5	Low	14 Å²	14	75.5 Å²	75.5	12%	0.116	43%	0.427	C	S	.	.	H	α-helix	trans	-72.1	-33.5	178.7	0	0	0	0	0	112.4	D285 V286 D287 T291 S292 A293 L309	D285-A289 PolarHBondContact O-N 3.17Å; V286-A289 WeakPolarHBondContact O-CA 3.48Å; V286-A289 WeakPolarHBondContact O-CB 3.29Å; V286-A289 PolarHBondContact O-N 3.48Å; D287-A289 VanDerWaalsContact C-N 3.3Å; D287-A289 PolarHBondContact O-N 3.05Å; A289-T291 VanDerWaalsContact C-N 3.34Å; A289-T291 PolarHBondContact O-N 3.36Å; A289-S292 PolarHBondContact O-N 3.4Å; A289-S292 PolarHBondContact O-OG 3.14Å; A289-A293 PolarHBondContact O-N 3.04Å; A289-A293 VanDerWaalsContact O-N 3.12Å; A289-L309 HydrophobicContact CB-CB 4.17Å; A289-L309 HydrophobicContact CB-CD1 4.29Å
290	N	50	Low	62.2	Low	53 Å²	53	76.9 Å²	76.9	28%	0.283	44%	0.437	S	S	.	.	H	α-helix	trans	-57	-48.1	172	-71.8	-22.5	0	0	0	111.1	V286 D287 S292 A293 D294 L306	V286-N290 PolarHBondContact O-N 3.37Å; D287-N290 PolarHBondContact O-N 3.09Å; N290-S292 VanDerWaalsContact C-N 3.25Å; N290-S292 PolarHBondContact O-N 3.27Å; N290-A293 PolarHBondContact O-N 3.43Å; N290-D294 PolarHBondContact O-N 3.46Å; N290-L306 WeakPolarHBondContact OD1-CD1 3.29Å
291	T	53.9	Low	61.4	Low	94 Å²	94	79.7 Å²	79.7	58%	0.577	45%	0.454	S	S	*	.	H	α-helix	trans	-57.4	-37.7	177.1	-38.9	0	0	0	0	112	D287 S288 A289	D287-T291 PolarHBondContact O-N 3.32Å; D287-T291 PolarHBondContact O-OG1 2.93Å; S288-T291 WeakPolarHBondContact O-CB 3.5Å; S288-T291 PolarHBondContact O-N 3.46Å; A289-T291 VanDerWaalsContact C-N 3.34Å; A289-T291 PolarHBondContact O-N 3.36Å
292	S	52.5	Low	60.7	Low	65 Å²	65	78 Å²	78	46%	0.455	45%	0.449	S	S	.	.	H	α-helix	trans	-74.1	-22.4	176.9	80.6	0	0	0	0	114.4	S288 A289 N290	S288-S292 PolarHBondContact O-N 3.28Å; A289-S292 PolarHBondContact O-N 3.4Å; A289-S292 PolarHBondContact O-OG 3.14Å; N290-S292 VanDerWaalsContact C-N 3.25Å; N290-S292 PolarHBondContact O-N 3.27Å
293	A	51.4	Low	60.2	Low	4 Å²	4	79 Å²	79	3%	0.033	45%	0.453	C	S	.	.	H	α-helix	trans	-87	-19.7	179.7	0	0	0	0	0	112.7	A289 N290 I295 L309	A289-A293 PolarHBondContact O-N 3.04Å; A289-A293 VanDerWaalsContact O-N 3.12Å; N290-A293 PolarHBondContact O-N 3.43Å; A293-I295 VanDerWaalsContact C-N 3.3Å; A293-I295 PolarHBondContact O-N 3.19Å; A293-L309 HydrophobicContact CB-CD1 4.28Å
294	D	52.2	Low	59.7	Low	96 Å²	96	81.1 Å²	81.1	51%	0.513	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-20.9	-173.3	-77.7	-29.4	0	0	0	114.7	N290 S296 K302	N290-D294 PolarHBondContact O-N 3.46Å; D294-S296 PolarHBondContact O-N 2.91Å; D294-K302 WeakPolarHBondContact OD1-CE 3.48Å; D294-K302 IonicContact OD1-NZ 2.68Å; D294-K302 PolarHBondContact OD1-NZ 3.42Å
295	I	55	Low	59.7	Low	151 Å²	151	84.5 Å²	84.5	77%	0.774	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-16.8	-164	-60.3	174.7	0	0	0	114.9	A293	A293-I295 VanDerWaalsContact C-N 3.3Å; A293-I295 PolarHBondContact O-N 3.19Å
296	S	57.7	Low	59.9	Low	106 Å²	106	82 Å²	82	74%	0.741	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-156.6	2.9	-167.6	168.8	0	0	0	0	120.5	D294	D294-S296 PolarHBondContact O-N 2.91Å
297	L	51.6	Low	60.7	Low	66 Å²	66	86.4 Å²	86.4	35%	0.346	47%	0.474	S	S	.	.			trans	-119.9	133.7	-168.1	-70.6	165	0	0	0	116.3	N301 K302 K305	L297-N301 HydrophobicContact CD2-CB 4.31Å; L297-K302 HydrophobicContact CB-CB 4.32Å; L297-K305 HydrophobicContact CD1-CB 4.35Å; L297-K305 HydrophobicContact CD1-CD 3.25Å; L297-K305 HydrophobicContact CD1-CG 4.41Å
298	N	56.9	Low	61.5	Low	136 Å²	136	82.7 Å²	82.7	73%	0.727	46%	0.456	S	S	*	.			trans	-59.1	148	170.8	-72.4	-6.7	0	0	0	112.7	C300 N301 K302	N298-C300 PolarHBondContact O-N 3.5Å; N298-C300 VanDerWaalsContact O-N 3.11Å; N298-N301 WeakPolarHBondContact O-CA 3.39Å; N298-N301 PolarHBondContact O-N 2.89Å; N298-K302 PolarHBondContact O-N 2.64Å
299	G	64.5	Low	62.5	Low	52 Å²	52	81.8 Å²	81.8	54%	0.536	45%	0.446	S	S	.	.	H	α-helix	trans	-50.1	-41.4	-163.4	0	0	0	0	0	117.7	K303	G299-K303 WeakPolarHBondContact O-CG 3.39Å; G299-K303 PolarHBondContact O-N 2.89Å
300	C	59	Low	64	Low	84 Å²	84	84.9 Å²	84.9	57%	0.568	46%	0.459	S	S	*	.	H	α-helix	trans	-70.9	-39.6	177.8	-172.5	0	0	0	0	112.3	N298 K304	N298-C300 PolarHBondContact O-N 3.5Å; N298-C300 VanDerWaalsContact O-N 3.11Å; C300-K304 PolarHBondContact O-N 3.38Å; C300-K304 VanDerWaalsContact O-N 3.13Å
301	N	67.1	Low	65.3	Low	90 Å²	90	89.4 Å²	89.4	48%	0.481	47%	0.471	S	S	.	.	H	α-helix	trans	-71.9	-35.4	175.8	-70.2	-16.7	0	0	0	111.3	L297 N298 K304 K305	L297-N301 HydrophobicContact CD2-CB 4.31Å; N298-N301 WeakPolarHBondContact O-CA 3.39Å; N298-N301 PolarHBondContact O-N 2.89Å; N301-K304 PolarHBondContact O-N 3.21Å; N301-K305 WeakPolarHBondContact O-CB 3.35Å; N301-K305 PolarHBondContact O-N 2.95Å
302	K	68.8	Low	66.6	Low	73 Å²	73	88 Å²	88	32%	0.317	46%	0.458	S	S	.	.	H	α-helix	trans	-59.6	-50	172.1	-167.7	175.4	-176.3	176.4	0	111.1	D294 L297 N298 K304 K305 L306	D294-K302 WeakPolarHBondContact OD1-CE 3.48Å; D294-K302 IonicContact OD1-NZ 2.68Å; D294-K302 PolarHBondContact OD1-NZ 3.42Å; L297-K302 HydrophobicContact CB-CB 4.32Å; N298-K302 PolarHBondContact O-N 2.64Å; K302-K304 PolarHBondContact O-N 2.94Å; K302-K305 PolarHBondContact O-N 3.1Å; K302-L306 VanDerWaalsContact O-CB 3.25Å; K302-L306 WeakPolarHBondContact O-CB 3.38Å; K302-L306 PolarHBondContact O-N 2.87Å
303	K	72.6	Confident	67.9	Low	154 Å²	154	85 Å²	85	67%	0.67	44%	0.437	S	S	*	.	H	α-helix	trans	-60	-42.7	176.8	-75.9	-177.4	180	-178.8	0	113	G299 K307	G299-K303 WeakPolarHBondContact O-CG 3.39Å; G299-K303 PolarHBondContact O-N 2.89Å; K303-K307 WeakPolarHBondContact O-CG 3.41Å; K303-K307 PolarHBondContact O-N 2.81Å
304	K	71.9	Confident	69.5	Low	135 Å²	135	89.5 Å²	89.5	59%	0.587	46%	0.464	S	S	*	.	H	α-helix	trans	-66.5	-41.9	177.3	-73.9	178.8	-177.7	174.4	0	112.3	C300 N301 K302 T308	C300-K304 PolarHBondContact O-N 3.38Å; C300-K304 VanDerWaalsContact O-N 3.13Å; N301-K304 PolarHBondContact O-N 3.21Å; K302-K304 PolarHBondContact O-N 2.94Å; K304-T308 WeakPolarHBondContact O-CB 3.47Å; K304-T308 PolarHBondContact O-N 3.13Å; K304-T308 PolarHBondContact O-OG1 3.23Å
305	K	73.6	Confident	70.9	Confident	86 Å²	86	87.3 Å²	87.3	37%	0.374	45%	0.451	S	S	.	.	H	α-helix	trans	-67	-42.7	176.8	-171.7	178.7	178.3	-171.6	0	111.1	L297 N301 K302 T308 L309	L297-K305 HydrophobicContact CD1-CB 4.35Å; L297-K305 HydrophobicContact CD1-CD 3.25Å; L297-K305 HydrophobicContact CD1-CG 4.41Å; N301-K305 WeakPolarHBondContact O-CB 3.35Å; N301-K305 PolarHBondContact O-N 2.95Å; K302-K305 PolarHBondContact O-N 3.1Å; K305-T308 WeakPolarHBondContact O-CA 3.34Å; K305-T308 VanDerWaalsContact O-CB 3.27Å; K305-T308 WeakPolarHBondContact O-CB 3.39Å; K305-T308 PolarHBondContact O-N 3.24Å; K305-T308 VanDerWaalsContact O-N 3.07Å; K305-L309 HydrophobicContact CG-CD1 4.13Å; K305-L309 HydrophobicContact CG-CG 4.47Å; K305-L309 WeakPolarHBondContact O-CG 3.28Å; K305-L309 PolarHBondContact O-N 2.72Å
306	L	76.1	Confident	72.3	Confident	47 Å²	47	80.7 Å²	80.7	25%	0.246	42%	0.417	C	S	.	.	H	α-helix	trans	-60.1	-51	177.5	-178.9	58.9	0	0	0	111.8	N290 K302 T308 L309 E310	N290-L306 WeakPolarHBondContact OD1-CD1 3.29Å; K302-L306 VanDerWaalsContact O-CB 3.25Å; K302-L306 WeakPolarHBondContact O-CB 3.38Å; K302-L306 PolarHBondContact O-N 2.87Å; L306-T308 PolarHBondContact O-N 2.7Å; L306-T308 VanDerWaalsContact O-N 3.1Å; L306-L309 PolarHBondContact O-N 3.33Å; L306-E310 HydrophobicContact CD1-CG 4.42Å; L306-E310 WeakPolarHBondContact O-CG 3.43Å; L306-E310 PolarHBondContact O-N 3.32Å
307	K	76.9	Confident	73.7	Confident	133 Å²	133	80.8 Å²	80.8	58%	0.578	41%	0.405	S	S	*	.	H	α-helix	trans	-56.7	-30.1	173.8	-75	-176.8	177.6	-171.2	0	113.4	K303 R311	K303-K307 WeakPolarHBondContact O-CG 3.41Å; K303-K307 PolarHBondContact O-N 2.81Å; K307-R311 VanDerWaalsContact O-CG 3.3Å; K307-R311 WeakPolarHBondContact O-CG 3.27Å; K307-R311 PolarHBondContact O-N 3.37Å
308	T	74.9	Confident	75.4	Confident	45 Å²	45	84.1 Å²	84.1	28%	0.276	42%	0.416	S	S	.	.	H	α-helix	trans	-74.8	-44.3	177.9	-61.8	0	0	0	0	111.2	K304 K305 L306 R311 E312	K304-T308 WeakPolarHBondContact O-CB 3.47Å; K304-T308 PolarHBondContact O-N 3.13Å; K304-T308 PolarHBondContact O-OG1 3.23Å; K305-T308 WeakPolarHBondContact O-CA 3.34Å; K305-T308 VanDerWaalsContact O-CB 3.27Å; K305-T308 WeakPolarHBondContact O-CB 3.39Å; K305-T308 PolarHBondContact O-N 3.24Å; K305-T308 VanDerWaalsContact O-N 3.07Å; L306-T308 PolarHBondContact O-N 2.7Å; L306-T308 VanDerWaalsContact O-N 3.1Å; T308-R311 PolarHBondContact O-N 2.86Å; T308-E312 WeakPolarHBondContact O-CG 3.37Å; T308-E312 PolarHBondContact O-N 2.65Å
309	L	76.9	Confident	76.8	Confident	33 Å²	33	77.7 Å²	77.7	17%	0.173	38%	0.382	C	S	.	.	H	α-helix	trans	-65.6	-40.2	176.5	-69.6	169.4	0	0	0	111.9	A289 A293 K305 L306 R311 E312 A313	A289-L309 HydrophobicContact CB-CB 4.17Å; A289-L309 HydrophobicContact CB-CD1 4.29Å; A293-L309 HydrophobicContact CB-CD1 4.28Å; K305-L309 HydrophobicContact CG-CD1 4.13Å; K305-L309 HydrophobicContact CG-CG 4.47Å; K305-L309 WeakPolarHBondContact O-CG 3.28Å; K305-L309 PolarHBondContact O-N 2.72Å; L306-L309 PolarHBondContact O-N 3.33Å; L309-R311 VanDerWaalsContact C-N 3.34Å; L309-R311 PolarHBondContact O-N 3.19Å; L309-E312 PolarHBondContact O-N 3.24Å; L309-A313 WeakPolarHBondContact O-CB 3.38Å; L309-A313 PolarHBondContact O-N 3.04Å
310	E	80.4	Confident	77.9	Confident	80 Å²	80	76.6 Å²	76.6	37%	0.374	36%	0.363	S	S	.	.	H	α-helix	trans	-57.8	-44.9	174	-73.9	169.4	177.8	0	0	111.7	V286 L306 A313 V314	V286-E310 HydrophobicContact CG1-CG 3.96Å; L306-E310 HydrophobicContact CD1-CG 4.42Å; L306-E310 WeakPolarHBondContact O-CG 3.43Å; L306-E310 PolarHBondContact O-N 3.32Å; E310-A313 PolarHBondContact O-N 3.43Å; E310-V314 WeakPolarHBondContact O-CG2 3.26Å; E310-V314 PolarHBondContact O-N 3.38Å
311	R	78.1	Confident	79.3	Confident	147 Å²	147	77 Å²	77	56%	0.555	37%	0.366	S	S	*	.	H	α-helix	trans	-64.1	-45	176.1	-72.1	174.6	-175.8	-164.6	-1.6	111.8	K307 T308 L309 A313 V314 E315	K307-R311 VanDerWaalsContact O-CG 3.3Å; K307-R311 WeakPolarHBondContact O-CG 3.27Å; K307-R311 PolarHBondContact O-N 3.37Å; T308-R311 PolarHBondContact O-N 2.86Å; L309-R311 VanDerWaalsContact C-N 3.34Å; L309-R311 PolarHBondContact O-N 3.19Å; R311-A313 VanDerWaalsContact C-N 3.3Å; R311-A313 PolarHBondContact O-N 2.92Å; R311-V314 PolarHBondContact O-N 2.95Å; R311-E315 WeakPolarHBondContact O-CG 3.47Å; R311-E315 PolarHBondContact O-N 3.48Å
312	E	79.8	Confident	80.3	Confident	64 Å²	64	76.5 Å²	76.5	30%	0.299	36%	0.364	S	S	.	.	H	α-helix	trans	-62.2	-37.6	177.2	-73	175.6	-174.8	0	0	111.5	R224 T308 L309 E315 N316	R224-E312 IonicContact CZ-OE1 3.45Å; R224-E312 VanDerWaalsContact CZ-OE1 3.22Å; R224-E312 IonicContact NE-OE1 3.14Å; R224-E312 PolarHBondContact NE-OE1 3.34Å; R224-E312 VanDerWaalsContact NE-OE1 3.14Å; R224-E312 IonicContact NH2-OE1 3.14Å; R224-E312 PolarHBondContact NH2-OE1 3.48Å; T308-E312 WeakPolarHBondContact O-CG 3.37Å; T308-E312 PolarHBondContact O-N 2.65Å; L309-E312 PolarHBondContact O-N 3.24Å; E312-E315 PolarHBondContact O-N 3.01Å; E312-N316 VanDerWaalsContact O-CB 3.28Å; E312-N316 WeakPolarHBondContact O-CB 3.45Å; E312-N316 PolarHBondContact O-N 3.28Å; E312-N316 PolarHBondContact O-ND2 3.25Å
313	A	81.7	Confident	81.2	Confident	2 Å²	2	73.9 Å²	73.9	2%	0.017	35%	0.354	C	S	.	.	H	α-helix	trans	-65.4	-44.2	175.1	0	0	0	0	0	112.2	V286 L309 E310 R311 E315 N316 K317	V286-A313 HydrophobicContact CG2-CB 3.81Å; L309-A313 WeakPolarHBondContact O-CB 3.38Å; L309-A313 PolarHBondContact O-N 3.04Å; E310-A313 PolarHBondContact O-N 3.43Å; R311-A313 VanDerWaalsContact C-N 3.3Å; R311-A313 PolarHBondContact O-N 2.92Å; A313-E315 PolarHBondContact O-N 3.43Å; A313-N316 PolarHBondContact O-N 2.91Å; A313-K317 WeakPolarHBondContact O-CG 3.48Å; A313-K317 PolarHBondContact O-N 3.34Å
314	V	84.2	Confident	82	Confident	99 Å²	99	72.1 Å²	72.1	60%	0.6	36%	0.356	S	S	*	.	H	α-helix	trans	-61.7	-43.2	175.7	172.5	0	0	0	0	111.3	E310 R311 K317 K318	E310-V314 WeakPolarHBondContact O-CG2 3.26Å; E310-V314 PolarHBondContact O-N 3.38Å; R311-V314 PolarHBondContact O-N 2.95Å; V314-K317 PolarHBondContact O-N 2.85Å; V314-K318 PolarHBondContact O-N 3.02Å
315	E	80.7	Confident	82.6	Confident	51 Å²	51	67.1 Å²	67.1	24%	0.238	33%	0.334	C	S	.	.	H	α-helix	trans	-65.9	-41.3	176.1	-74	170.9	-163.4	0	0	112.3	L228 R311 E312 A313 K317 K318 F319	L228-E315 HydrophobicContact CD1-CB 4.08Å; L228-E315 HydrophobicContact CD1-CG 4.28Å; L228-E315 WeakPolarHBondContact CD1-OE2 3.29Å; R311-E315 WeakPolarHBondContact O-CG 3.47Å; R311-E315 PolarHBondContact O-N 3.48Å; E312-E315 PolarHBondContact O-N 3.01Å; A313-E315 PolarHBondContact O-N 3.43Å; E315-K317 VanDerWaalsContact C-N 3.35Å; E315-K318 CarbonylContact O-C 3.59Å; E315-K318 PolarHBondContact O-N 2.94Å; E315-F319 PolarHBondContact O-N 3.43Å
316	N	86.1	Confident	83.3	Confident	12 Å²	12	67.8 Å²	67.8	6%	0.064	34%	0.342	C	S	.	.	H	α-helix	trans	-61	-44.7	174.5	-73.5	-24.3	0	0	0	110.3	R280 N283 E312 A313 K318 F319 M320	R280-N316 HydrophobicContact CB-CB 4.38Å; R280-N316 WeakPolarHBondContact CG-OD1 3.32Å; R280-N316 PolarHBondContact NH1-OD1 3.28Å; N283-N316 PolarHBondContact O-ND2 2.89Å; E312-N316 VanDerWaalsContact O-CB 3.28Å; E312-N316 WeakPolarHBondContact O-CB 3.45Å; E312-N316 PolarHBondContact O-N 3.28Å; E312-N316 PolarHBondContact O-ND2 3.25Å; A313-N316 PolarHBondContact O-N 2.91Å; N316-K318 VanDerWaalsContact C-N 3.31Å; N316-K318 PolarHBondContact O-N 3.2Å; N316-F319 CarbonylContact O-C 3.44Å; N316-F319 PolarHBondContact O-N 3.44Å; N316-F319 VanDerWaalsContact O-N 3.09Å; N316-M320 WeakPolarHBondContact O-CB 3.35Å; N316-M320 VanDerWaalsContact O-CG 3.28Å; N316-M320 WeakPolarHBondContact O-CG 3.28Å; N316-M320 PolarHBondContact O-N 3.45Å
317	K	86.2	Confident	83.7	Confident	108 Å²	108	66.2 Å²	66.2	47%	0.47	34%	0.335	S	S	.	.	H	α-helix	trans	-56.7	-43.9	173.2	-73.7	-177.1	-175	-168.3	0	111.9	C284 A313 V314 E315 F319 M320 S321	C284-K317 HydrophobicContact CB-CG 4.21Å; C284-K317 WeakPolarHBondContact O-CE 3.47Å; A313-K317 WeakPolarHBondContact O-CG 3.48Å; A313-K317 PolarHBondContact O-N 3.34Å; V314-K317 PolarHBondContact O-N 2.85Å; E315-K317 VanDerWaalsContact C-N 3.35Å; K317-F319 VanDerWaalsContact C-N 3.34Å; K317-F319 PolarHBondContact O-N 3.46Å; K317-M320 PolarHBondContact O-N 3.17Å; K317-S321 PolarHBondContact O-N 3.42Å
318	K	86.3	Confident	84.1	Confident	136 Å²	136	65.2 Å²	65.2	59%	0.591	33%	0.332	S	S	*	.	H	α-helix	trans	-67	-32	176.2	-172.8	178	-177.3	176.3	0	113.3	V314 E315 N316 S321	V314-K318 PolarHBondContact O-N 3.02Å; E315-K318 CarbonylContact O-C 3.59Å; E315-K318 PolarHBondContact O-N 2.94Å; N316-K318 VanDerWaalsContact C-N 3.31Å; N316-K318 PolarHBondContact O-N 3.2Å; K318-S321 PolarHBondContact O-OG 3.26Å
319	F	87.4	Confident	84.7	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-72.4	-45.4	172.9	177.8	-95.2	0	0	0	110.8	L228 D231 R232 V277 E315 N316 K317 S321 L322 V323	L228-F319 HydrophobicContact CD2-CB 4.4Å; D231-F319 HydrophobicContact CB-CE2 3.82Å; D231-F319 HydrophobicContact CB-CZ 4.04Å; R232-F319 HydrophobicContact CG-CD2 3.82Å; R232-F319 HydrophobicContact CG-CE2 3.9Å; V277-F319 HydrophobicContact CG1-CE1 4.48Å; V277-F319 HydrophobicContact CG2-CE1 4.24Å; E315-F319 PolarHBondContact O-N 3.43Å; N316-F319 CarbonylContact O-C 3.44Å; N316-F319 PolarHBondContact O-N 3.44Å; N316-F319 VanDerWaalsContact O-N 3.09Å; K317-F319 VanDerWaalsContact C-N 3.34Å; K317-F319 PolarHBondContact O-N 3.46Å; F319-S321 VanDerWaalsContact C-N 3.26Å; F319-S321 PolarHBondContact O-N 2.94Å; F319-L322 WeakPolarHBondContact O-CB 3.32Å; F319-L322 PolarHBondContact O-N 3.25Å; F319-V323 HydrophobicContact CD1-CG2 4.28Å; F319-V323 HydrophobicContact CE1-CG2 3.87Å; F319-V323 HydrophobicContact CZ-CG2 4.37Å
320	M	87.3	Confident	85.1	Confident	30 Å²	30	66.3 Å²	66.3	15%	0.148	33%	0.332	C	S	.	.	H	α-helix	trans	-63.4	-31.1	178.7	-67.8	-44.3	-61.5	0	0	112.1	V277 R280 Y281 C284 N316 K317 L322 V323 T327	V277-M320 HydrophobicContact CG1-CE 3.88Å; V277-M320 HydrophobicContact CG1-SD 3.98Å; R280-M320 HydrophobicContact CB-SD 4.34Å; Y281-M320 HydrophobicContact CD2-CE 3.91Å; Y281-M320 HydrophobicContact CG-CE 4.39Å; C284-M320 VanDerWaalsContact SG-CG 3.51Å; N316-M320 WeakPolarHBondContact O-CB 3.35Å; N316-M320 VanDerWaalsContact O-CG 3.28Å; N316-M320 WeakPolarHBondContact O-CG 3.28Å; N316-M320 PolarHBondContact O-N 3.45Å; K317-M320 PolarHBondContact O-N 3.17Å; M320-L322 PolarHBondContact O-N 3.29Å; M320-L322 VanDerWaalsContact O-N 3.15Å; M320-V323 HydrophobicContact CE-CB 4.2Å; M320-V323 HydrophobicContact CE-CG1 4.42Å; M320-V323 HydrophobicContact CE-CG2 4.26Å; M320-V323 PolarHBondContact O-N 3.34Å; M320-V323 HydrophobicContact SD-CG2 4.35Å; M320-T327 HydrophobicContact CE-CG2 3.98Å
321	S	88.1	Confident	85.3	Confident	91 Å²	91	63.4 Å²	63.4	64%	0.636	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-16.2	172.6	74.3	0	0	0	0	114	K317 K318 F319	K317-S321 PolarHBondContact O-N 3.42Å; K318-S321 PolarHBondContact O-OG 3.26Å; F319-S321 VanDerWaalsContact C-N 3.26Å; F319-S321 PolarHBondContact O-N 2.94Å
322	L	88.3	Confident	85.6	Confident	81 Å²	81	62 Å²	62	42%	0.424	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-18.8	174.4	-61.1	170.7	0	0	0	112.5	R232 R239 F319 M320 T324	R232-L322 HydrophobicContact CG-CD1 4.05Å; R239-L322 PolarHBondContact NH1-O 3.46Å; R239-L322 PolarHBondContact NH2-O 3.47Å; F319-L322 WeakPolarHBondContact O-CB 3.32Å; F319-L322 PolarHBondContact O-N 3.25Å; M320-L322 PolarHBondContact O-N 3.29Å; M320-L322 VanDerWaalsContact O-N 3.15Å; L322-T324 PolarHBondContact O-N 3.3Å
323	V	88.8	Confident	85.8	Confident	18 Å²	18	59.2 Å²	59.2	11%	0.109	31%	0.312	C	S	.	.			trans	-81.8	109.6	178.8	-178.4	0	0	0	0	107.4	L235 F273 V277 F319 M320 T327	L235-V323 HydrophobicContact CD2-CG2 3.94Å; F273-V323 HydrophobicContact CE1-CG1 3.87Å; V277-V323 HydrophobicContact CG1-CG1 4.47Å; V277-V323 HydrophobicContact CG1-CG2 4.29Å; F319-V323 HydrophobicContact CD1-CG2 4.28Å; F319-V323 HydrophobicContact CE1-CG2 3.87Å; F319-V323 HydrophobicContact CZ-CG2 4.37Å; M320-V323 HydrophobicContact CE-CB 4.2Å; M320-V323 HydrophobicContact CE-CG1 4.42Å; M320-V323 HydrophobicContact CE-CG2 4.26Å; M320-V323 PolarHBondContact O-N 3.34Å; M320-V323 HydrophobicContact SD-CG2 4.35Å; V323-T327 HydrophobicContact CG1-CG2 3.63Å
324	T	87.6	Confident	86	Confident	116 Å²	116	59.8 Å²	59.8	71%	0.712	32%	0.317	S	S	*	.			trans	-99	-12.4	-179.6	58.1	0	0	0	0	111.8	R239 L322	R239-T324 PolarHBondContact NH2-OG1 3.14Å; L322-T324 PolarHBondContact O-N 3.3Å
325	E	86.1	Confident	86.1	Confident	30 Å²	30	55.9 Å²	55.9	14%	0.14	30%	0.296	C	S	.	.	S	Bend	trans	-76.6	148.1	179.8	-58	88.3	161.6	0	0	111.6	R239 F273 T327 I330	R239-E325 IonicContact CZ-OE1 2.83Å; R239-E325 IonicContact CZ-OE2 3.6Å; R239-E325 IonicContact NE-OE1 3.07Å; R239-E325 PolarHBondContact NE-OE1 3.23Å; R239-E325 IonicContact NE-OE2 3.75Å; R239-E325 VanDerWaalsContact NH2-CD 3.35Å; R239-E325 IonicContact NH2-OE1 3.79Å; R239-E325 PolarHBondContact NH2-OE1 3.28Å; R239-E325 IonicContact NH2-OE2 3.63Å; R239-E325 PolarHBondContact NH2-OE2 3.15Å; F273-E325 HydrophobicContact CE1-CB 4.17Å; F273-E325 HydrophobicContact CZ-CB 4.03Å; F273-E325 HydrophobicContact CZ-CG 4.08Å; E325-T327 PolarHBondContact O-N 2.8Å; E325-I330 HydrophobicContact CB-CD1 3.55Å; E325-I330 HydrophobicContact CG-CD1 4.09Å
326	N	87.3	Confident	86.5	Confident	101 Å²	101	53.6 Å²	53.6	54%	0.54	29%	0.285	S	S	.	.			trans	-67.9	99.4	170.9	-175.2	-16.6	0	0	0	109.7	E328 F329 I330	N326-E328 PolarHBondContact O-N 2.99Å; N326-E328 PolarHBondContact OD1-N 3.28Å; N326-F329 HydrophobicContact CB-CB 3.93Å; N326-F329 PolarHBondContact O-N 3.47Å; N326-F329 PolarHBondContact OD1-N 3.49Å; N326-I330 WeakPolarHBondContact O-CG1 3.36Å; N326-I330 PolarHBondContact O-N 3.26Å; N326-I330 VanDerWaalsContact O-N 3.11Å
327	T	84.2	Confident	86.5	Confident	14 Å²	14	54.5 Å²	54.5	9%	0.086	29%	0.29	C	S	.	.	H	α-helix	trans	-63	-40.1	-174.5	59	0	0	0	0	113.1	F273 V277 M320 V323 E325 I330 V331	F273-T327 HydrophobicContact CD1-CG2 4.27Å; F273-T327 HydrophobicContact CE1-CG2 4.23Å; V277-T327 HydrophobicContact CG1-CG2 3.99Å; M320-T327 HydrophobicContact CE-CG2 3.98Å; V323-T327 HydrophobicContact CG1-CG2 3.63Å; E325-T327 PolarHBondContact O-N 2.8Å; T327-I330 PolarHBondContact O-N 3.37Å; T327-V331 VanDerWaalsContact O-CB 3.32Å; T327-V331 WeakPolarHBondContact O-CB 3.35Å; T327-V331 WeakPolarHBondContact O-CG2 3.42Å; T327-V331 PolarHBondContact O-N 2.91Å
328	E	85.3	Confident	86.6	Confident	112 Å²	112	54.3 Å²	54.3	52%	0.523	29%	0.294	S	S	.	.	H	α-helix	trans	-66.4	-44.4	179.8	-64.7	-177.1	169.3	0	0	110.9	N326 I330 V331 N332	N326-E328 PolarHBondContact O-N 2.99Å; N326-E328 PolarHBondContact OD1-N 3.28Å; E328-I330 PolarHBondContact O-N 2.9Å; E328-V331 PolarHBondContact O-N 3.02Å; E328-N332 WeakPolarHBondContact O-CB 3.46Å; E328-N332 PolarHBondContact O-N 3.31Å; E328-N332 PolarHBondContact O-ND2 3.41Å
329	F	87.2	Confident	86.8	Confident	89 Å²	89	48.8 Å²	48.8	39%	0.39	27%	0.272	S	S	.	.	H	α-helix	trans	-60.8	-43.9	177.5	179	-103.4	0	0	0	112.6	N326 G334 A335 L338	N326-F329 HydrophobicContact CB-CB 3.93Å; N326-F329 PolarHBondContact O-N 3.47Å; N326-F329 PolarHBondContact OD1-N 3.49Å; F329-G334 WeakPolarHBondContact CZ-O 3.39Å; F329-G334 PolarHBondContact O-N 3.23Å; F329-A335 HydrophobicContact CD1-CB 4.46Å; F329-A335 HydrophobicContact CE1-CB 3.98Å; F329-A335 VanDerWaalsContact CE1-N 3.27Å; F329-L338 HydrophobicContact CE1-CD1 4.28Å; F329-L338 HydrophobicContact CZ-CD1 3.63Å; F329-L338 HydrophobicContact CZ-CG 4.24Å
330	I	85.6	Confident	86.8	Confident	11 Å²	11	48.9 Å²	48.9	6%	0.056	27%	0.272	C	S	.	.	H	α-helix	trans	-67.2	-46.5	177.9	-66.2	173.5	0	0	0	110.4	L270 F273 E325 N326 T327 E328 N332 G333 A335	L270-I330 WeakPolarHBondContact CD1-O 3.41Å; F273-I330 HydrophobicContact CB-CG2 3.8Å; F273-I330 HydrophobicContact CD1-CD1 4.35Å; F273-I330 HydrophobicContact CD1-CG2 4.41Å; F273-I330 HydrophobicContact CD2-CD1 4.31Å; F273-I330 HydrophobicContact CD2-CG2 3.84Å; F273-I330 HydrophobicContact CE1-CD1 4.07Å; F273-I330 HydrophobicContact CE2-CD1 4.03Å; F273-I330 HydrophobicContact CG-CB 4.39Å; F273-I330 HydrophobicContact CG-CD1 4.48Å; F273-I330 HydrophobicContact CG-CG2 3.76Å; F273-I330 HydrophobicContact CZ-CD1 3.91Å; E325-I330 HydrophobicContact CB-CD1 3.55Å; E325-I330 HydrophobicContact CG-CD1 4.09Å; N326-I330 WeakPolarHBondContact O-CG1 3.36Å; N326-I330 PolarHBondContact O-N 3.26Å; N326-I330 VanDerWaalsContact O-N 3.11Å; T327-I330 PolarHBondContact O-N 3.37Å; E328-I330 PolarHBondContact O-N 2.9Å; I330-N332 VanDerWaalsContact C-N 3.26Å; I330-N332 PolarHBondContact O-N 2.86Å; I330-G333 PolarHBondContact O-N 3.23Å; I330-A335 HydrophobicContact CG1-CB 4.38Å
331	V	84.3	Confident	86.8	Confident	19 Å²	19	51.9 Å²	51.9	12%	0.115	29%	0.285	C	S	.	.	H	α-helix	trans	-63.4	-33	-177.5	167.8	0	0	0	0	112.2	L270 F273 L278 T327 E328 G333	L270-V331 WeakPolarHBondContact CD1-O 3.47Å; F273-V331 HydrophobicContact CB-CG2 4.11Å; L278-V331 HydrophobicContact CB-CG2 4.23Å; L278-V331 HydrophobicContact CD1-CG1 4.49Å; L278-V331 HydrophobicContact CD2-CG1 3.94Å; T327-V331 VanDerWaalsContact O-CB 3.32Å; T327-V331 WeakPolarHBondContact O-CB 3.35Å; T327-V331 WeakPolarHBondContact O-CG2 3.42Å; T327-V331 PolarHBondContact O-N 2.91Å; E328-V331 PolarHBondContact O-N 3.02Å; V331-G333 PolarHBondContact O-N 3.5Å
332	N	84.8	Confident	86.7	Confident	119 Å²	119	50.5 Å²	50.5	64%	0.636	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	6.3	174.8	-66.5	-16.7	0	0	0	113.3	E328 I330 G334	E328-N332 WeakPolarHBondContact O-CB 3.46Å; E328-N332 PolarHBondContact O-N 3.31Å; E328-N332 PolarHBondContact O-ND2 3.41Å; I330-N332 VanDerWaalsContact C-N 3.26Å; I330-N332 PolarHBondContact O-N 2.86Å; N332-G334 PolarHBondContact O-N 3.01Å
