A0A077ZIH2_TRITR Loading...

Hydrolase 3 and Abhydrolase 1 and EamA domain con taining protein

AlphaFold DB , UniProt , Accession A0A077ZIH2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 619 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	64.4	Low	82.1	Confident	146 Å²	146	86.4 Å²	86.4	72%	0.719	44%	0.441	S	S	*	.				0	133.2	0	-176.7	-177.6	-78.5	0	0	107.6	M5 A6 I9	M1-M5 HydrophobicContact CE-SD 4.41Å; M1-M5 HydrophobicContact CG-CB 4.07Å; M1-M5 HydrophobicContact CG-CG 4.03Å; M1-M5 HydrophobicContact CG-SD 3.86Å; M1-M5 HydrophobicContact SD-CB 4.42Å; M1-M5 HydrophobicContact SD-CG 3.99Å; M1-M5 HydrophobicContact SD-SD 4.22Å; M1-A6 HydrophobicContact CG-CB 4.43Å; M1-A6 HydrophobicContact SD-CB 4.05Å; M1-I9 HydrophobicContact CE-CD1 3.82Å; M1-I9 HydrophobicContact SD-CD1 3.71Å
2	P	73.1	Confident	83	Confident	71 Å²	71	90.4 Å²	90.4	46%	0.461	45%	0.447	S	S	.	.			trans	-56.5	144	176.5	-25	35	0	0	0	112.1	F4 M5 A6	P2-F4 VanDerWaalsContact C-N 3.33Å; P2-F4 HydrophobicContact CB-CD1 3.6Å; P2-F4 HydrophobicContact CB-CE1 3.32Å; P2-F4 HydrophobicContact CB-CZ 4.15Å; P2-F4 HydrophobicContact CG-CE1 4Å; P2-F4 PolarHBondContact O-N 2.76Å; P2-M5 PolarHBondContact O-N 3.03Å; P2-M5 VanDerWaalsContact O-N 3.15Å; P2-A6 PolarHBondContact O-N 3.22Å; P2-A6 VanDerWaalsContact O-N 3.08Å
3	S	74.2	Confident	83.6	Confident	88 Å²	88	83.5 Å²	83.5	62%	0.615	41%	0.413	S	S	*	.	H	α-helix	trans	-57.9	-40.1	-174	55.1	0	0	0	0	113.4	M5 A6 R7	S3-M5 VanDerWaalsContact C-N 3.3Å; S3-M5 PolarHBondContact O-N 3.03Å; S3-A6 PolarHBondContact O-N 3.43Å; S3-R7 WeakPolarHBondContact O-CB 3.28Å; S3-R7 WeakPolarHBondContact O-CG 3.4Å; S3-R7 PolarHBondContact O-N 3.43Å
4	F	80.1	Confident	84.2	Confident	131 Å²	131	80.4 Å²	80.4	58%	0.575	40%	0.397	S	S	*	.	H	α-helix	trans	-59.8	-39.6	179	74.6	-93.6	0	0	0	112.5	P2 Q8	P2-F4 VanDerWaalsContact C-N 3.33Å; P2-F4 HydrophobicContact CB-CD1 3.6Å; P2-F4 HydrophobicContact CB-CE1 3.32Å; P2-F4 HydrophobicContact CB-CZ 4.15Å; P2-F4 HydrophobicContact CG-CE1 4Å; P2-F4 PolarHBondContact O-N 2.76Å; F4-Q8 WeakPolarHBondContact O-CG 3.33Å; F4-Q8 PolarHBondContact O-N 2.93Å
5	M	82.2	Confident	84.7	Confident	82 Å²	82	79.9 Å²	79.9	40%	0.404	41%	0.411	S	S	.	.	H	α-helix	trans	-74.4	-43.9	179.4	-177.6	-178.7	-75.8	0	0	110.7	M1 P2 S3 R7 Q8 I9	M1-M5 HydrophobicContact CE-SD 4.41Å; M1-M5 HydrophobicContact CG-CB 4.07Å; M1-M5 HydrophobicContact CG-CG 4.03Å; M1-M5 HydrophobicContact CG-SD 3.86Å; M1-M5 HydrophobicContact SD-CB 4.42Å; M1-M5 HydrophobicContact SD-CG 3.99Å; M1-M5 HydrophobicContact SD-SD 4.22Å; P2-M5 PolarHBondContact O-N 3.03Å; P2-M5 VanDerWaalsContact O-N 3.15Å; S3-M5 VanDerWaalsContact C-N 3.3Å; S3-M5 PolarHBondContact O-N 3.03Å; M5-R7 VanDerWaalsContact C-N 3.32Å; M5-R7 PolarHBondContact O-N 3.47Å; M5-Q8 PolarHBondContact O-N 3.34Å; M5-I9 HydrophobicContact CG-CD1 4.05Å; M5-I9 WeakPolarHBondContact O-CG1 3.46Å; M5-I9 PolarHBondContact O-N 3.12Å
6	A	84.2	Confident	85.1	Confident	22 Å²	22	79.8 Å²	79.8	18%	0.182	41%	0.408	C	S	.	.	H	α-helix	trans	-58	-45.7	177	0	0	0	0	0	111.3	M1 P2 S3 Q8 I9 L10	M1-A6 HydrophobicContact CG-CB 4.43Å; M1-A6 HydrophobicContact SD-CB 4.05Å; P2-A6 PolarHBondContact O-N 3.22Å; P2-A6 VanDerWaalsContact O-N 3.08Å; S3-A6 PolarHBondContact O-N 3.43Å; A6-Q8 PolarHBondContact O-N 3.1Å; A6-I9 PolarHBondContact O-N 2.71Å; A6-L10 WeakPolarHBondContact O-CB 3.19Å; A6-L10 WeakPolarHBondContact O-CD1 3.39Å; A6-L10 WeakPolarHBondContact O-CG 3.31Å; A6-L10 PolarHBondContact O-N 2.99Å
7	R	86.3	Confident	85.2	Confident	120 Å²	120	80.5 Å²	80.5	45%	0.453	42%	0.419	S	S	.	.	H	α-helix	trans	-61.3	-44	177.3	-74.8	-178.7	179	-158.5	6.8	112.7	S3 M5 I9 L10 N11 E78	S3-R7 WeakPolarHBondContact O-CB 3.28Å; S3-R7 WeakPolarHBondContact O-CG 3.4Å; S3-R7 PolarHBondContact O-N 3.43Å; M5-R7 VanDerWaalsContact C-N 3.32Å; M5-R7 PolarHBondContact O-N 3.47Å; R7-I9 PolarHBondContact O-N 3.25Å; R7-L10 PolarHBondContact O-N 3.47Å; R7-N11 VanDerWaalsContact O-CB 3.3Å; R7-N11 WeakPolarHBondContact O-CB 3.34Å; R7-N11 VanDerWaalsContact O-CG 3.25Å; R7-N11 PolarHBondContact O-N 2.67Å; R7-N11 PolarHBondContact O-ND2 2.82Å; R7-E78 IonicContact CZ-OE1 2.72Å; R7-E78 VanDerWaalsContact CZ-OE1 3.31Å; R7-E78 IonicContact CZ-OE2 3.56Å; R7-E78 IonicContact NE-OE1 3.87Å; R7-E78 IonicContact NH1-OE2 3.11Å; R7-E78 IonicContact NH2-OE1 2.6Å; R7-E78 PolarHBondContact NH2-OE1 3.14Å; R7-E78 IonicContact NH2-OE2 2.96Å; R7-E78 PolarHBondContact NH2-OE2 3.47Å
8	Q	87.3	Confident	85.3	Confident	139 Å²	139	88.5 Å²	88.5	65%	0.65	44%	0.442	S	S	*	.	H	α-helix	trans	-60.9	-44.8	177.4	-78.4	-177.4	-13.5	0	0	111.9	F4 M5 A6 W12	F4-Q8 WeakPolarHBondContact O-CG 3.33Å; F4-Q8 PolarHBondContact O-N 2.93Å; M5-Q8 PolarHBondContact O-N 3.34Å; A6-Q8 PolarHBondContact O-N 3.1Å; Q8-W12 VanDerWaalsContact O-CB 3.29Å; Q8-W12 WeakPolarHBondContact O-CB 3.48Å; Q8-W12 PolarHBondContact O-N 3.21Å
9	I	88.9	Confident	85.3	Confident	51 Å²	51	88.5 Å²	88.5	26%	0.262	44%	0.44	S	S	.	.	H	α-helix	trans	-63	-46.4	178	-67.5	168.4	0	0	0	110.8	M1 M5 A6 R7 W12 A13 Y67	M1-I9 HydrophobicContact CE-CD1 3.82Å; M1-I9 HydrophobicContact SD-CD1 3.71Å; M5-I9 HydrophobicContact CG-CD1 4.05Å; M5-I9 WeakPolarHBondContact O-CG1 3.46Å; M5-I9 PolarHBondContact O-N 3.12Å; A6-I9 PolarHBondContact O-N 2.71Å; R7-I9 PolarHBondContact O-N 3.25Å; I9-W12 PolarHBondContact O-N 2.93Å; I9-A13 WeakPolarHBondContact O-CB 3.32Å; I9-A13 PolarHBondContact O-N 3.15Å; I9-Y67 HydrophobicContact CG2-CD1 4.46Å; I9-Y67 HydrophobicContact CG2-CE1 3.89Å