333	G	83.6	Confident	86.7	Confident	5 Å²	5	46.7 Å²	46.7	5%	0.052	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	79	-0.5	179.6	0	0	0	0	0	114.6	I330 V331 A335 V336 N337	I330-G333 PolarHBondContact O-N 3.23Å; V331-G333 PolarHBondContact O-N 3.5Å; G333-A335 VanDerWaalsContact C-N 3.29Å; G333-A335 PolarHBondContact O-N 3.35Å; G333-A335 VanDerWaalsContact O-N 3.14Å; G333-V336 WeakPolarHBondContact O-CB 3.35Å; G333-V336 PolarHBondContact O-N 2.89Å; G333-N337 PolarHBondContact O-N 3.17Å; G333-N337 PolarHBondContact O-OD1 3.32Å; G333-N337 VanDerWaalsContact O-OD1 3.07Å
334	G	86.2	Confident	86.5	Confident	13 Å²	13	46.4 Å²	46.4	13%	0.134	25%	0.254	C	S	.	.	H	α-helix	trans	-54.1	-41.3	-173.1	0	0	0	0	0	113.9	F329 N332 N337 L338	F329-G334 WeakPolarHBondContact CZ-O 3.39Å; F329-G334 PolarHBondContact O-N 3.23Å; N332-G334 PolarHBondContact O-N 3.01Å; G334-N337 PolarHBondContact O-N 3.29Å; G334-L338 WeakPolarHBondContact O-CG 3.48Å; G334-L338 PolarHBondContact O-N 3.25Å
335	A	87.1	Confident	86.3	Confident	18 Å²	18	45.2 Å²	45.2	15%	0.149	25%	0.25	C	S	.	.	H	α-helix	trans	-65.5	-42.2	177.7	0	0	0	0	0	112.8	F329 I330 G333 V339	F329-A335 HydrophobicContact CD1-CB 4.46Å; F329-A335 HydrophobicContact CE1-CB 3.98Å; F329-A335 VanDerWaalsContact CE1-N 3.27Å; I330-A335 HydrophobicContact CG1-CB 4.38Å; G333-A335 VanDerWaalsContact C-N 3.29Å; G333-A335 PolarHBondContact O-N 3.35Å; G333-A335 VanDerWaalsContact O-N 3.14Å; A335-V339 WeakPolarHBondContact O-CG2 3.41Å; A335-V339 PolarHBondContact O-N 3.36Å
336	V	88.1	Confident	86.2	Confident	3 Å²	3	48.4 Å²	48.4	2%	0.018	26%	0.261	C	S	.	.	H	α-helix	trans	-65.7	-42.9	177	173.3	0	0	0	0	109.9	E266 I267 L270 G333 V339 I340	E266-V336 VanDerWaalsContact C-CG2 3.49Å; E266-V336 HydrophobicContact CB-CG2 3.8Å; E266-V336 WeakPolarHBondContact O-CG2 3.48Å; I267-V336 HydrophobicContact CG1-CG1 4.02Å; I267-V336 HydrophobicContact CG1-CG2 4.34Å; L270-V336 HydrophobicContact CB-CG2 4Å; L270-V336 HydrophobicContact CD2-CG2 3.93Å; G333-V336 WeakPolarHBondContact O-CB 3.35Å; G333-V336 PolarHBondContact O-N 2.89Å; V336-V339 PolarHBondContact O-N 2.8Å; V336-I340 HydrophobicContact CG1-CD1 3.48Å; V336-I340 VanDerWaalsContact CG1-CD1 3.48Å; V336-I340 HydrophobicContact CG1-CG1 4.2Å; V336-I340 WeakPolarHBondContact O-CB 3.45Å; V336-I340 VanDerWaalsContact O-CG1 3.29Å; V336-I340 WeakPolarHBondContact O-CG1 3.27Å; V336-I340 PolarHBondContact O-N 3.26Å
337	N	87.4	Confident	86.1	Confident	30 Å²	30	43.7 Å²	43.7	16%	0.16	24%	0.235	C	C	.	.	H	α-helix	trans	-62.8	-46.2	-178.5	-63	3.2	0	0	0	110.8	G333 G334 V339 I340 E341 D369 L372	G333-N337 PolarHBondContact O-N 3.17Å; G333-N337 PolarHBondContact O-OD1 3.32Å; G333-N337 VanDerWaalsContact O-OD1 3.07Å; G334-N337 PolarHBondContact O-N 3.29Å; N337-V339 PolarHBondContact O-N 2.93Å; N337-I340 PolarHBondContact O-N 3.23Å; N337-E341 WeakPolarHBondContact O-CB 3.27Å; N337-E341 VanDerWaalsContact O-CG 3.3Å; N337-E341 WeakPolarHBondContact O-CG 3.48Å; N337-E341 PolarHBondContact O-N 3.23Å; N337-D369 PolarHBondContact ND2-OD2 3.34Å; N337-D369 VanDerWaalsContact ND2-OD2 3.11Å; N337-L372 HydrophobicContact CB-CD1 4.09Å; N337-L372 WeakPolarHBondContact OD1-CD1 3.37Å
338	L	88.1	Confident	85.7	Confident	104 Å²	104	46.8 Å²	46.8	55%	0.545	25%	0.254	S	S	.	.	H	α-helix	trans	-59.1	-45.6	175.5	-73.4	-179.6	0	0	0	112.5	F329 G334 S342	F329-L338 HydrophobicContact CE1-CD1 4.28Å; F329-L338 HydrophobicContact CZ-CD1 3.63Å; F329-L338 HydrophobicContact CZ-CG 4.24Å; G334-L338 WeakPolarHBondContact O-CG 3.48Å; G334-L338 PolarHBondContact O-N 3.25Å; L338-S342 WeakPolarHBondContact O-CB 3.16Å; L338-S342 PolarHBondContact O-N 3.44Å
339	V	89.2	Confident	85.3	Confident	21 Å²	21	48 Å²	48	13%	0.127	26%	0.264	C	S	.	.	H	α-helix	trans	-62.9	-52.2	177.9	173.7	0	0	0	0	109.3	L262 A263 E266 A335 V336 N337 E341 S342 L343	L262-V339 HydrophobicContact CD2-CG1 4.35Å; L262-V339 HydrophobicContact CD2-CG2 4.29Å; L262-V339 HydrophobicContact CG-CG1 4.29Å; L262-V339 HydrophobicContact CG-CG2 4.4Å; A263-V339 HydrophobicContact CB-CG1 4.04Å; E266-V339 HydrophobicContact CG-CG2 4.04Å; A335-V339 WeakPolarHBondContact O-CG2 3.41Å; A335-V339 PolarHBondContact O-N 3.36Å; V336-V339 PolarHBondContact O-N 2.8Å; N337-V339 PolarHBondContact O-N 2.93Å; V339-E341 VanDerWaalsContact C-N 3.34Å; V339-E341 PolarHBondContact O-N 3.05Å; V339-S342 WeakPolarHBondContact O-CB 3.4Å; V339-S342 PolarHBondContact O-N 2.95Å; V339-S342 VanDerWaalsContact O-N 3.13Å; V339-S342 PolarHBondContact O-OG 3.24Å; V339-L343 HydrophobicContact CG1-CD1 4.02Å; V339-L343 HydrophobicContact CG1-CG 4.3Å; V339-L343 VanDerWaalsContact O-CG 3.28Å; V339-L343 WeakPolarHBondContact O-CG 3.39Å; V339-L343 PolarHBondContact O-N 3.34Å
340	I	87.3	Confident	85	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-59	-43.5	-179.1	-67.4	170.8	0	0	0	111.6	V336 N337 S342 L343 L344 L357 L361 V376	V336-I340 HydrophobicContact CG1-CD1 3.48Å; V336-I340 VanDerWaalsContact CG1-CD1 3.48Å; V336-I340 HydrophobicContact CG1-CG1 4.2Å; V336-I340 WeakPolarHBondContact O-CB 3.45Å; V336-I340 VanDerWaalsContact O-CG1 3.29Å; V336-I340 WeakPolarHBondContact O-CG1 3.27Å; V336-I340 PolarHBondContact O-N 3.26Å; N337-I340 PolarHBondContact O-N 3.23Å; I340-S342 VanDerWaalsContact C-N 3.33Å; I340-S342 PolarHBondContact O-N 3.4Å; I340-L343 CarbonylContact O-C 3.22Å; I340-L343 WeakPolarHBondContact O-CA 3.24Å; I340-L343 WeakPolarHBondContact O-CB 3.5Å; I340-L343 PolarHBondContact O-N 2.92Å; I340-L344 HydrophobicContact CG2-CD1 4.01Å; I340-L344 HydrophobicContact CG2-CG 4.05Å; I340-L344 WeakPolarHBondContact O-CG 2.91Å; I340-L344 PolarHBondContact O-N 2.86Å; I340-L357 HydrophobicContact CG2-CD2 4.5Å; I340-L361 HydrophobicContact CD1-CD1 4.37Å; I340-L361 HydrophobicContact CD1-CD2 3.51Å; I340-V376 HydrophobicContact CG2-CG2 4.15Å
341	E	87.8	Confident	84.7	Confident	93 Å²	93	46.2 Å²	46.2	44%	0.435	26%	0.261	S	S	.	.	H	α-helix	trans	-62.3	-40	177.6	-73.6	-177.7	160.9	0	0	112.4	N337 V339 L343 L344 S345	N337-E341 WeakPolarHBondContact O-CB 3.27Å; N337-E341 VanDerWaalsContact O-CG 3.3Å; N337-E341 WeakPolarHBondContact O-CG 3.48Å; N337-E341 PolarHBondContact O-N 3.23Å; V339-E341 VanDerWaalsContact C-N 3.34Å; V339-E341 PolarHBondContact O-N 3.05Å; E341-L343 VanDerWaalsContact C-N 3.26Å; E341-L343 PolarHBondContact O-N 3.43Å; E341-L344 PolarHBondContact O-N 3.35Å; E341-S345 PolarHBondContact O-N 3.11Å; E341-S345 VanDerWaalsContact O-N 3.1Å; E341-S345 PolarHBondContact O-OG 2.88Å
342	S	87.3	Confident	84.7	Confident	62 Å²	62	53.6 Å²	53.6	43%	0.434	29%	0.291	S	S	.	.	H	α-helix	trans	-62.7	-34.3	172.3	79	0	0	0	0	112.2	L338 V339 I340 S345 R346	L338-S342 WeakPolarHBondContact O-CB 3.16Å; L338-S342 PolarHBondContact O-N 3.44Å; V339-S342 WeakPolarHBondContact O-CB 3.4Å; V339-S342 PolarHBondContact O-N 2.95Å; V339-S342 VanDerWaalsContact O-N 3.13Å; V339-S342 PolarHBondContact O-OG 3.24Å; I340-S342 VanDerWaalsContact C-N 3.33Å; I340-S342 PolarHBondContact O-N 3.4Å; S342-S345 PolarHBondContact O-OG 3.5Å; S342-R346 PolarHBondContact O-N 3.43Å
343	L	86.9	Confident	84.8	Confident	2 Å²	2	49 Å²	49	1%	0.01	27%	0.266	C	S	.	.	H	α-helix	trans	-74.3	-40.9	177.1	-62.1	-178.9	0	0	0	112.1	H259 A263 V339 I340 E341 S345 R346 W347 L357	H259-L343 HydrophobicContact CB-CD2 3.52Å; A263-L343 HydrophobicContact CB-CD1 3.78Å; V339-L343 HydrophobicContact CG1-CD1 4.02Å; V339-L343 HydrophobicContact CG1-CG 4.3Å; V339-L343 VanDerWaalsContact O-CG 3.28Å; V339-L343 WeakPolarHBondContact O-CG 3.39Å; V339-L343 PolarHBondContact O-N 3.34Å; I340-L343 CarbonylContact O-C 3.22Å; I340-L343 WeakPolarHBondContact O-CA 3.24Å; I340-L343 WeakPolarHBondContact O-CB 3.5Å; I340-L343 PolarHBondContact O-N 2.92Å; E341-L343 VanDerWaalsContact C-N 3.26Å; E341-L343 PolarHBondContact O-N 3.43Å; L343-S345 VanDerWaalsContact C-N 3.32Å; L343-S345 PolarHBondContact O-N 3.45Å; L343-R346 CarbonylContact O-C 3.6Å; L343-R346 PolarHBondContact O-N 2.94Å; L343-R346 VanDerWaalsContact O-N 3.1Å; L343-W347 HydrophobicContact CB-CD2 4.24Å; L343-W347 HydrophobicContact CB-CE3 3.84Å; L343-W347 HydrophobicContact CB-CH2 4.29Å; L343-W347 HydrophobicContact CB-CZ3 3.87Å; L343-W347 HydrophobicContact CD1-CH2 3.68Å; L343-W347 HydrophobicContact CD1-CZ2 4.49Å; L343-W347 HydrophobicContact CD1-CZ3 3.71Å; L343-W347 HydrophobicContact CD2-CH2 3.87Å; L343-W347 HydrophobicContact CD2-CZ2 3.84Å; L343-W347 HydrophobicContact CD2-CZ3 4.32Å; L343-W347 HydrophobicContact CG-CH2 4.13Å; L343-W347 HydrophobicContact CG-CZ3 4.15Å; L343-W347 VanDerWaalsContact O-CB 3.31Å; L343-W347 WeakPolarHBondContact O-CB 3.48Å; L343-W347 PolarHBondContact O-N 3.05Å; L343-L357 HydrophobicContact CD1-CD1 4.41Å
344	L	84.5	Confident	84.9	Confident	11 Å²	11	48.8 Å²	48.8	6%	0.058	26%	0.264	C	S	.	.	H	α-helix	trans	-63.8	-38.4	179	-71.2	-177.1	0	0	0	111.8	I340 E341 R346 V348 L354 K375 V376 L379	I340-L344 HydrophobicContact CG2-CD1 4.01Å; I340-L344 HydrophobicContact CG2-CG 4.05Å; I340-L344 WeakPolarHBondContact O-CG 2.91Å; I340-L344 PolarHBondContact O-N 2.86Å; E341-L344 PolarHBondContact O-N 3.35Å; L344-R346 VanDerWaalsContact C-N 3.29Å; L344-R346 PolarHBondContact O-N 3.18Å; L344-V348 WeakPolarHBondContact O-CG2 3.25Å; L344-L354 HydrophobicContact CD2-CD2 3.74Å; L344-K375 HydrophobicContact CD1-CD 4.07Å; L344-K375 HydrophobicContact CD1-CG 4.18Å; L344-V376 HydrophobicContact CD1-CG2 4.2Å; L344-V376 HydrophobicContact CD2-CG2 4.01Å; L344-L379 HydrophobicContact CB-CD1 4.22Å; L344-L379 HydrophobicContact CD1-CD1 4.01Å; L344-L379 HydrophobicContact CD2-CD1 3.55Å; L344-L379 HydrophobicContact CG-CD1 4.12Å
345	S	83.9	Confident	84.8	Confident	91 Å²	91	49.4 Å²	49.4	64%	0.636	27%	0.27	S	S	*	.	H	α-helix	trans	-66.2	-30.7	173.4	62.9	0	0	0	0	113	E341 S342 L343	E341-S345 PolarHBondContact O-N 3.11Å; E341-S345 VanDerWaalsContact O-N 3.1Å; E341-S345 PolarHBondContact O-OG 2.88Å; S342-S345 PolarHBondContact O-OG 3.5Å; L343-S345 VanDerWaalsContact C-N 3.32Å; L343-S345 PolarHBondContact O-N 3.45Å
346	R	84.2	Confident	84.8	Confident	97 Å²	97	52.1 Å²	52.1	37%	0.366	28%	0.282	S	S	.	.	H	α-helix	trans	-83.8	-35.6	179.1	-176.2	176.1	160	82.7	11.1	113.4	P253 E254 D256 S342 L343 L344	P253-R346 PolarHBondContact O-NH2 3.49Å; E254-R346 PolarHBondContact O-NH2 3.14Å; E254-R346 IonicContact OE2-CZ 3.58Å; E254-R346 IonicContact OE2-NH1 3.63Å; E254-R346 PolarHBondContact OE2-NH1 2.96Å; E254-R346 IonicContact OE2-NH2 3.89Å; E254-R346 PolarHBondContact OE2-NH2 3.41Å; E254-R346 VanDerWaalsContact OE2-NH2 3.09Å; D256-R346 IonicContact OD1-CZ 2.89Å; D256-R346 IonicContact OD1-NE 2.78Å; D256-R346 PolarHBondContact OD1-NE 3.16Å; D256-R346 IonicContact OD1-NH2 3.59Å; D256-R346 PolarHBondContact OD1-NH2 3.37Å; S342-R346 PolarHBondContact O-N 3.43Å; L343-R346 CarbonylContact O-C 3.6Å; L343-R346 PolarHBondContact O-N 2.94Å; L343-R346 VanDerWaalsContact O-N 3.1Å; L344-R346 VanDerWaalsContact C-N 3.29Å; L344-R346 PolarHBondContact O-N 3.18Å
347	W	85.3	Confident	84.7	Confident	2 Å²	2	52 Å²	52	1%	0.008	28%	0.281	C	S	.	.			trans	-103.2	25	-169	-64.9	-20.5	0	0	0	114.6	D256 H259 L260 L343 N349 N350 M353 L354 L357	D256-W347 HydrophobicContact CB-CZ2 3.93Å; D256-W347 VanDerWaalsContact O-CZ2 3.3Å; D256-W347 WeakPolarHBondContact O-CZ2 3.38Å; D256-W347 PolarHBondContact OD1-NE1 3Å; H259-W347 HydrophobicContact CB-CH2 4.2Å; H259-W347 HydrophobicContact CB-CZ2 3.64Å; L260-W347 HydrophobicContact CB-CH2 3.91Å; L260-W347 HydrophobicContact CD1-CH2 4.43Å; L343-W347 HydrophobicContact CB-CD2 4.24Å; L343-W347 HydrophobicContact CB-CE3 3.84Å; L343-W347 HydrophobicContact CB-CH2 4.29Å; L343-W347 HydrophobicContact CB-CZ3 3.87Å; L343-W347 HydrophobicContact CD1-CH2 3.68Å; L343-W347 HydrophobicContact CD1-CZ2 4.49Å; L343-W347 HydrophobicContact CD1-CZ3 3.71Å; L343-W347 HydrophobicContact CD2-CH2 3.87Å; L343-W347 HydrophobicContact CD2-CZ2 3.84Å; L343-W347 HydrophobicContact CD2-CZ3 4.32Å; L343-W347 HydrophobicContact CG-CH2 4.13Å; L343-W347 HydrophobicContact CG-CZ3 4.15Å; L343-W347 VanDerWaalsContact O-CB 3.31Å; L343-W347 WeakPolarHBondContact O-CB 3.48Å; L343-W347 PolarHBondContact O-N 3.05Å; W347-N349 PolarHBondContact O-N 3.23Å; W347-N350 HydrophobicContact CB-CB 4.11Å; W347-N350 HydrophobicContact CG-CB 4.36Å; W347-N350 PolarHBondContact O-N 2.91Å; W347-M353 HydrophobicContact CD2-CB 4.1Å; W347-M353 HydrophobicContact CE3-CB 4.12Å; W347-M353 HydrophobicContact CH2-CE 4.09Å; W347-M353 HydrophobicContact CZ2-CE 4.05Å; W347-M353 HydrophobicContact CZ3-CB 4.37Å; W347-L354 HydrophobicContact CB-CD2 4Å; W347-L354 HydrophobicContact CB-CG 4.19Å; W347-L354 HydrophobicContact CE3-CD2 4.41Å; W347-L354 VanDerWaalsContact O-CD1 3.3Å; W347-L354 WeakPolarHBondContact O-CD1 3.27Å; W347-L357 HydrophobicContact CE3-CD2 4.39Å; W347-L357 HydrophobicContact CZ3-CB 4.27Å; W347-L357 HydrophobicContact CZ3-CD2 4.1Å
348	V	76.2	Confident	84.6	Confident	80 Å²	80	52.8 Å²	52.8	49%	0.485	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.5	-36.4	-177.8	-175.2	0	0	0	0	112.5	L344	L344-V348 WeakPolarHBondContact O-CG2 3.25Å
349	N	75.6	Confident	84.5	Confident	136 Å²	136	53.2 Å²	53.2	73%	0.727	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.6	6.3	-178.3	-59.2	-6.8	0	0	0	114.4	W347 S351	W347-N349 PolarHBondContact O-N 3.23Å; N349-S351 PolarHBondContact O-N 3.47Å
350	N	80.5	Confident	84.3	Confident	45 Å²	45	53.2 Å²	53.2	24%	0.241	28%	0.283	C	S	.	.			trans	-98	76	-176.1	-163.3	-22.2	0	0	0	111.7	D256 W347 K352 M353 L354	D256-N350 PolarHBondContact OD2-ND2 2.96Å; W347-N350 HydrophobicContact CB-CB 4.11Å; W347-N350 HydrophobicContact CG-CB 4.36Å; W347-N350 PolarHBondContact O-N 2.91Å; N350-K352 VanDerWaalsContact C-N 3.27Å; N350-K352 PolarHBondContact O-N 2.86Å; N350-M353 HydrophobicContact CB-CB 4.22Å; N350-M353 VanDerWaalsContact CG-CG 3.45Å; N350-M353 WeakPolarHBondContact ND2-CG 3.4Å; N350-M353 PolarHBondContact O-N 3.36Å; N350-M353 VanDerWaalsContact O-N 3.15Å; N350-M353 WeakPolarHBondContact OD1-CG 3.5Å; N350-M353 PolarHBondContact OD1-N 3.09Å; N350-L354 WeakPolarHBondContact O-CB 3.44Å; N350-L354 WeakPolarHBondContact O-CG 3.41Å; N350-L354 PolarHBondContact O-N 3.2Å
351	S	80.2	Confident	84.1	Confident	19 Å²	19	53.1 Å²	53.1	13%	0.133	28%	0.282	C	S	.	.	H	α-helix	trans	-50.1	-42	-179.5	174	0	0	0	0	113.5	N349 G355 D387	N349-S351 PolarHBondContact O-N 3.47Å; S351-G355 PolarHBondContact O-N 3.27Å; S351-D387 WeakPolarHBondContact CB-OD2 3.45Å; S351-D387 PolarHBondContact OG-OD2 2.68Å; S351-D387 VanDerWaalsContact OG-OD2 3.05Å
352	K	84.2	Confident	83.9	Confident	174 Å²	174	53 Å²	53	76%	0.757	28%	0.284	S	S	*	.	H	α-helix	trans	-66.1	-46.8	179.2	-68	178.9	-176.4	170.7	0	112.4	N350 G355 L356	N350-K352 VanDerWaalsContact C-N 3.27Å; N350-K352 PolarHBondContact O-N 2.86Å; K352-G355 PolarHBondContact O-N 3.15Å; K352-L356 WeakPolarHBondContact O-CG 3.25Å; K352-L356 PolarHBondContact O-N 3Å
353	M	86.1	Confident	83.5	Confident	22 Å²	22	55.1 Å²	55.1	11%	0.108	30%	0.295	C	S	.	.	H	α-helix	trans	-71.5	-39	-179.1	-67.1	-57.6	-67.3	0	0	111.9	D256 L260 W347 N350 G355 L356 L357	D256-M353 HydrophobicContact CB-CE 3.82Å; D256-M353 HydrophobicContact CB-CG 4.03Å; D256-M353 HydrophobicContact CB-SD 4.38Å; D256-M353 WeakPolarHBondContact O-CE 3.21Å; L260-M353 HydrophobicContact CB-CE 3.64Å; L260-M353 HydrophobicContact CD2-CE 3.78Å; L260-M353 HydrophobicContact CG-CE 4.25Å; W347-M353 HydrophobicContact CD2-CB 4.1Å; W347-M353 HydrophobicContact CE3-CB 4.12Å; W347-M353 HydrophobicContact CH2-CE 4.09Å; W347-M353 HydrophobicContact CZ2-CE 4.05Å; W347-M353 HydrophobicContact CZ3-CB 4.37Å; N350-M353 HydrophobicContact CB-CB 4.22Å; N350-M353 VanDerWaalsContact CG-CG 3.45Å; N350-M353 WeakPolarHBondContact ND2-CG 3.4Å; N350-M353 PolarHBondContact O-N 3.36Å; N350-M353 VanDerWaalsContact O-N 3.15Å; N350-M353 WeakPolarHBondContact OD1-CG 3.5Å; N350-M353 PolarHBondContact OD1-N 3.09Å; M353-G355 VanDerWaalsContact C-N 3.31Å; M353-G355 PolarHBondContact O-N 3.32Å; M353-L356 PolarHBondContact O-N 2.89Å; M353-L356 HydrophobicContact SD-CD1 4.11Å; M353-L357 WeakPolarHBondContact O-CB 3.42Å; M353-L357 PolarHBondContact O-N 3.47Å
354	L	85.7	Confident	82.9	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.005	30%	0.304	C	S	.	.	H	α-helix	trans	-61.4	-40.5	172.1	-69.5	175.6	0	0	0	111.4	L344 W347 N350 L357 H358 L379 V380 A383	L344-L354 HydrophobicContact CD2-CD2 3.74Å; W347-L354 HydrophobicContact CB-CD2 4Å; W347-L354 HydrophobicContact CB-CG 4.19Å; W347-L354 HydrophobicContact CE3-CD2 4.41Å; W347-L354 VanDerWaalsContact O-CD1 3.3Å; W347-L354 WeakPolarHBondContact O-CD1 3.27Å; N350-L354 WeakPolarHBondContact O-CB 3.44Å; N350-L354 WeakPolarHBondContact O-CG 3.41Å; N350-L354 PolarHBondContact O-N 3.2Å; L354-L357 PolarHBondContact O-N 3.36Å; L354-H358 WeakPolarHBondContact O-CB 3.23Å; L354-H358 PolarHBondContact O-N 3.33Å; L354-L379 HydrophobicContact CD1-CB 4.37Å; L354-V380 HydrophobicContact CB-CG2 3.6Å; L354-A383 HydrophobicContact CD1-CB 4.22Å
355	G	84.7	Confident	82	Confident	26 Å²	26	59.7 Å²	59.7	27%	0.268	32%	0.324	S	S	.	.	H	α-helix	trans	-62.3	-44.7	174.5	0	0	0	0	0	113	S351 K352 M353 H358 Q359	S351-G355 PolarHBondContact O-N 3.27Å; K352-G355 PolarHBondContact O-N 3.15Å; M353-G355 VanDerWaalsContact C-N 3.31Å; M353-G355 PolarHBondContact O-N 3.32Å; G355-H358 PolarHBondContact O-N 2.92Å; G355-Q359 WeakPolarHBondContact O-CB 3.48Å; G355-Q359 PolarHBondContact O-N 3.42Å
356	L	86.5	Confident	81.4	Confident	75 Å²	75	63.7 Å²	63.7	39%	0.393	33%	0.333	S	S	.	.	H	α-helix	trans	-64.1	-41.2	174.3	-70.7	173.9	0	0	0	112	L260 K352 M353 Q359 T360	L260-L356 HydrophobicContact CD2-CB 3.87Å; L260-L356 HydrophobicContact CD2-CD1 4.09Å; K352-L356 WeakPolarHBondContact O-CG 3.25Å; K352-L356 PolarHBondContact O-N 3Å; M353-L356 PolarHBondContact O-N 2.89Å; M353-L356 HydrophobicContact SD-CD1 4.11Å; L356-Q359 PolarHBondContact O-N 3.45Å; L356-T360 WeakPolarHBondContact O-CG2 3.22Å; L356-T360 PolarHBondContact O-N 2.92Å; L356-T360 PolarHBondContact O-OG1 3.39Å
357	L	87.2	Confident	80.6	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-61	-49.8	175.4	-178.2	67.4	0	0	0	110.4	L260 A263 I340 L343 W347 M353 L354 Q359 T360 L361 V376	L260-L357 HydrophobicContact CD1-CB 4.08Å; L260-L357 HydrophobicContact CD1-CD1 4.06Å; A263-L357 HydrophobicContact CB-CD1 3.99Å; I340-L357 HydrophobicContact CG2-CD2 4.5Å; L343-L357 HydrophobicContact CD1-CD1 4.41Å; W347-L357 HydrophobicContact CE3-CD2 4.39Å; W347-L357 HydrophobicContact CZ3-CB 4.27Å; W347-L357 HydrophobicContact CZ3-CD2 4.1Å; M353-L357 WeakPolarHBondContact O-CB 3.42Å; M353-L357 PolarHBondContact O-N 3.47Å; L354-L357 PolarHBondContact O-N 3.36Å; L357-Q359 VanDerWaalsContact C-N 3.3Å; L357-Q359 PolarHBondContact O-N 2.93Å; L357-T360 WeakPolarHBondContact CA-OG1 3.45Å; L357-T360 WeakPolarHBondContact O-CA 3.18Å; L357-T360 PolarHBondContact O-N 3.31Å; L357-T360 PolarHBondContact O-OG1 3.46Å; L357-L361 HydrophobicContact CG-CD1 4.27Å; L357-L361 WeakPolarHBondContact O-CG 3.41Å; L357-L361 PolarHBondContact O-N 3.4Å; L357-V376 HydrophobicContact CD2-CG1 4.37Å; L357-V376 HydrophobicContact CD2-CG2 4.45Å
358	H	85.9	Confident	79.9	Confident	46 Å²	46	60.6 Å²	60.6	21%	0.213	32%	0.324	C	S	.	.	H	α-helix	trans	-56	-45.5	176.6	-175.5	-108	0	0	0	111.7	L354 G355 T360 L361 L362 V376 V380	L354-H358 WeakPolarHBondContact O-CB 3.23Å; L354-H358 PolarHBondContact O-N 3.33Å; G355-H358 PolarHBondContact O-N 2.92Å; H358-T360 VanDerWaalsContact C-N 3.29Å; H358-T360 PolarHBondContact O-N 3.46Å; H358-L361 PolarHBondContact O-N 2.89Å; H358-L362 VanDerWaalsContact CE1-CD1 3.47Å; H358-L362 WeakPolarHBondContact CE1-CD1 3.43Å; H358-L362 WeakPolarHBondContact O-CG 3.21Å; H358-L362 PolarHBondContact O-N 2.98Å; H358-V376 HydrophobicContact CB-CG1 3.94Å; H358-V380 HydrophobicContact CB-CG2 4.23Å
359	Q	85.6	Confident	79.9	Confident	114 Å²	114	60.6 Å²	60.6	53%	0.533	32%	0.321	S	S	.	.	H	α-helix	trans	-60.9	-38.6	176.4	-152.6	178.6	22.7	0	0	111.9	G355 L356 L357 L362 T363	G355-Q359 WeakPolarHBondContact O-CB 3.48Å; G355-Q359 PolarHBondContact O-N 3.42Å; L356-Q359 PolarHBondContact O-N 3.45Å; L357-Q359 VanDerWaalsContact C-N 3.3Å; L357-Q359 PolarHBondContact O-N 2.93Å; Q359-L362 PolarHBondContact O-N 3.4Å; Q359-T363 WeakPolarHBondContact O-CG2 3.15Å; Q359-T363 PolarHBondContact O-N 3.46Å
360	T	84.2	Confident	80	Confident	20 Å²	20	57.9 Å²	57.9	12%	0.123	32%	0.317	C	S	.	.	H	α-helix	trans	-66.9	-41.2	175	58.6	0	0	0	0	112.8	K264 L356 L357 H358 L362 T363	K264-T360 HydrophobicContact CD-CG2 4.08Å; K264-T360 HydrophobicContact CG-CG2 3.78Å; L356-T360 WeakPolarHBondContact O-CG2 3.22Å; L356-T360 PolarHBondContact O-N 2.92Å; L356-T360 PolarHBondContact O-OG1 3.39Å; L357-T360 WeakPolarHBondContact CA-OG1 3.45Å; L357-T360 WeakPolarHBondContact O-CA 3.18Å; L357-T360 PolarHBondContact O-N 3.31Å; L357-T360 PolarHBondContact O-OG1 3.46Å; H358-T360 VanDerWaalsContact C-N 3.29Å; H358-T360 PolarHBondContact O-N 3.46Å; T360-L362 VanDerWaalsContact C-N 3.3Å; T360-L362 PolarHBondContact O-N 3.34Å; T360-T363 PolarHBondContact O-N 2.93Å; T360-T363 VanDerWaalsContact O-N 3.1Å; T360-T363 PolarHBondContact O-OG1 3.1Å
361	L	84.3	Confident	79.8	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-62.9	-38.2	177	-62.1	172.6	0	0	0	111.7	I267 I340 L357 H358 T363 V364 I368 I373 V376	I267-L361 HydrophobicContact CD1-CD2 3.75Å; I340-L361 HydrophobicContact CD1-CD1 4.37Å; I340-L361 HydrophobicContact CD1-CD2 3.51Å; L357-L361 HydrophobicContact CG-CD1 4.27Å; L357-L361 WeakPolarHBondContact O-CG 3.41Å; L357-L361 PolarHBondContact O-N 3.4Å; H358-L361 PolarHBondContact O-N 2.89Å; L361-T363 PolarHBondContact O-N 3.31Å; L361-V364 CarbonylContact O-C 3.48Å; L361-V364 PolarHBondContact O-N 2.93Å; L361-I368 HydrophobicContact CB-CD1 4.25Å; L361-I368 HydrophobicContact CD2-CD1 3.65Å; L361-I368 HydrophobicContact CD2-CG2 4.39Å; L361-I373 HydrophobicContact CB-CG1 4.42Å; L361-V376 HydrophobicContact CD1-CB 4.12Å; L361-V376 HydrophobicContact CD1-CG1 4.19Å; L361-V376 HydrophobicContact CD1-CG2 3.74Å
362	L	82.8	Confident	79.6	Confident	91 Å²	91	61.8 Å²	61.8	48%	0.476	33%	0.332	S	S	.	.	H	α-helix	trans	-67.3	-16.7	175.7	-71.1	178.4	0	0	0	114.1	H358 Q359 T360 V364 P365 I373	H358-L362 VanDerWaalsContact CE1-CD1 3.47Å; H358-L362 WeakPolarHBondContact CE1-CD1 3.43Å; H358-L362 WeakPolarHBondContact O-CG 3.21Å; H358-L362 PolarHBondContact O-N 2.98Å; Q359-L362 PolarHBondContact O-N 3.4Å; T360-L362 VanDerWaalsContact C-N 3.3Å; T360-L362 PolarHBondContact O-N 3.34Å; L362-V364 PolarHBondContact O-N 3.1Å; L362-P365 WeakPolarHBondContact O-CD 3.47Å; L362-I373 HydrophobicContact CD2-CG2 4.21Å
363	T	78.2	Confident	79.4	Confident	106 Å²	106	54.7 Å²	54.7	65%	0.65	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-23.9	176	62.3	0	0	0	0	112.4	Q359 T360 L361	Q359-T363 WeakPolarHBondContact O-CG2 3.15Å; Q359-T363 PolarHBondContact O-N 3.46Å; T360-T363 PolarHBondContact O-N 2.93Å; T360-T363 VanDerWaalsContact O-N 3.1Å; T360-T363 PolarHBondContact O-OG1 3.1Å; L361-T363 PolarHBondContact O-N 3.31Å
364	V	74.8	Confident	79.2	Confident	33 Å²	33	59.1 Å²	59.1	20%	0.2	32%	0.322	C	S	.	.	S	Bend	trans	-134.8	64.2	-177.1	-165.1	0	0	0	0	111.3	I267 L361 L362 Q366 I367	I267-V364 HydrophobicContact CG2-CB 4.18Å; I267-V364 HydrophobicContact CG2-CG2 4.04Å; L361-V364 CarbonylContact O-C 3.48Å; L361-V364 PolarHBondContact O-N 2.93Å; L362-V364 PolarHBondContact O-N 3.1Å; V364-Q366 VanDerWaalsContact C-N 3.31Å; V364-Q366 PolarHBondContact O-N 3.07Å; V364-I367 HydrophobicContact CG1-CB 3.97Å; V364-I367 HydrophobicContact CG1-CD1 3.38Å; V364-I367 HydrophobicContact CG1-CG1 3.59Å
365	P	66.9	Low	78.9	Confident	75 Å²	75	62.9 Å²	62.9	49%	0.487	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-22.4	-171.5	28.6	-32.8	0	0	0	113.3	L362 I367	L362-P365 WeakPolarHBondContact O-CD 3.47Å; P365-I367 PolarHBondContact O-N 3.29Å