10	L	91.4	Very high	85.6	Confident	13 Å²	13	88.5 Å²	88.5	7%	0.068	43%	0.434	C	S	.	.	H	α-helix	trans	-65.9	-43.6	-178.7	-70.3	167.1	0	0	0	112.1	A6 R7 A13 E14 Y67 V70 R71 I74	A6-L10 WeakPolarHBondContact O-CB 3.19Å; A6-L10 WeakPolarHBondContact O-CD1 3.39Å; A6-L10 WeakPolarHBondContact O-CG 3.31Å; A6-L10 PolarHBondContact O-N 2.99Å; R7-L10 PolarHBondContact O-N 3.47Å; L10-A13 PolarHBondContact O-N 3.1Å; L10-E14 WeakPolarHBondContact O-CB 3.42Å; L10-E14 PolarHBondContact O-N 3.17Å; L10-Y67 HydrophobicContact CD2-CD1 4.14Å; L10-Y67 WeakPolarHBondContact CD2-O 3.07Å; L10-V70 HydrophobicContact CD1-CG1 4.06Å; L10-V70 HydrophobicContact CD2-CB 3.96Å; L10-V70 HydrophobicContact CD2-CG1 3.86Å; L10-R71 HydrophobicContact CB-CB 4.15Å; L10-R71 HydrophobicContact CB-CG 4.26Å; L10-R71 HydrophobicContact CD2-CB 4.22Å; L10-I74 HydrophobicContact CD1-CD1 3.54Å
11	N	91.3	Very high	85.7	Confident	87 Å²	87	89.4 Å²	89.4	47%	0.465	44%	0.441	S	S	.	.	H	α-helix	trans	-66.5	-39.1	177.6	-72.8	-22.3	0	0	0	112.1	R7 E14 A15 R71	R7-N11 VanDerWaalsContact O-CB 3.3Å; R7-N11 WeakPolarHBondContact O-CB 3.34Å; R7-N11 VanDerWaalsContact O-CG 3.25Å; R7-N11 PolarHBondContact O-N 2.67Å; R7-N11 PolarHBondContact O-ND2 2.82Å; N11-E14 PolarHBondContact O-N 2.95Å; N11-A15 PolarHBondContact O-N 3.02Å; N11-R71 PolarHBondContact OD1-NE 3.25Å
12	W	92.1	Very high	86.9	Confident	135 Å²	135	83.5 Å²	83.5	51%	0.511	42%	0.418	S	S	.	.	H	α-helix	trans	-63.5	-44.9	172.9	176.5	87.4	0	0	0	111.4	Q8 I9 E14 A15 H16 F19	Q8-W12 VanDerWaalsContact O-CB 3.29Å; Q8-W12 WeakPolarHBondContact O-CB 3.48Å; Q8-W12 PolarHBondContact O-N 3.21Å; I9-W12 PolarHBondContact O-N 2.93Å; W12-E14 VanDerWaalsContact C-N 3.34Å; W12-E14 PolarHBondContact O-N 2.89Å; W12-A15 PolarHBondContact O-N 2.94Å; W12-H16 AromaticContact CD1-CE1 3.74Å; W12-H16 AromaticContact CE2-CE1 3.69Å; W12-H16 AromaticContact CE2-ND1 3.79Å; W12-H16 AromaticContact NE1-CE1 3.32Å; W12-H16 PolarHBondContact NE1-CE1 3.4Å; W12-H16 VanDerWaalsContact NE1-CE1 3.32Å; W12-H16 AromaticContact NE1-ND1 3.83Å; W12-H16 PolarHBondContact O-ND1 3.23Å; W12-F19 HydrophobicContact CH2-CD1 4.43Å; W12-F19 AromaticContact CH2-CD2 3.69Å; W12-F19 HydrophobicContact CH2-CD2 3.69Å; W12-F19 HydrophobicContact CH2-CE1 4.37Å; W12-F19 AromaticContact CH2-CE2 3.62Å; W12-F19 HydrophobicContact CH2-CE2 3.62Å; W12-F19 HydrophobicContact CH2-CG 4.11Å; W12-F19 AromaticContact CH2-CZ 3.98Å; W12-F19 HydrophobicContact CH2-CZ 3.98Å; W12-F19 HydrophobicContact CZ2-CE2 4.46Å; W12-F19 HydrophobicContact CZ3-CB 4.37Å; W12-F19 HydrophobicContact CZ3-CD1 4.25Å; W12-F19 AromaticContact CZ3-CD2 3.96Å; W12-F19 HydrophobicContact CZ3-CD2 3.96Å; W12-F19 HydrophobicContact CZ3-CE2 4.29Å; W12-F19 AromaticContact CZ3-CG 3.94Å; W12-F19 HydrophobicContact CZ3-CG 3.94Å
13	A	91.5	Very high	87.7	Confident	0 Å²	0	84.5 Å²	84.5	0%	0	41%	0.413	C	S	.	.	H	α-helix	trans	-63.5	-39.3	178.7	0	0	0	0	0	112	I9 L10 A15 H16 F19 R20 Y67	I9-A13 WeakPolarHBondContact O-CB 3.32Å; I9-A13 PolarHBondContact O-N 3.15Å; L10-A13 PolarHBondContact O-N 3.1Å; A13-A15 VanDerWaalsContact C-N 3.28Å; A13-A15 PolarHBondContact O-N 2.96Å; A13-H16 CarbonylContact O-C 3.5Å; A13-H16 PolarHBondContact O-N 2.83Å; A13-F19 HydrophobicContact CB-CB 4.21Å; A13-R20 WeakPolarHBondContact O-CB 3.33Å; A13-R20 PolarHBondContact O-N 2.7Å; A13-Y67 HydrophobicContact CB-CD1 3.76Å; A13-Y67 HydrophobicContact CB-CE1 4.43Å; A13-Y67 HydrophobicContact CB-CG 3.81Å
14	E	91.7	Very high	88.4	Confident	40 Å²	40	80.8 Å²	80.8	19%	0.187	39%	0.387	C	S	.	.	H	α-helix	trans	-59.2	-38.4	176.8	-168.1	65.3	-154.2	0	0	112.1	L10 N11 W12 H16 R20 H68	L10-E14 WeakPolarHBondContact O-CB 3.42Å; L10-E14 PolarHBondContact O-N 3.17Å; N11-E14 PolarHBondContact O-N 2.95Å; W12-E14 VanDerWaalsContact C-N 3.34Å; W12-E14 PolarHBondContact O-N 2.89Å; E14-H16 PolarHBondContact O-N 3.28Å; E14-R20 IonicContact OE1-CZ 2.66Å; E14-R20 IonicContact OE1-NE 3.66Å; E14-R20 PolarHBondContact OE1-NE 3.11Å; E14-R20 IonicContact OE1-NH2 2.69Å; E14-R20 IonicContact OE2-NE 3.78Å; E14-H68 VanDerWaalsContact CD-ND1 3.3Å; E14-H68 IonicContact OE1-CE1 3.57Å; E14-H68 PolarHBondContact OE1-CE1 2.86Å; E14-H68 VanDerWaalsContact OE1-CE1 3.31Å; E14-H68 IonicContact OE1-ND1 2.72Å; E14-H68 PolarHBondContact OE1-ND1 3.48Å; E14-H68 IonicContact OE2-CE1 2.78Å; E14-H68 IonicContact OE2-CG 3.01Å; E14-H68 IonicContact OE2-ND1 3.29Å; E14-H68 PolarHBondContact OE2-ND1 3.38Å
15	A	91.9	Very high	88.5	Confident	74 Å²	74	80.1 Å²	80.1	61%	0.612	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-10.8	177.8	0	0	0	0	0	114	N11 W12 A13	N11-A15 PolarHBondContact O-N 3.02Å; W12-A15 PolarHBondContact O-N 2.94Å; A13-A15 VanDerWaalsContact C-N 3.28Å; A13-A15 PolarHBondContact O-N 2.96Å
16	H	91	Very high	88.3	Confident	78 Å²	78	80.2 Å²	80.2	36%	0.361	41%	0.411	S	S	.	.	S	Bend	trans	-122.2	101.8	-176.7	-63.8	83	0	0	0	110.7	W12 A13 E14 R18 F19 R20	W12-H16 AromaticContact CD1-CE1 3.74Å; W12-H16 AromaticContact CE2-CE1 3.69Å; W12-H16 AromaticContact CE2-ND1 3.79Å; W12-H16 AromaticContact NE1-CE1 3.32Å; W12-H16 PolarHBondContact NE1-CE1 3.4Å; W12-H16 VanDerWaalsContact NE1-CE1 3.32Å; W12-H16 AromaticContact NE1-ND1 3.83Å; W12-H16 PolarHBondContact O-ND1 3.23Å; A13-H16 CarbonylContact O-C 3.5Å; A13-H16 PolarHBondContact O-N 2.83Å; E14-H16 PolarHBondContact O-N 3.28Å; H16-R18 PolarHBondContact O-N 2.86Å; H16-F19 HydrophobicContact CB-CB 4.46Å; H16-F19 HydrophobicContact CB-CD2 3.9Å; H16-F19 PolarHBondContact O-N 2.85Å; H16-R20 PolarHBondContact O-N 2.73Å
17	P	86.9	Confident	88.3	Confident	91 Å²	91	81.7 Å²	81.7	59%	0.591	42%	0.417	S	S	*	.	H	α-helix	trans	-50.5	-39.3	-172.1	-30.6	34.9	0	0	0	114.8	F19 R20 D21	P17-F19 VanDerWaalsContact C-N 3.26Å; P17-F19 PolarHBondContact O-N 3.17Å; P17-R20 PolarHBondContact O-N 3.04Å; P17-D21 PolarHBondContact O-N 3.36Å
18	R	86.1	Confident	88.3	Confident	225 Å²	225	77.2 Å²	77.2	85%	0.849	41%	0.409	S	S	*	.	H	α-helix	trans	-60.4	-32.6	178.1	-173.8	177.6	177.9	176.4	0.4	113.7	H16	H16-R18 PolarHBondContact O-N 2.86Å
19	F	86.6	Confident	88.2	Confident	89 Å²	89	80.3 Å²	80.3	39%	0.39	41%	0.414	S	S	.	.	H	α-helix	trans	-93.9	-38.3	178.8	-68.7	-78.8	0	0	0	111.6	W12 A13 H16 P17 D21 G22 Y67	W12-F19 HydrophobicContact CH2-CD1 4.43Å; W12-F19 AromaticContact CH2-CD2 3.69Å; W12-F19 HydrophobicContact CH2-CD2 3.69Å; W12-F19 HydrophobicContact CH2-CE1 4.37Å; W12-F19 AromaticContact CH2-CE2 3.62Å; W12-F19 HydrophobicContact CH2-CE2 3.62Å; W12-F19 HydrophobicContact CH2-CG 4.11Å; W12-F19 AromaticContact CH2-CZ 3.98Å; W12-F19 HydrophobicContact CH2-CZ 3.98Å; W12-F19 HydrophobicContact CZ2-CE2 4.46Å; W12-F19 HydrophobicContact CZ3-CB 4.37Å; W12-F19 HydrophobicContact CZ3-CD1 4.25Å; W12-F19 AromaticContact CZ3-CD2 3.96Å; W12-F19 HydrophobicContact CZ3-CD2 3.96Å; W12-F19 HydrophobicContact CZ3-CE2 4.29Å; W12-F19 AromaticContact CZ3-CG 3.94Å; W12-F19 HydrophobicContact CZ3-CG 3.94Å; A13-F19 HydrophobicContact CB-CB 4.21Å; H16-F19 HydrophobicContact CB-CB 4.46Å; H16-F19 HydrophobicContact CB-CD2 3.9Å; H16-F19 PolarHBondContact O-N 2.85Å; P17-F19 VanDerWaalsContact C-N 3.26Å; P17-F19 PolarHBondContact O-N 3.17Å; F19-D21 VanDerWaalsContact C-N 3.26Å; F19-D21 PolarHBondContact O-N 3.26Å; F19-G22 WeakPolarHBondContact O-CA 3.41Å; F19-G22 PolarHBondContact O-N 3.23Å; F19-Y67 VanDerWaalsContact O-CD2 3.23Å; F19-Y67 WeakPolarHBondContact O-CD2 3.35Å
20	R	89.8	Confident	88	Confident	87 Å²	87	81.4 Å²	81.4	33%	0.328	42%	0.415	S	S	.	.	H	α-helix	trans	-45.8	-51.1	173.9	-177.9	-178.3	179	-139.4	-9.9	112.1	A13 E14 H16 P17 G22 H68	A13-R20 WeakPolarHBondContact O-CB 3.33Å; A13-R20 PolarHBondContact O-N 2.7Å; E14-R20 IonicContact OE1-CZ 2.66Å; E14-R20 IonicContact OE1-NE 3.66Å; E14-R20 PolarHBondContact OE1-NE 3.11Å; E14-R20 IonicContact OE1-NH2 2.69Å; E14-R20 IonicContact OE2-NE 3.78Å; H16-R20 PolarHBondContact O-N 2.73Å; P17-R20 PolarHBondContact O-N 3.04Å; R20-G22 VanDerWaalsContact C-N 3.29Å; R20-G22 PolarHBondContact O-N 3.16Å; R20-H68 HydrophobicContact CG-CB 3.76Å; R20-H68 PolarHBondContact NE-ND1 3.17Å; R20-H68 PolarHBondContact NH2-CE1 3.03Å; R20-H68 PolarHBondContact NH2-NE2 3.39Å; R20-H68 WeakPolarHBondContact O-CB 3.3Å; R20-H68 PolarHBondContact O-N 3.09Å; R20-H68 VanDerWaalsContact O-N 3.11Å
21	D	89.4	Confident	87.5	Confident	109 Å²	109	88.4 Å²	88.4	58%	0.583	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-0.6	-177.4	-58.6	-26.4	0	0	0	113.1	P17 F19 T66	P17-D21 PolarHBondContact O-N 3.36Å; F19-D21 VanDerWaalsContact C-N 3.26Å; F19-D21 PolarHBondContact O-N 3.26Å; D21-T66 WeakPolarHBondContact O-CG2 3.44Å
22	G	89.4	Confident	86.9	Confident	22 Å²	22	87 Å²	87	23%	0.227	44%	0.441	C	S	.	.	S	Bend	trans	-83.3	155.4	175.5	0	0	0	0	0	112.7	F19 R20 A24 T66 Y67	F19-G22 WeakPolarHBondContact O-CA 3.41Å; F19-G22 PolarHBondContact O-N 3.23Å; R20-G22 VanDerWaalsContact C-N 3.29Å; R20-G22 PolarHBondContact O-N 3.16Å; G22-A24 PolarHBondContact O-N 3.41Å; G22-T66 CarbonylContact O-C 3.27Å; G22-T66 WeakPolarHBondContact O-CA 3.47Å; G22-T66 WeakPolarHBondContact O-CB 3.34Å; G22-Y67 WeakPolarHBondContact O-CD2 3.47Å; G22-Y67 PolarHBondContact O-N 3.33Å
23	Y	90	Very high	86.3	Confident	91 Å²	91	84.5 Å²	84.5	36%	0.357	44%	0.437	S	S	.	.	B	Isolated β-bridge	trans	-58.9	132.9	172.1	-72.2	-68.2	0	0	0	111.4	T27 G28 R29 G64 Y67	Y23-T27 WeakPolarHBondContact CB-OG1 3.01Å; Y23-G28 WeakPolarHBondContact CE1-O 3.3Å; Y23-R29 HydrophobicContact CD2-CG 4.36Å; Y23-R29 HydrophobicContact CE2-CB 4.31Å; Y23-R29 HydrophobicContact CE2-CG 3.45Å; Y23-R29 VanDerWaalsContact CE2-CG 3.45Å; Y23-G64 WeakPolarHBondContact CD1-O 3.21Å; Y23-G64 WeakPolarHBondContact CE1-O 3.45Å; Y23-Y67 WeakPolarHBondContact O-CE2 3.28Å
24	A	87.8	Confident	85.8	Confident	10 Å²	10	88.3 Å²	88.3	8%	0.083	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-62.4	160.2	175.5	0	0	0	0	0	111.6	G22 G26 T27 P65 Y67 V70	G22-A24 PolarHBondContact O-N 3.41Å; A24-G26 PolarHBondContact O-N 3.27Å; A24-T27 HydrophobicContact CB-CG2 4.18Å; A24-T27 PolarHBondContact N-OG1 3.44Å; A24-T27 WeakPolarHBondContact O-CB 3.38Å; A24-T27 PolarHBondContact O-N 2.93Å; A24-T27 PolarHBondContact O-OG1 3.13Å; A24-P65 PolarHBondContact N-O 2.98Å; A24-Y67 HydrophobicContact CB-CD1 4.41Å; A24-Y67 HydrophobicContact CB-CG 4.39Å; A24-V70 HydrophobicContact CB-CG2 3.69Å
25	I	81.4	Confident	85.3	Confident	118 Å²	118	89.3 Å²	89.3	61%	0.605	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	129.6	179.2	-56.7	-177.4	0	0	0	110.5	T27 Y67	I25-T27 VanDerWaalsContact C-N 3.28Å; I25-T27 PolarHBondContact O-N 3.3Å; I25-Y67 HydrophobicContact CG1-CE1 4.11Å; I25-Y67 WeakPolarHBondContact CG1-OH 3.47Å
26	G	79.5	Confident	84.3	Confident	84 Å²	84	89.8 Å²	89.8	87%	0.866	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.7	-5.2	-179.1	0	0	0	0	0	114.7	A24	A24-G26 PolarHBondContact O-N 3.27Å
27	T	84.3	Confident	83.5	Confident	52 Å²	52	90.1 Å²	90.1	32%	0.319	47%	0.473	S	S	.	.			trans	-106.4	177	178.3	79.2	0	0	0	0	111	Y23 A24 I25 P65	Y23-T27 WeakPolarHBondContact CB-OG1 3.01Å; A24-T27 HydrophobicContact CB-CG2 4.18Å; A24-T27 PolarHBondContact N-OG1 3.44Å; A24-T27 WeakPolarHBondContact O-CB 3.38Å; A24-T27 PolarHBondContact O-N 2.93Å; A24-T27 PolarHBondContact O-OG1 3.13Å; I25-T27 VanDerWaalsContact C-N 3.28Å; I25-T27 PolarHBondContact O-N 3.3Å; T27-P65 HydrophobicContact CG2-CG 4Å; T27-P65 PolarHBondContact OG1-O 3.46Å; T27-P65 VanDerWaalsContact OG1-O 3.04Å
28	G	85.4	Confident	82.6	Confident	26 Å²	26	87 Å²	87	27%	0.268	45%	0.452	S	S	.	.			trans	178.7	-174.6	179.1	0	0	0	0	0	113.9	Y23 G63 G64	Y23-G28 WeakPolarHBondContact CE1-O 3.3Å; G28-G63 CarbonylContact O-C 3.55Å; G28-G63 WeakPolarHBondContact O-CA 3.3Å; G28-G64 PolarHBondContact O-N 2.92Å