366	Q	70.6	Confident	78.8	Confident	175 Å²	175	61.7 Å²	61.7	82%	0.818	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-18.9	-176.7	-63.8	179.4	-4.7	0	0	113.8	V364	V364-Q366 VanDerWaalsContact C-N 3.31Å; V364-Q366 PolarHBondContact O-N 3.07Å
367	I	66.6	Low	78.7	Confident	23 Å²	23	59.1 Å²	59.1	12%	0.118	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.8	-24.6	-167.3	-47.4	-176.1	0	0	0	111.6	L270 D271 V364 P365	L270-I367 HydrophobicContact CD1-CG2 3.98Å; L270-I367 HydrophobicContact CD2-CB 4.48Å; L270-I367 HydrophobicContact CD2-CG2 3.62Å; L270-I367 HydrophobicContact CG-CG2 3.48Å; L270-I367 VanDerWaalsContact CG-CG2 3.48Å; D271-I367 HydrophobicContact CB-CD1 3.77Å; D271-I367 WeakPolarHBondContact OD1-CD1 3.5Å; V364-I367 HydrophobicContact CG1-CB 3.97Å; V364-I367 HydrophobicContact CG1-CD1 3.38Å; V364-I367 HydrophobicContact CG1-CG1 3.59Å; P365-I367 PolarHBondContact O-N 3.29Å
368	I	71.7	Confident	78.5	Confident	12 Å²	12	62.9 Å²	62.9	6%	0.062	34%	0.336	C	S	.	.	S	Bend	trans	-96.9	142.4	-174	-56.4	174.8	0	0	0	109.6	I267 L361 A370 I373	I267-I368 HydrophobicContact CD1-CD1 4.24Å; I267-I368 HydrophobicContact CG1-CD1 4.19Å; I267-I368 HydrophobicContact CG2-CD1 4.23Å; L361-I368 HydrophobicContact CB-CD1 4.25Å; L361-I368 HydrophobicContact CD2-CD1 3.65Å; L361-I368 HydrophobicContact CD2-CG2 4.39Å; I368-A370 PolarHBondContact O-N 2.88Å; I368-I373 HydrophobicContact CB-CD1 4.44Å; I368-I373 HydrophobicContact CG2-CD1 4.43Å; I368-I373 HydrophobicContact CG2-CG1 4.1Å
369	D	74.8	Confident	78.1	Confident	79 Å²	79	62.9 Å²	62.9	42%	0.422	34%	0.337	S	S	.	.			trans	-60.4	126	177.9	-61.3	-38.6	0	0	0	111.2	N337 H371 L372 I373	N337-D369 PolarHBondContact ND2-OD2 3.34Å; N337-D369 VanDerWaalsContact ND2-OD2 3.11Å; D369-H371 PolarHBondContact O-N 2.92Å; D369-H371 VanDerWaalsContact O-N 3.16Å; D369-L372 HydrophobicContact CB-CD1 4.14Å; D369-L372 HydrophobicContact CB-CG 4.42Å; D369-L372 WeakPolarHBondContact O-CB 3.4Å; D369-L372 PolarHBondContact O-N 3.08Å; D369-I373 PolarHBondContact O-N 2.84Å
370	A	78.3	Confident	77.9	Confident	79 Å²	79	57.7 Å²	57.7	65%	0.653	31%	0.313	S	S	*	.	H	α-helix	trans	-55	-36.5	-179.1	0	0	0	0	0	112.7	I368 L372 I373 E374	I368-A370 PolarHBondContact O-N 2.88Å; A370-L372 VanDerWaalsContact C-N 3.31Å; A370-L372 PolarHBondContact O-N 3.22Å; A370-I373 PolarHBondContact O-N 3.39Å; A370-E374 PolarHBondContact O-N 2.93Å
371	H	77	Confident	77.6	Confident	137 Å²	137	60.5 Å²	60.5	63%	0.634	33%	0.328	S	S	*	.	H	α-helix	trans	-61.8	-34.3	177.4	180	-91.6	0	0	0	113.1	D369 K375	D369-H371 PolarHBondContact O-N 2.92Å; D369-H371 VanDerWaalsContact O-N 3.16Å; H371-K375 WeakPolarHBondContact O-CB 3.34Å; H371-K375 PolarHBondContact O-N 3.12Å
372	L	76	Confident	77.3	Confident	9 Å²	9	64.7 Å²	64.7	5%	0.047	35%	0.35	C	S	.	.	H	α-helix	trans	-72.3	-38.6	177	-77.6	167.1	0	0	0	112	N337 D369 A370 E374 K375 V376	N337-L372 HydrophobicContact CB-CD1 4.09Å; N337-L372 WeakPolarHBondContact OD1-CD1 3.37Å; D369-L372 HydrophobicContact CB-CD1 4.14Å; D369-L372 HydrophobicContact CB-CG 4.42Å; D369-L372 WeakPolarHBondContact O-CB 3.4Å; D369-L372 PolarHBondContact O-N 3.08Å; A370-L372 VanDerWaalsContact C-N 3.31Å; A370-L372 PolarHBondContact O-N 3.22Å; L372-E374 VanDerWaalsContact C-N 3.32Å; L372-K375 PolarHBondContact O-N 3.14Å; L372-V376 VanDerWaalsContact O-CG2 3.26Å; L372-V376 WeakPolarHBondContact O-CG2 3.39Å; L372-V376 PolarHBondContact O-N 2.95Å
373	I	79.1	Confident	76.8	Confident	25 Å²	25	60.7 Å²	60.7	13%	0.128	33%	0.33	C	S	.	.	H	α-helix	trans	-61.3	-46	175.3	-59.1	176.6	0	0	0	109.4	L361 L362 I368 D369 A370 V376 A377	L361-I373 HydrophobicContact CB-CG1 4.42Å; L362-I373 HydrophobicContact CD2-CG2 4.21Å; I368-I373 HydrophobicContact CB-CD1 4.44Å; I368-I373 HydrophobicContact CG2-CD1 4.43Å; I368-I373 HydrophobicContact CG2-CG1 4.1Å; D369-I373 PolarHBondContact O-N 2.84Å; A370-I373 PolarHBondContact O-N 3.39Å; I373-V376 PolarHBondContact O-N 2.84Å; I373-A377 WeakPolarHBondContact O-CB 3.32Å; I373-A377 PolarHBondContact O-N 3.36Å
374	E	81.5	Confident	76.3	Confident	115 Å²	115	60.9 Å²	60.9	54%	0.537	32%	0.322	S	S	.	.	H	α-helix	trans	-62.5	-44.4	176.9	-170.1	178.2	-179.8	0	0	112.2	A370 L372 V376 A377 N378	A370-E374 PolarHBondContact O-N 2.93Å; L372-E374 VanDerWaalsContact C-N 3.32Å; E374-V376 VanDerWaalsContact C-N 3.33Å; E374-V376 PolarHBondContact O-N 3.43Å; E374-A377 PolarHBondContact O-N 3.15Å; E374-N378 WeakPolarHBondContact O-CB 3.43Å; E374-N378 VanDerWaalsContact O-CG 3.25Å; E374-N378 PolarHBondContact O-N 3.39Å; E374-N378 PolarHBondContact O-ND2 3.39Å
375	K	81.4	Confident	75.7	Confident	81 Å²	81	65 Å²	65	35%	0.352	34%	0.339	S	S	.	.	H	α-helix	trans	-58.5	-43.4	176	-173.6	177.7	-179.9	-179.4	0	112.2	L344 H371 L372 L379	L344-K375 HydrophobicContact CD1-CD 4.07Å; L344-K375 HydrophobicContact CD1-CG 4.18Å; H371-K375 WeakPolarHBondContact O-CB 3.34Å; H371-K375 PolarHBondContact O-N 3.12Å; L372-K375 PolarHBondContact O-N 3.14Å; K375-L379 WeakPolarHBondContact O-CG 3.49Å; K375-L379 PolarHBondContact O-N 3.45Å
376	V	82	Confident	75.3	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-68.4	-42.2	176.7	175.8	0	0	0	0	110.6	I340 L344 L357 H358 L361 L372 I373 E374 N378 L379 V380	I340-V376 HydrophobicContact CG2-CG2 4.15Å; L344-V376 HydrophobicContact CD1-CG2 4.2Å; L344-V376 HydrophobicContact CD2-CG2 4.01Å; L357-V376 HydrophobicContact CD2-CG1 4.37Å; L357-V376 HydrophobicContact CD2-CG2 4.45Å; H358-V376 HydrophobicContact CB-CG1 3.94Å; L361-V376 HydrophobicContact CD1-CB 4.12Å; L361-V376 HydrophobicContact CD1-CG1 4.19Å; L361-V376 HydrophobicContact CD1-CG2 3.74Å; L372-V376 VanDerWaalsContact O-CG2 3.26Å; L372-V376 WeakPolarHBondContact O-CG2 3.39Å; L372-V376 PolarHBondContact O-N 2.95Å; I373-V376 PolarHBondContact O-N 2.84Å; E374-V376 VanDerWaalsContact C-N 3.33Å; E374-V376 PolarHBondContact O-N 3.43Å; V376-N378 PolarHBondContact O-N 2.86Å; V376-L379 PolarHBondContact O-N 3.22Å; V376-V380 HydrophobicContact CG1-CG2 4.39Å; V376-V380 VanDerWaalsContact O-CG2 3.31Å; V376-V380 WeakPolarHBondContact O-CG2 3.38Å; V376-V380 PolarHBondContact O-N 3.04Å
377	A	83.3	Confident	74.6	Confident	22 Å²	22	60.4 Å²	60.4	18%	0.182	32%	0.318	C	S	.	.	H	α-helix	trans	-60	-44.3	177.4	0	0	0	0	0	112	I373 E374 L379 V380 N381	I373-A377 WeakPolarHBondContact O-CB 3.32Å; I373-A377 PolarHBondContact O-N 3.36Å; E374-A377 PolarHBondContact O-N 3.15Å; A377-L379 PolarHBondContact O-N 3.28Å; A377-V380 PolarHBondContact O-N 2.94Å; A377-N381 VanDerWaalsContact O-CG 3.3Å; A377-N381 PolarHBondContact O-N 3.49Å; A377-N381 PolarHBondContact O-ND2 2.84Å
378	N	82.9	Confident	73.8	Confident	79 Å²	79	62.4 Å²	62.4	42%	0.422	33%	0.332	S	S	.	.	H	α-helix	trans	-61.9	-42.6	176.7	-69.8	-17.9	0	0	0	111.6	E374 V376 N381 N382	E374-N378 WeakPolarHBondContact O-CB 3.43Å; E374-N378 VanDerWaalsContact O-CG 3.25Å; E374-N378 PolarHBondContact O-N 3.39Å; E374-N378 PolarHBondContact O-ND2 3.39Å; V376-N378 PolarHBondContact O-N 2.86Å; N378-N381 PolarHBondContact O-N 2.9Å; N378-N382 PolarHBondContact O-N 2.87Å; N378-N382 PolarHBondContact O-OD1 3.01Å
379	L	78.7	Confident	72.6	Confident	45 Å²	45	65.1 Å²	65.1	24%	0.236	35%	0.352	C	S	.	.	H	α-helix	trans	-67.6	-36.3	176	-70.9	172.9	0	0	0	113	L344 L354 K375 V376 A377 N381 N382 A383	L344-L379 HydrophobicContact CB-CD1 4.22Å; L344-L379 HydrophobicContact CD1-CD1 4.01Å; L344-L379 HydrophobicContact CD2-CD1 3.55Å; L344-L379 HydrophobicContact CG-CD1 4.12Å; L354-L379 HydrophobicContact CD1-CB 4.37Å; K375-L379 WeakPolarHBondContact O-CG 3.49Å; K375-L379 PolarHBondContact O-N 3.45Å; V376-L379 PolarHBondContact O-N 3.22Å; A377-L379 PolarHBondContact O-N 3.28Å; L379-N381 VanDerWaalsContact C-N 3.33Å; L379-N382 PolarHBondContact O-N 2.89Å; L379-A383 VanDerWaalsContact O-CB 3.31Å; L379-A383 WeakPolarHBondContact O-CB 3.27Å; L379-A383 PolarHBondContact O-N 2.77Å
380	V	81	Confident	70.9	Confident	5 Å²	5	68.5 Å²	68.5	3%	0.03	37%	0.365	C	S	.	.	H	α-helix	trans	-61.8	-43	172.5	170.2	0	0	0	0	110.8	L354 H358 V376 A377 A383 K384	L354-V380 HydrophobicContact CB-CG2 3.6Å; H358-V380 HydrophobicContact CB-CG2 4.23Å; V376-V380 HydrophobicContact CG1-CG2 4.39Å; V376-V380 VanDerWaalsContact O-CG2 3.31Å; V376-V380 WeakPolarHBondContact O-CG2 3.38Å; V376-V380 PolarHBondContact O-N 3.04Å; A377-V380 PolarHBondContact O-N 2.94Å; V380-A383 PolarHBondContact O-N 2.87Å; V380-K384 HydrophobicContact CG1-CD 4.09Å; V380-K384 WeakPolarHBondContact O-CB 3.48Å; V380-K384 VanDerWaalsContact O-CG 3.27Å; V380-K384 WeakPolarHBondContact O-CG 3.31Å; V380-K384 PolarHBondContact O-N 3.4Å
381	N	79	Confident	69	Low	80 Å²	80	68 Å²	68	43%	0.428	36%	0.357	S	S	.	.	H	α-helix	trans	-65.3	-47	178.3	-68.3	-19	0	0	0	111	A377 N378 L379 A383 K384 E385	A377-N381 VanDerWaalsContact O-CG 3.3Å; A377-N381 PolarHBondContact O-N 3.49Å; A377-N381 PolarHBondContact O-ND2 2.84Å; N378-N381 PolarHBondContact O-N 2.9Å; L379-N381 VanDerWaalsContact C-N 3.33Å; N381-A383 VanDerWaalsContact C-N 3.33Å; N381-A383 PolarHBondContact O-N 3.3Å; N381-K384 PolarHBondContact O-N 2.96Å; N381-E385 WeakPolarHBondContact O-CG 3.43Å; N381-E385 PolarHBondContact O-N 3.37Å
382	N	77	Confident	66.9	Low	88 Å²	88	67.8 Å²	67.8	47%	0.471	36%	0.36	S	S	.	.	H	α-helix	trans	-59.5	-41.9	175.9	-64.9	-5	0	0	0	112.1	N378 L379 E385 V386	N378-N382 PolarHBondContact O-N 2.87Å; N378-N382 PolarHBondContact O-OD1 3.01Å; L379-N382 PolarHBondContact O-N 2.89Å; N382-E385 WeakPolarHBondContact O-CB 3.47Å; N382-E385 PolarHBondContact O-N 2.94Å; N382-V386 WeakPolarHBondContact O-CG2 3.23Å; N382-V386 PolarHBondContact O-N 3.38Å
383	A	71.6	Confident	64.7	Low	7 Å²	7	76 Å²	76	6%	0.058	40%	0.398	C	S	.	.	H	α-helix	trans	-67.6	-37.5	178	0	0	0	0	0	112.4	L354 L379 V380 N381 E385 V386 D387	L354-A383 HydrophobicContact CD1-CB 4.22Å; L379-A383 VanDerWaalsContact O-CB 3.31Å; L379-A383 WeakPolarHBondContact O-CB 3.27Å; L379-A383 PolarHBondContact O-N 2.77Å; V380-A383 PolarHBondContact O-N 2.87Å; N381-A383 VanDerWaalsContact C-N 3.33Å; N381-A383 PolarHBondContact O-N 3.3Å; A383-E385 VanDerWaalsContact C-N 3.33Å; A383-V386 PolarHBondContact O-N 3.05Å; A383-D387 PolarHBondContact O-N 2.96Å
384	K	69.1	Low	62.5	Low	109 Å²	109	82.9 Å²	82.9	47%	0.474	43%	0.427	S	S	.	.	H	α-helix	trans	-65.8	-35.3	171.8	-73.4	172.4	-179.6	176	0	112	V380 N381 V386 D387 T388	V380-K384 HydrophobicContact CG1-CD 4.09Å; V380-K384 WeakPolarHBondContact O-CB 3.48Å; V380-K384 VanDerWaalsContact O-CG 3.27Å; V380-K384 WeakPolarHBondContact O-CG 3.31Å; V380-K384 PolarHBondContact O-N 3.4Å; N381-K384 PolarHBondContact O-N 2.96Å; K384-V386 VanDerWaalsContact C-N 3.34Å; K384-D387 PolarHBondContact O-N 3.26Å; K384-T388 WeakPolarHBondContact O-CB 3.44Å; K384-T388 VanDerWaalsContact O-CG2 3.3Å; K384-T388 WeakPolarHBondContact O-CG2 3.35Å; K384-T388 PolarHBondContact O-N 2.76Å; K384-T388 PolarHBondContact O-OG1 2.73Å
385	E	61	Low	59.9	Low	119 Å²	119	84 Å²	84	56%	0.556	44%	0.435	S	S	*	.	H	α-helix	trans	-65.5	-35.6	174	-75.7	178.5	-171.2	0	0	112	N381 N382 A383 T388 S389	N381-E385 WeakPolarHBondContact O-CG 3.43Å; N381-E385 PolarHBondContact O-N 3.37Å; N382-E385 WeakPolarHBondContact O-CB 3.47Å; N382-E385 PolarHBondContact O-N 2.94Å; A383-E385 VanDerWaalsContact C-N 3.33Å; E385-T388 VanDerWaalsContact CA-OG1 3.23Å; E385-T388 WeakPolarHBondContact CA-OG1 3.33Å; E385-T388 PolarHBondContact O-OG1 3.36Å; E385-S389 VanDerWaalsContact O-CB 3.22Å; E385-S389 WeakPolarHBondContact O-CB 3.5Å; E385-S389 PolarHBondContact O-N 3.25Å; E385-S389 PolarHBondContact O-OG 3.44Å
386	V	59	Low	57.3	Low	74 Å²	74	89.7 Å²	89.7	45%	0.448	46%	0.46	S	S	.	.	H	α-helix	trans	-70.5	-46	173.1	177.1	0	0	0	0	111.6	N382 A383 K384 T388 S389 E390	N382-V386 WeakPolarHBondContact O-CG2 3.23Å; N382-V386 PolarHBondContact O-N 3.38Å; A383-V386 PolarHBondContact O-N 3.05Å; K384-V386 VanDerWaalsContact C-N 3.34Å; V386-T388 PolarHBondContact O-N 3.45Å; V386-S389 PolarHBondContact O-N 2.9Å; V386-S389 VanDerWaalsContact O-N 3.13Å; V386-E390 PolarHBondContact O-N 2.65Å
387	D	54.6	Low	54.8	Low	80 Å²	80	95 Å²	95	43%	0.428	49%	0.494	S	S	.	.	H	α-helix	trans	-58.7	-38.7	175.2	-77.1	-26.2	0	0	0	111.2	S351 A383 K384 S391	S351-D387 WeakPolarHBondContact CB-OD2 3.45Å; S351-D387 PolarHBondContact OG-OD2 2.68Å; S351-D387 VanDerWaalsContact OG-OD2 3.05Å; A383-D387 PolarHBondContact O-N 2.96Å; K384-D387 PolarHBondContact O-N 3.26Å; D387-S391 WeakPolarHBondContact O-CB 3.36Å; D387-S391 PolarHBondContact O-N 3.27Å; D387-S391 PolarHBondContact O-OG 2.88Å
388	T	51.7	Low	52.5	Low	65 Å²	65	98.9 Å²	98.9	40%	0.399	52%	0.518	S	S	.	.	H	α-helix	trans	-73.7	-39.2	174.8	50.8	0	0	0	0	111.6	K384 E385 V386 E390 S391 L392	K384-T388 WeakPolarHBondContact O-CB 3.44Å; K384-T388 VanDerWaalsContact O-CG2 3.3Å; K384-T388 WeakPolarHBondContact O-CG2 3.35Å; K384-T388 PolarHBondContact O-N 2.76Å; K384-T388 PolarHBondContact O-OG1 2.73Å; E385-T388 VanDerWaalsContact CA-OG1 3.23Å; E385-T388 WeakPolarHBondContact CA-OG1 3.33Å; E385-T388 PolarHBondContact O-OG1 3.36Å; V386-T388 PolarHBondContact O-N 3.45Å; T388-E390 PolarHBondContact O-N 2.95Å; T388-S391 VanDerWaalsContact CA-OG 3.32Å; T388-S391 WeakPolarHBondContact CA-OG 3.27Å; T388-S391 CarbonylContact O-C 3.24Å; T388-S391 PolarHBondContact O-N 3.47Å; T388-S391 PolarHBondContact O-OG 3.14Å; T388-L392 WeakPolarHBondContact O-CA 3.49Å; T388-L392 WeakPolarHBondContact O-CB 3.42Å; T388-L392 VanDerWaalsContact O-CD1 3.27Å; T388-L392 WeakPolarHBondContact O-CD1 3.39Å; T388-L392 WeakPolarHBondContact O-CG 3.43Å; T388-L392 PolarHBondContact O-N 3.39Å
389	S	44.9	Very low	50.3	Low	70 Å²	70	101 Å²	101	49%	0.49	53%	0.529	S	S	.	.	H	α-helix	trans	-65.6	-40.3	178.4	-60.3	0	0	0	0	112.7	E385 V386 S391 L392 E393	E385-S389 VanDerWaalsContact O-CB 3.22Å; E385-S389 WeakPolarHBondContact O-CB 3.5Å; E385-S389 PolarHBondContact O-N 3.25Å; E385-S389 PolarHBondContact O-OG 3.44Å; V386-S389 PolarHBondContact O-N 2.9Å; V386-S389 VanDerWaalsContact O-N 3.13Å; S389-S391 VanDerWaalsContact C-N 3.31Å; S389-S391 PolarHBondContact O-N 3.27Å; S389-L392 PolarHBondContact O-N 2.99Å; S389-E393 PolarHBondContact O-N 3.46Å
390	E	40.7	Very low	48.3	Very low	150 Å²	150	107.2 Å²	107.2	70%	0.701	56%	0.556	S	S	*	*	H	α-helix	trans	-69.7	-27.5	174.2	-72.3	-172.3	172.6	0	0	112.8	V386 T388	V386-E390 PolarHBondContact O-N 2.65Å; T388-E390 PolarHBondContact O-N 2.95Å
391	S	37.7	Very low	46.1	Very low	69 Å²	69	112.3 Å²	112.3	48%	0.483	59%	0.591	S	S	.	*	H	α-helix	trans	-89.6	-19.9	174.3	53.2	0	0	0	0	114	D387 T388 S389 K394	D387-S391 WeakPolarHBondContact O-CB 3.36Å; D387-S391 PolarHBondContact O-N 3.27Å; D387-S391 PolarHBondContact O-OG 2.88Å; T388-S391 VanDerWaalsContact CA-OG 3.32Å; T388-S391 WeakPolarHBondContact CA-OG 3.27Å; T388-S391 CarbonylContact O-C 3.24Å; T388-S391 PolarHBondContact O-N 3.47Å; T388-S391 PolarHBondContact O-OG 3.14Å; S389-S391 VanDerWaalsContact C-N 3.31Å; S389-S391 PolarHBondContact O-N 3.27Å; S391-K394 CarbonylContact O-C 3.53Å; S391-K394 VanDerWaalsContact O-C 3.24Å; S391-K394 PolarHBondContact O-N 3.17Å
392	L	31.9	Very low	44.9	Very low	132 Å²	132	115.4 Å²	115.4	69%	0.691	60%	0.601	S	S	*	*	H	α-helix	trans	-79.6	-26.2	178.7	-77.6	164.4	0	0	0	112.1	T388 S389 K394	T388-L392 WeakPolarHBondContact O-CA 3.49Å; T388-L392 WeakPolarHBondContact O-CB 3.42Å; T388-L392 VanDerWaalsContact O-CD1 3.27Å; T388-L392 WeakPolarHBondContact O-CD1 3.39Å; T388-L392 WeakPolarHBondContact O-CG 3.43Å; T388-L392 PolarHBondContact O-N 3.39Å; S389-L392 PolarHBondContact O-N 2.99Å; L392-K394 VanDerWaalsContact C-N 3.26Å; L392-K394 PolarHBondContact O-N 2.91Å
393	E	29.9	Very low	44.1	Very low	181 Å²	181	114.1 Å²	114.1	85%	0.846	60%	0.596	S	S	*	*	S	Bend	trans	-75.3	-14.1	172.6	-100.9	-169.3	169.5	0	0	113.9	S389	S389-E393 PolarHBondContact O-N 3.46Å
394	K	34.4	Very low	43.7	Very low	170 Å²	170	120.4 Å²	120.4	74%	0.739	62%	0.624	S	S	*	*	S	Bend	trans	-138.7	86.1	170.6	-71.7	177.9	-176	167.6	0	109.1	S391 L392	S391-K394 CarbonylContact O-C 3.53Å; S391-K394 VanDerWaalsContact O-C 3.24Å; S391-K394 PolarHBondContact O-N 3.17Å; L392-K394 VanDerWaalsContact C-N 3.26Å; L392-K394 PolarHBondContact O-N 2.91Å
395	I	26.5	Very low	44	Very low	137 Å²	137	121.1 Å²	121.1	70%	0.703	63%	0.629	S	S	*	*			trans	168.3	103.9	132.9	-80.3	147.4	0	0	0	108.5
396	K	25.4	Very low	44.6	Very low	201 Å²	201	119 Å²	119	87%	0.874	62%	0.621	S	S	*	*			trans	-88.9	147.4	142.7	-90.7	-180	176.7	176.1	0	107.7	P398	K396-P398 WeakPolarHBondContact O-CD 3.36Å
397	P	31	Very low	45.4	Very low	111 Å²	111	120.5 Å²	120.5	72%	0.721	62%	0.618	S	S	*	*			trans	-91.3	136.9	-144.6	33.9	-33.7	0	0	0	114.2
398	P	33.8	Very low	46.5	Very low	105 Å²	105	119.7 Å²	119.7	68%	0.682	62%	0.619	S	S	*	*			trans	-129.8	76.3	147.7	33.7	-17.5	0	0	0	109.8	K396	K396-P398 WeakPolarHBondContact O-CD 3.36Å
399	L	37	Very low	47.9	Very low	124 Å²	124	122.9 Å²	122.9	65%	0.649	63%	0.627	S	S	*	*			trans	-119.2	-8.8	174.9	-77.5	174.1	0	0	0	114.9	T403	L399-T403 WeakPolarHBondContact O-CG2 3.46Å
400	E	37.1	Very low	49.7	Very low	174 Å²	174	120 Å²	120	81%	0.813	61%	0.606	S	S	*	*	H	α-helix	trans	-75.6	-46.2	-179	-70.7	-177.4	170.3	0	0	113.1	K402 T403	E400-K402 VanDerWaalsContact C-N 3.35Å; E400-K402 PolarHBondContact O-N 2.86Å; E400-T403 PolarHBondContact O-N 3.46Å; E400-T403 PolarHBondContact O-OG1 2.63Å
401	C	34	Very low	51.7	Low	112 Å²	112	115.2 Å²	115.2	76%	0.757	59%	0.589	S	S	*	*	H	α-helix	trans	-58.3	-37.6	-178	-81.6	0	0	0	0	114.6	T403	C401-T403 VanDerWaalsContact C-N 3.31Å; C401-T403 PolarHBondContact O-N 3.19Å
402	K	55.3	Low	54	Low	145 Å²	145	116.5 Å²	116.5	63%	0.63	59%	0.591	S	S	*	*	H	α-helix	trans	-70.3	-26.4	-178.1	-69.1	-176.5	-179.7	177.5	0	113.1	E400 I406	E400-K402 VanDerWaalsContact C-N 3.35Å; E400-K402 PolarHBondContact O-N 2.86Å; K402-I406 WeakPolarHBondContact O-CD1 3.25Å; K402-I406 WeakPolarHBondContact O-CG1 3.37Å; K402-I406 PolarHBondContact O-N 3.35Å
403	T	58.9	Low	56.5	Low	62 Å²	62	112.9 Å²	112.9	38%	0.38	57%	0.57	S	S	.	*	H	α-helix	trans	-73.1	-35.4	-178.7	62.9	0	0	0	0	111.9	L399 E400 C401 I406 R407	L399-T403 WeakPolarHBondContact O-CG2 3.46Å; E400-T403 PolarHBondContact O-N 3.46Å; E400-T403 PolarHBondContact O-OG1 2.63Å; C401-T403 VanDerWaalsContact C-N 3.31Å; C401-T403 PolarHBondContact O-N 3.19Å; T403-I406 PolarHBondContact O-N 3.47Å; T403-R407 WeakPolarHBondContact O-CG 3.39Å; T403-R407 PolarHBondContact O-N 3.14Å
404	H	64.4	Low	59.1	Low	139 Å²	139	105.5 Å²	105.5	64%	0.644	54%	0.536	S	S	*	.	H	α-helix	trans	-68.8	-39.4	-178.3	-141.6	-61.2	0	0	0	112.6	R407 S408	H404-R407 PolarHBondContact O-N 3.36Å; H404-S408 PolarHBondContact O-N 3.21Å
405	E	74.1	Confident	61.6	Low	124 Å²	124	100.8 Å²	100.8	58%	0.579	52%	0.522	S	S	*	.	H	α-helix	trans	-64.1	-41	174	-71.4	-177.7	-172.6	0	0	112.3	S408 K409	E405-S408 PolarHBondContact O-N 3.23Å; E405-K409 WeakPolarHBondContact O-CG 3.41Å; E405-K409 PolarHBondContact O-N 3.11Å
406	I	73.9	Confident	64.5	Low	74 Å²	74	99.1 Å²	99.1	38%	0.379	51%	0.51	S	S	.	.	H	α-helix	trans	-66.2	-44.2	177.3	-65.5	168	0	0	0	109.8	K402 T403 S408 K409 L410 I457	K402-I406 WeakPolarHBondContact O-CD1 3.25Å; K402-I406 WeakPolarHBondContact O-CG1 3.37Å; K402-I406 PolarHBondContact O-N 3.35Å; T403-I406 PolarHBondContact O-N 3.47Å; I406-S408 PolarHBondContact O-N 3.01Å; I406-K409 PolarHBondContact O-N 3.16Å; I406-L410 HydrophobicContact CG2-CD1 3.78Å; I406-L410 HydrophobicContact CG2-CG 4.24Å; I406-L410 VanDerWaalsContact O-CG 3.26Å; I406-L410 WeakPolarHBondContact O-CG 3.39Å; I406-L410 PolarHBondContact O-N 3Å; I406-I457 HydrophobicContact CG2-CD1 4.15Å
407	R	75.9	Confident	67.4	Low	106 Å²	106	89.7 Å²	89.7	40%	0.4	47%	0.468	S	S	.	.	H	α-helix	trans	-58.7	-46.8	175.4	-78.1	-176.9	-177.9	175.6	0.7	112.1	T403 H404 K409 L410 S411 I457	T403-R407 WeakPolarHBondContact O-CG 3.39Å; T403-R407 PolarHBondContact O-N 3.14Å; H404-R407 PolarHBondContact O-N 3.36Å; R407-K409 PolarHBondContact O-N 2.89Å; R407-L410 PolarHBondContact O-N 2.86Å; R407-S411 WeakPolarHBondContact O-CB 3.3Å; R407-S411 PolarHBondContact O-N 3.42Å; R407-I457 HydrophobicContact CG-CG2 3.95Å
408	S	77.2	Confident	69.9	Low	62 Å²	62	89.8 Å²	89.8	43%	0.434	46%	0.459	S	S	.	.	H	α-helix	trans	-57.8	-49.6	176.2	-168	0	0	0	0	111.2	H404 E405 I406 L410 S411 D412	H404-S408 PolarHBondContact O-N 3.21Å; E405-S408 PolarHBondContact O-N 3.23Å; I406-S408 PolarHBondContact O-N 3.01Å; S408-L410 VanDerWaalsContact C-N 3.34Å; S408-L410 PolarHBondContact O-N 3.24Å; S408-S411 WeakPolarHBondContact O-CB 3.44Å; S408-S411 PolarHBondContact O-N 3.45Å; S408-D412 PolarHBondContact O-N 3.46Å
409	K	82.6	Confident	72.3	Confident	133 Å²	133	90.1 Å²	90.1	58%	0.578	45%	0.452	S	S	*	.	H	α-helix	trans	-59.2	-42.6	177.9	-74.2	172.3	-179.6	169.9	0	112.4	E405 I406 R407 Q413	E405-K409 WeakPolarHBondContact O-CG 3.41Å; E405-K409 PolarHBondContact O-N 3.11Å; I406-K409 PolarHBondContact O-N 3.16Å; R407-K409 PolarHBondContact O-N 2.89Å; K409-Q413 WeakPolarHBondContact O-CG 3.4Å; K409-Q413 PolarHBondContact O-N 2.86Å
410	L	81.9	Confident	74.7	Confident	8 Å²	8	85.1 Å²	85.1	4%	0.042	43%	0.426	C	S	.	.	H	α-helix	trans	-69	-37.8	178.9	-67.1	172	0	0	0	111.9	I406 R407 S408 Q413 L414 I453 I457 E459 A460 L463	I406-L410 HydrophobicContact CG2-CD1 3.78Å; I406-L410 HydrophobicContact CG2-CG 4.24Å; I406-L410 VanDerWaalsContact O-CG 3.26Å; I406-L410 WeakPolarHBondContact O-CG 3.39Å; I406-L410 PolarHBondContact O-N 3Å; R407-L410 PolarHBondContact O-N 2.86Å; S408-L410 VanDerWaalsContact C-N 3.34Å; S408-L410 PolarHBondContact O-N 3.24Å; L410-Q413 PolarHBondContact O-N 3.41Å; L410-L414 PolarHBondContact O-N 2.84Å; L410-I453 HydrophobicContact CD1-CG2 4.12Å; L410-I453 HydrophobicContact CD2-CD1 3.95Å; L410-I457 HydrophobicContact CD1-CG2 3.99Å; L410-E459 HydrophobicContact CB-CB 3.86Å; L410-A460 HydrophobicContact CD1-CB 4.17Å; L410-L463 HydrophobicContact CB-CD1 3.89Å; L410-L463 HydrophobicContact CD2-CD1 3.45Å; L410-L463 VanDerWaalsContact CD2-CD1 3.45Å; L410-L463 HydrophobicContact CG-CD1 4.2Å
411	S	83.1	Confident	76.9	Confident	50 Å²	50	79 Å²	79	35%	0.35	40%	0.398	S	S	.	.	H	α-helix	trans	-62.6	-46.9	173.6	-170	0	0	0	0	111.4	R407 S408 Q413 L414 V415	R407-S411 WeakPolarHBondContact O-CB 3.3Å; R407-S411 PolarHBondContact O-N 3.42Å; S408-S411 WeakPolarHBondContact O-CB 3.44Å; S408-S411 PolarHBondContact O-N 3.45Å; S411-Q413 VanDerWaalsContact C-N 3.25Å; S411-Q413 PolarHBondContact O-N 3.34Å; S411-L414 WeakPolarHBondContact O-CB 3.31Å; S411-L414 PolarHBondContact O-N 3.04Å; S411-L414 VanDerWaalsContact O-N 3.08Å; S411-V415 WeakPolarHBondContact O-CG2 3.44Å; S411-V415 PolarHBondContact O-N 2.91Å
412	D	85.5	Confident	79	Confident	96 Å²	96	81.5 Å²	81.5	51%	0.513	40%	0.401	S	S	.	.	H	α-helix	trans	-59.3	-38.2	176.1	-65.3	-27.1	0	0	0	111.6	S408 V415 K416	S408-D412 PolarHBondContact O-N 3.46Å; D412-V415 PolarHBondContact O-N 2.88Å; D412-K416 WeakPolarHBondContact O-CB 3.45Å; D412-K416 PolarHBondContact O-N 3.2Å
413	Q	84.6	Confident	80.2	Confident	56 Å²	56	80.8 Å²	80.8	26%	0.262	40%	0.404	S	S	.	.	H	α-helix	trans	-68	-39.9	175.2	-68.9	-64	-22.7	0	0	112.6	K409 L410 S411 K416 I417 W436 L463	K409-Q413 WeakPolarHBondContact O-CG 3.4Å; K409-Q413 PolarHBondContact O-N 2.86Å; L410-Q413 PolarHBondContact O-N 3.41Å; S411-Q413 VanDerWaalsContact C-N 3.25Å; S411-Q413 PolarHBondContact O-N 3.34Å; Q413-K416 PolarHBondContact O-N 3.4Å; Q413-I417 WeakPolarHBondContact O-CB 3.45Å; Q413-I417 WeakPolarHBondContact O-CG1 3.42Å; Q413-I417 PolarHBondContact O-N 2.91Å; Q413-W436 HydrophobicContact CB-CH2 3.55Å; Q413-W436 HydrophobicContact CB-CZ2 3.8Å; Q413-W436 HydrophobicContact CB-CZ3 4.49Å; Q413-W436 HydrophobicContact CG-CH2 3.61Å; Q413-W436 HydrophobicContact CG-CZ2 4.03Å; Q413-W436 HydrophobicContact CG-CZ3 4.1Å; Q413-L463 HydrophobicContact CB-CD2 4.25Å