29	R	85.7	Confident	81.7	Confident	204 Å²	204	82 Å²	82	77%	0.77	45%	0.446	S	S	*	.	S	Bend	trans	-56.8	149.1	174.1	-63.9	-178.4	-175.9	-167.6	-0.7	110.8	Y23 R31	Y23-R29 HydrophobicContact CD2-CG 4.36Å; Y23-R29 HydrophobicContact CE2-CB 4.31Å; Y23-R29 HydrophobicContact CE2-CG 3.45Å; Y23-R29 VanDerWaalsContact CE2-CG 3.45Å; R29-R31 PolarHBondContact O-N 3.19Å
30	W	84.8	Confident	80.9	Confident	74 Å²	74	84.7 Å²	84.7	28%	0.28	46%	0.464	S	S	.	.			trans	-50.6	138.9	172.3	179.6	91.2	0	0	0	111.7	A32 L51 Y54 R61	W30-A32 HydrophobicContact CH2-CB 3.69Å; W30-A32 HydrophobicContact CZ2-CB 4.13Å; W30-A32 HydrophobicContact CZ3-CB 4.27Å; W30-L51 HydrophobicContact CH2-CD2 4.11Å; W30-L51 HydrophobicContact CZ2-CD2 3.83Å; W30-Y54 AromaticContact CE2-CD2 3.8Å; W30-Y54 AromaticContact CZ2-CD2 3.57Å; W30-Y54 HydrophobicContact CZ2-CD2 3.57Å; W30-Y54 HydrophobicContact CZ2-CE2 4.42Å; W30-Y54 HydrophobicContact CZ2-CG 4.15Å; W30-Y54 AromaticContact NE1-CD2 3.69Å; W30-Y54 AromaticContact NE1-CE2 3.77Å; W30-R61 HydrophobicContact CB-CB 4.16Å; W30-R61 HydrophobicContact CD2-CB 4.37Å; W30-R61 HydrophobicContact CD2-CG 4.25Å; W30-R61 HydrophobicContact CE3-CG 4.28Å; W30-R61 HydrophobicContact CG-CB 4.18Å
31	R	79.8	Confident	80	Confident	161 Å²	161	81.4 Å²	81.4	61%	0.608	45%	0.453	S	S	*	.			trans	-138.6	136	175	-66.5	-177.8	-177.9	174.3	3.8	109.5	R29 L33	R29-R31 PolarHBondContact O-N 3.19Å; R31-L33 VanDerWaalsContact C-N 3.33Å; R31-L33 PolarHBondContact O-N 3.29Å
32	A	80	Confident	78.9	Confident	56 Å²	56	80.6 Å²	80.6	46%	0.463	45%	0.446	S	S	.	.			trans	-74.7	84	170.6	0	0	0	0	0	110.4	W30 L51	W30-A32 HydrophobicContact CH2-CB 3.69Å; W30-A32 HydrophobicContact CZ2-CB 4.13Å; W30-A32 HydrophobicContact CZ3-CB 4.27Å; A32-L51 HydrophobicContact CB-CD2 3.75Å
33	L	79.2	Confident	78.5	Confident	84 Å²	84	81.8 Å²	81.8	44%	0.44	45%	0.451	S	S	.	.			trans	-66.8	132.4	170.1	-67.6	177.3	0	0	0	109.3	R31 I37 Y47	R31-L33 VanDerWaalsContact C-N 3.33Å; R31-L33 PolarHBondContact O-N 3.29Å; L33-I37 HydrophobicContact CB-CD1 4.46Å; L33-I37 HydrophobicContact CB-CG1 4.22Å; L33-I37 HydrophobicContact CD2-CD1 4.13Å; L33-Y47 WeakPolarHBondContact O-CE2 3.45Å; L33-Y47 VanDerWaalsContact O-CZ 3.3Å; L33-Y47 PolarHBondContact O-OH 3.01Å
34	P	80.1	Confident	78	Confident	80 Å²	80	85.8 Å²	85.8	52%	0.519	47%	0.465	S	S	.	.			trans	-48.7	143.4	175.2	-26.5	32.6	0	0	0	112.1	A36 I37 N38	P34-A36 PolarHBondContact O-N 3.38Å; P34-I37 HydrophobicContact CB-CG1 4.29Å; P34-I37 HydrophobicContact CG-CD1 4.48Å; P34-I37 HydrophobicContact CG-CG1 4.4Å; P34-I37 CarbonylContact O-C 3.48Å; P34-I37 WeakPolarHBondContact O-CG1 3.48Å; P34-I37 PolarHBondContact O-N 3.37Å; P34-N38 PolarHBondContact O-N 2.93Å; P34-N38 VanDerWaalsContact O-N 3.13Å
35	F	81.2	Confident	77.7	Confident	60 Å²	60	91.5 Å²	91.5	26%	0.263	49%	0.49	S	S	.	.	G	3₁₀ helix	trans	-51.4	-35.9	-178.8	-177.2	-108	0	0	0	113.2	I37 N38 T41 H42 R44 Y47	F35-I37 PolarHBondContact O-N 3.41Å; F35-N38 WeakPolarHBondContact O-CB 3.28Å; F35-N38 PolarHBondContact O-N 3.22Å; F35-N38 VanDerWaalsContact O-N 3.14Å; F35-T41 WeakPolarHBondContact CE2-O 3.47Å; F35-H42 WeakPolarHBondContact CZ-O 3.42Å; F35-R44 HydrophobicContact CD1-CB 4.25Å; F35-R44 HydrophobicContact CD1-CG 3.94Å; F35-R44 HydrophobicContact CE1-CB 3.8Å; F35-R44 HydrophobicContact CE1-CG 3.99Å; F35-R44 HydrophobicContact CE2-CB 4.15Å; F35-R44 HydrophobicContact CG-CG 4.21Å; F35-R44 HydrophobicContact CZ-CB 3.74Å; F35-R44 HydrophobicContact CZ-CG 4.31Å; F35-Y47 HydrophobicContact CB-CD1 3.85Å; F35-Y47 HydrophobicContact CB-CE1 3.76Å; F35-Y47 HydrophobicContact CB-CG 4.32Å; F35-Y47 AromaticContact CD2-CD1 3.79Å; F35-Y47 HydrophobicContact CD2-CD1 3.79Å; F35-Y47 AromaticContact CD2-CD2 3.97Å; F35-Y47 HydrophobicContact CD2-CD2 3.97Å; F35-Y47 HydrophobicContact CD2-CE1 4.47Å; F35-Y47 AromaticContact CD2-CG 3.5Å; F35-Y47 HydrophobicContact CD2-CG 3.5Å; F35-Y47 HydrophobicContact CE2-CG 4.31Å; F35-Y47 HydrophobicContact CG-CD1 4.2Å; F35-Y47 HydrophobicContact CG-CG 4.34Å; F35-Y47 PolarHBondContact N-OH 3.31Å
36	A	72.2	Confident	77.8	Confident	84 Å²	84	92.2 Å²	92.2	69%	0.694	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-60.5	-24.2	179.2	0	0	0	0	0	114.5	P34	P34-A36 PolarHBondContact O-N 3.38Å
37	I	73.5	Confident	78.1	Confident	85 Å²	85	89.8 Å²	89.8	44%	0.436	45%	0.45	S	S	.	.	G	3₁₀ helix	trans	-118.8	11.4	178	64.9	168.4	0	0	0	112.1	L33 P34 F35	L33-I37 HydrophobicContact CB-CD1 4.46Å; L33-I37 HydrophobicContact CB-CG1 4.22Å; L33-I37 HydrophobicContact CD2-CD1 4.13Å; P34-I37 HydrophobicContact CB-CG1 4.29Å; P34-I37 HydrophobicContact CG-CD1 4.48Å; P34-I37 HydrophobicContact CG-CG1 4.4Å; P34-I37 CarbonylContact O-C 3.48Å; P34-I37 WeakPolarHBondContact O-CG1 3.48Å; P34-I37 PolarHBondContact O-N 3.37Å; F35-I37 PolarHBondContact O-N 3.41Å
38	N	68.3	Low	78.2	Confident	27 Å²	27	95 Å²	95	14%	0.144	46%	0.464	C	S	.	.			trans	-79.3	120.4	176.7	171.1	46.4	0	0	0	109.7	P34 F35 L40 T41 Y47	P34-N38 PolarHBondContact O-N 2.93Å; P34-N38 VanDerWaalsContact O-N 3.13Å; F35-N38 WeakPolarHBondContact O-CB 3.28Å; F35-N38 PolarHBondContact O-N 3.22Å; F35-N38 VanDerWaalsContact O-N 3.14Å; N38-L40 PolarHBondContact OD1-N 3.37Å; N38-L40 VanDerWaalsContact OD1-N 3.14Å; N38-T41 WeakPolarHBondContact ND2-CG2 3.29Å; N38-T41 PolarHBondContact ND2-N 2.91Å; N38-T41 VanDerWaalsContact ND2-N 3.15Å; N38-T41 PolarHBondContact ND2-O 3.33Å; N38-Y47 HydrophobicContact CB-CD2 4.31Å; N38-Y47 HydrophobicContact CB-CE2 4.12Å
39	V	67	Low	78.3	Confident	119 Å²	119	101 Å²	101	72%	0.721	48%	0.479	S	S	*	.	S	Bend	trans	-93.8	-9.6	178.1	-63.2	0	0	0	0	113.5