414	L	84.8	Confident	81.3	Confident	26 Å²	26	85.4 Å²	85.4	14%	0.136	42%	0.419	C	S	.	.	H	α-helix	trans	-60.4	-47.4	173.4	-81	169.3	0	0	0	110.8	L410 S411 K416 I417 H418 E459 L463	L410-L414 PolarHBondContact O-N 2.84Å; S411-L414 WeakPolarHBondContact O-CB 3.31Å; S411-L414 PolarHBondContact O-N 3.04Å; S411-L414 VanDerWaalsContact O-N 3.08Å; L414-K416 VanDerWaalsContact C-N 3.31Å; L414-K416 PolarHBondContact O-N 3.28Å; L414-I417 PolarHBondContact O-N 2.72Å; L414-H418 PolarHBondContact O-CD2 3.43Å; L414-H418 PolarHBondContact O-N 3.36Å; L414-E459 HydrophobicContact CD1-CB 3.91Å; L414-E459 HydrophobicContact CD1-CG 4.3Å; L414-L463 HydrophobicContact CD1-CG 4.34Å; L414-L463 HydrophobicContact CD2-CB 4.42Å; L414-L463 HydrophobicContact CD2-CD2 3.54Å; L414-L463 HydrophobicContact CD2-CG 3.63Å; L414-L463 HydrophobicContact CG-CD1 4.31Å; L414-L463 HydrophobicContact CG-CD2 3.65Å; L414-L463 HydrophobicContact CG-CG 3.65Å
415	V	86.3	Confident	82.2	Confident	71 Å²	71	80.1 Å²	80.1	43%	0.43	40%	0.402	S	S	.	.	H	α-helix	trans	-58.1	-45.8	176.4	173.8	0	0	0	0	110.5	S411 D412 I417 H418 Q419	S411-V415 WeakPolarHBondContact O-CG2 3.44Å; S411-V415 PolarHBondContact O-N 2.91Å; D412-V415 PolarHBondContact O-N 2.88Å; V415-I417 PolarHBondContact O-N 3.17Å; V415-H418 PolarHBondContact O-N 2.92Å; V415-Q419 HydrophobicContact CG1-CG 4.42Å; V415-Q419 WeakPolarHBondContact O-CG 3.22Å; V415-Q419 PolarHBondContact O-N 3.43Å
416	K	87.3	Confident	82.8	Confident	103 Å²	103	75 Å²	75	45%	0.448	38%	0.379	S	S	.	.	H	α-helix	trans	-62.1	-41.9	177.6	-165.5	176.4	-174.3	175	0	112.2	D412 Q413 L414 Q419 T420 L432	D412-K416 WeakPolarHBondContact O-CB 3.45Å; D412-K416 PolarHBondContact O-N 3.2Å; Q413-K416 PolarHBondContact O-N 3.4Å; L414-K416 VanDerWaalsContact C-N 3.31Å; L414-K416 PolarHBondContact O-N 3.28Å; K416-Q419 PolarHBondContact O-N 2.83Å; K416-T420 WeakPolarHBondContact O-CG2 3.42Å; K416-T420 PolarHBondContact O-N 3.35Å; K416-T420 PolarHBondContact O-OG1 2.9Å; K416-L432 HydrophobicContact CD-CD2 4.45Å; K416-L432 HydrophobicContact CG-CD2 4.09Å
417	I	86.8	Confident	83.4	Confident	2 Å²	2	75.4 Å²	75.4	1%	0.01	38%	0.379	C	S	.	.	H	α-helix	trans	-60.7	-48.5	174.6	-77.4	174	0	0	0	110.4	Q413 L414 V415 Q419 T420 M421 V429 L432 W436 L463	Q413-I417 WeakPolarHBondContact O-CB 3.45Å; Q413-I417 WeakPolarHBondContact O-CG1 3.42Å; Q413-I417 PolarHBondContact O-N 2.91Å; L414-I417 PolarHBondContact O-N 2.72Å; V415-I417 PolarHBondContact O-N 3.17Å; I417-Q419 PolarHBondContact O-N 3.36Å; I417-T420 WeakPolarHBondContact CA-OG1 3.42Å; I417-T420 PolarHBondContact O-N 3.27Å; I417-T420 PolarHBondContact O-OG1 3.23Å; I417-M421 WeakPolarHBondContact O-CB 3.37Å; I417-M421 PolarHBondContact O-N 3.34Å; I417-V429 HydrophobicContact CG2-CG1 3.84Å; I417-L432 HydrophobicContact CG1-CD2 3.99Å; I417-W436 HydrophobicContact CD1-CZ2 4.15Å; I417-L463 HydrophobicContact CD1-CD2 3.61Å
418	H	83.1	Confident	83.9	Confident	114 Å²	114	71.8 Å²	71.8	53%	0.528	37%	0.372	S	S	.	.	H	α-helix	trans	-61.6	-43.7	178.8	-74.7	-61.5	0	0	0	112	L414 V415 M421 M422	L414-H418 PolarHBondContact O-CD2 3.43Å; L414-H418 PolarHBondContact O-N 3.36Å; V415-H418 PolarHBondContact O-N 2.92Å; H418-M421 WeakPolarHBondContact O-CB 3.48Å; H418-M421 PolarHBondContact O-N 3.18Å; H418-M422 WeakPolarHBondContact O-CG 3.37Å; H418-M422 PolarHBondContact O-N 2.89Å
419	Q	84.9	Confident	84.4	Confident	112 Å²	112	68.9 Å²	68.9	52%	0.523	35%	0.351	S	S	.	.	H	α-helix	trans	-60.8	-47.2	173.8	-73.7	174.2	-12.9	0	0	111.5	V415 K416 I417 M421 M422 D423	V415-Q419 HydrophobicContact CG1-CG 4.42Å; V415-Q419 WeakPolarHBondContact O-CG 3.22Å; V415-Q419 PolarHBondContact O-N 3.43Å; K416-Q419 PolarHBondContact O-N 2.83Å; I417-Q419 PolarHBondContact O-N 3.36Å; Q419-M421 VanDerWaalsContact C-N 3.28Å; Q419-M421 PolarHBondContact O-N 3.5Å; Q419-M422 PolarHBondContact O-N 3.23Å; Q419-M422 VanDerWaalsContact O-N 3.11Å; Q419-D423 PolarHBondContact O-N 3.48Å
420	T	86.7	Confident	84.7	Confident	19 Å²	19	62.6 Å²	62.6	12%	0.117	32%	0.324	C	S	.	.	H	α-helix	trans	-65.3	-30.1	178.1	53.6	0	0	0	0	114	K416 I417 M422 K424 G425 L432	K416-T420 WeakPolarHBondContact O-CG2 3.42Å; K416-T420 PolarHBondContact O-N 3.35Å; K416-T420 PolarHBondContact O-OG1 2.9Å; I417-T420 WeakPolarHBondContact CA-OG1 3.42Å; I417-T420 PolarHBondContact O-N 3.27Å; I417-T420 PolarHBondContact O-OG1 3.23Å; T420-M422 VanDerWaalsContact C-N 3.3Å; T420-K424 PolarHBondContact O-N 3.39Å; T420-G425 PolarHBondContact O-N 3.08Å; T420-L432 HydrophobicContact CG2-CD2 3.87Å; T420-L432 WeakPolarHBondContact OG1-CD2 3.48Å
421	M	83	Confident	85	Confident	44 Å²	44	66.7 Å²	66.7	22%	0.217	34%	0.343	C	S	.	.	H	α-helix	trans	-63.3	-39.5	173.8	-171.4	65	81.3	0	0	111.1	I417 H418 Q419 V426 V429 A470 L473	I417-M421 WeakPolarHBondContact O-CB 3.37Å; I417-M421 PolarHBondContact O-N 3.34Å; H418-M421 WeakPolarHBondContact O-CB 3.48Å; H418-M421 PolarHBondContact O-N 3.18Å; Q419-M421 VanDerWaalsContact C-N 3.28Å; Q419-M421 PolarHBondContact O-N 3.5Å; M421-V426 HydrophobicContact SD-CB 4.32Å; M421-V426 HydrophobicContact SD-CG2 3.89Å; M421-V429 VanDerWaalsContact CA-CG2 3.41Å; M421-V429 HydrophobicContact CB-CG2 3.71Å; M421-V429 HydrophobicContact CE-CB 3.99Å; M421-V429 HydrophobicContact CE-CG1 3.85Å; M421-V429 HydrophobicContact CE-CG2 3.8Å; M421-V429 HydrophobicContact CG-CG2 4.36Å; M421-V429 HydrophobicContact SD-CB 4.46Å; M421-V429 HydrophobicContact SD-CG2 3.83Å; M421-A470 HydrophobicContact CE-CB 3.8Å; M421-L473 HydrophobicContact CE-CD1 4.39Å
422	M	79.9	Confident	85.2	Confident	165 Å²	165	65.7 Å²	65.7	81%	0.813	33%	0.334	S	S	*	.	H	α-helix	trans	-76.5	-38.5	179.1	-58.5	-64.4	-86.9	0	0	112.3	H418 Q419 T420	H418-M422 WeakPolarHBondContact O-CG 3.37Å; H418-M422 PolarHBondContact O-N 2.89Å; Q419-M422 PolarHBondContact O-N 3.23Å; Q419-M422 VanDerWaalsContact O-N 3.11Å; T420-M422 VanDerWaalsContact C-N 3.3Å
423	D	80.1	Confident	85.2	Confident	130 Å²	130	61.2 Å²	61.2	70%	0.695	31%	0.309	S	S	*	.	H	α-helix	trans	-88.3	-39.5	-171.6	-65.9	-15.2	0	0	0	114.2	Q419	Q419-D423 PolarHBondContact O-N 3.48Å
424	K	82	Confident	85.2	Confident	160 Å²	160	59.6 Å²	59.6	70%	0.696	30%	0.303	S	S	*	.	H	α-helix	trans	-122	-2.6	-166.7	-61.8	-176.1	-179.7	-178.5	0	114.1	T420 A428	T420-K424 PolarHBondContact O-N 3.39Å; K424-A428 HydrophobicContact CB-CB 3.43Å; K424-A428 VanDerWaalsContact CB-CB 3.43Å; K424-A428 HydrophobicContact CD-CB 4.43Å
425	G	82.8	Confident	85	Confident	28 Å²	28	62.6 Å²	62.6	29%	0.289	33%	0.326	S	S	.	.	H	α-helix	trans	79.9	-177.4	179	0	0	0	0	0	114.9	T420 A428 V429	T420-G425 PolarHBondContact O-N 3.08Å; G425-A428 PolarHBondContact O-N 2.82Å; G425-V429 PolarHBondContact O-N 2.83Å
426	V	86.7	Confident	84.2	Confident	17 Å²	17	62.4 Å²	62.4	10%	0.103	32%	0.317	C	S	.	.	H	α-helix	trans	-70.4	-39.1	-165.5	-173	0	0	0	0	112.9	M421 A428 V429 I430 A470 L473 Y474	M421-V426 HydrophobicContact SD-CB 4.32Å; M421-V426 HydrophobicContact SD-CG2 3.89Å; V426-A428 VanDerWaalsContact C-N 3.35Å; V426-A428 PolarHBondContact O-N 2.61Å; V426-V429 WeakPolarHBondContact O-CB 3.43Å; V426-V429 PolarHBondContact O-N 3Å; V426-I430 HydrophobicContact CG1-CD1 4.33Å; V426-I430 PolarHBondContact O-N 3.32Å; V426-I430 VanDerWaalsContact O-N 3.16Å; V426-A470 HydrophobicContact CG1-CB 4.15Å; V426-A470 WeakPolarHBondContact CG1-O 3.47Å; V426-L473 HydrophobicContact CG1-CB 4.32Å; V426-L473 HydrophobicContact CG2-CB 4.2Å; V426-Y474 HydrophobicContact CG1-CD2 4.39Å
427	E	86.1	Confident	83.2	Confident	82 Å²	82	57.7 Å²	57.7	38%	0.383	30%	0.297	S	S	.	.	H	α-helix	trans	-64.1	-41.2	-179.6	-170.5	173.8	-177.9	0	0	111.3	V429 I430 H431 Y474 F513	E427-V429 VanDerWaalsContact C-N 3.29Å; E427-V429 PolarHBondContact O-N 3.41Å; E427-I430 PolarHBondContact O-N 2.82Å; E427-H431 PolarHBondContact O-CD2 2.7Å; E427-H431 PolarHBondContact O-N 3.15Å; E427-H431 IonicContact OE1-NE2 2.78Å; E427-Y474 HydrophobicContact CB-CE2 4.31Å; E427-F513 HydrophobicContact CG-CE1 4.12Å; E427-F513 HydrophobicContact CG-CE2 4.32Å; E427-F513 HydrophobicContact CG-CZ 3.79Å
428	A	86.7	Confident	81.7	Confident	29 Å²	29	59.6 Å²	59.6	24%	0.24	31%	0.307	C	S	.	.	H	α-helix	trans	-62.5	-34.9	176.1	0	0	0	0	0	112.5	K424 G425 V426 H431 L432	K424-A428 HydrophobicContact CB-CB 3.43Å; K424-A428 VanDerWaalsContact CB-CB 3.43Å; K424-A428 HydrophobicContact CD-CB 4.43Å; G425-A428 PolarHBondContact O-N 2.82Å; V426-A428 VanDerWaalsContact C-N 3.35Å; V426-A428 PolarHBondContact O-N 2.61Å; A428-H431 PolarHBondContact O-N 2.87Å; A428-L432 WeakPolarHBondContact O-CB 3.23Å; A428-L432 PolarHBondContact O-N 3.12Å
429	V	88.7	Confident	80.1	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.006	30%	0.296	C	S	.	.	H	α-helix	trans	-66.2	-43.5	174.6	171.4	0	0	0	0	111.4	I417 M421 G425 V426 E427 H431 L432 W433 A470	I417-V429 HydrophobicContact CG2-CG1 3.84Å; M421-V429 VanDerWaalsContact CA-CG2 3.41Å; M421-V429 HydrophobicContact CB-CG2 3.71Å; M421-V429 HydrophobicContact CE-CB 3.99Å; M421-V429 HydrophobicContact CE-CG1 3.85Å; M421-V429 HydrophobicContact CE-CG2 3.8Å; M421-V429 HydrophobicContact CG-CG2 4.36Å; M421-V429 HydrophobicContact SD-CB 4.46Å; M421-V429 HydrophobicContact SD-CG2 3.83Å; G425-V429 PolarHBondContact O-N 2.83Å; V426-V429 WeakPolarHBondContact O-CB 3.43Å; V426-V429 PolarHBondContact O-N 3Å; E427-V429 VanDerWaalsContact C-N 3.29Å; E427-V429 PolarHBondContact O-N 3.41Å; V429-H431 VanDerWaalsContact C-N 3.32Å; V429-H431 PolarHBondContact O-N 3.43Å; V429-L432 PolarHBondContact O-N 2.65Å; V429-W433 WeakPolarHBondContact O-CB 3.24Å; V429-W433 PolarHBondContact O-N 2.92Å; V429-A470 HydrophobicContact CG1-CB 4.07Å
430	I	88.5	Confident	78	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-63.8	-41.8	177.8	-64.5	164.8	0	0	0	110.1	V426 E427 W433 N434 A470 L471 Y474 F513 E517	V426-I430 HydrophobicContact CG1-CD1 4.33Å; V426-I430 PolarHBondContact O-N 3.32Å; V426-I430 VanDerWaalsContact O-N 3.16Å; E427-I430 PolarHBondContact O-N 2.82Å; I430-W433 PolarHBondContact O-N 3.05Å; I430-N434 WeakPolarHBondContact O-CB 3.43Å; I430-N434 PolarHBondContact O-N 2.97Å; I430-N434 PolarHBondContact O-ND2 3.44Å; I430-A470 HydrophobicContact CG1-CB 4.1Å; I430-L471 HydrophobicContact CD1-CD2 3.78Å; I430-L471 HydrophobicContact CG1-CD2 4.3Å; I430-Y474 HydrophobicContact CD1-CD2 4.28Å; I430-Y474 HydrophobicContact CD1-CG 4.41Å; I430-F513 HydrophobicContact CB-CZ 4.38Å; I430-F513 HydrophobicContact CD1-CE1 4.03Å; I430-F513 HydrophobicContact CD1-CZ 4.47Å; I430-F513 HydrophobicContact CG2-CZ 4.05Å; I430-E517 HydrophobicContact CG2-CG 3.81Å; I430-E517 WeakPolarHBondContact CG2-OE2 3.14Å
431	H	87.7	Confident	75.5	Confident	95 Å²	95	64 Å²	64	44%	0.44	35%	0.345	S	S	.	.	H	α-helix	trans	-63.9	-44	173.8	-77.8	-61.1	0	0	0	112.8	E427 A428 V429 W433 N434 S435 F513	E427-H431 PolarHBondContact O-CD2 2.7Å; E427-H431 PolarHBondContact O-N 3.15Å; E427-H431 IonicContact OE1-NE2 2.78Å; A428-H431 PolarHBondContact O-N 2.87Å; V429-H431 VanDerWaalsContact C-N 3.32Å; V429-H431 PolarHBondContact O-N 3.43Å; H431-W433 VanDerWaalsContact C-N 3.34Å; H431-W433 PolarHBondContact O-N 2.86Å; H431-N434 PolarHBondContact O-N 3.44Å; H431-S435 PolarHBondContact O-N 2.89Å; H431-F513 AromaticContact CE1-CE2 3.82Å; H431-F513 AromaticContact NE2-CE2 3.67Å
432	L	86.4	Confident	73	Confident	29 Å²	29	64.3 Å²	64.3	15%	0.152	36%	0.358	C	S	.	.	H	α-helix	trans	-57.1	-51.4	174.2	-179.8	65.9	0	0	0	109.2	K416 I417 T420 A428 V429 N434 S435 W436	K416-L432 HydrophobicContact CD-CD2 4.45Å; K416-L432 HydrophobicContact CG-CD2 4.09Å; I417-L432 HydrophobicContact CG1-CD2 3.99Å; T420-L432 HydrophobicContact CG2-CD2 3.87Å; T420-L432 WeakPolarHBondContact OG1-CD2 3.48Å; A428-L432 WeakPolarHBondContact O-CB 3.23Å; A428-L432 PolarHBondContact O-N 3.12Å; V429-L432 PolarHBondContact O-N 2.65Å; L432-N434 VanDerWaalsContact C-N 3.34Å; L432-N434 PolarHBondContact O-N 3.31Å; L432-S435 WeakPolarHBondContact O-CB 3.24Å; L432-S435 PolarHBondContact O-N 2.98Å; L432-S435 VanDerWaalsContact O-N 3.08Å; L432-S435 PolarHBondContact O-OG 3.22Å; L432-W436 PolarHBondContact O-NE1 3.5Å
433	W	87.2	Confident	70.7	Confident	1 Å²	1	65.4 Å²	65.4	0%	0.004	36%	0.361	C	S	.	.	H	α-helix	trans	-55	-47.9	177.3	-159.5	99.8	0	0	0	111.9	V429 I430 H431 S435 W436 Y437 L438 L463 L464 R467 L524	V429-W433 WeakPolarHBondContact O-CB 3.24Å; V429-W433 PolarHBondContact O-N 2.92Å; I430-W433 PolarHBondContact O-N 3.05Å; H431-W433 VanDerWaalsContact C-N 3.34Å; H431-W433 PolarHBondContact O-N 2.86Å; W433-S435 PolarHBondContact O-N 3.32Å; W433-W436 PolarHBondContact O-N 3.45Å; W433-Y437 HydrophobicContact CB-CD2 4.47Å; W433-Y437 AromaticContact CD1-CD2 3.78Å; W433-Y437 AromaticContact CD1-CE2 3.47Å; W433-Y437 VanDerWaalsContact CD1-CE2 3.47Å; W433-Y437 AromaticContact CD2-CD2 3.22Å; W433-Y437 HydrophobicContact CD2-CD2 3.22Å; W433-Y437 AromaticContact CD2-CE2 3.69Å; W433-Y437 HydrophobicContact CD2-CE2 3.69Å; W433-Y437 HydrophobicContact CD2-CG 4.11Å; W433-Y437 AromaticContact CE2-CD2 3.15Å; W433-Y437 AromaticContact CE2-CE2 3.21Å; W433-Y437 AromaticContact CE2-CG 3.96Å; W433-Y437 AromaticContact CE3-CD2 3.66Å; W433-Y437 HydrophobicContact CE3-CD2 3.66Å; W433-Y437 HydrophobicContact CE3-CG 4.16Å; W433-Y437 AromaticContact CG-CD2 3.62Å; W433-Y437 HydrophobicContact CG-CD2 3.62Å; W433-Y437 AromaticContact CG-CE2 3.82Å; W433-Y437 HydrophobicContact CG-CE2 3.82Å; W433-Y437 AromaticContact CH2-CD2 3.86Å; W433-Y437 HydrophobicContact CH2-CD2 3.86Å; W433-Y437 HydrophobicContact CH2-CE2 4.46Å; W433-Y437 AromaticContact CH2-CG 3.84Å; W433-Y437 HydrophobicContact CH2-CG 3.84Å; W433-Y437 HydrophobicContact CZ2-CD1 4.47Å; W433-Y437 AromaticContact CZ2-CD2 3.48Å; W433-Y437 HydrophobicContact CZ2-CD2 3.48Å; W433-Y437 VanDerWaalsContact CZ2-CD2 3.48Å; W433-Y437 AromaticContact CZ2-CE2 3.66Å; W433-Y437 HydrophobicContact CZ2-CE2 3.66Å; W433-Y437 AromaticContact CZ2-CG 3.82Å; W433-Y437 HydrophobicContact CZ2-CG 3.82Å; W433-Y437 AromaticContact CZ3-CD2 4Å; W433-Y437 HydrophobicContact CZ3-CD2 4Å; W433-Y437 HydrophobicContact CZ3-CG 4.07Å; W433-Y437 AromaticContact NE1-CD2 3.55Å; W433-Y437 AromaticContact NE1-CE2 3.11Å; W433-Y437 WeakPolarHBondContact O-CB 3.49Å; W433-Y437 WeakPolarHBondContact O-CD2 3.45Å; W433-Y437 PolarHBondContact O-N 3.38Å; W433-L438 HydrophobicContact CE3-CD1 4.05Å; W433-L438 HydrophobicContact CZ3-CD1 3.52Å; W433-L463 PolarHBondContact NE1-O 3.42Å; W433-L463 VanDerWaalsContact NE1-O 3.15Å; W433-L464 HydrophobicContact CZ2-CD2 4.28Å; W433-R467 HydrophobicContact CD2-CB 4.27Å; W433-R467 HydrophobicContact CD2-CG 4.2Å; W433-R467 HydrophobicContact CG-CB 4.33Å; W433-R467 HydrophobicContact CG-CG 4.45Å; W433-L524 HydrophobicContact CH2-CD1 4.35Å; W433-L524 HydrophobicContact CH2-CD2 3.31Å; W433-L524 HydrophobicContact CH2-CG 4.41Å; W433-L524 HydrophobicContact CZ2-CD2 3.98Å; W433-L524 HydrophobicContact CZ3-CD2 4.13Å
434	N	84.7	Confident	68.6	Low	23 Å²	23	64.1 Å²	64.1	12%	0.123	36%	0.362	C	S	.	.	H	α-helix	trans	-62.2	-29.6	179.7	-72.4	-17.5	0	0	0	113.4	I430 H431 L432 W436 R467 E517	I430-N434 WeakPolarHBondContact O-CB 3.43Å; I430-N434 PolarHBondContact O-N 2.97Å; I430-N434 PolarHBondContact O-ND2 3.44Å; H431-N434 PolarHBondContact O-N 3.44Å; L432-N434 VanDerWaalsContact C-N 3.34Å; L432-N434 PolarHBondContact O-N 3.31Å; N434-W436 VanDerWaalsContact C-N 3.32Å; N434-W436 PolarHBondContact O-N 3.28Å; N434-R467 PolarHBondContact OD1-NH1 2.9Å; N434-E517 PolarHBondContact ND2-OE1 3.45Å; N434-E517 PolarHBondContact ND2-OE2 2.89Å; N434-E517 PolarHBondContact OD1-OE2 3.07Å
435	S	80.3	Confident	66.3	Low	89 Å²	89	64.9 Å²	64.9	62%	0.622	37%	0.373	S	S	*	.	H	α-helix	trans	-67.2	-25.5	-174.7	71.8	0	0	0	0	115	H431 L432 W433	H431-S435 PolarHBondContact O-N 2.89Å; L432-S435 WeakPolarHBondContact O-CB 3.24Å; L432-S435 PolarHBondContact O-N 2.98Å; L432-S435 VanDerWaalsContact O-N 3.08Å; L432-S435 PolarHBondContact O-OG 3.22Å; W433-S435 PolarHBondContact O-N 3.32Å
436	W	68.9	Low	64.3	Low	66 Å²	66	70 Å²	70	25%	0.25	39%	0.389	C	S	.	.	H	α-helix	trans	-119	-15.6	-175.8	58.6	-88	0	0	0	114.3	Q413 I417 L432 W433 N434 L463	Q413-W436 HydrophobicContact CB-CH2 3.55Å; Q413-W436 HydrophobicContact CB-CZ2 3.8Å; Q413-W436 HydrophobicContact CB-CZ3 4.49Å; Q413-W436 HydrophobicContact CG-CH2 3.61Å; Q413-W436 HydrophobicContact CG-CZ2 4.03Å; Q413-W436 HydrophobicContact CG-CZ3 4.1Å; I417-W436 HydrophobicContact CD1-CZ2 4.15Å; L432-W436 PolarHBondContact O-NE1 3.5Å; W433-W436 PolarHBondContact O-N 3.45Å; N434-W436 VanDerWaalsContact C-N 3.32Å; N434-W436 PolarHBondContact O-N 3.28Å; W436-L463 HydrophobicContact CH2-CD1 4.07Å; W436-L463 HydrophobicContact CH2-CD2 3.94Å; W436-L463 HydrophobicContact CZ2-CD2 3.98Å
437	Y	65.2	Low	62.5	Low	4 Å²	4	73 Å²	73	2%	0.016	41%	0.408	C	S	.	.	H	α-helix	trans	-105.9	-37.1	-174.9	-74.2	-58.8	0	0	0	116	W433 F450 L463	W433-Y437 HydrophobicContact CB-CD2 4.47Å; W433-Y437 AromaticContact CD1-CD2 3.78Å; W433-Y437 AromaticContact CD1-CE2 3.47Å; W433-Y437 VanDerWaalsContact CD1-CE2 3.47Å; W433-Y437 AromaticContact CD2-CD2 3.22Å; W433-Y437 HydrophobicContact CD2-CD2 3.22Å; W433-Y437 AromaticContact CD2-CE2 3.69Å; W433-Y437 HydrophobicContact CD2-CE2 3.69Å; W433-Y437 HydrophobicContact CD2-CG 4.11Å; W433-Y437 AromaticContact CE2-CD2 3.15Å; W433-Y437 AromaticContact CE2-CE2 3.21Å; W433-Y437 AromaticContact CE2-CG 3.96Å; W433-Y437 AromaticContact CE3-CD2 3.66Å; W433-Y437 HydrophobicContact CE3-CD2 3.66Å; W433-Y437 HydrophobicContact CE3-CG 4.16Å; W433-Y437 AromaticContact CG-CD2 3.62Å; W433-Y437 HydrophobicContact CG-CD2 3.62Å; W433-Y437 AromaticContact CG-CE2 3.82Å; W433-Y437 HydrophobicContact CG-CE2 3.82Å; W433-Y437 AromaticContact CH2-CD2 3.86Å; W433-Y437 HydrophobicContact CH2-CD2 3.86Å; W433-Y437 HydrophobicContact CH2-CE2 4.46Å; W433-Y437 AromaticContact CH2-CG 3.84Å; W433-Y437 HydrophobicContact CH2-CG 3.84Å; W433-Y437 HydrophobicContact CZ2-CD1 4.47Å; W433-Y437 AromaticContact CZ2-CD2 3.48Å; W433-Y437 HydrophobicContact CZ2-CD2 3.48Å; W433-Y437 VanDerWaalsContact CZ2-CD2 3.48Å; W433-Y437 AromaticContact CZ2-CE2 3.66Å; W433-Y437 HydrophobicContact CZ2-CE2 3.66Å; W433-Y437 AromaticContact CZ2-CG 3.82Å; W433-Y437 HydrophobicContact CZ2-CG 3.82Å; W433-Y437 AromaticContact CZ3-CD2 4Å; W433-Y437 HydrophobicContact CZ3-CD2 4Å; W433-Y437 HydrophobicContact CZ3-CG 4.07Å; W433-Y437 AromaticContact NE1-CD2 3.55Å; W433-Y437 AromaticContact NE1-CE2 3.11Å; W433-Y437 WeakPolarHBondContact O-CB 3.49Å; W433-Y437 WeakPolarHBondContact O-CD2 3.45Å; W433-Y437 PolarHBondContact O-N 3.38Å; Y437-F450 HydrophobicContact CD1-CB 4.01Å; Y437-F450 AromaticContact CD1-CD2 3.67Å; Y437-F450 HydrophobicContact CD1-CD2 3.67Å; Y437-F450 HydrophobicContact CD1-CE2 4.46Å; Y437-F450 HydrophobicContact CD1-CG 4.09Å; Y437-F450 HydrophobicContact CE1-CB 4.3Å; Y437-F450 AromaticContact CE1-CD2 3.1Å; Y437-F450 HydrophobicContact CE1-CD2 3.1Å; Y437-F450 AromaticContact CE1-CE2 3.55Å; Y437-F450 HydrophobicContact CE1-CE2 3.55Å; Y437-F450 AromaticContact CE1-CG 3.96Å; Y437-F450 HydrophobicContact CE1-CG 3.96Å; Y437-F450 AromaticContact CZ-CD2 3.86Å; Y437-F450 AromaticContact CZ-CE2 3.83Å; Y437-L463 WeakPolarHBondContact OH-CB 3.38Å; Y437-L463 VanDerWaalsContact OH-CD1 3.23Å; Y437-L463 WeakPolarHBondContact OH-CD1 3.43Å; Y437-L463 WeakPolarHBondContact OH-CG 3.37Å
438	L	57.1	Low	61	Low	43 Å²	43	69.8 Å²	69.8	23%	0.225	40%	0.395	C	S	.	.	S	Bend	trans	-83.4	133.8	174.3	-87.9	85.6	0	0	0	107.8	W433 S440 K520	W433-L438 HydrophobicContact CE3-CD1 4.05Å; W433-L438 HydrophobicContact CZ3-CD1 3.52Å; L438-S440 PolarHBondContact O-N 3.48Å; L438-S440 VanDerWaalsContact O-N 3.12Å; L438-K520 HydrophobicContact CD2-CB 4.09Å; L438-K520 HydrophobicContact CD2-CD 3.89Å; L438-K520 HydrophobicContact CD2-CG 3.94Å
439	P	49.2	Very low	60	Low	47 Å²	47	71.8 Å²	71.8	31%	0.305	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-51.9	125.2	169.9	-21.3	31	0	0	0	108.6	M441 Q446	P439-M441 PolarHBondContact O-N 2.9Å; P439-M441 VanDerWaalsContact O-N 3.15Å; P439-Q446 HydrophobicContact CB-CB 4.28Å; P439-Q446 WeakPolarHBondContact CG-O 3.41Å
440	S	39.4	Very low	59.2	Low	108 Å²	108	71.8 Å²	71.8	76%	0.755	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-51.6	125.4	166.5	-173.7	0	0	0	0	106.7	L438 G442	L438-S440 PolarHBondContact O-N 3.48Å; L438-S440 VanDerWaalsContact O-N 3.12Å; S440-G442 VanDerWaalsContact C-N 3.29Å; S440-G442 PolarHBondContact O-N 3.37Å
441	M	34	Very low	58.5	Low	183 Å²	183	75.6 Å²	75.6	90%	0.901	42%	0.419	S	S	*	.	S	Bend	trans	-54.1	89.7	-173.2	-75.4	-80.6	144	0	0	110.4	P439	P439-M441 PolarHBondContact O-N 2.9Å; P439-M441 VanDerWaalsContact O-N 3.15Å
442	G	31.4	Very low	57.7	Low	49 Å²	49	77.4 Å²	77.4	51%	0.505	43%	0.432	S	S	.	.			trans	-150.1	124.1	-174.3	0	0	0	0	0	108.3	S440	S440-G442 VanDerWaalsContact C-N 3.29Å; S440-G442 PolarHBondContact O-N 3.37Å
443	H	32.2	Very low	57.2	Low	189 Å²	189	77.3 Å²	77.3	88%	0.875	43%	0.431	S	S	*	.	S	Bend	trans	-50.7	142.4	-170.3	-64.1	-87.4	0	0	0	114
444	S	35.1	Very low	56.7	Low	102 Å²	102	81 Å²	81	71%	0.713	45%	0.451	S	S	*	.	S	Bend	trans	88.9	105.5	174.2	76.8	0	0	0	0	117.7	Q446	S444-Q446 PolarHBondContact O-N 3.46Å
445	L	34.8	Very low	56.3	Low	177 Å²	177	80.1 Å²	80.1	93%	0.927	45%	0.447	S	S	*	.			trans	38.9	25.9	150.3	-77.3	158.1	0	0	0	120.2	T447	L445-T447 PolarHBondContact O-N 3.18Å
446	Q	40.2	Very low	56.1	Low	134 Å²	134	80 Å²	80	63%	0.626	45%	0.446	S	S	*	.			trans	-70.9	95.6	170.8	-70.9	-173	0.8	0	0	109.6	P439 S444 S448	P439-Q446 HydrophobicContact CB-CB 4.28Å; P439-Q446 WeakPolarHBondContact CG-O 3.41Å; S444-Q446 PolarHBondContact O-N 3.46Å; Q446-S448 PolarHBondContact O-N 3.45Å
447	T	48.8	Very low	56.6	Low	81 Å²	81	77.4 Å²	77.4	50%	0.497	44%	0.437	S	S	.	.			trans	-49.7	129.3	163.3	41.1	0	0	0	0	109	L445	L445-T447 PolarHBondContact O-N 3.18Å
448	S	54.3	Low	57.4	Low	14 Å²	14	81.6 Å²	81.6	10%	0.098	47%	0.465	C	S	.	.			trans	-53.4	128.4	177.5	51.1	0	0	0	0	109.4	Q446 F450 R451	Q446-S448 PolarHBondContact O-N 3.45Å; S448-F450 PolarHBondContact O-N 2.98Å; S448-R451 VanDerWaalsContact O-CB 3.28Å; S448-R451 WeakPolarHBondContact O-CB 3.34Å; S448-R451 PolarHBondContact O-N 3Å
449	P	65.6	Low	58.6	Low	72 Å²	72	82 Å²	82	47%	0.468	47%	0.465	S	S	.	.	G	3₁₀ helix	trans	-57.9	-27.4	-177.8	20	-30.6	0	0	0	111.6	R451 L452	P449-R451 VanDerWaalsContact C-N 3.28Å; P449-R451 PolarHBondContact O-N 3.25Å; P449-L452 PolarHBondContact O-N 3.09Å
450	F	72.7	Confident	60.3	Low	1 Å²	1	79.7 Å²	79.7	0%	0.004	45%	0.45	C	S	.	.	G	3₁₀ helix	trans	-61.1	-31.6	174.9	-157.6	-107.1	0	0	0	114.3	Y437 S448 L452 I453 A460 L464 L528 W533	Y437-F450 HydrophobicContact CD1-CB 4.01Å; Y437-F450 AromaticContact CD1-CD2 3.67Å; Y437-F450 HydrophobicContact CD1-CD2 3.67Å; Y437-F450 HydrophobicContact CD1-CE2 4.46Å; Y437-F450 HydrophobicContact CD1-CG 4.09Å; Y437-F450 HydrophobicContact CE1-CB 4.3Å; Y437-F450 AromaticContact CE1-CD2 3.1Å; Y437-F450 HydrophobicContact CE1-CD2 3.1Å; Y437-F450 AromaticContact CE1-CE2 3.55Å; Y437-F450 HydrophobicContact CE1-CE2 3.55Å; Y437-F450 AromaticContact CE1-CG 3.96Å; Y437-F450 HydrophobicContact CE1-CG 3.96Å; Y437-F450 AromaticContact CZ-CD2 3.86Å; Y437-F450 AromaticContact CZ-CE2 3.83Å; S448-F450 PolarHBondContact O-N 2.98Å; F450-L452 PolarHBondContact O-N 3.33Å; F450-I453 HydrophobicContact CD2-CD1 3.55Å; F450-I453 HydrophobicContact CE2-CD1 3.92Å; F450-I453 HydrophobicContact CG-CD1 4.42Å; F450-I453 PolarHBondContact O-N 3.41Å; F450-A460 HydrophobicContact CZ-CB 4.4Å; F450-A460 WeakPolarHBondContact CZ-O 3.37Å; F450-L464 HydrophobicContact CD1-CD2 4.16Å; F450-L464 HydrophobicContact CE1-CD1 3.83Å; F450-L464 HydrophobicContact CE1-CD2 3.43Å; F450-L464 VanDerWaalsContact CE1-CD2 3.43Å; F450-L464 HydrophobicContact CE1-CG 3.47Å; F450-L464 VanDerWaalsContact CE1-CG 3.47Å; F450-L464 HydrophobicContact CZ-CD1 4.35Å; F450-L464 HydrophobicContact CZ-CD2 3.91Å; F450-L464 HydrophobicContact CZ-CG 3.67Å; F450-L528 HydrophobicContact CD1-CD1 3.83Å; F450-L528 HydrophobicContact CD1-CD2 3.94Å; F450-L528 HydrophobicContact CE1-CD1 4.02Å; F450-W533 HydrophobicContact CD1-CZ2 4.12Å; F450-W533 AromaticContact CE1-CE2 3.99Å; F450-W533 AromaticContact CE1-CH2 3.55Å; F450-W533 HydrophobicContact CE1-CH2 3.55Å; F450-W533 AromaticContact CE1-CZ2 3.38Å; F450-W533 HydrophobicContact CE1-CZ2 3.38Å; F450-W533 HydrophobicContact CE1-CZ3 4.28Å; F450-W533 HydrophobicContact CE2-CZ2 4.41Å; F450-W533 AromaticContact CZ-CH2 3.56Å; F450-W533 HydrophobicContact CZ-CH2 3.56Å; F450-W533 AromaticContact CZ-CZ2 3.59Å; F450-W533 HydrophobicContact CZ-CZ2 3.59Å; F450-W533 PolarHBondContact O-NE1 3.33Å
451	R	72.4	Confident	62.6	Low	80 Å²	80	75.6 Å²	75.6	30%	0.302	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-63.8	-25.2	178.7	-168.6	179.7	-176.1	-157.7	-1.1	112.6	S448 P449 L528 T530	S448-R451 VanDerWaalsContact O-CB 3.28Å; S448-R451 WeakPolarHBondContact O-CB 3.34Å; S448-R451 PolarHBondContact O-N 3Å; P449-R451 VanDerWaalsContact C-N 3.28Å; P449-R451 PolarHBondContact O-N 3.25Å; R451-L528 HydrophobicContact CB-CD2 4.21Å; R451-L528 HydrophobicContact CG-CD2 4.46Å; R451-T530 PolarHBondContact NH2-O 2.96Å; R451-T530 PolarHBondContact NH2-OG1 3.48Å; R451-T530 VanDerWaalsContact NH2-OG1 3.13Å
452	L	72.5	Confident	65.1	Low	133 Å²	133	68 Å²	68	70%	0.696	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-88.4	-9.7	-178.5	-60.3	174.1	0	0	0	113	P449 F450	P449-L452 PolarHBondContact O-N 3.09Å; F450-L452 PolarHBondContact O-N 3.33Å
453	I	76.2	Confident	67.8	Low	27 Å²	27	65.6 Å²	65.6	14%	0.138	37%	0.365	C	S	.	.	S	Bend	trans	-74.1	133.2	178.1	-58	-178.9	0	0	0	108.7	L410 F450 P455 I457 A460 W533	L410-I453 HydrophobicContact CD1-CG2 4.12Å; L410-I453 HydrophobicContact CD2-CD1 3.95Å; F450-I453 HydrophobicContact CD2-CD1 3.55Å; F450-I453 HydrophobicContact CE2-CD1 3.92Å; F450-I453 HydrophobicContact CG-CD1 4.42Å; F450-I453 PolarHBondContact O-N 3.41Å; I453-P455 WeakPolarHBondContact O-CD 3.31Å; I453-I457 HydrophobicContact CG2-CD1 4.23Å; I453-A460 HydrophobicContact CG2-CB 3.81Å; I453-W533 PolarHBondContact O-NE1 2.94Å
454	N	76.5	Confident	70.5	Confident	78 Å²	78	56.7 Å²	56.7	42%	0.417	32%	0.323	S	S	.	.			trans	-62.7	121.1	175.8	-175.8	-14.8	0	0	0	109.6	S456 I457	N454-S456 PolarHBondContact O-N 2.97Å; N454-S456 VanDerWaalsContact O-N 3.14Å; N454-S456 WeakPolarHBondContact OD1-CB 3.38Å; N454-S456 PolarHBondContact OD1-N 3.07Å; N454-S456 PolarHBondContact OD1-OG 2.91Å; N454-I457 HydrophobicContact CB-CD1 4.38Å; N454-I457 HydrophobicContact CB-CG1 4.48Å; N454-I457 PolarHBondContact O-N 2.71Å
455	P	75.3	Confident	73.2	Confident	6 Å²	6	56 Å²	56	4%	0.039	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-16.5	179.9	24.6	-35.2	0	0	0	114.7	I453 I457 Q532 W533 H536 C537	I453-P455 WeakPolarHBondContact O-CD 3.31Å; P455-I457 PolarHBondContact O-N 3.47Å; P455-Q532 HydrophobicContact CG-CB 4.15Å; P455-W533 HydrophobicContact CB-CD2 3.88Å; P455-W533 HydrophobicContact CB-CE3 4.08Å; P455-W533 HydrophobicContact CB-CG 4.11Å; P455-H536 HydrophobicContact CG-CB 4.17Å; P455-C537 HydrophobicContact CB-CB 3.75Å
456	S	75.9	Confident	75.7	Confident	87 Å²	87	48 Å²	48	61%	0.608	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-4	177.5	-53.7	0	0	0	0	114	N454 P458	N454-S456 PolarHBondContact O-N 2.97Å; N454-S456 VanDerWaalsContact O-N 3.14Å; N454-S456 WeakPolarHBondContact OD1-CB 3.38Å; N454-S456 PolarHBondContact OD1-N 3.07Å; N454-S456 PolarHBondContact OD1-OG 2.91Å; S456-P458 WeakPolarHBondContact O-CD 3.23Å
457	I	80.2	Confident	78.2	Confident	11 Å²	11	41.9 Å²	41.9	6%	0.056	24%	0.239	C	C	.	.			trans	-86.5	113.5	178.6	-59.9	176.1	0	0	0	109.4	I406 R407 L410 I453 N454 P455 E459 A460 V461	I406-I457 HydrophobicContact CG2-CD1 4.15Å; R407-I457 HydrophobicContact CG-CG2 3.95Å; L410-I457 HydrophobicContact CD1-CG2 3.99Å; I453-I457 HydrophobicContact CG2-CD1 4.23Å; N454-I457 HydrophobicContact CB-CD1 4.38Å; N454-I457 HydrophobicContact CB-CG1 4.48Å; N454-I457 PolarHBondContact O-N 2.71Å; P455-I457 PolarHBondContact O-N 3.47Å; I457-E459 HydrophobicContact CG2-CB 4.12Å; I457-E459 WeakPolarHBondContact CG2-OE2 3.47Å; I457-E459 PolarHBondContact O-N 3.11Å; I457-A460 HydrophobicContact CB-CB 4.24Å; I457-A460 HydrophobicContact CG2-CB 4.46Å; I457-A460 WeakPolarHBondContact O-CB 3.18Å; I457-A460 PolarHBondContact O-N 3.45Å; I457-V461 PolarHBondContact O-N 2.87Å
458	P	81.6	Confident	80.2	Confident	92 Å²	92	38.7 Å²	38.7	60%	0.597	22%	0.218	S	C	*	.	H	α-helix	trans	-57	-36.1	-178.7	-25.2	34.7	0	0	0	113.7	S456 A460 V461 G462	S456-P458 WeakPolarHBondContact O-CD 3.23Å; P458-A460 VanDerWaalsContact C-N 3.27Å; P458-A460 PolarHBondContact O-N 3.46Å; P458-V461 PolarHBondContact O-N 3.01Å; P458-G462 PolarHBondContact O-N 3.34Å
459	E	83.2	Confident	81.9	Confident	50 Å²	50	40.4 Å²	40.4	23%	0.234	23%	0.229	C	C	.	.	H	α-helix	trans	-62.6	-34.2	178.9	-60.9	86.5	162.5	0	0	111.8	L410 L414 I457 G462 L463	L410-E459 HydrophobicContact CB-CB 3.86Å; L414-E459 HydrophobicContact CD1-CB 3.91Å; L414-E459 HydrophobicContact CD1-CG 4.3Å; I457-E459 HydrophobicContact CG2-CB 4.12Å; I457-E459 WeakPolarHBondContact CG2-OE2 3.47Å; I457-E459 PolarHBondContact O-N 3.11Å; E459-G462 PolarHBondContact O-N 3.41Å; E459-L463 WeakPolarHBondContact O-CD1 3.22Å; E459-L463 VanDerWaalsContact O-CG 3.28Å; E459-L463 WeakPolarHBondContact O-CG 3.49Å; E459-L463 PolarHBondContact O-N 2.94Å
460	A	84.7	Confident	83.1	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-68.6	-42.7	176.6	0	0	0	0	0	111.4	L410 F450 I453 I457 P458 G462 L463 L464 W533	L410-A460 HydrophobicContact CD1-CB 4.17Å; F450-A460 HydrophobicContact CZ-CB 4.4Å; F450-A460 WeakPolarHBondContact CZ-O 3.37Å; I453-A460 HydrophobicContact CG2-CB 3.81Å; I457-A460 HydrophobicContact CB-CB 4.24Å; I457-A460 HydrophobicContact CG2-CB 4.46Å; I457-A460 WeakPolarHBondContact O-CB 3.18Å; I457-A460 PolarHBondContact O-N 3.45Å; P458-A460 VanDerWaalsContact C-N 3.27Å; P458-A460 PolarHBondContact O-N 3.46Å; A460-G462 VanDerWaalsContact C-N 3.32Å; A460-L463 PolarHBondContact O-N 3.36Å; A460-L464 PolarHBondContact O-N 3.37Å; A460-W533 HydrophobicContact CB-CH2 3.66Å; A460-W533 HydrophobicContact CB-CZ2 3.91Å
461	V	87.4	Confident	84	Confident	22 Å²	22	37 Å²	37	13%	0.133	21%	0.206	C	C	.	.	H	α-helix	trans	-63.4	-42.2	174.4	-178.1	0	0	0	0	110.2	I457 P458 L463 L464 Q465 W533 E539 L543	I457-V461 PolarHBondContact O-N 2.87Å; P458-V461 PolarHBondContact O-N 3.01Å; V461-L463 PolarHBondContact O-N 3.31Å; V461-L464 PolarHBondContact O-N 3.29Å; V461-L464 VanDerWaalsContact O-N 3.17Å; V461-Q465 WeakPolarHBondContact O-CB 3.43Å; V461-Q465 PolarHBondContact O-N 2.93Å; V461-W533 HydrophobicContact CG2-CZ3 4.1Å; V461-E539 HydrophobicContact CG1-CB 4.05Å; V461-L543 HydrophobicContact CG1-CD1 3.95Å
462	G	86.8	Confident	84.8	Confident	22 Å²	22	34.9 Å²	34.9	23%	0.227	20%	0.204	C	C	.	.	H	α-helix	trans	-57.1	-36	174.2	0	0	0	0	0	113.2	P458 E459 A460 Q465 S466	P458-G462 PolarHBondContact O-N 3.34Å; E459-G462 PolarHBondContact O-N 3.41Å; A460-G462 VanDerWaalsContact C-N 3.32Å; G462-Q465 PolarHBondContact O-N 3.49Å; G462-S466 WeakPolarHBondContact O-CB 3.37Å; G462-S466 PolarHBondContact O-N 3.33Å
463	L	87.8	Confident	85.5	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-72.5	-33.3	177.2	-74.6	157.4	0	0	0	114	L410 Q413 L414 I417 W433 W436 Y437 E459 A460 V461 S466 R467	L410-L463 HydrophobicContact CB-CD1 3.89Å; L410-L463 HydrophobicContact CD2-CD1 3.45Å; L410-L463 VanDerWaalsContact CD2-CD1 3.45Å; L410-L463 HydrophobicContact CG-CD1 4.2Å; Q413-L463 HydrophobicContact CB-CD2 4.25Å; L414-L463 HydrophobicContact CD1-CG 4.34Å; L414-L463 HydrophobicContact CD2-CB 4.42Å; L414-L463 HydrophobicContact CD2-CD2 3.54Å; L414-L463 HydrophobicContact CD2-CG 3.63Å; L414-L463 HydrophobicContact CG-CD1 4.31Å; L414-L463 HydrophobicContact CG-CD2 3.65Å; L414-L463 HydrophobicContact CG-CG 3.65Å; I417-L463 HydrophobicContact CD1-CD2 3.61Å; W433-L463 PolarHBondContact NE1-O 3.42Å; W433-L463 VanDerWaalsContact NE1-O 3.15Å; W436-L463 HydrophobicContact CH2-CD1 4.07Å; W436-L463 HydrophobicContact CH2-CD2 3.94Å; W436-L463 HydrophobicContact CZ2-CD2 3.98Å; Y437-L463 WeakPolarHBondContact OH-CB 3.38Å; Y437-L463 VanDerWaalsContact OH-CD1 3.23Å; Y437-L463 WeakPolarHBondContact OH-CD1 3.43Å; Y437-L463 WeakPolarHBondContact OH-CG 3.37Å; E459-L463 WeakPolarHBondContact O-CD1 3.22Å; E459-L463 VanDerWaalsContact O-CG 3.28Å; E459-L463 WeakPolarHBondContact O-CG 3.49Å; E459-L463 PolarHBondContact O-N 2.94Å; A460-L463 PolarHBondContact O-N 3.36Å; V461-L463 PolarHBondContact O-N 3.31Å; L463-S466 PolarHBondContact O-OG 3.29Å; L463-R467 PolarHBondContact O-N 3.03Å
464	L	89.2	Confident	86.1	Confident	2 Å²	2	30.2 Å²	30.2	1%	0.01	18%	0.18	C	C	.	.	H	α-helix	trans	-68.4	-43	169.3	-75.6	-177.7	0	0	0	110.9	W433 F450 A460 V461 S466 R467 L468 L524 F525 L528 W533 F540 L543	W433-L464 HydrophobicContact CZ2-CD2 4.28Å; F450-L464 HydrophobicContact CD1-CD2 4.16Å; F450-L464 HydrophobicContact CE1-CD1 3.83Å; F450-L464 HydrophobicContact CE1-CD2 3.43Å; F450-L464 VanDerWaalsContact CE1-CD2 3.43Å; F450-L464 HydrophobicContact CE1-CG 3.47Å; F450-L464 VanDerWaalsContact CE1-CG 3.47Å; F450-L464 HydrophobicContact CZ-CD1 4.35Å; F450-L464 HydrophobicContact CZ-CD2 3.91Å; F450-L464 HydrophobicContact CZ-CG 3.67Å; A460-L464 PolarHBondContact O-N 3.37Å; V461-L464 PolarHBondContact O-N 3.29Å; V461-L464 VanDerWaalsContact O-N 3.17Å; L464-S466 VanDerWaalsContact C-N 3.31Å; L464-S466 PolarHBondContact O-N 3.12Å; L464-R467 PolarHBondContact O-N 2.87Å; L464-L468 PolarHBondContact O-N 3.18Å; L464-L468 VanDerWaalsContact O-N 3.14Å; L464-L524 HydrophobicContact CD2-CD2 3.98Å; L464-F525 HydrophobicContact CD1-CE1 4.34Å; L464-F525 HydrophobicContact CD2-CE1 4.18Å; L464-L528 HydrophobicContact CD1-CD1 4.08Å; L464-L528 HydrophobicContact CD2-CD1 4.09Å; L464-W533 HydrophobicContact CD1-CE3 3.86Å; L464-W533 HydrophobicContact CD1-CH2 3.94Å; L464-W533 HydrophobicContact CD1-CZ3 3.4Å; L464-W533 HydrophobicContact CG-CH2 4.42Å; L464-W533 HydrophobicContact CG-CZ3 4.3Å; L464-F540 HydrophobicContact CD1-CD2 4.14Å; L464-L543 HydrophobicContact CB-CD1 3.99Å
465	Q	90.4	Very high	86.5	Confident	88 Å²	88	27.8 Å²	27.8	41%	0.411	17%	0.169	S	C	.	.	H	α-helix	trans	-61.2	-41.7	178.1	-174.3	173.5	-10	0	0	111	V461 G462 R467 L468 T469 L543	V461-Q465 WeakPolarHBondContact O-CB 3.43Å; V461-Q465 PolarHBondContact O-N 2.93Å; G462-Q465 PolarHBondContact O-N 3.49Å; Q465-R467 VanDerWaalsContact C-N 3.3Å; Q465-R467 PolarHBondContact O-N 3.07Å; Q465-L468 PolarHBondContact O-N 2.74Å; Q465-L468 VanDerWaalsContact O-N 3.12Å; Q465-T469 HydrophobicContact CG-CG2 4.37Å; Q465-T469 WeakPolarHBondContact O-CG2 3.48Å; Q465-T469 PolarHBondContact O-N 3.26Å; Q465-T469 PolarHBondContact O-OG1 3.31Å; Q465-L543 HydrophobicContact CB-CD1 4.43Å; Q465-L543 HydrophobicContact CB-CD2 4.05Å; Q465-L543 HydrophobicContact CG-CD2 4.11Å
466	S	89.2	Confident	86.9	Confident	8 Å²	8	31 Å²	31	6%	0.056	19%	0.188	C	C	.	.	H	α-helix	trans	-61.9	-36	178.6	74.1	0	0	0	0	112.7	G462 L463 L464 T469 A470	G462-S466 WeakPolarHBondContact O-CB 3.37Å; G462-S466 PolarHBondContact O-N 3.33Å; L463-S466 PolarHBondContact O-OG 3.29Å; L464-S466 VanDerWaalsContact C-N 3.31Å; L464-S466 PolarHBondContact O-N 3.12Å; S466-T469 VanDerWaalsContact CA-OG1 3.25Å; S466-T469 WeakPolarHBondContact CA-OG1 3.44Å; S466-T469 PolarHBondContact O-OG1 3.39Å; S466-A470 VanDerWaalsContact O-CB 3.3Å; S466-A470 WeakPolarHBondContact O-CB 3.28Å; S466-A470 PolarHBondContact O-N 2.89Å
467	R	91.3	Very high	87	Confident	6 Å²	6	33.9 Å²	33.9	2%	0.023	19%	0.187	C	C	.	.	H	α-helix	trans	-64.1	-47.6	171.6	-176.9	179.5	179.6	79.7	3.9	111.6	W433 N434 L463 L464 Q465 T469 A470 L471 E517 T521	W433-R467 HydrophobicContact CD2-CB 4.27Å; W433-R467 HydrophobicContact CD2-CG 4.2Å; W433-R467 HydrophobicContact CG-CB 4.33Å; W433-R467 HydrophobicContact CG-CG 4.45Å; N434-R467 PolarHBondContact OD1-NH1 2.9Å; L463-R467 PolarHBondContact O-N 3.03Å; L464-R467 PolarHBondContact O-N 2.87Å; Q465-R467 VanDerWaalsContact C-N 3.3Å; Q465-R467 PolarHBondContact O-N 3.07Å; R467-T469 VanDerWaalsContact C-N 3.34Å; R467-A470 PolarHBondContact O-N 2.78Å; R467-L471 HydrophobicContact CG-CD1 4.17Å; R467-L471 WeakPolarHBondContact O-CG 3.39Å; R467-L471 PolarHBondContact O-N 2.93Å; R467-E517 IonicContact CZ-OE2 3.33Å; R467-E517 IonicContact NH1-OE2 3.8Å; R467-E517 PolarHBondContact NH2-O 2.91Å; R467-E517 IonicContact NH2-OE2 2.67Å; R467-E517 PolarHBondContact NH2-OE2 3.38Å; R467-T521 PolarHBondContact NE-OG1 3.08Å; R467-T521 PolarHBondContact NH2-OG1 2.84Å
468	L	91.8	Very high	86.6	Confident	13 Å²	13	36.1 Å²	36.1	7%	0.068	20%	0.197	C	C	.	.	H	α-helix	trans	-63.9	-41.2	179.5	-68.1	-170	0	0	0	111.9	L464 Q465 L471 S472 T521 F525 L543 F547	L464-L468 PolarHBondContact O-N 3.18Å; L464-L468 VanDerWaalsContact O-N 3.14Å; Q465-L468 PolarHBondContact O-N 2.74Å; Q465-L468 VanDerWaalsContact O-N 3.12Å; L468-L471 PolarHBondContact O-N 2.56Å; L468-S472 WeakPolarHBondContact O-CB 3.5Å; L468-S472 PolarHBondContact O-N 3.38Å; L468-S472 PolarHBondContact O-OG 3.23Å; L468-T521 HydrophobicContact CD2-CG2 4Å; L468-F525 HydrophobicContact CD1-CE2 4.28Å; L468-F525 HydrophobicContact CD1-CZ 3.89Å; L468-F525 HydrophobicContact CD2-CE2 3.87Å; L468-F525 HydrophobicContact CD2-CZ 3.8Å; L468-F525 HydrophobicContact CG-CZ 4.04Å; L468-L543 HydrophobicContact CD1-CB 3.79Å; L468-L543 HydrophobicContact CD1-CD2 4.02Å; L468-L543 HydrophobicContact CD1-CG 4.45Å; L468-L543 WeakPolarHBondContact CD1-O 3.4Å; L468-F547 HydrophobicContact CD1-CB 4.06Å; L468-F547 HydrophobicContact CD2-CB 3.73Å; L468-F547 HydrophobicContact CD2-CD2 3.64Å; L468-F547 HydrophobicContact CD2-CG 4Å
469	T	90.1	Very high	86	Confident	51 Å²	51	32.8 Å²	32.8	31%	0.313	17%	0.174	S	C	.	.	H	α-helix	trans	-62.6	-44.9	174.5	53.6	0	0	0	0	110.5	Q465 S466 R467 L471 S472 L473	Q465-T469 HydrophobicContact CG-CG2 4.37Å; Q465-T469 WeakPolarHBondContact O-CG2 3.48Å; Q465-T469 PolarHBondContact O-N 3.26Å; Q465-T469 PolarHBondContact O-OG1 3.31Å; S466-T469 VanDerWaalsContact CA-OG1 3.25Å; S466-T469 WeakPolarHBondContact CA-OG1 3.44Å; S466-T469 PolarHBondContact O-OG1 3.39Å; R467-T469 VanDerWaalsContact C-N 3.34Å; T469-L471 PolarHBondContact O-N 2.8Å; T469-S472 WeakPolarHBondContact CA-OG 3.17Å; T469-S472 PolarHBondContact O-N 3.33Å; T469-S472 PolarHBondContact O-OG 3.44Å; T469-L473 WeakPolarHBondContact O-CB 3.49Å; T469-L473 VanDerWaalsContact O-CG 3.26Å; T469-L473 WeakPolarHBondContact O-CG 3.26Å; T469-L473 PolarHBondContact O-N 2.97Å
470	A	90.5	Very high	85.2	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-58.9	-46.5	176.7	0	0	0	0	0	111.9	M421 V426 V429 I430 S466 R467 S472 L473 Y474	M421-A470 HydrophobicContact CE-CB 3.8Å; V426-A470 HydrophobicContact CG1-CB 4.15Å; V426-A470 WeakPolarHBondContact CG1-O 3.47Å; V429-A470 HydrophobicContact CG1-CB 4.07Å; I430-A470 HydrophobicContact CG1-CB 4.1Å; S466-A470 VanDerWaalsContact O-CB 3.3Å; S466-A470 WeakPolarHBondContact O-CB 3.28Å; S466-A470 PolarHBondContact O-N 2.89Å; R467-A470 PolarHBondContact O-N 2.78Å; A470-S472 VanDerWaalsContact C-N 3.33Å; A470-S472 PolarHBondContact O-N 3.38Å; A470-L473 PolarHBondContact O-N 2.77Å; A470-Y474 WeakPolarHBondContact O-CB 3.3Å; A470-Y474 PolarHBondContact O-N 3.34Å
471	L	92	Very high	83.8	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-64.9	-37.3	177	-67.5	170.8	0	0	0	112.5	I430 R467 L468 T469 Y474 S475 L514 E517 T521 I551	I430-L471 HydrophobicContact CD1-CD2 3.78Å; I430-L471 HydrophobicContact CG1-CD2 4.3Å; R467-L471 HydrophobicContact CG-CD1 4.17Å; R467-L471 WeakPolarHBondContact O-CG 3.39Å; R467-L471 PolarHBondContact O-N 2.93Å; L468-L471 PolarHBondContact O-N 2.56Å; T469-L471 PolarHBondContact O-N 2.8Å; L471-Y474 PolarHBondContact O-N 2.74Å; L471-S475 WeakPolarHBondContact O-CB 3.37Å; L471-S475 PolarHBondContact O-N 3.08Å; L471-S475 PolarHBondContact O-OG 2.96Å; L471-L514 HydrophobicContact CD2-CD1 4.06Å; L471-E517 HydrophobicContact CD2-CB 3.67Å; L471-T521 HydrophobicContact CD1-CG2 4.2Å; L471-T521 VanDerWaalsContact CD1-OG1 3.31Å; L471-T521 WeakPolarHBondContact CD1-OG1 3.46Å; L471-I551 HydrophobicContact CB-CD1 3.61Å
472	S	88.1	Confident	82.1	Confident	37 Å²	37	40.6 Å²	40.6	26%	0.259	21%	0.214	S	C	.	.	H	α-helix	trans	-66.5	-44	176.5	72	0	0	0	0	111.3	L468 T469 A470 Y474 S475 V476	L468-S472 WeakPolarHBondContact O-CB 3.5Å; L468-S472 PolarHBondContact O-N 3.38Å; L468-S472 PolarHBondContact O-OG 3.23Å; T469-S472 WeakPolarHBondContact CA-OG 3.17Å; T469-S472 PolarHBondContact O-N 3.33Å; T469-S472 PolarHBondContact O-OG 3.44Å; A470-S472 VanDerWaalsContact C-N 3.33Å; A470-S472 PolarHBondContact O-N 3.38Å; S472-Y474 VanDerWaalsContact C-N 3.35Å; S472-Y474 PolarHBondContact O-N 3.46Å; S472-S475 PolarHBondContact O-N 3.42Å; S472-S475 VanDerWaalsContact O-N 3.16Å; S472-S475 PolarHBondContact O-OG 3.2Å; S472-V476 WeakPolarHBondContact O-CG2 3.38Å; S472-V476 PolarHBondContact O-N 2.67Å
473	L	87.6	Confident	80.3	Confident	61 Å²	61	43.3 Å²	43.3	32%	0.319	23%	0.23	S	C	.	.	H	α-helix	trans	-63.1	-41.4	175.5	-69.1	175.1	0	0	0	111.1	M421 V426 T469 A470 S475 V476 Y477	M421-L473 HydrophobicContact CE-CD1 4.39Å; V426-L473 HydrophobicContact CG1-CB 4.32Å; V426-L473 HydrophobicContact CG2-CB 4.2Å; T469-L473 WeakPolarHBondContact O-CB 3.49Å; T469-L473 VanDerWaalsContact O-CG 3.26Å; T469-L473 WeakPolarHBondContact O-CG 3.26Å; T469-L473 PolarHBondContact O-N 2.97Å; A470-L473 PolarHBondContact O-N 2.77Å; L473-S475 VanDerWaalsContact C-N 3.31Å; L473-S475 PolarHBondContact O-N 3.18Å; L473-V476 PolarHBondContact O-N 3.35Å; L473-Y477 HydrophobicContact CB-CD2 4.3Å; L473-Y477 HydrophobicContact CD2-CD2 3.71Å; L473-Y477 HydrophobicContact CD2-CE2 3.47Å; L473-Y477 VanDerWaalsContact CD2-CE2 3.47Å; L473-Y477 WeakPolarHBondContact O-CB 3.47Å; L473-Y477 PolarHBondContact O-N 2.86Å
474	Y	88.8	Confident	77.9	Confident	1 Å²	1	49 Å²	49	0%	0.004	26%	0.259	C	S	.	.	I	π-helix	trans	-61.1	-42.3	174.2	-169.9	-83.1	0	0	0	111.2	V426 E427 I430 A470 L471 S472 V476 E478 L479 K510 F513 L514	V426-Y474 HydrophobicContact CG1-CD2 4.39Å; E427-Y474 HydrophobicContact CB-CE2 4.31Å; I430-Y474 HydrophobicContact CD1-CD2 4.28Å; I430-Y474 HydrophobicContact CD1-CG 4.41Å; A470-Y474 WeakPolarHBondContact O-CB 3.3Å; A470-Y474 PolarHBondContact O-N 3.34Å; L471-Y474 PolarHBondContact O-N 2.74Å; S472-Y474 VanDerWaalsContact C-N 3.35Å; S472-Y474 PolarHBondContact O-N 3.46Å; Y474-V476 PolarHBondContact O-N 3.13Å; Y474-E478 HydrophobicContact CD1-CB 4.35Å; Y474-E478 HydrophobicContact CD2-CB 3.77Å; Y474-E478 HydrophobicContact CD2-CG 3.8Å; Y474-E478 HydrophobicContact CE1-CB 4.48Å; Y474-E478 HydrophobicContact CE2-CB 3.92Å; Y474-E478 HydrophobicContact CE2-CG 4.12Å; Y474-E478 HydrophobicContact CG-CB 4Å; Y474-E478 HydrophobicContact CG-CG 4.36Å; Y474-E478 WeakPolarHBondContact O-CB 3.4Å; Y474-E478 PolarHBondContact O-N 3.45Å; Y474-L479 HydrophobicContact CD1-CG 4.45Å; Y474-L479 HydrophobicContact CE1-CG 4.24Å; Y474-L479 PolarHBondContact O-N 3.48Å; Y474-L479 VanDerWaalsContact O-N 3.11Å; Y474-K510 WeakPolarHBondContact OH-CA 3.45Å; Y474-K510 WeakPolarHBondContact OH-CB 3.34Å; Y474-K510 PolarHBondContact OH-O 2.95Å; Y474-F513 HydrophobicContact CD2-CE1 4.3Å; Y474-F513 AromaticContact CE1-CD1 3.91Å; Y474-F513 HydrophobicContact CE1-CD1 3.91Å; Y474-F513 AromaticContact CE2-CD1 3.87Å; Y474-F513 HydrophobicContact CE2-CD1 3.87Å; Y474-F513 AromaticContact CE2-CE1 3.85Å; Y474-F513 HydrophobicContact CE2-CE1 3.85Å; Y474-F513 AromaticContact CZ-CD1 3.48Å; Y474-F513 VanDerWaalsContact CZ-CD1 3.48Å; Y474-F513 AromaticContact CZ-CE1 3.96Å; Y474-F513 WeakPolarHBondContact OH-CD1 3.41Å; Y474-L514 HydrophobicContact CD1-CB 4.07Å; Y474-L514 HydrophobicContact CD1-CD1 4Å; Y474-L514 HydrophobicContact CD1-CD2 4.48Å; Y474-L514 HydrophobicContact CD1-CG 4.4Å; Y474-L514 HydrophobicContact CE1-CB 3.95Å
475	S	85.8	Confident	75.6	Confident	26 Å²	26	55 Å²	55	18%	0.182	29%	0.288	C	S	.	.	I	π-helix	trans	-68.7	-32.5	179.4	73.9	0	0	0	0	113.9	L471 S472 L473	L471-S475 WeakPolarHBondContact O-CB 3.37Å; L471-S475 PolarHBondContact O-N 3.08Å; L471-S475 PolarHBondContact O-OG 2.96Å; S472-S475 PolarHBondContact O-N 3.42Å; S472-S475 VanDerWaalsContact O-N 3.16Å; S472-S475 PolarHBondContact O-OG 3.2Å; L473-S475 VanDerWaalsContact C-N 3.31Å; L473-S475 PolarHBondContact O-N 3.18Å
476	V	82	Confident	73.4	Confident	75 Å²	75	56.3 Å²	56.3	46%	0.455	30%	0.298	S	S	.	.	I	π-helix	trans	-90.7	-42.1	-175.5	172.4	0	0	0	0	112.2	S472 L473 Y474 N480	S472-V476 WeakPolarHBondContact O-CG2 3.38Å; S472-V476 PolarHBondContact O-N 2.67Å; L473-V476 PolarHBondContact O-N 3.35Å; Y474-V476 PolarHBondContact O-N 3.13Å; V476-N480 VanDerWaalsContact O-CB 3.27Å; V476-N480 WeakPolarHBondContact O-CB 3.34Å; V476-N480 PolarHBondContact O-ND2 2.86Å
477	Y	78	Confident	71	Confident	146 Å²	146	60.6 Å²	60.6	57%	0.573	33%	0.327	S	S	*	.	I	π-helix	trans	-98	-63	-175.7	-63.6	-77.8	0	0	0	110.2	L473 L479 N480 D481	L473-Y477 HydrophobicContact CB-CD2 4.3Å; L473-Y477 HydrophobicContact CD2-CD2 3.71Å; L473-Y477 HydrophobicContact CD2-CE2 3.47Å; L473-Y477 VanDerWaalsContact CD2-CE2 3.47Å; L473-Y477 WeakPolarHBondContact O-CB 3.47Å; L473-Y477 PolarHBondContact O-N 2.86Å; Y477-L479 VanDerWaalsContact C-N 3.33Å; Y477-L479 PolarHBondContact O-N 3.25Å; Y477-N480 PolarHBondContact O-N 3.31Å; Y477-D481 VanDerWaalsContact O-CB 3.27Å; Y477-D481 WeakPolarHBondContact O-CB 3.03Å; Y477-D481 PolarHBondContact O-N 3.38Å
478	E	72.6	Confident	68.4	Low	58 Å²	58	65.9 Å²	65.9	27%	0.271	36%	0.36	S	S	.	.	I	π-helix	trans	-62.4	-32.8	-172.1	-72.7	-68.3	165.2	0	0	115.3	Y474 K510	Y474-E478 HydrophobicContact CD1-CB 4.35Å; Y474-E478 HydrophobicContact CD2-CB 3.77Å; Y474-E478 HydrophobicContact CD2-CG 3.8Å; Y474-E478 HydrophobicContact CE1-CB 4.48Å; Y474-E478 HydrophobicContact CE2-CB 3.92Å; Y474-E478 HydrophobicContact CE2-CG 4.12Å; Y474-E478 HydrophobicContact CG-CB 4Å; Y474-E478 HydrophobicContact CG-CG 4.36Å; Y474-E478 WeakPolarHBondContact O-CB 3.4Å; Y474-E478 PolarHBondContact O-N 3.45Å; E478-K510 WeakPolarHBondContact O-CD 3.35Å; E478-K510 PolarHBondContact O-NZ 3.16Å; E478-K510 IonicContact OE2-NZ 3.55Å; E478-K510 PolarHBondContact OE2-NZ 2.93Å
479	L	69.7	Low	65.8	Low	22 Å²	22	70 Å²	70	12%	0.115	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-27.2	174.5	-78	180	0	0	0	113.7	Y474 Y477 Y507 K510 R511 L514	Y474-L479 HydrophobicContact CD1-CG 4.45Å; Y474-L479 HydrophobicContact CE1-CG 4.24Å; Y474-L479 PolarHBondContact O-N 3.48Å; Y474-L479 VanDerWaalsContact O-N 3.11Å; Y477-L479 VanDerWaalsContact C-N 3.33Å; Y477-L479 PolarHBondContact O-N 3.25Å; L479-Y507 HydrophobicContact CD2-CE2 4.31Å; L479-K510 HydrophobicContact CD2-CB 3.69Å; L479-R511 HydrophobicContact CD2-CB 4.26Å; L479-L514 HydrophobicContact CD1-CB 4.49Å; L479-L514 HydrophobicContact CD1-CD2 3.41Å; L479-L514 VanDerWaalsContact CD1-CD2 3.41Å
480	N	66.1	Low	63.1	Low	89 Å²	89	73.3 Å²	73.3	48%	0.476	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104	-16.2	-174.7	-61.2	-33	0	0	0	114.4	V476 Y477 Q482 S483	V476-N480 VanDerWaalsContact O-CB 3.27Å; V476-N480 WeakPolarHBondContact O-CB 3.34Å; V476-N480 PolarHBondContact O-ND2 2.86Å; Y477-N480 PolarHBondContact O-N 3.31Å; N480-Q482 PolarHBondContact O-N 3.11Å; N480-S483 PolarHBondContact O-N 3.32Å; N480-S483 PolarHBondContact O-OG 3.02Å