40	L	69.3	Low	78.4	Confident	146 Å²	146	93.4 Å²	93.4	76%	0.764	45%	0.453	S	S	*	.	S	Bend	trans	-91.4	-19.6	-171.2	-61.9	176.5	0	0	0	114.1	N38	N38-L40 PolarHBondContact OD1-N 3.37Å; N38-L40 VanDerWaalsContact OD1-N 3.14Å
41	T	70.8	Confident	78.5	Confident	17 Å²	17	92.3 Å²	92.3	10%	0.104	45%	0.452	C	S	.	.			trans	-151.8	134.4	175.2	-174.8	0	0	0	0	112.3	F35 N38 S43 Y47	F35-T41 WeakPolarHBondContact CE2-O 3.47Å; N38-T41 WeakPolarHBondContact ND2-CG2 3.29Å; N38-T41 PolarHBondContact ND2-N 2.91Å; N38-T41 VanDerWaalsContact ND2-N 3.15Å; N38-T41 PolarHBondContact ND2-O 3.33Å; T41-S43 PolarHBondContact OG1-N 2.83Å; T41-Y47 HydrophobicContact CG2-CD2 4.22Å
42	H	67.3	Low	78.8	Confident	92 Å²	92	93.1 Å²	93.1	43%	0.426	46%	0.456	S	S	.	.	S	Bend	trans	-90.9	-4.8	178.1	-43.8	-65.3	0	0	0	112.9	F35 Q373	F35-H42 WeakPolarHBondContact CZ-O 3.42Å; H42-Q373 PolarHBondContact CE1-O 2.91Å; H42-Q373 VanDerWaalsContact CE1-O 3.22Å; H42-Q373 PolarHBondContact NE2-O 3.34Å
43	S	79.7	Confident	79.2	Confident	48 Å²	48	95.6 Å²	95.6	34%	0.336	46%	0.456	S	S	.	.			trans	-95.4	112.7	178.6	171.6	0	0	0	0	110.5	T41 Q45 R46 Y47	T41-S43 PolarHBondContact OG1-N 2.83Å; S43-Q45 PolarHBondContact O-N 3.04Å; S43-R46 PolarHBondContact O-N 2.72Å; S43-R46 WeakPolarHBondContact OG-CB 3.47Å; S43-R46 PolarHBondContact OG-N 3.01Å; S43-R46 VanDerWaalsContact OG-N 3.08Å; S43-Y47 WeakPolarHBondContact O-CB 3.06Å; S43-Y47 PolarHBondContact O-N 2.87Å
44	R	80.5	Confident	79.6	Confident	174 Å²	174	94.7 Å²	94.7	66%	0.657	45%	0.447	S	S	*	.	H	α-helix	trans	-60.4	-33.7	177.1	-162.5	172.3	-176.1	176.3	0.8	111.8	F35 R48	F35-R44 HydrophobicContact CD1-CB 4.25Å; F35-R44 HydrophobicContact CD1-CG 3.94Å; F35-R44 HydrophobicContact CE1-CB 3.8Å; F35-R44 HydrophobicContact CE1-CG 3.99Å; F35-R44 HydrophobicContact CE2-CB 4.15Å; F35-R44 HydrophobicContact CG-CG 4.21Å; F35-R44 HydrophobicContact CZ-CB 3.74Å; F35-R44 HydrophobicContact CZ-CG 4.31Å; R44-R48 WeakPolarHBondContact O-CB 3.21Å; R44-R48 VanDerWaalsContact O-CG 3.31Å; R44-R48 WeakPolarHBondContact O-CG 3.37Å; R44-R48 PolarHBondContact O-N 2.89Å
45	Q	81.1	Confident	79.9	Confident	131 Å²	131	93.8 Å²	93.8	61%	0.612	45%	0.446	S	S	*	.	H	α-helix	trans	-70.8	-46.4	175.8	-61.8	-61.9	-2.7	0	0	111.9	S43 Y47 R48 R49	S43-Q45 PolarHBondContact O-N 3.04Å; Q45-Y47 VanDerWaalsContact C-N 3.3Å; Q45-Y47 PolarHBondContact O-N 3.49Å; Q45-R48 PolarHBondContact O-N 2.91Å; Q45-R49 WeakPolarHBondContact O-CB 3.38Å; Q45-R49 PolarHBondContact O-N 3.25Å
46	R	83.5	Confident	80.2	Confident	132 Å²	132	96.3 Å²	96.3	50%	0.498	46%	0.463	S	S	.	.	H	α-helix	trans	-59.9	-43.1	174.9	-169	-177.5	-63.4	-175.5	-0.2	111.2	S43 R49 N50	S43-R46 PolarHBondContact O-N 2.72Å; S43-R46 WeakPolarHBondContact OG-CB 3.47Å; S43-R46 PolarHBondContact OG-N 3.01Å; S43-R46 VanDerWaalsContact OG-N 3.08Å; R46-R49 PolarHBondContact O-N 3.24Å; R46-N50 WeakPolarHBondContact O-CB 3.36Å; R46-N50 VanDerWaalsContact O-CG 3.23Å; R46-N50 PolarHBondContact O-N 3.49Å
47	Y	85.7	Confident	81.1	Confident	33 Å²	33	95.4 Å²	95.4	13%	0.129	45%	0.446	C	S	.	.	H	α-helix	trans	-59.2	-50.4	175.1	176.5	-95.1	0	0	0	111.9	L33 F35 N38 T41 S43 Q45 R49 N50 L51	L33-Y47 WeakPolarHBondContact O-CE2 3.45Å; L33-Y47 VanDerWaalsContact O-CZ 3.3Å; L33-Y47 PolarHBondContact O-OH 3.01Å; F35-Y47 HydrophobicContact CB-CD1 3.85Å; F35-Y47 HydrophobicContact CB-CE1 3.76Å; F35-Y47 HydrophobicContact CB-CG 4.32Å; F35-Y47 AromaticContact CD2-CD1 3.79Å; F35-Y47 HydrophobicContact CD2-CD1 3.79Å; F35-Y47 AromaticContact CD2-CD2 3.97Å; F35-Y47 HydrophobicContact CD2-CD2 3.97Å; F35-Y47 HydrophobicContact CD2-CE1 4.47Å; F35-Y47 AromaticContact CD2-CG 3.5Å; F35-Y47 HydrophobicContact CD2-CG 3.5Å; F35-Y47 HydrophobicContact CE2-CG 4.31Å; F35-Y47 HydrophobicContact CG-CD1 4.2Å; F35-Y47 HydrophobicContact CG-CG 4.34Å; F35-Y47 PolarHBondContact N-OH 3.31Å; N38-Y47 HydrophobicContact CB-CD2 4.31Å; N38-Y47 HydrophobicContact CB-CE2 4.12Å; T41-Y47 HydrophobicContact CG2-CD2 4.22Å; S43-Y47 WeakPolarHBondContact O-CB 3.06Å; S43-Y47 PolarHBondContact O-N 2.87Å; Q45-Y47 VanDerWaalsContact C-N 3.3Å; Q45-Y47 PolarHBondContact O-N 3.49Å; Y47-R49 PolarHBondContact O-N 3.28Å; Y47-N50 PolarHBondContact O-N 2.88Å; Y47-L51 HydrophobicContact CD1-CD1 3.96Å; Y47-L51 HydrophobicContact CD1-CG 4.36Å; Y47-L51 HydrophobicContact CE1-CD1 3.24Å; Y47-L51 HydrophobicContact CE1-CG 3.95Å; Y47-L51 HydrophobicContact CE2-CD1 4.35Å; Y47-L51 HydrophobicContact CE2-CG 4.33Å; Y47-L51 VanDerWaalsContact CZ-CD1 3.47Å; Y47-L51 WeakPolarHBondContact O-CB 3.16Å; Y47-L51 WeakPolarHBondContact O-CG 3.45Å; Y47-L51 PolarHBondContact O-N 2.91Å
48	R	86.6	Confident	81.7	Confident	162 Å²	162	94.9 Å²	94.9	61%	0.611	45%	0.448	S	S	*	.	H	α-helix	trans	-60.5	-43.4	176.4	-76.7	177.7	78.2	-178.1	5	112	R44 Q45 L51 R52	R44-R48 WeakPolarHBondContact O-CB 3.21Å; R44-R48 VanDerWaalsContact O-CG 3.31Å; R44-R48 WeakPolarHBondContact O-CG 3.37Å; R44-R48 PolarHBondContact O-N 2.89Å; Q45-R48 PolarHBondContact O-N 2.91Å; R48-L51 PolarHBondContact O-N 3.06Å; R48-R52 WeakPolarHBondContact O-CB 3.24Å; R48-R52 PolarHBondContact O-N 3.24Å
49	R	88.1	Confident	82.6	Confident	152 Å²	152	99.4 Å²	99.4	57%	0.574	48%	0.477	S	S	*	.	H	α-helix	trans	-61.2	-48.3	177.5	-170.2	-176.6	79.6	177.4	8.6	111.3	Q45 R46 Y47 R52 F53	Q45-R49 WeakPolarHBondContact O-CB 3.38Å; Q45-R49 PolarHBondContact O-N 3.25Å; R46-R49 PolarHBondContact O-N 3.24Å; Y47-R49 PolarHBondContact O-N 3.28Å; R49-R52 WeakPolarHBondContact O-CB 3.3Å; R49-R52 PolarHBondContact O-N 3.05Å; R49-F53 HydrophobicContact CG-CD2 3.93Å; R49-F53 HydrophobicContact CG-CE2 3.55Å; R49-F53 HydrophobicContact CG-CZ 4.35Å; R49-F53 WeakPolarHBondContact O-CD2 3.32Å; R49-F53 PolarHBondContact O-N 3.32Å
50	N	86.3	Confident	83.6	Confident	45 Å²	45	97.3 Å²	97.3	24%	0.241	46%	0.461	C	S	.	.	H	α-helix	trans	-65.2	-43.1	179	-72.3	-9	0	0	0	111.5	R46 Y47 R52 F53 Y54	R46-N50 WeakPolarHBondContact O-CB 3.36Å; R46-N50 VanDerWaalsContact O-CG 3.23Å; R46-N50 PolarHBondContact O-N 3.49Å; Y47-N50 PolarHBondContact O-N 2.88Å; N50-R52 PolarHBondContact O-N 3.46Å; N50-F53 PolarHBondContact O-N 2.96Å; N50-Y54 HydrophobicContact CB-CD2 4.46Å; N50-Y54 HydrophobicContact CB-CE2 3.94Å; N50-Y54 WeakPolarHBondContact O-CB 3.22Å; N50-Y54 WeakPolarHBondContact O-CD2 3.42Å; N50-Y54 PolarHBondContact O-N 3.29Å
51	L	87.3	Confident	84.4	Confident	50 Å²	50	94.9 Å²	94.9	26%	0.262	44%	0.442	S	S	.	.	H	α-helix	trans	-57.2	-40.2	173.2	-80.1	-172.2	0	0	0	112.1	W30 A32 Y47 R48 Y54 A55	W30-L51 HydrophobicContact CH2-CD2 4.11Å; W30-L51 HydrophobicContact CZ2-CD2 3.83Å; A32-L51 HydrophobicContact CB-CD2 3.75Å; Y47-L51 HydrophobicContact CD1-CD1 3.96Å; Y47-L51 HydrophobicContact CD1-CG 4.36Å; Y47-L51 HydrophobicContact CE1-CD1 3.24Å; Y47-L51 HydrophobicContact CE1-CG 3.95Å; Y47-L51 HydrophobicContact CE2-CD1 4.35Å; Y47-L51 HydrophobicContact CE2-CG 4.33Å; Y47-L51 VanDerWaalsContact CZ-CD1 3.47Å; Y47-L51 WeakPolarHBondContact O-CB 3.16Å; Y47-L51 WeakPolarHBondContact O-CG 3.45Å; Y47-L51 PolarHBondContact O-N 2.91Å; R48-L51 PolarHBondContact O-N 3.06Å; L51-Y54 PolarHBondContact O-N 3.49Å; L51-A55 WeakPolarHBondContact O-CB 3.41Å; L51-A55 PolarHBondContact O-N 2.75Å
52	R	87.2	Confident	84.8	Confident	178 Å²	178	99.2 Å²	99.2	67%	0.672	47%	0.468	S	S	*	.	H	α-helix	trans	-66.3	-47.7	176.5	-170.3	176.5	-178.4	174.8	2.7	111.5	R48 R49 N50 Y54 A55 D56	R48-R52 WeakPolarHBondContact O-CB 3.24Å; R48-R52 PolarHBondContact O-N 3.24Å; R49-R52 WeakPolarHBondContact O-CB 3.3Å; R49-R52 PolarHBondContact O-N 3.05Å; N50-R52 PolarHBondContact O-N 3.46Å; R52-Y54 VanDerWaalsContact C-N 3.3Å; R52-Y54 PolarHBondContact O-N 3.36Å; R52-A55 WeakPolarHBondContact O-CA 3.49Å; R52-A55 WeakPolarHBondContact O-CB 3.39Å; R52-A55 PolarHBondContact O-N 3.08Å; R52-D56 WeakPolarHBondContact O-CB 3.27Å; R52-D56 VanDerWaalsContact O-CG 3.23Å; R52-D56 PolarHBondContact O-N 2.9Å
53	F	87.1	Confident	85.6	Confident	108 Å²	108	95.8 Å²	95.8	47%	0.474	46%	0.458	S	S	.	.	H	α-helix	trans	-56.2	-44.4	174.1	-77.6	-51.1	0	0	0	112.4	R49 N50 A55 D56 D57 I60	R49-F53 HydrophobicContact CG-CD2 3.93Å; R49-F53 HydrophobicContact CG-CE2 3.55Å; R49-F53 HydrophobicContact CG-CZ 4.35Å; R49-F53 WeakPolarHBondContact O-CD2 3.32Å; R49-F53 PolarHBondContact O-N 3.32Å; N50-F53 PolarHBondContact O-N 2.96Å; F53-A55 VanDerWaalsContact C-N 3.28Å; F53-A55 PolarHBondContact O-N 3.28Å; F53-D56 PolarHBondContact O-N 3.46Å; F53-D57 PolarHBondContact O-N 3.05Å; F53-I60 HydrophobicContact CB-CD1 4.13Å
54	Y	88.4	Confident	85.9	Confident	66 Å²	66	94.9 Å²	94.9	26%	0.259	46%	0.456	S	S	.	.	H	α-helix	trans	-66.8	-30.6	176.1	-61.5	-34	0	0	0	112.5	W30 N50 L51 R52 D57 I60 R61	W30-Y54 AromaticContact CE2-CD2 3.8Å; W30-Y54 AromaticContact CZ2-CD2 3.57Å; W30-Y54 HydrophobicContact CZ2-CD2 3.57Å; W30-Y54 HydrophobicContact CZ2-CE2 4.42Å; W30-Y54 HydrophobicContact CZ2-CG 4.15Å; W30-Y54 AromaticContact NE1-CD2 3.69Å; W30-Y54 AromaticContact NE1-CE2 3.77Å; N50-Y54 HydrophobicContact CB-CD2 4.46Å; N50-Y54 HydrophobicContact CB-CE2 3.94Å; N50-Y54 WeakPolarHBondContact O-CB 3.22Å; N50-Y54 WeakPolarHBondContact O-CD2 3.42Å; N50-Y54 PolarHBondContact O-N 3.29Å; L51-Y54 PolarHBondContact O-N 3.49Å; R52-Y54 VanDerWaalsContact C-N 3.3Å; R52-Y54 PolarHBondContact O-N 3.36Å; Y54-D57 CarbonylContact O-C 3.54Å; Y54-I60 HydrophobicContact CD1-CD1 3.72Å; Y54-I60 HydrophobicContact CD1-CG1 3.93Å; Y54-I60 HydrophobicContact CE1-CD1 4.03Å; Y54-I60 HydrophobicContact CE1-CG1 4.39Å; Y54-R61 HydrophobicContact CD1-CG 4.33Å; Y54-R61 HydrophobicContact CG-CG 4.29Å; Y54-R61 PolarHBondContact O-NE 2.87Å; Y54-R61 PolarHBondContact O-NH2 3.17Å
55	A	85.5	Confident	86.3	Confident	60 Å²	60	89 Å²	89	50%	0.496	44%	0.44	S	S	.	.	H	α-helix	trans	-70	-45.3	174.3	0	0	0	0	0	111.4	L51 R52 F53	L51-A55 WeakPolarHBondContact O-CB 3.41Å; L51-A55 PolarHBondContact O-N 2.75Å; R52-A55 WeakPolarHBondContact O-CA 3.49Å; R52-A55 WeakPolarHBondContact O-CB 3.39Å; R52-A55 PolarHBondContact O-N 3.08Å; F53-A55 VanDerWaalsContact C-N 3.28Å; F53-A55 PolarHBondContact O-N 3.28Å
56	D	89.4	Confident	86.8	Confident	114 Å²	114	84.2 Å²	84.2	61%	0.61	42%	0.42	S	S	*	.	H	α-helix	trans	-70.7	-38.4	-177.3	-64	-18	0	0	0	111.9	R52 F53	R52-D56 WeakPolarHBondContact O-CB 3.27Å; R52-D56 VanDerWaalsContact O-CG 3.23Å; R52-D56 PolarHBondContact O-N 2.9Å; F53-D56 PolarHBondContact O-N 3.46Å
57	D	89.8	Confident	87.3	Confident	64 Å²	64	79.8 Å²	79.8	34%	0.342	40%	0.403	S	S	.	.			trans	-126.5	96.4	174	-174.5	-5	0	0	0	110.8	F53 Y54 T59 I60	F53-D57 PolarHBondContact O-N 3.05Å; Y54-D57 CarbonylContact O-C 3.54Å; D57-T59 VanDerWaalsContact CG-OG1 3.3Å; D57-T59 PolarHBondContact O-N 3.29Å; D57-T59 VanDerWaalsContact OD1-CB 3.29Å; D57-T59 WeakPolarHBondContact OD1-CB 3.42Å; D57-T59 WeakPolarHBondContact OD1-CG2 3.42Å; D57-T59 PolarHBondContact OD1-N 2.92Å; D57-T59 PolarHBondContact OD1-OG1 3.42Å; D57-T59 PolarHBondContact OD2-OG1 2.96Å; D57-I60 HydrophobicContact CB-CD1 4.39Å; D57-I60 HydrophobicContact CB-CG1 4.05Å; D57-I60 WeakPolarHBondContact O-CG1 3.39Å
58	P	86.4	Confident	87.6	Confident	74 Å²	74	80 Å²	80	48%	0.481	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-64.9	-17.1	176.8	-24.1	34.9	0	0	0	114.7	I60 R61	P58-I60 VanDerWaalsContact C-N 3.34Å; P58-R61 WeakPolarHBondContact O-CB 3.36Å; P58-R61 WeakPolarHBondContact O-CG 3.15Å; P58-R61 PolarHBondContact O-N 3.45Å