481	D	55.8	Low	60.7	Low	78 Å²	78	78.1 Å²	78.1	42%	0.417	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-59.2	-25.1	-171.7	-153.4	27.3	0	0	0	113.4	Y477 S483 L484	Y477-D481 VanDerWaalsContact O-CB 3.27Å; Y477-D481 WeakPolarHBondContact O-CB 3.03Å; Y477-D481 PolarHBondContact O-N 3.38Å; D481-S483 PolarHBondContact O-N 2.89Å; D481-L484 PolarHBondContact O-N 3.26Å; D481-L484 VanDerWaalsContact O-N 3.11Å
482	Q	51.5	Low	58.3	Low	69 Å²	69	85.8 Å²	85.8	32%	0.322	48%	0.481	S	S	.	.	G	3₁₀ helix	trans	-69.5	-13.8	178.4	-68.6	-172.8	-12.1	0	0	114	N480	N480-Q482 PolarHBondContact O-N 3.11Å
483	S	48.5	Very low	56.3	Low	79 Å²	79	92.5 Å²	92.5	55%	0.552	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-76.7	-25.1	172.2	66	0	0	0	0	113	N480 D481 S487	N480-S483 PolarHBondContact O-N 3.32Å; N480-S483 PolarHBondContact O-OG 3.02Å; D481-S483 PolarHBondContact O-N 2.89Å; S483-S487 PolarHBondContact O-OG 3.47Å
484	L	37.8	Very low	54.3	Low	119 Å²	119	98.4 Å²	98.4	62%	0.623	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-39.6	-174.6	-113.5	84.3	0	0	0	113.4	D481 N486 S487	D481-L484 PolarHBondContact O-N 3.26Å; D481-L484 VanDerWaalsContact O-N 3.11Å; L484-N486 PolarHBondContact O-N 2.87Å; L484-S487 WeakPolarHBondContact O-CB 3.41Å; L484-S487 PolarHBondContact O-N 2.81Å
485	Q	39.8	Very low	52.5	Low	130 Å²	130	102.4 Å²	102.4	61%	0.607	56%	0.561	S	S	*	*	G	3₁₀ helix	trans	-66	-21.8	-177.6	-71.7	-176.9	-6.7	0	0	113.5	S487 T488	Q485-S487 VanDerWaalsContact C-N 3.34Å; Q485-T488 PolarHBondContact O-OG1 3.19Å
486	N	45.3	Very low	51.2	Low	115 Å²	115	104.6 Å²	104.6	62%	0.615	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-83.7	-7.8	174.4	-71.1	-7.2	0	0	0	113.7	L484	L484-N486 PolarHBondContact O-N 2.87Å
487	S	37.6	Very low	50.4	Low	97 Å²	97	107.2 Å²	107.2	68%	0.678	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-80.9	-19.1	175.1	-58	0	0	0	0	112.5	S483 L484 Q485	S483-S487 PolarHBondContact O-OG 3.47Å; L484-S487 WeakPolarHBondContact O-CB 3.41Å; L484-S487 PolarHBondContact O-N 2.81Å; Q485-S487 VanDerWaalsContact C-N 3.34Å
488	T	38	Very low	49.9	Very low	117 Å²	117	106.5 Å²	106.5	72%	0.718	59%	0.586	S	S	*	*	S	Bend	trans	-101.2	-9.6	-179.7	41.3	0	0	0	0	114.8	Q485 T490	Q485-T488 PolarHBondContact O-OG1 3.19Å; T488-T490 PolarHBondContact O-N 3.16Å
489	V	36.8	Very low	49.6	Very low	101 Å²	101	108.5 Å²	108.5	61%	0.612	60%	0.596	S	S	*	*	S	Bend	trans	-87.7	94.8	170.4	-174.2	0	0	0	0	107.9	S491	V489-S491 PolarHBondContact O-N 3.48Å
490	T	33.3	Very low	49.5	Very low	120 Å²	120	112.8 Å²	112.8	74%	0.736	62%	0.615	S	S	*	*			trans	-31.7	120.9	163	23.8	0	0	0	0	111.4	T488 N492	T488-T490 PolarHBondContact O-N 3.16Å; T490-N492 PolarHBondContact O-N 3.29Å; T490-N492 VanDerWaalsContact O-N 3.12Å
491	S	39	Very low	49.9	Very low	100 Å²	100	112.3 Å²	112.3	70%	0.699	62%	0.616	S	S	*	*	S	Bend	trans	-23.3	109.4	157.6	46.9	0	0	0	0	112.3	V489	V489-S491 PolarHBondContact O-N 3.48Å
492	N	43.2	Very low	50.8	Low	162 Å²	162	115 Å²	115	87%	0.866	62%	0.624	S	S	*	*			trans	172.6	5	140.1	-85.1	-11.4	0	0	0	116.2	T490	T490-N492 PolarHBondContact O-N 3.29Å; T490-N492 VanDerWaalsContact O-N 3.12Å
493	E	46	Very low	51.8	Low	178 Å²	178	115.1 Å²	115.1	83%	0.832	63%	0.626	S	S	*	*	S	Bend	trans	-102.5	117.8	170.8	-68.2	-175.6	176	0	0	110.7	V495	E493-V495 PolarHBondContact O-N 2.84Å
494	M	45.1	Very low	53	Low	184 Å²	184	116.5 Å²	116.5	91%	0.906	62%	0.623	S	S	*	*			trans	-53.9	108.8	170	-86.8	177.7	126.6	0	0	108.9	T496	M494-T496 PolarHBondContact O-N 3.23Å
495	V	50.7	Low	55	Low	85 Å²	85	115.2 Å²	115.2	52%	0.515	62%	0.618	S	S	.	*			trans	-59.3	120.6	171.3	-177.9	0	0	0	0	107.6	E493 Q499 E500	E493-V495 PolarHBondContact O-N 2.84Å; V495-Q499 HydrophobicContact CG1-CB 4.05Å; V495-E500 HydrophobicContact CG1-CG 3.77Å
496	T	59.2	Low	57	Low	73 Å²	73	110.5 Å²	110.5	45%	0.448	60%	0.601	S	S	.	*			trans	-73.5	144	-179.6	55.1	0	0	0	0	110.3	M494 E498 Q499 E500	M494-T496 PolarHBondContact O-N 3.23Å; T496-E498 PolarHBondContact O-N 3.41Å; T496-Q499 VanDerWaalsContact N-OE1 3.1Å; T496-Q499 WeakPolarHBondContact O-CA 3.43Å; T496-Q499 WeakPolarHBondContact O-CB 3.37Å; T496-Q499 PolarHBondContact O-N 3.36Å; T496-Q499 VanDerWaalsContact OG1-CD 3.22Å; T496-Q499 VanDerWaalsContact OG1-CG 3.29Å; T496-Q499 WeakPolarHBondContact OG1-CG 3.46Å; T496-Q499 PolarHBondContact OG1-OE1 3.43Å; T496-E500 PolarHBondContact O-N 3.16Å
497	N	64.7	Low	58.8	Low	129 Å²	129	109.2 Å²	109.2	69%	0.69	59%	0.588	S	S	*	*	H	α-helix	trans	-52.3	-28.5	175.9	-72.1	-10	0	0	0	112.9	T501	N497-T501 WeakPolarHBondContact O-CG2 3.46Å; N497-T501 PolarHBondContact O-N 2.93Å; N497-T501 VanDerWaalsContact O-N 3.1Å; N497-T501 PolarHBondContact O-OG1 3.44Å
498	E	68.2	Low	60.9	Low	131 Å²	131	107.8 Å²	107.8	61%	0.612	57%	0.57	S	S	*	*	H	α-helix	trans	-68.5	-36.4	173.6	-73.2	-167.3	-178.1	0	0	113.4	T496 T501 K502	T496-E498 PolarHBondContact O-N 3.41Å; E498-T501 WeakPolarHBondContact CA-OG1 3.39Å; E498-T501 PolarHBondContact O-OG1 2.81Å; E498-K502 WeakPolarHBondContact O-CB 3.3Å; E498-K502 WeakPolarHBondContact O-CD 3.18Å; E498-K502 WeakPolarHBondContact O-CG 3.49Å; E498-K502 PolarHBondContact O-N 3.33Å; E498-K502 IonicContact OE2-NZ 3.77Å
499	Q	64.7	Low	63.1	Low	100 Å²	100	108.5 Å²	108.5	47%	0.467	57%	0.566	S	S	.	*	H	α-helix	trans	-69.5	-41.9	175.8	-74.5	164.9	-29	0	0	110.9	V495 T496 T501 K502 L503	V495-Q499 HydrophobicContact CG1-CB 4.05Å; T496-Q499 VanDerWaalsContact N-OE1 3.1Å; T496-Q499 WeakPolarHBondContact O-CA 3.43Å; T496-Q499 WeakPolarHBondContact O-CB 3.37Å; T496-Q499 PolarHBondContact O-N 3.36Å; T496-Q499 VanDerWaalsContact OG1-CD 3.22Å; T496-Q499 VanDerWaalsContact OG1-CG 3.29Å; T496-Q499 WeakPolarHBondContact OG1-CG 3.46Å; T496-Q499 PolarHBondContact OG1-OE1 3.43Å; Q499-T501 PolarHBondContact O-N 3.48Å; Q499-K502 PolarHBondContact O-N 2.86Å; Q499-L503 WeakPolarHBondContact O-CB 3.43Å; Q499-L503 VanDerWaalsContact O-CG 3.31Å; Q499-L503 WeakPolarHBondContact O-CG 3.4Å; Q499-L503 PolarHBondContact O-N 3.34Å
500	E	69.4	Low	65.5	Low	112 Å²	112	106.1 Å²	106.1	52%	0.523	55%	0.547	S	S	.	.	H	α-helix	trans	-61.6	-44.6	175.5	-66.7	-169.4	160.2	0	0	112.2	V495 T496 L503 H504	V495-E500 HydrophobicContact CG1-CG 3.77Å; T496-E500 PolarHBondContact O-N 3.16Å; E500-L503 PolarHBondContact O-N 2.71Å; E500-H504 VanDerWaalsContact O-CB 3.3Å; E500-H504 WeakPolarHBondContact O-CB 3.21Å; E500-H504 PolarHBondContact O-N 3.49Å
501	T	72.6	Confident	68	Low	79 Å²	79	107.1 Å²	107.1	49%	0.485	54%	0.537	S	S	.	.	H	α-helix	trans	-65.8	-39.5	178.2	49.2	0	0	0	0	112.2	N497 E498 Q499 H504 N505	N497-T501 WeakPolarHBondContact O-CG2 3.46Å; N497-T501 PolarHBondContact O-N 2.93Å; N497-T501 VanDerWaalsContact O-N 3.1Å; N497-T501 PolarHBondContact O-OG1 3.44Å; E498-T501 WeakPolarHBondContact CA-OG1 3.39Å; E498-T501 PolarHBondContact O-OG1 2.81Å; Q499-T501 PolarHBondContact O-N 3.48Å; T501-H504 PolarHBondContact O-N 3.49Å; T501-N505 WeakPolarHBondContact O-CB 3.43Å; T501-N505 PolarHBondContact O-N 2.97Å; T501-N505 PolarHBondContact O-ND2 3.48Å
502	K	75.3	Confident	70.3	Confident	135 Å²	135	108.7 Å²	108.7	59%	0.587	53%	0.534	S	S	*	.	H	α-helix	trans	-62.3	-44.8	173	-75.1	170.1	-174.2	167.8	0	111.8	E498 Q499 N505 A506	E498-K502 WeakPolarHBondContact O-CB 3.3Å; E498-K502 WeakPolarHBondContact O-CD 3.18Å; E498-K502 WeakPolarHBondContact O-CG 3.49Å; E498-K502 PolarHBondContact O-N 3.33Å; E498-K502 IonicContact OE2-NZ 3.77Å; Q499-K502 PolarHBondContact O-N 2.86Å; K502-N505 PolarHBondContact O-N 2.95Å; K502-A506 WeakPolarHBondContact O-CB 3.38Å; K502-A506 PolarHBondContact O-N 2.71Å
503	L	72.1	Confident	72.6	Confident	72 Å²	72	102.6 Å²	102.6	38%	0.377	50%	0.499	S	S	.	.	H	α-helix	trans	-63	-45.9	176.5	-74.6	171.2	0	0	0	112	Q499 E500 N505 A506 Y507	Q499-L503 WeakPolarHBondContact O-CB 3.43Å; Q499-L503 VanDerWaalsContact O-CG 3.31Å; Q499-L503 WeakPolarHBondContact O-CG 3.4Å; Q499-L503 PolarHBondContact O-N 3.34Å; E500-L503 PolarHBondContact O-N 2.71Å; L503-N505 VanDerWaalsContact C-N 3.35Å; L503-N505 PolarHBondContact O-N 3.4Å; L503-A506 PolarHBondContact O-N 2.84Å; L503-Y507 PolarHBondContact O-N 2.99Å
504	H	75.4	Confident	74.7	Confident	107 Å²	107	95 Å²	95	50%	0.495	46%	0.464	S	S	.	.	H	α-helix	trans	-59.4	-45.6	177.1	-173.6	73.6	0	0	0	111.6	E500 T501 Y507 H508	E500-H504 VanDerWaalsContact O-CB 3.3Å; E500-H504 WeakPolarHBondContact O-CB 3.21Å; E500-H504 PolarHBondContact O-N 3.49Å; T501-H504 PolarHBondContact O-N 3.49Å; H504-Y507 PolarHBondContact O-N 3.16Å; H504-H508 AromaticContact CD2-CD2 3.54Å; H504-H508 AromaticContact CD2-NE2 3.94Å; H504-H508 AromaticContact CE1-CD2 3.38Å; H504-H508 PolarHBondContact CE1-CD2 2.96Å; H504-H508 AromaticContact CE1-NE2 3.05Å; H504-H508 PolarHBondContact CE1-NE2 3.4Å; H504-H508 AromaticContact CG-CD2 3.88Å; H504-H508 AromaticContact ND1-CD2 3.78Å; H504-H508 AromaticContact ND1-NE2 3.83Å; H504-H508 AromaticContact NE2-CD2 3.22Å; H504-H508 PolarHBondContact NE2-CD2 3.33Å; H504-H508 AromaticContact NE2-NE2 3.11Å; H504-H508 PolarHBondContact NE2-NE2 2.94Å; H504-H508 VanDerWaalsContact NE2-NE2 3.11Å; H504-H508 WeakPolarHBondContact O-CB 3.43Å; H504-H508 PolarHBondContact O-CD2 3.01Å; H504-H508 PolarHBondContact O-N 3.19Å
505	N	79.2	Confident	76.9	Confident	93 Å²	93	89.7 Å²	89.7	50%	0.497	45%	0.446	S	S	.	.	H	α-helix	trans	-62.8	-42.4	176.7	-72.4	-22.2	0	0	0	112	T501 K502 L503 H508 Q509	T501-N505 WeakPolarHBondContact O-CB 3.43Å; T501-N505 PolarHBondContact O-N 2.97Å; T501-N505 PolarHBondContact O-ND2 3.48Å; K502-N505 PolarHBondContact O-N 2.95Å; L503-N505 VanDerWaalsContact C-N 3.35Å; L503-N505 PolarHBondContact O-N 3.4Å; N505-H508 PolarHBondContact O-N 3.34Å; N505-Q509 WeakPolarHBondContact O-CG 3.38Å; N505-Q509 PolarHBondContact O-N 3.46Å
506	A	81.6	Confident	78.8	Confident	31 Å²	31	88.1 Å²	88.1	26%	0.256	44%	0.438	S	S	.	.	H	α-helix	trans	-62.5	-45.5	176.6	0	0	0	0	0	112.1	K502 L503 H508 Q509 K510	K502-A506 WeakPolarHBondContact O-CB 3.38Å; K502-A506 PolarHBondContact O-N 2.71Å; L503-A506 PolarHBondContact O-N 2.84Å; A506-H508 VanDerWaalsContact C-N 3.33Å; A506-H508 PolarHBondContact O-N 3.07Å; A506-Q509 PolarHBondContact O-N 3.24Å; A506-K510 PolarHBondContact O-N 3.16Å
507	Y	82.4	Confident	80.3	Confident	88 Å²	88	84.8 Å²	84.8	35%	0.345	42%	0.417	S	S	.	.	H	α-helix	trans	-59.1	-44.1	174.5	174.1	-100.1	0	0	0	111.8	L479 L503 H504 Q509 K510 R511	L479-Y507 HydrophobicContact CD2-CE2 4.31Å; L503-Y507 PolarHBondContact O-N 2.99Å; H504-Y507 PolarHBondContact O-N 3.16Å; Y507-Q509 PolarHBondContact O-N 2.91Å; Y507-K510 PolarHBondContact O-N 3.08Å; Y507-R511 WeakPolarHBondContact O-CB 3.31Å; Y507-R511 PolarHBondContact O-N 2.96Å
508	H	81.9	Confident	81.6	Confident	66 Å²	66	79.3 Å²	79.3	31%	0.306	39%	0.389	S	S	.	.	H	α-helix	trans	-63.3	-40.5	177	-88.5	-71.8	0	0	0	112.9	H504 N505 A506 R511 Q512	H504-H508 AromaticContact CD2-CD2 3.54Å; H504-H508 AromaticContact CD2-NE2 3.94Å; H504-H508 AromaticContact CE1-CD2 3.38Å; H504-H508 PolarHBondContact CE1-CD2 2.96Å; H504-H508 AromaticContact CE1-NE2 3.05Å; H504-H508 PolarHBondContact CE1-NE2 3.4Å; H504-H508 AromaticContact CG-CD2 3.88Å; H504-H508 AromaticContact ND1-CD2 3.78Å; H504-H508 AromaticContact ND1-NE2 3.83Å; H504-H508 AromaticContact NE2-CD2 3.22Å; H504-H508 PolarHBondContact NE2-CD2 3.33Å; H504-H508 AromaticContact NE2-NE2 3.11Å; H504-H508 PolarHBondContact NE2-NE2 2.94Å; H504-H508 VanDerWaalsContact NE2-NE2 3.11Å; H504-H508 WeakPolarHBondContact O-CB 3.43Å; H504-H508 PolarHBondContact O-CD2 3.01Å; H504-H508 PolarHBondContact O-N 3.19Å; N505-H508 PolarHBondContact O-N 3.34Å; A506-H508 VanDerWaalsContact C-N 3.33Å; A506-H508 PolarHBondContact O-N 3.07Å; H508-R511 PolarHBondContact O-N 2.66Å; H508-Q512 WeakPolarHBondContact O-CB 3.41Å; H508-Q512 VanDerWaalsContact O-CG 3.29Å; H508-Q512 WeakPolarHBondContact O-CG 3.27Å; H508-Q512 PolarHBondContact O-N 2.96Å
509	Q	84.4	Confident	82.7	Confident	133 Å²	133	76.2 Å²	76.2	62%	0.621	38%	0.381	S	S	*	.	H	α-helix	trans	-62.2	-47.7	174.6	-74	173.8	-0.9	0	0	111.5	N505 A506 Y507 R511 Q512 F513	N505-Q509 WeakPolarHBondContact O-CG 3.38Å; N505-Q509 PolarHBondContact O-N 3.46Å; A506-Q509 PolarHBondContact O-N 3.24Å; Y507-Q509 PolarHBondContact O-N 2.91Å; Q509-R511 VanDerWaalsContact C-N 3.29Å; Q509-R511 PolarHBondContact O-N 2.84Å; Q509-Q512 PolarHBondContact O-N 2.84Å; Q509-F513 PolarHBondContact O-N 3.08Å
510	K	87	Confident	83.9	Confident	50 Å²	50	74.9 Å²	74.9	22%	0.217	37%	0.374	C	S	.	.	H	α-helix	trans	-59.7	-39.5	176.4	-72.2	-164.3	179.3	-165.2	0	112.2	Y474 E478 L479 A506 Y507 F513 L514	Y474-K510 WeakPolarHBondContact OH-CA 3.45Å; Y474-K510 WeakPolarHBondContact OH-CB 3.34Å; Y474-K510 PolarHBondContact OH-O 2.95Å; E478-K510 WeakPolarHBondContact O-CD 3.35Å; E478-K510 PolarHBondContact O-NZ 3.16Å; E478-K510 IonicContact OE2-NZ 3.55Å; E478-K510 PolarHBondContact OE2-NZ 2.93Å; L479-K510 HydrophobicContact CD2-CB 3.69Å; A506-K510 PolarHBondContact O-N 3.16Å; Y507-K510 PolarHBondContact O-N 3.08Å; K510-F513 WeakPolarHBondContact O-CB 3.45Å; K510-F513 PolarHBondContact O-N 3.08Å; K510-L514 PolarHBondContact O-N 3.42Å
511	R	86.8	Confident	85	Confident	141 Å²	141	69.6 Å²	69.6	53%	0.532	35%	0.349	S	S	.	.	H	α-helix	trans	-70	-37.7	178	-169	176.2	-179.1	-156	1.8	112.4	L479 Y507 H508 Q509 L514 S515	L479-R511 HydrophobicContact CD2-CB 4.26Å; Y507-R511 WeakPolarHBondContact O-CB 3.31Å; Y507-R511 PolarHBondContact O-N 2.96Å; H508-R511 PolarHBondContact O-N 2.66Å; Q509-R511 VanDerWaalsContact C-N 3.29Å; Q509-R511 PolarHBondContact O-N 2.84Å; R511-L514 PolarHBondContact O-N 3.47Å; R511-S515 WeakPolarHBondContact O-CB 3.48Å; R511-S515 PolarHBondContact O-N 3.14Å
512	Q	87.6	Confident	85.9	Confident	134 Å²	134	68.7 Å²	68.7	63%	0.626	34%	0.337	S	S	*	.	H	α-helix	trans	-64.7	-41.9	173	-76.1	177.1	4.1	0	0	111.4	H508 Q509 S515 S516	H508-Q512 WeakPolarHBondContact O-CB 3.41Å; H508-Q512 VanDerWaalsContact O-CG 3.29Å; H508-Q512 WeakPolarHBondContact O-CG 3.27Å; H508-Q512 PolarHBondContact O-N 2.96Å; Q509-Q512 PolarHBondContact O-N 2.84Å; Q512-S515 PolarHBondContact O-N 3.42Å; Q512-S516 WeakPolarHBondContact O-CB 3.4Å; Q512-S516 PolarHBondContact O-N 2.93Å
513	F	89.8	Confident	86.6	Confident	34 Å²	34	66 Å²	66	15%	0.149	34%	0.336	C	S	.	.	H	α-helix	trans	-57.2	-52.6	172.9	176.1	-93.5	0	0	0	111.3	E427 I430 H431 Y474 Q509 K510 S515 S516 E517	E427-F513 HydrophobicContact CG-CE1 4.12Å; E427-F513 HydrophobicContact CG-CE2 4.32Å; E427-F513 HydrophobicContact CG-CZ 3.79Å; I430-F513 HydrophobicContact CB-CZ 4.38Å; I430-F513 HydrophobicContact CD1-CE1 4.03Å; I430-F513 HydrophobicContact CD1-CZ 4.47Å; I430-F513 HydrophobicContact CG2-CZ 4.05Å; H431-F513 AromaticContact CE1-CE2 3.82Å; H431-F513 AromaticContact NE2-CE2 3.67Å; Y474-F513 HydrophobicContact CD2-CE1 4.3Å; Y474-F513 AromaticContact CE1-CD1 3.91Å; Y474-F513 HydrophobicContact CE1-CD1 3.91Å; Y474-F513 AromaticContact CE2-CD1 3.87Å; Y474-F513 HydrophobicContact CE2-CD1 3.87Å; Y474-F513 AromaticContact CE2-CE1 3.85Å; Y474-F513 HydrophobicContact CE2-CE1 3.85Å; Y474-F513 AromaticContact CZ-CD1 3.48Å; Y474-F513 VanDerWaalsContact CZ-CD1 3.48Å; Y474-F513 AromaticContact CZ-CE1 3.96Å; Y474-F513 WeakPolarHBondContact OH-CD1 3.41Å; Q509-F513 PolarHBondContact O-N 3.08Å; K510-F513 WeakPolarHBondContact O-CB 3.45Å; K510-F513 PolarHBondContact O-N 3.08Å; F513-S515 VanDerWaalsContact C-N 3.32Å; F513-S515 PolarHBondContact O-N 3.22Å; F513-S516 WeakPolarHBondContact O-CB 3.44Å; F513-S516 PolarHBondContact O-N 3.35Å; F513-E517 HydrophobicContact CD1-CG 4.37Å; F513-E517 HydrophobicContact CE1-CG 4Å; F513-E517 HydrophobicContact CE2-CG 4.25Å; F513-E517 HydrophobicContact CZ-CG 3.93Å; F513-E517 WeakPolarHBondContact O-CG 3.46Å; F513-E517 PolarHBondContact O-N 3.33Å
514	L	90.1	Very high	87.4	Confident	17 Å²	17	63.3 Å²	63.3	9%	0.089	32%	0.322	C	S	.	.	H	α-helix	trans	-58.4	-44.4	177.5	-177.7	62.2	0	0	0	111.7	L471 Y474 L479 K510 R511 S516 E517 V518 I551	L471-L514 HydrophobicContact CD2-CD1 4.06Å; Y474-L514 HydrophobicContact CD1-CB 4.07Å; Y474-L514 HydrophobicContact CD1-CD1 4Å; Y474-L514 HydrophobicContact CD1-CD2 4.48Å; Y474-L514 HydrophobicContact CD1-CG 4.4Å; Y474-L514 HydrophobicContact CE1-CB 3.95Å; L479-L514 HydrophobicContact CD1-CB 4.49Å; L479-L514 HydrophobicContact CD1-CD2 3.41Å; L479-L514 VanDerWaalsContact CD1-CD2 3.41Å; K510-L514 PolarHBondContact O-N 3.42Å; R511-L514 PolarHBondContact O-N 3.47Å; L514-S516 VanDerWaalsContact C-N 3.33Å; L514-S516 PolarHBondContact O-N 3.04Å; L514-E517 PolarHBondContact O-N 2.97Å; L514-E517 VanDerWaalsContact O-N 3.16Å; L514-V518 HydrophobicContact CD1-CG2 4.15Å; L514-V518 HydrophobicContact CG-CG2 4.19Å; L514-V518 WeakPolarHBondContact O-CB 3.44Å; L514-V518 WeakPolarHBondContact O-CG2 3.35Å; L514-V518 PolarHBondContact O-N 3.34Å; L514-I551 HydrophobicContact CD1-CG2 4.14Å; L514-I551 HydrophobicContact CD2-CG2 4.36Å; L514-I551 HydrophobicContact CG-CG2 4.44Å
515	S	90.8	Very high	88.2	Confident	74 Å²	74	58.3 Å²	58.3	52%	0.517	30%	0.298	S	S	.	.	H	α-helix	trans	-60.5	-40.6	178.8	-174.2	0	0	0	0	112.9	R511 Q512 F513 S519	R511-S515 WeakPolarHBondContact O-CB 3.48Å; R511-S515 PolarHBondContact O-N 3.14Å; Q512-S515 PolarHBondContact O-N 3.42Å; F513-S515 VanDerWaalsContact C-N 3.32Å; F513-S515 PolarHBondContact O-N 3.22Å; S515-S519 WeakPolarHBondContact O-CB 3.42Å; S515-S519 PolarHBondContact O-N 3.27Å; S515-S519 PolarHBondContact O-OG 3.45Å
516	S	91.3	Very high	88.7	Confident	52 Å²	52	56.8 Å²	56.8	36%	0.364	29%	0.29	S	S	.	.	H	α-helix	trans	-60.6	-47.2	172.8	168.7	0	0	0	0	111.1	Q512 F513 L514 S519 K520	Q512-S516 WeakPolarHBondContact O-CB 3.4Å; Q512-S516 PolarHBondContact O-N 2.93Å; F513-S516 WeakPolarHBondContact O-CB 3.44Å; F513-S516 PolarHBondContact O-N 3.35Å; L514-S516 VanDerWaalsContact C-N 3.33Å; L514-S516 PolarHBondContact O-N 3.04Å; S516-S519 WeakPolarHBondContact O-CB 3.29Å; S516-S519 PolarHBondContact O-N 2.92Å; S516-K520 WeakPolarHBondContact O-CG 3.41Å; S516-K520 PolarHBondContact O-N 3.47Å
517	E	91.2	Very high	89	Confident	2 Å²	2	57.2 Å²	57.2	1%	0.009	29%	0.291	C	S	.	.	H	α-helix	trans	-70.4	-34	-178.5	-66.9	-57.5	131.3	0	0	113.4	I430 N434 R467 L471 F513 L514 S519 K520 T521	I430-E517 HydrophobicContact CG2-CG 3.81Å; I430-E517 WeakPolarHBondContact CG2-OE2 3.14Å; N434-E517 PolarHBondContact ND2-OE1 3.45Å; N434-E517 PolarHBondContact ND2-OE2 2.89Å; N434-E517 PolarHBondContact OD1-OE2 3.07Å; R467-E517 IonicContact CZ-OE2 3.33Å; R467-E517 IonicContact NH1-OE2 3.8Å; R467-E517 PolarHBondContact NH2-O 2.91Å; R467-E517 IonicContact NH2-OE2 2.67Å; R467-E517 PolarHBondContact NH2-OE2 3.38Å; L471-E517 HydrophobicContact CD2-CB 3.67Å; F513-E517 HydrophobicContact CD1-CG 4.37Å; F513-E517 HydrophobicContact CE1-CG 4Å; F513-E517 HydrophobicContact CE2-CG 4.25Å; F513-E517 HydrophobicContact CZ-CG 3.93Å; F513-E517 WeakPolarHBondContact O-CG 3.46Å; F513-E517 PolarHBondContact O-N 3.33Å; L514-E517 PolarHBondContact O-N 2.97Å; L514-E517 VanDerWaalsContact O-N 3.16Å; E517-S519 VanDerWaalsContact C-N 3.34Å; E517-K520 PolarHBondContact O-N 3.48Å; E517-K520 WeakPolarHBondContact OE1-CD 3.4Å; E517-K520 IonicContact OE1-NZ 3.15Å; E517-K520 PolarHBondContact OE1-NZ 2.89Å; E517-T521 WeakPolarHBondContact O-CB 3.35Å; E517-T521 PolarHBondContact O-N 2.95Å; E517-T521 PolarHBondContact O-OG1 3.44Å
518	V	92.3	Very high	89.3	Confident	14 Å²	14	53 Å²	53	9%	0.085	28%	0.275	C	S	.	.	H	α-helix	trans	-61.9	-44.1	170.3	169	0	0	0	0	110.3	L514 T521 R522 F547 I551	L514-V518 HydrophobicContact CD1-CG2 4.15Å; L514-V518 HydrophobicContact CG-CG2 4.19Å; L514-V518 WeakPolarHBondContact O-CB 3.44Å; L514-V518 WeakPolarHBondContact O-CG2 3.35Å; L514-V518 PolarHBondContact O-N 3.34Å; V518-T521 PolarHBondContact O-N 3.32Å; V518-R522 WeakPolarHBondContact O-CB 3.4Å; V518-R522 PolarHBondContact O-N 2.9Å; V518-F547 HydrophobicContact CG1-CE2 4.28Å; V518-F547 HydrophobicContact CG1-CZ 3.9Å; V518-I551 HydrophobicContact CG2-CB 4.49Å; V518-I551 HydrophobicContact CG2-CG2 3.38Å
519	S	90.2	Very high	89.6	Confident	66 Å²	66	50.2 Å²	50.2	46%	0.462	26%	0.262	S	S	.	.	H	α-helix	trans	-63.8	-42.7	178.4	-58.9	0	0	0	0	111.9	S515 S516 E517 R522 S523	S515-S519 WeakPolarHBondContact O-CB 3.42Å; S515-S519 PolarHBondContact O-N 3.27Å; S515-S519 PolarHBondContact O-OG 3.45Å; S516-S519 WeakPolarHBondContact O-CB 3.29Å; S516-S519 PolarHBondContact O-N 2.92Å; E517-S519 VanDerWaalsContact C-N 3.34Å; S519-R522 PolarHBondContact O-N 3.05Å; S519-S523 PolarHBondContact O-N 3.44Å
520	K	90.5	Very high	89.7	Confident	72 Å²	72	48.3 Å²	48.3	31%	0.313	26%	0.26	S	S	.	.	H	α-helix	trans	-62.4	-43.9	174.2	-70.9	172	-172.9	175	0	112.3	L438 S516 E517 S523 L524	L438-K520 HydrophobicContact CD2-CB 4.09Å; L438-K520 HydrophobicContact CD2-CD 3.89Å; L438-K520 HydrophobicContact CD2-CG 3.94Å; S516-K520 WeakPolarHBondContact O-CG 3.41Å; S516-K520 PolarHBondContact O-N 3.47Å; E517-K520 PolarHBondContact O-N 3.48Å; E517-K520 WeakPolarHBondContact OE1-CD 3.4Å; E517-K520 IonicContact OE1-NZ 3.15Å; E517-K520 PolarHBondContact OE1-NZ 2.89Å; K520-S523 PolarHBondContact O-N 3.43Å; K520-L524 PolarHBondContact O-N 2.93Å
521	T	91.5	Very high	89.6	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.006	26%	0.256	C	S	.	.	H	α-helix	trans	-66.4	-40.3	-179.9	-50.8	0	0	0	0	111.6	R467 L468 L471 E517 V518 L524 F525 F547	R467-T521 PolarHBondContact NE-OG1 3.08Å; R467-T521 PolarHBondContact NH2-OG1 2.84Å; L468-T521 HydrophobicContact CD2-CG2 4Å; L471-T521 HydrophobicContact CD1-CG2 4.2Å; L471-T521 VanDerWaalsContact CD1-OG1 3.31Å; L471-T521 WeakPolarHBondContact CD1-OG1 3.46Å; E517-T521 WeakPolarHBondContact O-CB 3.35Å; E517-T521 PolarHBondContact O-N 2.95Å; E517-T521 PolarHBondContact O-OG1 3.44Å; V518-T521 PolarHBondContact O-N 3.32Å; T521-L524 WeakPolarHBondContact O-CB 3.43Å; T521-L524 PolarHBondContact O-N 2.88Å; T521-F525 HydrophobicContact CG2-CD2 4.27Å; T521-F525 HydrophobicContact CG2-CE2 3.94Å; T521-F525 HydrophobicContact CG2-CZ 4.23Å; T521-F525 PolarHBondContact O-N 2.64Å; T521-F547 HydrophobicContact CG2-CD2 4.04Å; T521-F547 HydrophobicContact CG2-CE2 3.8Å; T521-F547 HydrophobicContact CG2-CZ 4.2Å
522	R	92.8	Very high	89.4	Confident	61 Å²	61	45.1 Å²	45.1	23%	0.23	25%	0.254	C	S	.	.	H	α-helix	trans	-62.6	-46	174.5	-173.2	174.7	-65.6	110.4	-0	111.7	V518 S519 L524 F525 D526 F547 E548	V518-R522 WeakPolarHBondContact O-CB 3.4Å; V518-R522 PolarHBondContact O-N 2.9Å; S519-R522 PolarHBondContact O-N 3.05Å; R522-L524 VanDerWaalsContact C-N 3.29Å; R522-L524 PolarHBondContact O-N 3.22Å; R522-F525 PolarHBondContact O-N 3.22Å; R522-D526 PolarHBondContact O-N 2.94Å; R522-F547 HydrophobicContact CB-CE1 4.02Å; R522-F547 HydrophobicContact CB-CZ 4.17Å; R522-E548 IonicContact CZ-OE1 3.24Å; R522-E548 IonicContact CZ-OE2 3.9Å; R522-E548 IonicContact NE-OE1 2.8Å; R522-E548 PolarHBondContact NE-OE1 2.91Å; R522-E548 IonicContact NE-OE2 2.74Å; R522-E548 IonicContact NH2-OE1 2.93Å; R522-E548 IonicContact NH2-OE2 3.33Å; R522-E548 PolarHBondContact NH2-OE2 2.97Å
523	S	89.5	Confident	89.5	Confident	79 Å²	79	38.8 Å²	38.8	55%	0.552	22%	0.224	S	C	*	.	H	α-helix	trans	-58.3	-41.6	175.5	-177.7	0	0	0	0	112.2	S519 K520 D526 S527	S519-S523 PolarHBondContact O-N 3.44Å; K520-S523 PolarHBondContact O-N 3.43Å; S523-D526 PolarHBondContact O-N 3.38Å; S523-S527 WeakPolarHBondContact O-CB 2.79Å; S523-S527 PolarHBondContact O-N 3.36Å
524	L	88.8	Confident	89.4	Confident	15 Å²	15	37.1 Å²	37.1	8%	0.079	22%	0.217	C	C	.	.	H	α-helix	trans	-60.1	-50.6	173.4	175.2	76.1	0	0	0	111.6	W433 L464 K520 T521 R522 D526 S527 L528	W433-L524 HydrophobicContact CH2-CD1 4.35Å; W433-L524 HydrophobicContact CH2-CD2 3.31Å; W433-L524 HydrophobicContact CH2-CG 4.41Å; W433-L524 HydrophobicContact CZ2-CD2 3.98Å; W433-L524 HydrophobicContact CZ3-CD2 4.13Å; L464-L524 HydrophobicContact CD2-CD2 3.98Å; K520-L524 PolarHBondContact O-N 2.93Å; T521-L524 WeakPolarHBondContact O-CB 3.43Å; T521-L524 PolarHBondContact O-N 2.88Å; R522-L524 VanDerWaalsContact C-N 3.29Å; R522-L524 PolarHBondContact O-N 3.22Å; L524-D526 VanDerWaalsContact C-N 3.33Å; L524-D526 PolarHBondContact O-N 3.42Å; L524-S527 WeakPolarHBondContact O-CB 3.46Å; L524-S527 PolarHBondContact O-N 3.38Å; L524-S527 VanDerWaalsContact O-N 3.11Å; L524-L528 HydrophobicContact CD1-CD1 4.13Å; L524-L528 HydrophobicContact CD1-CG 4.25Å; L524-L528 HydrophobicContact CD2-CD1 4.4Å; L524-L528 HydrophobicContact CG-CD1 3.92Å; L524-L528 HydrophobicContact CG-CG 4.33Å; L524-L528 WeakPolarHBondContact O-CG 3.39Å; L524-L528 PolarHBondContact O-N 3.49Å
525	F	92.5	Very high	89.3	Confident	1 Å²	1	37.7 Å²	37.7	0%	0.004	22%	0.222	C	C	.	.	H	α-helix	trans	-63.6	-38.4	179.5	-73.7	-23.1	0	0	0	112.9	L464 L468 T521 R522 S527 L528 S529 F540 Y544 F547	L464-F525 HydrophobicContact CD1-CE1 4.34Å; L464-F525 HydrophobicContact CD2-CE1 4.18Å; L468-F525 HydrophobicContact CD1-CE2 4.28Å; L468-F525 HydrophobicContact CD1-CZ 3.89Å; L468-F525 HydrophobicContact CD2-CE2 3.87Å; L468-F525 HydrophobicContact CD2-CZ 3.8Å; L468-F525 HydrophobicContact CG-CZ 4.04Å; T521-F525 HydrophobicContact CG2-CD2 4.27Å; T521-F525 HydrophobicContact CG2-CE2 3.94Å; T521-F525 HydrophobicContact CG2-CZ 4.23Å; T521-F525 PolarHBondContact O-N 2.64Å; R522-F525 PolarHBondContact O-N 3.22Å; F525-S527 VanDerWaalsContact C-N 3.31Å; F525-S527 PolarHBondContact O-N 3.07Å; F525-L528 HydrophobicContact CD1-CD1 4.44Å; F525-L528 PolarHBondContact O-N 3.1Å; F525-S529 VanDerWaalsContact O-CB 3.32Å; F525-S529 WeakPolarHBondContact O-CB 3.5Å; F525-S529 PolarHBondContact O-N 3.41Å; F525-F540 HydrophobicContact CB-CE2 4.45Å; F525-F540 HydrophobicContact CB-CZ 4.48Å; F525-F540 HydrophobicContact CD1-CD2 4.44Å; F525-F540 AromaticContact CD1-CE2 3.67Å; F525-F540 HydrophobicContact CD1-CE2 3.67Å; F525-F540 HydrophobicContact CD1-CZ 4.49Å; F525-F540 HydrophobicContact CE1-CE2 4.24Å; F525-F540 HydrophobicContact CG-CE2 4.33Å; F525-F540 WeakPolarHBondContact O-CZ 3.37Å; F525-Y544 HydrophobicContact CB-CD1 3.76Å; F525-Y544 HydrophobicContact CB-CD2 3.96Å; F525-Y544 HydrophobicContact CB-CE1 3.61Å; F525-Y544 HydrophobicContact CB-CE2 3.84Å; F525-Y544 HydrophobicContact CB-CG 3.95Å; F525-Y544 HydrophobicContact CD2-CD1 4.5Å; F525-Y544 AromaticContact CD2-CD2 3.46Å; F525-Y544 HydrophobicContact CD2-CD2 3.46Å; F525-Y544 VanDerWaalsContact CD2-CD2 3.46Å; F525-Y544 AromaticContact CD2-CE2 3.9Å; F525-Y544 HydrophobicContact CD2-CE2 3.9Å; F525-Y544 AromaticContact CD2-CG 3.82Å; F525-Y544 HydrophobicContact CD2-CG 3.82Å; F525-Y544 HydrophobicContact CE2-CD2 4.25Å; F525-Y544 HydrophobicContact CG-CD1 4.31Å; F525-Y544 HydrophobicContact CG-CD2 4.05Å; F525-Y544 HydrophobicContact CG-CE2 4.35Å; F525-Y544 HydrophobicContact CG-CG 4.05Å; F525-F547 HydrophobicContact CD2-CB 4.34Å; F525-F547 AromaticContact CD2-CD1 3.76Å; F525-F547 HydrophobicContact CD2-CD1 3.76Å; F525-F547 HydrophobicContact CD2-CE1 4.29Å; F525-F547 HydrophobicContact CD2-CG 4.1Å; F525-F547 HydrophobicContact CE2-CB 3.61Å; F525-F547 AromaticContact CE2-CD1 3.83Å; F525-F547 HydrophobicContact CE2-CD1 3.83Å; F525-F547 HydrophobicContact CE2-CD2 4.33Å; F525-F547 AromaticContact CE2-CG 3.66Å; F525-F547 HydrophobicContact CE2-CG 3.66Å
526	D	90.4	Very high	89	Confident	61 Å²	61	37.7 Å²	37.7	33%	0.326	21%	0.214	S	C	.	.	H	α-helix	trans	-60.3	-42.5	171.7	-79.9	-39.9	0	0	0	111.5	R522 S523 L524 S529 Y544 R563	R522-D526 PolarHBondContact O-N 2.94Å; S523-D526 PolarHBondContact O-N 3.38Å; L524-D526 VanDerWaalsContact C-N 3.33Å; L524-D526 PolarHBondContact O-N 3.42Å; D526-S529 PolarHBondContact O-OG 3.46Å; D526-Y544 PolarHBondContact OD1-OH 2.72Å; D526-R563 IonicContact OD1-CZ 2.76Å; D526-R563 VanDerWaalsContact OD1-CZ 3.28Å; D526-R563 IonicContact OD1-NH1 3.18Å; D526-R563 PolarHBondContact OD1-NH1 3.37Å; D526-R563 IonicContact OD1-NH2 2.87Å; D526-R563 PolarHBondContact OD1-NH2 2.98Å
527	S	87.1	Confident	88.9	Confident	40 Å²	40	35.3 Å²	35.3	28%	0.28	20%	0.198	S	C	.	.	H	α-helix	trans	-62.8	-48.4	174.8	-168.6	0	0	0	0	112.6	S523 L524 F525 S529 T530	S523-S527 WeakPolarHBondContact O-CB 2.79Å; S523-S527 PolarHBondContact O-N 3.36Å; L524-S527 WeakPolarHBondContact O-CB 3.46Å; L524-S527 PolarHBondContact O-N 3.38Å; L524-S527 VanDerWaalsContact O-N 3.11Å; F525-S527 VanDerWaalsContact C-N 3.31Å; F525-S527 PolarHBondContact O-N 3.07Å; S527-S529 VanDerWaalsContact C-N 3.33Å; S527-S529 PolarHBondContact O-N 3.28Å; S527-T530 PolarHBondContact O-N 3.33Å; S527-T530 PolarHBondContact O-OG1 3.25Å
528	L	88.4	Confident	88.9	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-66.3	-33.7	-178.8	-67.1	177	0	0	0	112.5	F450 R451 L464 L524 F525 T530 S531 W533 G534 F540	F450-L528 HydrophobicContact CD1-CD1 3.83Å; F450-L528 HydrophobicContact CD1-CD2 3.94Å; F450-L528 HydrophobicContact CE1-CD1 4.02Å; R451-L528 HydrophobicContact CB-CD2 4.21Å; R451-L528 HydrophobicContact CG-CD2 4.46Å; L464-L528 HydrophobicContact CD1-CD1 4.08Å; L464-L528 HydrophobicContact CD2-CD1 4.09Å; L524-L528 HydrophobicContact CD1-CD1 4.13Å; L524-L528 HydrophobicContact CD1-CG 4.25Å; L524-L528 HydrophobicContact CD2-CD1 4.4Å; L524-L528 HydrophobicContact CG-CD1 3.92Å; L524-L528 HydrophobicContact CG-CG 4.33Å; L524-L528 WeakPolarHBondContact O-CG 3.39Å; L524-L528 PolarHBondContact O-N 3.49Å; F525-L528 HydrophobicContact CD1-CD1 4.44Å; F525-L528 PolarHBondContact O-N 3.1Å; L528-T530 PolarHBondContact O-N 3.17Å; L528-T530 VanDerWaalsContact O-N 3.1Å; L528-S531 WeakPolarHBondContact O-CB 3.37Å; L528-S531 PolarHBondContact O-N 3.04Å; L528-S531 PolarHBondContact O-OG 2.81Å; L528-W533 HydrophobicContact CB-CB 4.19Å; L528-W533 HydrophobicContact CB-CG 4.42Å; L528-W533 HydrophobicContact CD2-CG 4.18Å; L528-G534 PolarHBondContact O-N 2.91Å; L528-F540 HydrophobicContact CB-CD2 4.4Å; L528-F540 HydrophobicContact CB-CE2 3.6Å; L528-F540 HydrophobicContact CB-CZ 3.84Å; L528-F540 HydrophobicContact CD1-CE2 4.08Å
529	S	88.8	Confident	88.8	Confident	7 Å²	7	37.3 Å²	37.3	5%	0.049	21%	0.206	C	C	.	.	H	α-helix	trans	-60.6	-22.6	177.3	75.7	0	0	0	0	113.9	F525 D526 S527 S531 R563	F525-S529 VanDerWaalsContact O-CB 3.32Å; F525-S529 WeakPolarHBondContact O-CB 3.5Å; F525-S529 PolarHBondContact O-N 3.41Å; D526-S529 PolarHBondContact O-OG 3.46Å; S527-S529 VanDerWaalsContact C-N 3.33Å; S527-S529 PolarHBondContact O-N 3.28Å; S529-S531 VanDerWaalsContact C-N 3.35Å; S529-R563 PolarHBondContact OG-NH2 3.49Å
530	T	85.7	Confident	88.9	Confident	93 Å²	93	34.1 Å²	34.1	57%	0.571	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.2	15.6	177.4	68.6	0	0	0	0	112.6	R451 S527 L528	R451-T530 PolarHBondContact NH2-O 2.96Å; R451-T530 PolarHBondContact NH2-OG1 3.48Å; R451-T530 VanDerWaalsContact NH2-OG1 3.13Å; S527-T530 PolarHBondContact O-N 3.33Å; S527-T530 PolarHBondContact O-OG1 3.25Å; L528-T530 PolarHBondContact O-N 3.17Å; L528-T530 VanDerWaalsContact O-N 3.1Å
531	S	84.5	Confident	89.1	Confident	18 Å²	18	30.7 Å²	30.7	13%	0.126	17%	0.169	C	C	.	.	S	Bend	trans	-122	-173.6	-179.2	78.7	0	0	0	0	111.2	L528 S529 W533 G534	L528-S531 WeakPolarHBondContact O-CB 3.37Å; L528-S531 PolarHBondContact O-N 3.04Å; L528-S531 PolarHBondContact O-OG 2.81Å; S529-S531 VanDerWaalsContact C-N 3.35Å; S531-W533 PolarHBondContact O-N 3.37Å; S531-W533 VanDerWaalsContact O-N 3.13Å; S531-W533 PolarHBondContact OG-N 3.4Å; S531-G534 PolarHBondContact O-N 3.04Å
532	Q	84.6	Confident	89.2	Confident	107 Å²	107	31.3 Å²	31.3	50%	0.5	17%	0.172	S	C	.	.	H	α-helix	trans	-55	-29	174.8	-68.8	-177	-19.8	0	0	112.9	P455 G534 S535 H536	P455-Q532 HydrophobicContact CG-CB 4.15Å; Q532-G534 VanDerWaalsContact C-N 3.35Å; Q532-G534 PolarHBondContact O-N 3.28Å; Q532-S535 PolarHBondContact O-N 3.35Å; Q532-S535 PolarHBondContact O-OG 3.04Å; Q532-H536 WeakPolarHBondContact O-CB 3.36Å; Q532-H536 PolarHBondContact O-N 3.26Å; Q532-H536 PolarHBondContact O-ND1 2.94Å
533	W	88	Confident	89.2	Confident	0 Å²	0	29 Å²	29	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-57.7	-44.9	174.2	-70.5	77.1	0	0	0	112.5	F450 I453 P455 A460 V461 L464 L528 S531 S535 C537 F540	F450-W533 HydrophobicContact CD1-CZ2 4.12Å; F450-W533 AromaticContact CE1-CE2 3.99Å; F450-W533 AromaticContact CE1-CH2 3.55Å; F450-W533 HydrophobicContact CE1-CH2 3.55Å; F450-W533 AromaticContact CE1-CZ2 3.38Å; F450-W533 HydrophobicContact CE1-CZ2 3.38Å; F450-W533 HydrophobicContact CE1-CZ3 4.28Å; F450-W533 HydrophobicContact CE2-CZ2 4.41Å; F450-W533 AromaticContact CZ-CH2 3.56Å; F450-W533 HydrophobicContact CZ-CH2 3.56Å; F450-W533 AromaticContact CZ-CZ2 3.59Å; F450-W533 HydrophobicContact CZ-CZ2 3.59Å; F450-W533 PolarHBondContact O-NE1 3.33Å; I453-W533 PolarHBondContact O-NE1 2.94Å; P455-W533 HydrophobicContact CB-CD2 3.88Å; P455-W533 HydrophobicContact CB-CE3 4.08Å; P455-W533 HydrophobicContact CB-CG 4.11Å; A460-W533 HydrophobicContact CB-CH2 3.66Å; A460-W533 HydrophobicContact CB-CZ2 3.91Å; V461-W533 HydrophobicContact CG2-CZ3 4.1Å; L464-W533 HydrophobicContact CD1-CE3 3.86Å; L464-W533 HydrophobicContact CD1-CH2 3.94Å; L464-W533 HydrophobicContact CD1-CZ3 3.4Å; L464-W533 HydrophobicContact CG-CH2 4.42Å; L464-W533 HydrophobicContact CG-CZ3 4.3Å; L528-W533 HydrophobicContact CB-CB 4.19Å; L528-W533 HydrophobicContact CB-CG 4.42Å; L528-W533 HydrophobicContact CD2-CG 4.18Å; S531-W533 PolarHBondContact O-N 3.37Å; S531-W533 VanDerWaalsContact O-N 3.13Å; S531-W533 PolarHBondContact OG-N 3.4Å; W533-S535 VanDerWaalsContact C-N 3.32Å; W533-S535 PolarHBondContact O-N 3.49Å; W533-C537 WeakPolarHBondContact O-CB 3.39Å; W533-C537 PolarHBondContact O-N 3.39Å; W533-C537 VanDerWaalsContact O-N 3.14Å; W533-F540 HydrophobicContact CB-CD2 4.5Å; W533-F540 HydrophobicContact CB-CG 4.32Å; W533-F540 HydrophobicContact CE3-CB 4.12Å; W533-F540 HydrophobicContact CE3-CD2 4.23Å; W533-F540 HydrophobicContact CE3-CG 4.4Å
534	G	88.5	Confident	89.4	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-67.9	-30.6	179.5	0	0	0	0	0	113.6	L528 S531 Q532 W541 T567	L528-G534 PolarHBondContact O-N 2.91Å; S531-G534 PolarHBondContact O-N 3.04Å; Q532-G534 VanDerWaalsContact C-N 3.35Å; Q532-G534 PolarHBondContact O-N 3.28Å; G534-W541 PolarHBondContact O-NE1 3Å; G534-T567 PolarHBondContact O-OG1 3.38Å
535	S	87.1	Confident	89.6	Confident	28 Å²	28	25.2 Å²	25.2	20%	0.196	14%	0.137	C	C	.	.	H	α-helix	trans	-93.2	-29.7	-176.9	46.7	0	0	0	0	115.1	Q532 W533 T567 L569	Q532-S535 PolarHBondContact O-N 3.35Å; Q532-S535 PolarHBondContact O-OG 3.04Å; W533-S535 VanDerWaalsContact C-N 3.32Å; W533-S535 PolarHBondContact O-N 3.49Å; S535-T567 WeakPolarHBondContact CA-O 3.45Å; S535-L569 PolarHBondContact O-N 2.98Å
536	H	86.5	Confident	89.6	Confident	74 Å²	74	31 Å²	31	34%	0.343	16%	0.16	S	C	.	.	H	α-helix	trans	-115.7	-10.6	-171.4	-58	76.7	0	0	0	114.7	P455 Q532 P538 H572	P455-H536 HydrophobicContact CG-CB 4.17Å; Q532-H536 WeakPolarHBondContact O-CB 3.36Å; Q532-H536 PolarHBondContact O-N 3.26Å; Q532-H536 PolarHBondContact O-ND1 2.94Å; H536-P538 VanDerWaalsContact O-CD 3.29Å; H536-P538 WeakPolarHBondContact O-CD 3.27Å; H536-H572 AromaticContact CD2-NE2 3.95Å
537	C	88.8	Confident	89.8	Confident	3 Å²	3	28.2 Å²	28.2	2%	0.02	14%	0.144	C	C	.	.			trans	-117.4	95.2	-174	-162.8	0	0	0	0	112.2	P455 W533 E539 F540	P455-C537 HydrophobicContact CB-CB 3.75Å; W533-C537 WeakPolarHBondContact O-CB 3.39Å; W533-C537 PolarHBondContact O-N 3.39Å; W533-C537 VanDerWaalsContact O-N 3.14Å; C537-E539 VanDerWaalsContact C-N 3.26Å; C537-E539 PolarHBondContact O-N 3.11Å; C537-F540 HydrophobicContact CB-CB 3.82Å; C537-F540 WeakPolarHBondContact O-CB 3.27Å; C537-F540 PolarHBondContact O-N 3.02Å; C537-F540 PolarHBondContact SG-N 2.8Å
538	P	90.4	Very high	90.2	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.006	13%	0.131	C	C	.	.	H	α-helix	trans	-54.9	-39.8	169.1	-34.5	43.8	0	0	0	113.9	H536 F540 W541 L542 L568 H572 K575 F576 M579	H536-P538 VanDerWaalsContact O-CD 3.29Å; H536-P538 WeakPolarHBondContact O-CD 3.27Å; P538-F540 VanDerWaalsContact C-N 3.29Å; P538-F540 PolarHBondContact O-N 3.17Å; P538-W541 PolarHBondContact O-N 2.95Å; P538-W541 VanDerWaalsContact O-N 3.14Å; P538-L542 PolarHBondContact O-N 3.49Å; P538-L568 HydrophobicContact CG-CD2 4.29Å; P538-H572 HydrophobicContact CG-CB 3.71Å; P538-H572 WeakPolarHBondContact CG-O 3.21Å; P538-K575 HydrophobicContact CG-CB 4.26Å; P538-K575 HydrophobicContact CG-CD 4.32Å; P538-F576 HydrophobicContact CB-CB 3.88Å; P538-F576 HydrophobicContact CG-CB 4.42Å; P538-M579 HydrophobicContact CB-CE 3.24Å; P538-M579 HydrophobicContact CG-CE 4.42Å
539	E	90.2	Very high	90.2	Very high	56 Å²	56	32.7 Å²	32.7	26%	0.262	16%	0.159	S	C	.	.	H	α-helix	trans	-62.7	-36.2	-178.1	-64.7	78.8	-179	0	0	111.5	V461 C537 W541 L542 L543 K575 M579	V461-E539 HydrophobicContact CG1-CB 4.05Å; C537-E539 VanDerWaalsContact C-N 3.26Å; C537-E539 PolarHBondContact O-N 3.11Å; E539-W541 VanDerWaalsContact C-N 3.34Å; E539-W541 PolarHBondContact O-N 3.19Å; E539-L542 PolarHBondContact O-N 3.22Å; E539-L543 WeakPolarHBondContact O-CG 3.42Å; E539-L543 PolarHBondContact O-N 2.85Å; E539-K575 WeakPolarHBondContact OE1-CE 3.36Å; E539-K575 IonicContact OE1-NZ 2.73Å; E539-K575 PolarHBondContact OE1-NZ 2.92Å; E539-M579 HydrophobicContact CG-CE 4.12Å; E539-M579 HydrophobicContact CG-SD 4.31Å
540	F	93.1	Very high	90.2	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-58	-44.2	173.7	162.2	-100.6	0	0	0	112.3	L464 F525 L528 W533 C537 P538 L542 L543 Y544	L464-F540 HydrophobicContact CD1-CD2 4.14Å; F525-F540 HydrophobicContact CB-CE2 4.45Å; F525-F540 HydrophobicContact CB-CZ 4.48Å; F525-F540 HydrophobicContact CD1-CD2 4.44Å; F525-F540 AromaticContact CD1-CE2 3.67Å; F525-F540 HydrophobicContact CD1-CE2 3.67Å; F525-F540 HydrophobicContact CD1-CZ 4.49Å; F525-F540 HydrophobicContact CE1-CE2 4.24Å; F525-F540 HydrophobicContact CG-CE2 4.33Å; F525-F540 WeakPolarHBondContact O-CZ 3.37Å; L528-F540 HydrophobicContact CB-CD2 4.4Å; L528-F540 HydrophobicContact CB-CE2 3.6Å; L528-F540 HydrophobicContact CB-CZ 3.84Å; L528-F540 HydrophobicContact CD1-CE2 4.08Å; W533-F540 HydrophobicContact CB-CD2 4.5Å; W533-F540 HydrophobicContact CB-CG 4.32Å; W533-F540 HydrophobicContact CE3-CB 4.12Å; W533-F540 HydrophobicContact CE3-CD2 4.23Å; W533-F540 HydrophobicContact CE3-CG 4.4Å; C537-F540 HydrophobicContact CB-CB 3.82Å; C537-F540 WeakPolarHBondContact O-CB 3.27Å; C537-F540 PolarHBondContact O-N 3.02Å; C537-F540 PolarHBondContact SG-N 2.8Å; P538-F540 VanDerWaalsContact C-N 3.29Å; P538-F540 PolarHBondContact O-N 3.17Å; F540-L542 VanDerWaalsContact C-N 3.34Å; F540-L542 PolarHBondContact O-N 3.35Å; F540-L543 PolarHBondContact O-N 3.37Å; F540-Y544 HydrophobicContact CE1-CD1 4.45Å; F540-Y544 HydrophobicContact CZ-CD1 4.08Å; F540-Y544 WeakPolarHBondContact O-CB 3.37Å; F540-Y544 PolarHBondContact O-N 3.43Å
541	W	94.3	Very high	90.3	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-68.6	-34.2	179.9	-71.9	106.3	0	0	0	112.4	G534 P538 E539 Y544 L545 V560 R563 A564 T567 L568 F576	G534-W541 PolarHBondContact O-NE1 3Å; P538-W541 PolarHBondContact O-N 2.95Å; P538-W541 VanDerWaalsContact O-N 3.14Å; E539-W541 VanDerWaalsContact C-N 3.34Å; E539-W541 PolarHBondContact O-N 3.19Å; W541-Y544 HydrophobicContact CE3-CD1 4.2Å; W541-Y544 HydrophobicContact CZ3-CD1 4.04Å; W541-Y544 HydrophobicContact CZ3-CE1 4.43Å; W541-Y544 PolarHBondContact O-N 2.89Å; W541-L545 WeakPolarHBondContact O-CB 3.47Å; W541-L545 VanDerWaalsContact O-CG 3.32Å; W541-L545 WeakPolarHBondContact O-CG 3.36Å; W541-L545 PolarHBondContact O-N 3.49Å; W541-V560 HydrophobicContact CE3-CG1 3.86Å; W541-V560 HydrophobicContact CZ3-CG1 4.05Å; W541-R563 HydrophobicContact CH2-CB 3.59Å; W541-R563 HydrophobicContact CZ3-CB 3.73Å; W541-A564 HydrophobicContact CB-CB 3.89Å; W541-A564 HydrophobicContact CD2-CB 3.42Å; W541-A564 VanDerWaalsContact CD2-CB 3.42Å; W541-A564 HydrophobicContact CE3-CB 3.69Å; W541-A564 HydrophobicContact CG-CB 3.51Å; W541-A564 HydrophobicContact CZ3-CB 4.4Å; W541-T567 HydrophobicContact CZ2-CG2 4.42Å; W541-T567 WeakPolarHBondContact CZ2-OG1 3.48Å; W541-L568 HydrophobicContact CG-CD1 4.4Å; W541-F576 HydrophobicContact CB-CD2 4Å; W541-F576 HydrophobicContact CB-CE2 3.6Å; W541-F576 HydrophobicContact CB-CZ 4.36Å
542	L	92.5	Very high	90.5	Very high	13 Å²	13	33.2 Å²	33.2	7%	0.068	17%	0.165	C	C	.	.	H	α-helix	trans	-66.1	-44.5	172.2	-64.8	173.1	0	0	0	111.5	P538 E539 F540 Y544 L545 R546 F576 M579 L580	P538-L542 PolarHBondContact O-N 3.49Å; E539-L542 PolarHBondContact O-N 3.22Å; F540-L542 VanDerWaalsContact C-N 3.34Å; F540-L542 PolarHBondContact O-N 3.35Å; L542-Y544 VanDerWaalsContact C-N 3.27Å; L542-Y544 PolarHBondContact O-N 3.22Å; L542-L545 PolarHBondContact O-N 2.91Å; L542-R546 VanDerWaalsContact O-CB 3.29Å; L542-R546 WeakPolarHBondContact O-CB 3.39Å; L542-R546 PolarHBondContact O-N 3.34Å; L542-F576 HydrophobicContact CD2-CD2 4.12Å; L542-F576 HydrophobicContact CD2-CE2 3.75Å; L542-F576 HydrophobicContact CG-CD2 4.15Å; L542-F576 HydrophobicContact CG-CE2 4.07Å; L542-M579 HydrophobicContact CD1-CB 3.5Å; L542-M579 VanDerWaalsContact CD1-CB 3.5Å; L542-M579 HydrophobicContact CD1-CE 3.68Å; L542-M579 HydrophobicContact CD1-CG 4.34Å; L542-M579 HydrophobicContact CD1-SD 3.98Å; L542-L580 HydrophobicContact CD2-CB 4.21Å; L542-L580 HydrophobicContact CD2-CD1 3.85Å
543	L	92.8	Very high	90.5	Very high	14 Å²	14	31.4 Å²	31.4	7%	0.073	16%	0.158	C	C	.	.	H	α-helix	trans	-59	-40.8	173.8	-70	175.7	0	0	0	111.3	V461 L464 Q465 L468 E539 F540 R546 F547	V461-L543 HydrophobicContact CG1-CD1 3.95Å; L464-L543 HydrophobicContact CB-CD1 3.99Å; Q465-L543 HydrophobicContact CB-CD1 4.43Å; Q465-L543 HydrophobicContact CB-CD2 4.05Å; Q465-L543 HydrophobicContact CG-CD2 4.11Å; L468-L543 HydrophobicContact CD1-CB 3.79Å; L468-L543 HydrophobicContact CD1-CD2 4.02Å; L468-L543 HydrophobicContact CD1-CG 4.45Å; L468-L543 WeakPolarHBondContact CD1-O 3.4Å; E539-L543 WeakPolarHBondContact O-CG 3.42Å; E539-L543 PolarHBondContact O-N 2.85Å; F540-L543 PolarHBondContact O-N 3.37Å; L543-R546 PolarHBondContact O-N 2.95Å; L543-F547 WeakPolarHBondContact O-CB 3.41Å; L543-F547 PolarHBondContact O-N 2.69Å
544	Y	94.9	Very high	90.5	Very high	4 Å²	4	36.5 Å²	36.5	2%	0.016	19%	0.185	C	C	.	.	H	α-helix	trans	-66	-46.1	176.7	-162.5	171.7	0	0	0	111.6	F525 D526 F540 W541 L542 R546 F547 E548 V560 R563	F525-Y544 HydrophobicContact CB-CD1 3.76Å; F525-Y544 HydrophobicContact CB-CD2 3.96Å; F525-Y544 HydrophobicContact CB-CE1 3.61Å; F525-Y544 HydrophobicContact CB-CE2 3.84Å; F525-Y544 HydrophobicContact CB-CG 3.95Å; F525-Y544 HydrophobicContact CD2-CD1 4.5Å; F525-Y544 AromaticContact CD2-CD2 3.46Å; F525-Y544 HydrophobicContact CD2-CD2 3.46Å; F525-Y544 VanDerWaalsContact CD2-CD2 3.46Å; F525-Y544 AromaticContact CD2-CE2 3.9Å; F525-Y544 HydrophobicContact CD2-CE2 3.9Å; F525-Y544 AromaticContact CD2-CG 3.82Å; F525-Y544 HydrophobicContact CD2-CG 3.82Å; F525-Y544 HydrophobicContact CE2-CD2 4.25Å; F525-Y544 HydrophobicContact CG-CD1 4.31Å; F525-Y544 HydrophobicContact CG-CD2 4.05Å; F525-Y544 HydrophobicContact CG-CE2 4.35Å; F525-Y544 HydrophobicContact CG-CG 4.05Å; D526-Y544 PolarHBondContact OD1-OH 2.72Å; F540-Y544 HydrophobicContact CE1-CD1 4.45Å; F540-Y544 HydrophobicContact CZ-CD1 4.08Å; F540-Y544 WeakPolarHBondContact O-CB 3.37Å; F540-Y544 PolarHBondContact O-N 3.43Å; W541-Y544 HydrophobicContact CE3-CD1 4.2Å; W541-Y544 HydrophobicContact CZ3-CD1 4.04Å; W541-Y544 HydrophobicContact CZ3-CE1 4.43Å; W541-Y544 PolarHBondContact O-N 2.89Å; L542-Y544 VanDerWaalsContact C-N 3.27Å; L542-Y544 PolarHBondContact O-N 3.22Å; Y544-R546 VanDerWaalsContact C-N 3.33Å; Y544-R546 PolarHBondContact O-N 3.48Å; Y544-F547 HydrophobicContact CD2-CD1 4.08Å; Y544-F547 HydrophobicContact CE2-CD1 4.21Å; Y544-F547 WeakPolarHBondContact O-CB 3.46Å; Y544-F547 PolarHBondContact O-N 3.49Å; Y544-E548 HydrophobicContact CD2-CG 4.06Å; Y544-E548 HydrophobicContact CE2-CG 3.89Å; Y544-E548 PolarHBondContact O-N 2.88Å; Y544-V560 HydrophobicContact CD1-CG1 3.91Å; Y544-V560 HydrophobicContact CD2-CG1 4.29Å; Y544-V560 HydrophobicContact CD2-CG2 4.26Å; Y544-V560 HydrophobicContact CE1-CG1 4.41Å; Y544-V560 HydrophobicContact CE1-CG2 4.32Å; Y544-V560 HydrophobicContact CE2-CG2 4.01Å; Y544-V560 HydrophobicContact CG-CG1 3.84Å; Y544-R563 PolarHBondContact OH-NH1 2.89Å
545	L	93.5	Very high	90.4	Very high	9 Å²	9	41.5 Å²	41.5	5%	0.047	22%	0.215	C	C	.	.	H	α-helix	trans	-59.9	-43.9	175	-74.4	171.4	0	0	0	111.9	W541 L542 F547 E548 K549 M557 V560 Q561 F576 L580	W541-L545 WeakPolarHBondContact O-CB 3.47Å; W541-L545 VanDerWaalsContact O-CG 3.32Å; W541-L545 WeakPolarHBondContact O-CG 3.36Å; W541-L545 PolarHBondContact O-N 3.49Å; L542-L545 PolarHBondContact O-N 2.91Å; L545-F547 PolarHBondContact O-N 3.39Å; L545-E548 PolarHBondContact O-N 3.47Å; L545-K549 WeakPolarHBondContact O-CB 3.38Å; L545-K549 PolarHBondContact O-N 2.91Å; L545-M557 HydrophobicContact CD2-CB 4.29Å; L545-M557 HydrophobicContact CD2-CE 4.41Å; L545-V560 HydrophobicContact CD2-CB 3.86Å; L545-V560 HydrophobicContact CD2-CG1 3.71Å; L545-V560 HydrophobicContact CG-CG1 3.94Å; L545-Q561 HydrophobicContact CD2-CB 4.3Å; L545-F576 HydrophobicContact CD1-CE2 4.17Å; L545-F576 HydrophobicContact CD1-CZ 3.88Å; L545-L580 HydrophobicContact CD1-CD1 3.91Å
546	R	91.8	Very high	90.4	Very high	124 Å²	124	44.1 Å²	44.1	47%	0.468	22%	0.224	S	C	.	.	H	α-helix	trans	-61.4	-43.8	176.6	-173.4	172.4	179.7	165.8	0.4	111.4	L542 L543 Y544 K549 T550	L542-R546 VanDerWaalsContact O-CB 3.29Å; L542-R546 WeakPolarHBondContact O-CB 3.39Å; L542-R546 PolarHBondContact O-N 3.34Å; L543-R546 PolarHBondContact O-N 2.95Å; Y544-R546 VanDerWaalsContact C-N 3.33Å; Y544-R546 PolarHBondContact O-N 3.48Å; R546-K549 WeakPolarHBondContact O-CB 3.31Å; R546-K549 PolarHBondContact O-N 3.49Å; R546-T550 HydrophobicContact CG-CG2 4.19Å; R546-T550 WeakPolarHBondContact O-CG2 3.39Å; R546-T550 PolarHBondContact O-N 3.05Å; R546-T550 PolarHBondContact O-OG1 3Å
547	F	94.8	Very high	90.5	Very high	1 Å²	1	42.9 Å²	42.9	0%	0.004	22%	0.219	C	C	.	.	H	α-helix	trans	-57.9	-50.7	175.6	163.3	-104	0	0	0	112.8	L468 V518 T521 R522 F525 L543 Y544 L545 K549 T550 I551 G552	L468-F547 HydrophobicContact CD1-CB 4.06Å; L468-F547 HydrophobicContact CD2-CB 3.73Å; L468-F547 HydrophobicContact CD2-CD2 3.64Å; L468-F547 HydrophobicContact CD2-CG 4Å; V518-F547 HydrophobicContact CG1-CE2 4.28Å; V518-F547 HydrophobicContact CG1-CZ 3.9Å; T521-F547 HydrophobicContact CG2-CD2 4.04Å; T521-F547 HydrophobicContact CG2-CE2 3.8Å; T521-F547 HydrophobicContact CG2-CZ 4.2Å; R522-F547 HydrophobicContact CB-CE1 4.02Å; R522-F547 HydrophobicContact CB-CZ 4.17Å; F525-F547 HydrophobicContact CD2-CB 4.34Å; F525-F547 AromaticContact CD2-CD1 3.76Å; F525-F547 HydrophobicContact CD2-CD1 3.76Å; F525-F547 HydrophobicContact CD2-CE1 4.29Å; F525-F547 HydrophobicContact CD2-CG 4.1Å; F525-F547 HydrophobicContact CE2-CB 3.61Å; F525-F547 AromaticContact CE2-CD1 3.83Å; F525-F547 HydrophobicContact CE2-CD1 3.83Å; F525-F547 HydrophobicContact CE2-CD2 4.33Å; F525-F547 AromaticContact CE2-CG 3.66Å; F525-F547 HydrophobicContact CE2-CG 3.66Å; L543-F547 WeakPolarHBondContact O-CB 3.41Å; L543-F547 PolarHBondContact O-N 2.69Å; Y544-F547 HydrophobicContact CD2-CD1 4.08Å; Y544-F547 HydrophobicContact CE2-CD1 4.21Å; Y544-F547 WeakPolarHBondContact O-CB 3.46Å; Y544-F547 PolarHBondContact O-N 3.49Å; L545-F547 PolarHBondContact O-N 3.39Å; F547-K549 PolarHBondContact O-N 3.16Å; F547-T550 PolarHBondContact O-N 3.41Å; F547-I551 PolarHBondContact O-N 2.87Å; F547-G552 PolarHBondContact O-N 3.3Å