59	T	87.5	Confident	87.9	Confident	123 Å²	123	79.9 Å²	79.9	76%	0.755	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-73.4	-26.8	-175	72.3	0	0	0	0	112.6	D57 R61	D57-T59 VanDerWaalsContact CG-OG1 3.3Å; D57-T59 PolarHBondContact O-N 3.29Å; D57-T59 VanDerWaalsContact OD1-CB 3.29Å; D57-T59 WeakPolarHBondContact OD1-CB 3.42Å; D57-T59 WeakPolarHBondContact OD1-CG2 3.42Å; D57-T59 PolarHBondContact OD1-N 2.92Å; D57-T59 PolarHBondContact OD1-OG1 3.42Å; D57-T59 PolarHBondContact OD2-OG1 2.96Å; T59-R61 VanDerWaalsContact C-N 3.26Å; T59-R61 PolarHBondContact O-N 3.45Å
60	I	88	Confident	88	Confident	74 Å²	74	74.5 Å²	74.5	38%	0.379	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-81.9	4	176.1	58.4	157.4	0	0	0	113.8	F53 Y54 D57 P58 V62	F53-I60 HydrophobicContact CB-CD1 4.13Å; Y54-I60 HydrophobicContact CD1-CD1 3.72Å; Y54-I60 HydrophobicContact CD1-CG1 3.93Å; Y54-I60 HydrophobicContact CE1-CD1 4.03Å; Y54-I60 HydrophobicContact CE1-CG1 4.39Å; D57-I60 HydrophobicContact CB-CD1 4.39Å; D57-I60 HydrophobicContact CB-CG1 4.05Å; D57-I60 WeakPolarHBondContact O-CG1 3.39Å; P58-I60 VanDerWaalsContact C-N 3.34Å; I60-V62 PolarHBondContact O-N 3.09Å
61	R	86.2	Confident	88.3	Confident	96 Å²	96	75 Å²	75	36%	0.362	39%	0.387	S	S	.	.			trans	-75.8	93.4	177.4	-66.9	177.9	-170.1	172.3	8.3	110.8	W30 Y54 P58 T59	W30-R61 HydrophobicContact CB-CB 4.16Å; W30-R61 HydrophobicContact CD2-CB 4.37Å; W30-R61 HydrophobicContact CD2-CG 4.25Å; W30-R61 HydrophobicContact CE3-CG 4.28Å; W30-R61 HydrophobicContact CG-CB 4.18Å; Y54-R61 HydrophobicContact CD1-CG 4.33Å; Y54-R61 HydrophobicContact CG-CG 4.29Å; Y54-R61 PolarHBondContact O-NE 2.87Å; Y54-R61 PolarHBondContact O-NH2 3.17Å; P58-R61 WeakPolarHBondContact O-CB 3.36Å; P58-R61 WeakPolarHBondContact O-CG 3.15Å; P58-R61 PolarHBondContact O-N 3.45Å; T59-R61 VanDerWaalsContact C-N 3.26Å; T59-R61 PolarHBondContact O-N 3.45Å
62	V	79.8	Confident	88.6	Confident	107 Å²	107	76.4 Å²	76.4	65%	0.648	39%	0.393	S	S	*	.			trans	-82.2	125.8	174.9	-166.8	0	0	0	0	109.8	I60	I60-V62 PolarHBondContact O-N 3.09Å
63	G	84.1	Confident	88.7	Confident	21 Å²	21	71.8 Å²	71.8	22%	0.216	39%	0.387	C	S	.	.			trans	-78.8	-162	170.9	0	0	0	0	0	112	G28	G28-G63 CarbonylContact O-C 3.55Å; G28-G63 WeakPolarHBondContact O-CA 3.3Å
64	G	84.9	Confident	88.7	Confident	28 Å²	28	69.6 Å²	69.6	29%	0.289	38%	0.38	S	S	.	.	S	Bend	trans	-71.9	173.6	167.9	0	0	0	0	0	112.6	Y23 G28	Y23-G64 WeakPolarHBondContact CD1-O 3.21Å; Y23-G64 WeakPolarHBondContact CE1-O 3.45Å; G28-G64 PolarHBondContact O-N 2.92Å
65	P	89.3	Confident	88.8	Confident	51 Å²	51	69 Å²	69	33%	0.331	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-69.6	147.1	-177.3	28.3	-35.3	0	0	0	112.5	A24 T27 W69 V70	A24-P65 PolarHBondContact N-O 2.98Å; T27-P65 HydrophobicContact CG2-CG 4Å; T27-P65 PolarHBondContact OG1-O 3.46Å; T27-P65 VanDerWaalsContact OG1-O 3.04Å; P65-W69 HydrophobicContact CB-CB 4Å; P65-V70 HydrophobicContact CB-CG2 3.85Å; P65-V70 HydrophobicContact CG-CG2 3.8Å
66	T	92.1	Very high	89.1	Confident	30 Å²	30	68.4 Å²	68.4	18%	0.184	38%	0.376	C	S	.	.	B	Isolated β-bridge	trans	-75.8	166.1	170.3	59.4	0	0	0	0	111.3	D21 G22 H68 W69 V70	D21-T66 WeakPolarHBondContact O-CG2 3.44Å; G22-T66 CarbonylContact O-C 3.27Å; G22-T66 WeakPolarHBondContact O-CA 3.47Å; G22-T66 WeakPolarHBondContact O-CB 3.34Å; T66-H68 PolarHBondContact O-N 3.38Å; T66-W69 PolarHBondContact O-N 3.4Å; T66-W69 PolarHBondContact OG1-N 3.5Å; T66-W69 VanDerWaalsContact OG1-N 3.17Å; T66-V70 WeakPolarHBondContact O-CG2 3.5Å; T66-V70 PolarHBondContact O-N 2.82Å
67	Y	92.7	Very high	89.1	Confident	39 Å²	39	64.7 Å²	64.7	15%	0.153	37%	0.365	C	S	.	.	H	α-helix	trans	-54.9	-42.5	171.7	-77.2	-87.1	0	0	0	111.4	I9 L10 A13 F19 G22 Y23 A24 I25 V70 R71	I9-Y67 HydrophobicContact CG2-CD1 4.46Å; I9-Y67 HydrophobicContact CG2-CE1 3.89Å; L10-Y67 HydrophobicContact CD2-CD1 4.14Å; L10-Y67 WeakPolarHBondContact CD2-O 3.07Å; A13-Y67 HydrophobicContact CB-CD1 3.76Å; A13-Y67 HydrophobicContact CB-CE1 4.43Å; A13-Y67 HydrophobicContact CB-CG 3.81Å; F19-Y67 VanDerWaalsContact O-CD2 3.23Å; F19-Y67 WeakPolarHBondContact O-CD2 3.35Å; G22-Y67 WeakPolarHBondContact O-CD2 3.47Å; G22-Y67 PolarHBondContact O-N 3.33Å; Y23-Y67 WeakPolarHBondContact O-CE2 3.28Å; A24-Y67 HydrophobicContact CB-CD1 4.41Å; A24-Y67 HydrophobicContact CB-CG 4.39Å; I25-Y67 HydrophobicContact CG1-CE1 4.11Å; I25-Y67 WeakPolarHBondContact CG1-OH 3.47Å; Y67-V70 PolarHBondContact O-N 3.22Å; Y67-R71 WeakPolarHBondContact O-CB 3.29Å; Y67-R71 PolarHBondContact O-N 3.17Å
68	H	93.9	Very high	89	Confident	38 Å²	38	65 Å²	65	18%	0.176	36%	0.364	C	S	.	.	H	α-helix	trans	-57.8	-50.8	174.9	-173.5	51	0	0	0	111.9	E14 R20 T66 V70 R71 E72	E14-H68 VanDerWaalsContact CD-ND1 3.3Å; E14-H68 IonicContact OE1-CE1 3.57Å; E14-H68 PolarHBondContact OE1-CE1 2.86Å; E14-H68 VanDerWaalsContact OE1-CE1 3.31Å; E14-H68 IonicContact OE1-ND1 2.72Å; E14-H68 PolarHBondContact OE1-ND1 3.48Å; E14-H68 IonicContact OE2-CE1 2.78Å; E14-H68 IonicContact OE2-CG 3.01Å; E14-H68 IonicContact OE2-ND1 3.29Å; E14-H68 PolarHBondContact OE2-ND1 3.38Å; R20-H68 HydrophobicContact CG-CB 3.76Å; R20-H68 PolarHBondContact NE-ND1 3.17Å; R20-H68 PolarHBondContact NH2-CE1 3.03Å; R20-H68 PolarHBondContact NH2-NE2 3.39Å; R20-H68 WeakPolarHBondContact O-CB 3.3Å; R20-H68 PolarHBondContact O-N 3.09Å; R20-H68 VanDerWaalsContact O-N 3.11Å; T66-H68 PolarHBondContact O-N 3.38Å; H68-V70 PolarHBondContact O-N 3.1Å; H68-R71 WeakPolarHBondContact O-CB 3.46Å; H68-R71 PolarHBondContact O-N 3.32Å; H68-R71 VanDerWaalsContact O-N 3.14Å; H68-E72 VanDerWaalsContact CE1-CG 3.5Å; H68-E72 WeakPolarHBondContact CE1-CG 3.47Å; H68-E72 IonicContact CE1-OE1 3.31Å; H68-E72 WeakPolarHBondContact O-CG 3.45Å; H68-E72 PolarHBondContact O-N 3.02Å