548	E	94.1	Very high	90.6	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-67	-28.7	178.6	-65.8	-63.6	179.1	0	0	111.9	R522 Y544 L545 G552 D553 I554 Q556 M557 V560	R522-E548 IonicContact CZ-OE1 3.24Å; R522-E548 IonicContact CZ-OE2 3.9Å; R522-E548 IonicContact NE-OE1 2.8Å; R522-E548 PolarHBondContact NE-OE1 2.91Å; R522-E548 IonicContact NE-OE2 2.74Å; R522-E548 IonicContact NH2-OE1 2.93Å; R522-E548 IonicContact NH2-OE2 3.33Å; R522-E548 PolarHBondContact NH2-OE2 2.97Å; Y544-E548 HydrophobicContact CD2-CG 4.06Å; Y544-E548 HydrophobicContact CE2-CG 3.89Å; Y544-E548 PolarHBondContact O-N 2.88Å; L545-E548 PolarHBondContact O-N 3.47Å; E548-G552 CarbonylContact O-C 3.59Å; E548-G552 VanDerWaalsContact O-C 3.31Å; E548-G552 WeakPolarHBondContact OE2-CA 3.44Å; E548-D553 CarbonylContact O-C 3.31Å; E548-D553 PolarHBondContact O-N 3.22Å; E548-D553 PolarHBondContact OE2-N 3.49Å; E548-I554 PolarHBondContact O-N 3.24Å; E548-Q556 HydrophobicContact CG-CB 4.25Å; E548-M557 HydrophobicContact CB-CG 4.18Å; E548-V560 HydrophobicContact CG-CG2 4.35Å
549	K	90.4	Very high	90.6	Very high	134 Å²	134	49 Å²	49	58%	0.583	26%	0.263	S	S	*	.	H	α-helix	trans	-71.1	-43.6	174.5	-173.3	179.3	177.8	-177.9	0	113.1	L545 R546 F547 M557	L545-K549 WeakPolarHBondContact O-CB 3.38Å; L545-K549 PolarHBondContact O-N 2.91Å; R546-K549 WeakPolarHBondContact O-CB 3.31Å; R546-K549 PolarHBondContact O-N 3.49Å; F547-K549 PolarHBondContact O-N 3.16Å; K549-M557 HydrophobicContact CB-CE 4.11Å; K549-M557 HydrophobicContact CB-SD 3.82Å; K549-M557 HydrophobicContact CD-CE 4.38Å; K549-M557 HydrophobicContact CG-CE 4.46Å; K549-M557 HydrophobicContact CG-SD 4.2Å
550	T	88	Confident	90.7	Very high	77 Å²	77	46.4 Å²	46.4	47%	0.472	25%	0.251	S	S	.	.	H	α-helix	trans	-91.3	-41.1	-169.3	56.5	0	0	0	0	114.1	R546 F547	R546-T550 HydrophobicContact CG-CG2 4.19Å; R546-T550 WeakPolarHBondContact O-CG2 3.39Å; R546-T550 PolarHBondContact O-N 3.05Å; R546-T550 PolarHBondContact O-OG1 3Å; F547-T550 PolarHBondContact O-N 3.41Å
551	I	88.4	Confident	90.6	Very high	27 Å²	27	50.6 Å²	50.6	14%	0.138	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.1	-30.5	-170.9	-50.3	144.4	0	0	0	111	L471 L514 V518 F547	L471-I551 HydrophobicContact CB-CD1 3.61Å; L514-I551 HydrophobicContact CD1-CG2 4.14Å; L514-I551 HydrophobicContact CD2-CG2 4.36Å; L514-I551 HydrophobicContact CG-CG2 4.44Å; V518-I551 HydrophobicContact CG2-CB 4.49Å; V518-I551 HydrophobicContact CG2-CG2 3.38Å; F547-I551 PolarHBondContact O-N 2.87Å
552	G	88.3	Confident	90.4	Very high	25 Å²	25	57.7 Å²	57.7	26%	0.258	30%	0.297	S	S	.	.	S	Bend	trans	-82.9	-146	-178.6	0	0	0	0	0	114	F547 E548	F547-G552 PolarHBondContact O-N 3.3Å; E548-G552 CarbonylContact O-C 3.59Å; E548-G552 VanDerWaalsContact O-C 3.31Å; E548-G552 WeakPolarHBondContact OE2-CA 3.44Å
553	D	85.2	Confident	90.5	Very high	68 Å²	68	60.1 Å²	60.1	36%	0.364	31%	0.305	S	S	.	.			trans	-109.3	107.9	-177.7	-178.1	-2.9	0	0	0	109.9	E548 T555 Q556	E548-D553 CarbonylContact O-C 3.31Å; E548-D553 PolarHBondContact O-N 3.22Å; E548-D553 PolarHBondContact OE2-N 3.49Å; D553-T555 PolarHBondContact O-N 3.44Å; D553-T555 VanDerWaalsContact OD1-CB 3.32Å; D553-T555 WeakPolarHBondContact OD1-CB 3.4Å; D553-T555 WeakPolarHBondContact OD1-CG2 3.46Å; D553-T555 PolarHBondContact OD1-N 3.02Å; D553-T555 PolarHBondContact OD1-OG1 3.47Å; D553-T555 PolarHBondContact OD2-OG1 3.45Å; D553-Q556 HydrophobicContact CB-CG 4.08Å; D553-Q556 WeakPolarHBondContact O-CB 3.33Å; D553-Q556 PolarHBondContact O-N 2.96Å
554	I	86.6	Confident	90.4	Very high	108 Å²	108	59.5 Å²	59.5	55%	0.554	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-54.4	-27.9	179.6	-57.9	171.9	0	0	0	111.2	E548 Q556 M557	E548-I554 PolarHBondContact O-N 3.24Å; I554-Q556 PolarHBondContact O-N 3.22Å; I554-M557 HydrophobicContact CG2-SD 3.91Å; I554-M557 WeakPolarHBondContact O-CB 3.39Å; I554-M557 WeakPolarHBondContact O-CG 3.21Å; I554-M557 PolarHBondContact O-N 2.87Å; I554-M557 VanDerWaalsContact O-N 3.14Å
555	T	86.7	Confident	90.2	Very high	104 Å²	104	64.2 Å²	64.2	64%	0.638	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-67.9	-17.9	178.7	72	0	0	0	0	113.6	D553 P558	D553-T555 PolarHBondContact O-N 3.44Å; D553-T555 VanDerWaalsContact OD1-CB 3.32Å; D553-T555 WeakPolarHBondContact OD1-CB 3.4Å; D553-T555 WeakPolarHBondContact OD1-CG2 3.46Å; D553-T555 PolarHBondContact OD1-N 3.02Å; D553-T555 PolarHBondContact OD1-OG1 3.47Å; D553-T555 PolarHBondContact OD2-OG1 3.45Å; T555-P558 WeakPolarHBondContact O-CD 3.34Å
556	Q	87.2	Confident	90	Very high	84 Å²	84	70.1 Å²	70.1	39%	0.393	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-81.3	-15.6	175.3	-61.3	-59.6	-32.2	0	0	113.1	E548 D553 I554 A559 V560	E548-Q556 HydrophobicContact CG-CB 4.25Å; D553-Q556 HydrophobicContact CB-CG 4.08Å; D553-Q556 WeakPolarHBondContact O-CB 3.33Å; D553-Q556 PolarHBondContact O-N 2.96Å; I554-Q556 PolarHBondContact O-N 3.22Å; Q556-A559 WeakPolarHBondContact O-CB 3.48Å; Q556-A559 PolarHBondContact O-N 2.9Å; Q556-V560 WeakPolarHBondContact O-CG2 3.45Å; Q556-V560 PolarHBondContact O-N 3.3Å
557	M	89.5	Confident	89.7	Confident	48 Å²	48	66.7 Å²	66.7	24%	0.236	34%	0.343	C	S	.	.	H	α-helix	trans	-54.9	-45.4	-175.4	-67.9	-176.4	69	0	0	113.7	L545 E548 K549 I554 A559 V560 Q561	L545-M557 HydrophobicContact CD2-CB 4.29Å; L545-M557 HydrophobicContact CD2-CE 4.41Å; E548-M557 HydrophobicContact CB-CG 4.18Å; K549-M557 HydrophobicContact CB-CE 4.11Å; K549-M557 HydrophobicContact CB-SD 3.82Å; K549-M557 HydrophobicContact CD-CE 4.38Å; K549-M557 HydrophobicContact CG-CE 4.46Å; K549-M557 HydrophobicContact CG-SD 4.2Å; I554-M557 HydrophobicContact CG2-SD 3.91Å; I554-M557 WeakPolarHBondContact O-CB 3.39Å; I554-M557 WeakPolarHBondContact O-CG 3.21Å; I554-M557 PolarHBondContact O-N 2.87Å; I554-M557 VanDerWaalsContact O-N 3.14Å; M557-A559 VanDerWaalsContact C-N 3.27Å; M557-A559 PolarHBondContact O-N 3.42Å; M557-V560 PolarHBondContact O-N 3.19Å; M557-Q561 WeakPolarHBondContact O-CB 3.39Å; M557-Q561 PolarHBondContact O-N 3.11Å
558	P	89.5	Confident	89.4	Confident	87 Å²	87	67.3 Å²	67.3	57%	0.565	35%	0.346	S	S	*	.	H	α-helix	trans	-62.5	-34.5	177.5	-22.7	34.9	0	0	0	112.9	T555 W562	T555-P558 WeakPolarHBondContact O-CD 3.34Å; P558-W562 VanDerWaalsContact O-CB 3.29Å; P558-W562 WeakPolarHBondContact O-CB 3.37Å; P558-W562 PolarHBondContact O-N 2.77Å
559	A	90.7	Very high	89	Confident	45 Å²	45	71.4 Å²	71.4	37%	0.372	37%	0.367	S	S	.	.	H	α-helix	trans	-70.8	-39.9	177.4	0	0	0	0	0	111.5	Q556 M557 W562 R563	Q556-A559 WeakPolarHBondContact O-CB 3.48Å; Q556-A559 PolarHBondContact O-N 2.9Å; M557-A559 VanDerWaalsContact C-N 3.27Å; M557-A559 PolarHBondContact O-N 3.42Å; A559-W562 PolarHBondContact O-N 2.92Å; A559-R563 VanDerWaalsContact O-CG 3.29Å; A559-R563 WeakPolarHBondContact O-CG 3.33Å; A559-R563 PolarHBondContact O-N 3.07Å
560	V	91.7	Very high	88.6	Confident	2 Å²	2	69.7 Å²	69.7	1%	0.012	37%	0.368	C	S	.	.	H	α-helix	trans	-64.6	-46.7	174.8	175.9	0	0	0	0	110.8	W541 Y544 L545 E548 Q556 M557 W562 R563 A564	W541-V560 HydrophobicContact CE3-CG1 3.86Å; W541-V560 HydrophobicContact CZ3-CG1 4.05Å; Y544-V560 HydrophobicContact CD1-CG1 3.91Å; Y544-V560 HydrophobicContact CD2-CG1 4.29Å; Y544-V560 HydrophobicContact CD2-CG2 4.26Å; Y544-V560 HydrophobicContact CE1-CG1 4.41Å; Y544-V560 HydrophobicContact CE1-CG2 4.32Å; Y544-V560 HydrophobicContact CE2-CG2 4.01Å; Y544-V560 HydrophobicContact CG-CG1 3.84Å; L545-V560 HydrophobicContact CD2-CB 3.86Å; L545-V560 HydrophobicContact CD2-CG1 3.71Å; L545-V560 HydrophobicContact CG-CG1 3.94Å; E548-V560 HydrophobicContact CG-CG2 4.35Å; Q556-V560 WeakPolarHBondContact O-CG2 3.45Å; Q556-V560 PolarHBondContact O-N 3.3Å; M557-V560 PolarHBondContact O-N 3.19Å; V560-W562 VanDerWaalsContact C-N 3.32Å; V560-W562 PolarHBondContact O-N 3.03Å; V560-R563 WeakPolarHBondContact O-CB 3.29Å; V560-R563 PolarHBondContact O-N 2.8Å; V560-R563 VanDerWaalsContact O-N 3.14Å; V560-A564 PolarHBondContact O-N 3.26Å
561	Q	91.2	Very high	88.3	Confident	87 Å²	87	73.9 Å²	73.9	41%	0.407	38%	0.382	S	S	.	.	H	α-helix	trans	-61.7	-40.8	177.4	-170.4	178.8	2.2	0	0	111.8	L545 M557 A564 Q565	L545-Q561 HydrophobicContact CD2-CB 4.3Å; M557-Q561 WeakPolarHBondContact O-CB 3.39Å; M557-Q561 PolarHBondContact O-N 3.11Å; Q561-A564 WeakPolarHBondContact O-CB 3.42Å; Q561-A564 PolarHBondContact O-N 2.93Å; Q561-Q565 PolarHBondContact O-N 3.4Å; Q561-Q565 VanDerWaalsContact O-N 3.08Å
562	W	91.1	Very high	88.2	Confident	150 Å²	150	75 Å²	75	57%	0.568	39%	0.387	S	S	*	.	H	α-helix	trans	-63.2	-40.7	174.5	-175.9	87.3	0	0	0	112.1	P558 A559 V560 Q565 K566	P558-W562 VanDerWaalsContact O-CB 3.29Å; P558-W562 WeakPolarHBondContact O-CB 3.37Å; P558-W562 PolarHBondContact O-N 2.77Å; A559-W562 PolarHBondContact O-N 2.92Å; V560-W562 VanDerWaalsContact C-N 3.32Å; V560-W562 PolarHBondContact O-N 3.03Å; W562-Q565 PolarHBondContact O-N 2.92Å; W562-K566 HydrophobicContact CD2-CG 4.15Å; W562-K566 HydrophobicContact CE3-CG 4.3Å; W562-K566 HydrophobicContact CH2-CG 4.05Å; W562-K566 HydrophobicContact CZ2-CD 4.44Å; W562-K566 HydrophobicContact CZ2-CG 3.89Å; W562-K566 HydrophobicContact CZ3-CG 4.25Å; W562-K566 WeakPolarHBondContact O-CG 3.5Å; W562-K566 PolarHBondContact O-N 2.96Å
563	R	93.5	Very high	88	Confident	64 Å²	64	76 Å²	76	24%	0.242	38%	0.384	C	S	.	.	H	α-helix	trans	-63.6	-44.4	175.2	-73.5	165.1	68.1	-178.7	10.9	111.6	D526 S529 W541 Y544 A559 V560 Q565 K566 T567	D526-R563 IonicContact OD1-CZ 2.76Å; D526-R563 VanDerWaalsContact OD1-CZ 3.28Å; D526-R563 IonicContact OD1-NH1 3.18Å; D526-R563 PolarHBondContact OD1-NH1 3.37Å; D526-R563 IonicContact OD1-NH2 2.87Å; D526-R563 PolarHBondContact OD1-NH2 2.98Å; S529-R563 PolarHBondContact OG-NH2 3.49Å; W541-R563 HydrophobicContact CH2-CB 3.59Å; W541-R563 HydrophobicContact CZ3-CB 3.73Å; Y544-R563 PolarHBondContact OH-NH1 2.89Å; A559-R563 VanDerWaalsContact O-CG 3.29Å; A559-R563 WeakPolarHBondContact O-CG 3.33Å; A559-R563 PolarHBondContact O-N 3.07Å; V560-R563 WeakPolarHBondContact O-CB 3.29Å; V560-R563 PolarHBondContact O-N 2.8Å; V560-R563 VanDerWaalsContact O-N 3.14Å; R563-Q565 VanDerWaalsContact C-N 3.29Å; R563-Q565 PolarHBondContact O-N 3.43Å; R563-K566 PolarHBondContact O-N 3.31Å; R563-T567 WeakPolarHBondContact O-CB 3.46Å; R563-T567 WeakPolarHBondContact O-CG2 3.42Å; R563-T567 PolarHBondContact O-N 3.05Å; R563-T567 PolarHBondContact O-OG1 3.16Å
564	A	91.2	Very high	88	Confident	0 Å²	0	77.2 Å²	77.2	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-54.3	-47.7	175.5	0	0	0	0	0	111	W541 V560 Q561 K566 T567 L568 F576	W541-A564 HydrophobicContact CB-CB 3.89Å; W541-A564 HydrophobicContact CD2-CB 3.42Å; W541-A564 VanDerWaalsContact CD2-CB 3.42Å; W541-A564 HydrophobicContact CE3-CB 3.69Å; W541-A564 HydrophobicContact CG-CB 3.51Å; W541-A564 HydrophobicContact CZ3-CB 4.4Å; V560-A564 PolarHBondContact O-N 3.26Å; Q561-A564 WeakPolarHBondContact O-CB 3.42Å; Q561-A564 PolarHBondContact O-N 2.93Å; A564-K566 PolarHBondContact O-N 3.11Å; A564-T567 PolarHBondContact O-N 3.22Å; A564-L568 HydrophobicContact CB-CD1 4.28Å; A564-L568 WeakPolarHBondContact O-CB 3.3Å; A564-L568 WeakPolarHBondContact O-CG 3.31Å; A564-L568 PolarHBondContact O-N 3.25Å; A564-F576 HydrophobicContact CB-CE1 4.08Å; A564-F576 HydrophobicContact CB-CE2 4.45Å; A564-F576 HydrophobicContact CB-CZ 3.96Å
565	Q	90.1	Very high	88	Confident	104 Å²	104	77 Å²	77	49%	0.486	39%	0.386	S	S	.	.	H	α-helix	trans	-60.7	-28.5	177.5	-173.9	179.9	21.7	0	0	114	Q561 W562 R563 F573	Q561-Q565 PolarHBondContact O-N 3.4Å; Q561-Q565 VanDerWaalsContact O-N 3.08Å; W562-Q565 PolarHBondContact O-N 2.92Å; R563-Q565 VanDerWaalsContact C-N 3.29Å; R563-Q565 PolarHBondContact O-N 3.43Å; Q565-F573 HydrophobicContact CB-CE2 3.81Å; Q565-F573 HydrophobicContact CB-CZ 4.37Å; Q565-F573 HydrophobicContact CG-CE2 3.74Å; Q565-F573 HydrophobicContact CG-CZ 3.85Å
566	K	89.5	Confident	88.1	Confident	133 Å²	133	72.1 Å²	72.1	58%	0.578	36%	0.356	S	S	*	.	H	α-helix	trans	-94.2	-17.7	-177.8	-65	-59.3	177	-169.4	0	114.4	W562 R563 A564	W562-K566 HydrophobicContact CD2-CG 4.15Å; W562-K566 HydrophobicContact CE3-CG 4.3Å; W562-K566 HydrophobicContact CH2-CG 4.05Å; W562-K566 HydrophobicContact CZ2-CD 4.44Å; W562-K566 HydrophobicContact CZ2-CG 3.89Å; W562-K566 HydrophobicContact CZ3-CG 4.25Å; W562-K566 WeakPolarHBondContact O-CG 3.5Å; W562-K566 PolarHBondContact O-N 2.96Å; R563-K566 PolarHBondContact O-N 3.31Å; A564-K566 PolarHBondContact O-N 3.11Å
567	T	87.3	Confident	88.1	Confident	52 Å²	52	70.9 Å²	70.9	32%	0.319	35%	0.351	S	S	.	.	H	α-helix	trans	-109.6	-34	-172.3	50.2	0	0	0	0	112.9	G534 S535 W541 R563 A564	G534-T567 PolarHBondContact O-OG1 3.38Å; S535-T567 WeakPolarHBondContact CA-O 3.45Å; W541-T567 HydrophobicContact CZ2-CG2 4.42Å; W541-T567 WeakPolarHBondContact CZ2-OG1 3.48Å; R563-T567 WeakPolarHBondContact O-CB 3.46Å; R563-T567 WeakPolarHBondContact O-CG2 3.42Å; R563-T567 PolarHBondContact O-N 3.05Å; R563-T567 PolarHBondContact O-OG1 3.16Å; A564-T567 PolarHBondContact O-N 3.22Å
568	L	87.9	Confident	88	Confident	14 Å²	14	74 Å²	74	7%	0.073	37%	0.368	C	S	.	.	S	Bend	trans	-64	135.4	175.5	-76	168.7	0	0	0	110.7	P538 W541 A564 H572 F573 F576	P538-L568 HydrophobicContact CG-CD2 4.29Å; W541-L568 HydrophobicContact CG-CD1 4.4Å; A564-L568 HydrophobicContact CB-CD1 4.28Å; A564-L568 WeakPolarHBondContact O-CB 3.3Å; A564-L568 WeakPolarHBondContact O-CG 3.31Å; A564-L568 PolarHBondContact O-N 3.25Å; L568-H572 HydrophobicContact CD2-CB 4.12Å; L568-F573 HydrophobicContact CB-CB 4.21Å; L568-F573 HydrophobicContact CD1-CD2 4.41Å; L568-F576 HydrophobicContact CD1-CB 3.67Å; L568-F576 HydrophobicContact CD1-CD1 4.15Å; L568-F576 HydrophobicContact CD1-CD2 4.24Å; L568-F576 HydrophobicContact CD1-CG 3.76Å
569	L	85.3	Confident	87.9	Confident	86 Å²	86	71.7 Å²	71.7	45%	0.45	35%	0.35	S	S	.	.			trans	-64.4	151.3	167.9	-61.1	174.7	0	0	0	109.8	S535 E571 H572 F573	S535-L569 PolarHBondContact O-N 2.98Å; L569-E571 VanDerWaalsContact C-N 3.3Å; L569-E571 PolarHBondContact O-N 3.43Å; L569-H572 PolarHBondContact O-N 2.98Å; L569-F573 PolarHBondContact O-N 2.93Å
570	T	82.6	Confident	87.6	Confident	99 Å²	99	70.3 Å²	70.3	61%	0.607	34%	0.337	S	S	*	.	H	α-helix	trans	-53.2	-44.5	-172	-50.6	0	0	0	0	112.9	H572 F573 D574	T570-H572 VanDerWaalsContact C-N 3.3Å; T570-H572 PolarHBondContact O-N 3.19Å; T570-F573 PolarHBondContact O-N 3.47Å; T570-D574 PolarHBondContact O-N 3.44Å
571	E	81.8	Confident	87.1	Confident	164 Å²	164	73.8 Å²	73.8	77%	0.766	36%	0.355	S	S	*	.	H	α-helix	trans	-60.3	-37.5	179.1	-61.9	175.7	-170.9	0	0	113.1	L569	L569-E571 VanDerWaalsContact C-N 3.3Å; L569-E571 PolarHBondContact O-N 3.43Å
572	H	84.7	Confident	86.5	Confident	50 Å²	50	77.1 Å²	77.1	23%	0.231	37%	0.368	C	S	.	.	H	α-helix	trans	-83.5	-27.7	-179.6	-63.8	-49.7	0	0	0	112.2	H536 P538 L568 L569 T570 D574 K575 F576	H536-H572 AromaticContact CD2-NE2 3.95Å; P538-H572 HydrophobicContact CG-CB 3.71Å; P538-H572 WeakPolarHBondContact CG-O 3.21Å; L568-H572 HydrophobicContact CD2-CB 4.12Å; L569-H572 PolarHBondContact O-N 2.98Å; T570-H572 VanDerWaalsContact C-N 3.3Å; T570-H572 PolarHBondContact O-N 3.19Å; H572-D574 PolarHBondContact O-N 2.96Å; H572-K575 PolarHBondContact O-N 2.85Å; H572-F576 PolarHBondContact O-N 2.97Å
573	F	85.3	Confident	85.5	Confident	46 Å²	46	74.6 Å²	74.6	20%	0.202	36%	0.363	C	S	.	.	H	α-helix	trans	-63	-40.4	177.4	-178.8	-103.6	0	0	0	112.1	Q565 L568 L569 T570 K575 F576 I577	Q565-F573 HydrophobicContact CB-CE2 3.81Å; Q565-F573 HydrophobicContact CB-CZ 4.37Å; Q565-F573 HydrophobicContact CG-CE2 3.74Å; Q565-F573 HydrophobicContact CG-CZ 3.85Å; L568-F573 HydrophobicContact CB-CB 4.21Å; L568-F573 HydrophobicContact CD1-CD2 4.41Å; L569-F573 PolarHBondContact O-N 2.93Å; T570-F573 PolarHBondContact O-N 3.47Å; F573-K575 VanDerWaalsContact C-N 3.33Å; F573-K575 PolarHBondContact O-N 3.34Å; F573-F576 HydrophobicContact CD2-CD1 4.26Å; F573-F576 HydrophobicContact CE2-CD1 4.19Å; F573-F576 WeakPolarHBondContact O-CB 3.39Å; F573-F576 PolarHBondContact O-N 3.24Å; F573-F576 VanDerWaalsContact O-N 3.11Å; F573-I577 HydrophobicContact CD1-CG1 4.22Å; F573-I577 HydrophobicContact CE1-CD1 4.2Å; F573-I577 HydrophobicContact CE1-CG1 3.72Å; F573-I577 HydrophobicContact CE2-CD1 4.01Å; F573-I577 HydrophobicContact CE2-CG1 4.12Å; F573-I577 HydrophobicContact CZ-CD1 3.64Å; F573-I577 HydrophobicContact CZ-CG1 3.67Å; F573-I577 WeakPolarHBondContact O-CG1 3.36Å; F573-I577 PolarHBondContact O-N 3.42Å
574	D	84.8	Confident	84.1	Confident	95 Å²	95	78.5 Å²	78.5	51%	0.508	38%	0.384	S	S	.	.	H	α-helix	trans	-62.5	-41.9	176.8	-67.4	-22.2	0	0	0	111.4	T570 H572 F576 I577 L578	T570-D574 PolarHBondContact O-N 3.44Å; H572-D574 PolarHBondContact O-N 2.96Å; D574-F576 VanDerWaalsContact C-N 3.33Å; D574-F576 PolarHBondContact O-N 3.21Å; D574-I577 PolarHBondContact O-N 3.49Å; D574-L578 WeakPolarHBondContact O-CG 3.29Å; D574-L578 PolarHBondContact O-N 3.36Å
575	K	86.5	Confident	81.7	Confident	103 Å²	103	88.7 Å²	88.7	45%	0.448	43%	0.431	S	S	.	.	H	α-helix	trans	-61.5	-41	172.8	-165.5	-170.4	-175.9	-165.4	0	111.6	P538 E539 H572 F573 L578 M579	P538-K575 HydrophobicContact CG-CB 4.26Å; P538-K575 HydrophobicContact CG-CD 4.32Å; E539-K575 WeakPolarHBondContact OE1-CE 3.36Å; E539-K575 IonicContact OE1-NZ 2.73Å; E539-K575 PolarHBondContact OE1-NZ 2.92Å; H572-K575 PolarHBondContact O-N 2.85Å; F573-K575 VanDerWaalsContact C-N 3.33Å; F573-K575 PolarHBondContact O-N 3.34Å; K575-L578 PolarHBondContact O-N 3.22Å; K575-M579 HydrophobicContact CD-CE 4.44Å; K575-M579 HydrophobicContact CG-CE 4.2Å; K575-M579 VanDerWaalsContact O-CG 3.31Å; K575-M579 WeakPolarHBondContact O-CG 3.43Å; K575-M579 PolarHBondContact O-N 3.23Å
576	F	89.2	Confident	81.3	Confident	2 Å²	2	87.9 Å²	87.9	1%	0.009	43%	0.429	C	S	.	.	H	α-helix	trans	-60.6	-46.2	176	171.7	-104.5	0	0	0	112	P538 W541 L542 L545 A564 L568 H572 F573 D574 M579 L580	P538-F576 HydrophobicContact CB-CB 3.88Å; P538-F576 HydrophobicContact CG-CB 4.42Å; W541-F576 HydrophobicContact CB-CD2 4Å; W541-F576 HydrophobicContact CB-CE2 3.6Å; W541-F576 HydrophobicContact CB-CZ 4.36Å; L542-F576 HydrophobicContact CD2-CD2 4.12Å; L542-F576 HydrophobicContact CD2-CE2 3.75Å; L542-F576 HydrophobicContact CG-CD2 4.15Å; L542-F576 HydrophobicContact CG-CE2 4.07Å; L545-F576 HydrophobicContact CD1-CE2 4.17Å; L545-F576 HydrophobicContact CD1-CZ 3.88Å; A564-F576 HydrophobicContact CB-CE1 4.08Å; A564-F576 HydrophobicContact CB-CE2 4.45Å; A564-F576 HydrophobicContact CB-CZ 3.96Å; L568-F576 HydrophobicContact CD1-CB 3.67Å; L568-F576 HydrophobicContact CD1-CD1 4.15Å; L568-F576 HydrophobicContact CD1-CD2 4.24Å; L568-F576 HydrophobicContact CD1-CG 3.76Å; H572-F576 PolarHBondContact O-N 2.97Å; F573-F576 HydrophobicContact CD2-CD1 4.26Å; F573-F576 HydrophobicContact CE2-CD1 4.19Å; F573-F576 WeakPolarHBondContact O-CB 3.39Å; F573-F576 PolarHBondContact O-N 3.24Å; F573-F576 VanDerWaalsContact O-N 3.11Å; D574-F576 VanDerWaalsContact C-N 3.33Å; D574-F576 PolarHBondContact O-N 3.21Å; F576-M579 PolarHBondContact O-N 3.49Å; F576-L580 HydrophobicContact CE1-CD2 4.26Å; F576-L580 HydrophobicContact CZ-CD2 4.3Å; F576-L580 VanDerWaalsContact O-CB 3.3Å; F576-L580 WeakPolarHBondContact O-CB 3.49Å; F576-L580 PolarHBondContact O-N 3.05Å
577	I	87.5	Confident	80.9	Confident	57 Å²	57	85.5 Å²	85.5	29%	0.292	42%	0.421	S	S	.	.	H	α-helix	trans	-63.9	-44.1	178	-64.7	-61.2	0	0	0	111.3	F573 D574 M579 L580 N581	F573-I577 HydrophobicContact CD1-CG1 4.22Å; F573-I577 HydrophobicContact CE1-CD1 4.2Å; F573-I577 HydrophobicContact CE1-CG1 3.72Å; F573-I577 HydrophobicContact CE2-CD1 4.01Å; F573-I577 HydrophobicContact CE2-CG1 4.12Å; F573-I577 HydrophobicContact CZ-CD1 3.64Å; F573-I577 HydrophobicContact CZ-CG1 3.67Å; F573-I577 WeakPolarHBondContact O-CG1 3.36Å; F573-I577 PolarHBondContact O-N 3.42Å; D574-I577 PolarHBondContact O-N 3.49Å; I577-M579 VanDerWaalsContact C-N 3.31Å; I577-M579 PolarHBondContact O-N 3.34Å; I577-L580 PolarHBondContact O-N 2.98Å; I577-N581 VanDerWaalsContact O-CG 3.31Å; I577-N581 PolarHBondContact O-N 2.94Å
578	L	87	Confident	80.5	Confident	114 Å²	114	87.4 Å²	87.4	60%	0.597	43%	0.426	S	S	*	.	H	α-helix	trans	-58.9	-42	176	-74.5	171.9	0	0	0	112.2	D574 K575 K582	D574-L578 WeakPolarHBondContact O-CG 3.29Å; D574-L578 PolarHBondContact O-N 3.36Å; K575-L578 PolarHBondContact O-N 3.22Å; L578-K582 WeakPolarHBondContact O-CG 3.48Å; L578-K582 PolarHBondContact O-N 3.1Å
579	M	86.4	Confident	80.1	Confident	39 Å²	39	91.7 Å²	91.7	19%	0.192	45%	0.447	C	S	.	.	H	α-helix	trans	-73.5	-37	177.7	-68.7	-169	-63	0	0	112.9	P538 E539 L542 K575 F576 I577 N581 K582 E583	P538-M579 HydrophobicContact CB-CE 3.24Å; P538-M579 HydrophobicContact CG-CE 4.42Å; E539-M579 HydrophobicContact CG-CE 4.12Å; E539-M579 HydrophobicContact CG-SD 4.31Å; L542-M579 HydrophobicContact CD1-CB 3.5Å; L542-M579 VanDerWaalsContact CD1-CB 3.5Å; L542-M579 HydrophobicContact CD1-CE 3.68Å; L542-M579 HydrophobicContact CD1-CG 4.34Å; L542-M579 HydrophobicContact CD1-SD 3.98Å; K575-M579 HydrophobicContact CD-CE 4.44Å; K575-M579 HydrophobicContact CG-CE 4.2Å; K575-M579 VanDerWaalsContact O-CG 3.31Å; K575-M579 WeakPolarHBondContact O-CG 3.43Å; K575-M579 PolarHBondContact O-N 3.23Å; F576-M579 PolarHBondContact O-N 3.49Å; I577-M579 VanDerWaalsContact C-N 3.31Å; I577-M579 PolarHBondContact O-N 3.34Å; M579-N581 VanDerWaalsContact C-N 3.31Å; M579-N581 PolarHBondContact O-N 3.23Å; M579-K582 PolarHBondContact O-N 3.23Å; M579-E583 PolarHBondContact O-N 3.12Å; M579-E583 VanDerWaalsContact O-N 3.12Å
580	L	85.3	Confident	79.8	Confident	16 Å²	16	92.1 Å²	92.1	8%	0.084	45%	0.447	C	S	.	.	H	α-helix	trans	-62.7	-40.1	177.1	-173	70.5	0	0	0	111.2	L542 L545 F576 I577 E583 Q584	L542-L580 HydrophobicContact CD2-CB 4.21Å; L542-L580 HydrophobicContact CD2-CD1 3.85Å; L545-L580 HydrophobicContact CD1-CD1 3.91Å; F576-L580 HydrophobicContact CE1-CD2 4.26Å; F576-L580 HydrophobicContact CZ-CD2 4.3Å; F576-L580 VanDerWaalsContact O-CB 3.3Å; F576-L580 WeakPolarHBondContact O-CB 3.49Å; F576-L580 PolarHBondContact O-N 3.05Å; I577-L580 PolarHBondContact O-N 2.98Å; L580-E583 PolarHBondContact O-N 2.99Å; L580-Q584 WeakPolarHBondContact O-CG 3.33Å; L580-Q584 PolarHBondContact O-N 3.19Å
581	N	81.8	Confident	79.6	Confident	75 Å²	75	91.6 Å²	91.6	40%	0.401	44%	0.436	S	S	.	.	H	α-helix	trans	-65.2	-39.9	175.6	-68.9	-11.1	0	0	0	111.5	I577 M579 E583 Q584 E585	I577-N581 VanDerWaalsContact O-CG 3.31Å; I577-N581 PolarHBondContact O-N 2.94Å; M579-N581 VanDerWaalsContact C-N 3.31Å; M579-N581 PolarHBondContact O-N 3.23Å; N581-E583 VanDerWaalsContact C-N 3.29Å; N581-E583 PolarHBondContact O-N 3.01Å; N581-Q584 PolarHBondContact O-N 2.83Å; N581-Q584 VanDerWaalsContact O-N 3.09Å; N581-E585 PolarHBondContact O-N 3.01Å
582	K	78.6	Confident	79.4	Confident	156 Å²	156	86.4 Å²	86.4	68%	0.678	41%	0.413	S	S	*	.	H	α-helix	trans	-65.4	-24.6	175.4	-75.2	-180	177.9	-174.5	0	114.8	L578 M579	L578-K582 WeakPolarHBondContact O-CG 3.48Å; L578-K582 PolarHBondContact O-N 3.1Å; M579-K582 PolarHBondContact O-N 3.23Å
583	E	68.8	Low	79	Confident	98 Å²	98	89.2 Å²	89.2	46%	0.458	43%	0.427	S	S	.	.	H	α-helix	trans	-83.9	-15.1	172.8	-78.4	-165.6	155.6	0	0	112.9	M579 L580 N581	M579-E583 PolarHBondContact O-N 3.12Å; M579-E583 VanDerWaalsContact O-N 3.12Å; L580-E583 PolarHBondContact O-N 2.99Å; N581-E583 VanDerWaalsContact C-N 3.29Å; N581-E583 PolarHBondContact O-N 3.01Å
584	Q	63.6	Low	78.5	Confident	146 Å²	146	92.8 Å²	92.8	68%	0.682	45%	0.445	S	S	*	.	H	α-helix	trans	-90.9	-32.1	177.3	-72.4	-179.2	-1.9	0	0	112.6	L580 N581	L580-Q584 WeakPolarHBondContact O-CG 3.33Å; L580-Q584 PolarHBondContact O-N 3.19Å; N581-Q584 PolarHBondContact O-N 2.83Å; N581-Q584 VanDerWaalsContact O-N 3.09Å
585	E	42.6	Very low	77.9	Confident	213 Å²	213	92.6 Å²	92.6	100%	0.995	44%	0.44	S	S	*	.			trans	-66	0	161.1	-68	176.7	-179.4	0	0	110.7	N581	N581-E585 PolarHBondContact O-N 3.01Å

Retrieved 585 of 585 residues in 183.7 ms (Link to these results)

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