69	W	91.8	Very high	89.3	Confident	160 Å²	160	68.1 Å²	68.1	61%	0.606	37%	0.372	S	S	*	.	H	α-helix	trans	-61.5	-41.1	179.6	-86.9	34.4	0	0	0	113.2	P65 T66 R71 S73	P65-W69 HydrophobicContact CB-CB 4Å; T66-W69 PolarHBondContact O-N 3.4Å; T66-W69 PolarHBondContact OG1-N 3.5Å; T66-W69 VanDerWaalsContact OG1-N 3.17Å; W69-R71 VanDerWaalsContact C-N 3.31Å; W69-R71 PolarHBondContact O-N 3.14Å; W69-S73 VanDerWaalsContact O-CB 3.31Å; W69-S73 WeakPolarHBondContact O-CB 3.26Å; W69-S73 PolarHBondContact O-N 3.04Å; W69-S73 PolarHBondContact O-OG 3.25Å
70	V	90.4	Very high	89.4	Confident	38 Å²	38	66.4 Å²	66.4	23%	0.23	36%	0.361	C	S	.	.	H	α-helix	trans	-62.6	-42.4	176.1	175.8	0	0	0	0	110.4	L10 A24 P65 T66 Y67 H68 S73 I74	L10-V70 HydrophobicContact CD1-CG1 4.06Å; L10-V70 HydrophobicContact CD2-CB 3.96Å; L10-V70 HydrophobicContact CD2-CG1 3.86Å; A24-V70 HydrophobicContact CB-CG2 3.69Å; P65-V70 HydrophobicContact CB-CG2 3.85Å; P65-V70 HydrophobicContact CG-CG2 3.8Å; T66-V70 WeakPolarHBondContact O-CG2 3.5Å; T66-V70 PolarHBondContact O-N 2.82Å; Y67-V70 PolarHBondContact O-N 3.22Å; H68-V70 PolarHBondContact O-N 3.1Å; V70-S73 PolarHBondContact O-N 2.76Å; V70-I74 HydrophobicContact CG1-CD1 4.1Å; V70-I74 WeakPolarHBondContact O-CG1 3.36Å; V70-I74 PolarHBondContact O-N 3.06Å; V70-I74 VanDerWaalsContact O-N 3.09Å
71	R	92	Very high	89.5	Confident	55 Å²	55	64.6 Å²	64.6	21%	0.208	35%	0.353	C	S	.	.	H	α-helix	trans	-63.5	-50.7	177.9	-175.2	178.8	168.8	-81.3	-0.7	111.7	L10 N11 Y67 H68 W69 S73 I74 L75	L10-R71 HydrophobicContact CB-CB 4.15Å; L10-R71 HydrophobicContact CB-CG 4.26Å; L10-R71 HydrophobicContact CD2-CB 4.22Å; N11-R71 PolarHBondContact OD1-NE 3.25Å; Y67-R71 WeakPolarHBondContact O-CB 3.29Å; Y67-R71 PolarHBondContact O-N 3.17Å; H68-R71 WeakPolarHBondContact O-CB 3.46Å; H68-R71 PolarHBondContact O-N 3.32Å; H68-R71 VanDerWaalsContact O-N 3.14Å; W69-R71 VanDerWaalsContact C-N 3.31Å; W69-R71 PolarHBondContact O-N 3.14Å; R71-S73 VanDerWaalsContact C-N 3.27Å; R71-S73 PolarHBondContact O-N 3.15Å; R71-I74 PolarHBondContact O-N 3.05Å; R71-L75 HydrophobicContact CG-CD1 4.18Å; R71-L75 WeakPolarHBondContact O-CG 3.41Å; R71-L75 PolarHBondContact O-N 3.04Å
72	E	93.3	Very high	89.8	Confident	81 Å²	81	64 Å²	64	38%	0.379	37%	0.368	S	S	.	.	H	α-helix	trans	-60.7	-38.2	178.2	-67.6	-54.7	121.3	0	0	111.5	H68 I74 L75 A76	H68-E72 VanDerWaalsContact CE1-CG 3.5Å; H68-E72 WeakPolarHBondContact CE1-CG 3.47Å; H68-E72 IonicContact CE1-OE1 3.31Å; H68-E72 WeakPolarHBondContact O-CG 3.45Å; H68-E72 PolarHBondContact O-N 3.02Å; E72-I74 PolarHBondContact O-N 3.33Å; E72-L75 PolarHBondContact O-N 2.79Å; E72-A76 VanDerWaalsContact O-CB 3.26Å; E72-A76 WeakPolarHBondContact O-CB 3.47Å; E72-A76 PolarHBondContact O-N 2.87Å
73	S	89.4	Confident	90.3	Very high	80 Å²	80	60.3 Å²	60.3	56%	0.559	35%	0.352	S	S	*	.	H	α-helix	trans	-63.1	-41.4	176.2	-57.7	0	0	0	0	112.2	W69 V70 R71 G77	W69-S73 VanDerWaalsContact O-CB 3.31Å; W69-S73 WeakPolarHBondContact O-CB 3.26Å; W69-S73 PolarHBondContact O-N 3.04Å; W69-S73 PolarHBondContact O-OG 3.25Å; V70-S73 PolarHBondContact O-N 2.76Å; R71-S73 VanDerWaalsContact C-N 3.27Å; R71-S73 PolarHBondContact O-N 3.15Å; S73-G77 PolarHBondContact O-N 3.38Å
74	I	88.3	Confident	90.6	Very high	63 Å²	63	59.4 Å²	59.4	32%	0.323	34%	0.342	S	S	.	.	H	α-helix	trans	-66.9	-45.7	176.6	-71	169.1	0	0	0	110.5	L10 V70 R71 E72 A76 G77 E78	L10-I74 HydrophobicContact CD1-CD1 3.54Å; V70-I74 HydrophobicContact CG1-CD1 4.1Å; V70-I74 WeakPolarHBondContact O-CG1 3.36Å; V70-I74 PolarHBondContact O-N 3.06Å; V70-I74 VanDerWaalsContact O-N 3.09Å; R71-I74 PolarHBondContact O-N 3.05Å; E72-I74 PolarHBondContact O-N 3.33Å; I74-A76 PolarHBondContact O-N 3.39Å; I74-G77 PolarHBondContact O-N 3.47Å; I74-E78 VanDerWaalsContact CG2-OE1 3.24Å; I74-E78 WeakPolarHBondContact CG2-OE1 3.4Å; I74-E78 WeakPolarHBondContact O-CG 3.23Å; I74-E78 PolarHBondContact O-N 3.35Å
75	L	90.6	Very high	90.8	Very high	54 Å²	54	59.1 Å²	59.1	28%	0.283	34%	0.34	S	S	.	.	H	α-helix	trans	-61.9	-43.3	178.2	-70.4	175.5	0	0	0	112	R71 E72 E78 Q79	R71-L75 HydrophobicContact CG-CD1 4.18Å; R71-L75 WeakPolarHBondContact O-CG 3.41Å; R71-L75 PolarHBondContact O-N 3.04Å; E72-L75 PolarHBondContact O-N 2.79Å; L75-E78 PolarHBondContact O-N 3.1Å; L75-Q79 WeakPolarHBondContact O-CB 3.46Å; L75-Q79 VanDerWaalsContact O-CG 3.31Å; L75-Q79 WeakPolarHBondContact O-CG 3.34Å; L75-Q79 PolarHBondContact O-N 3.23Å
76	A	91.2	Very high	90.8	Very high	47 Å²	47	63.8 Å²	63.8	39%	0.388	36%	0.361	S	S	.	.	H	α-helix	trans	-61.3	-46	175.6	0	0	0	0	0	111.2	E72 I74 E78 Q79 V80	E72-A76 VanDerWaalsContact O-CB 3.26Å; E72-A76 WeakPolarHBondContact O-CB 3.47Å; E72-A76 PolarHBondContact O-N 2.87Å; I74-A76 PolarHBondContact O-N 3.39Å; A76-E78 VanDerWaalsContact C-N 3.32Å; A76-E78 PolarHBondContact O-N 3Å; A76-Q79 PolarHBondContact O-N 3.19Å; A76-V80 VanDerWaalsContact O-CG2 3.27Å; A76-V80 WeakPolarHBondContact O-CG2 3.42Å; A76-V80 PolarHBondContact O-N 2.65Å
77	G	89.2	Confident	90.5	Very high	36 Å²	36	65.1 Å²	65.1	37%	0.371	37%	0.367	S	S	.	.	H	α-helix	trans	-60	-40.9	175.9	0	0	0	0	0	113	S73 I74 V80 L81	S73-G77 PolarHBondContact O-N 3.38Å; I74-G77 PolarHBondContact O-N 3.47Å; G77-V80 PolarHBondContact O-N 2.9Å; G77-L81 WeakPolarHBondContact O-CG 3.35Å; G77-L81 PolarHBondContact O-N 3.23Å
78	E	89	Confident	90.2	Very high	69 Å²	69	66.1 Å²	66.1	32%	0.322	38%	0.384	S	S	.	.	H	α-helix	trans	-67.3	-40.6	176.2	-72.6	175.1	-162.1	0	0	112.6	R7 I74 L75 A76 L81 A82	R7-E78 IonicContact CZ-OE1 2.72Å; R7-E78 VanDerWaalsContact CZ-OE1 3.31Å; R7-E78 IonicContact CZ-OE2 3.56Å; R7-E78 IonicContact NE-OE1 3.87Å; R7-E78 IonicContact NH1-OE2 3.11Å; R7-E78 IonicContact NH2-OE1 2.6Å; R7-E78 PolarHBondContact NH2-OE1 3.14Å; R7-E78 IonicContact NH2-OE2 2.96Å; R7-E78 PolarHBondContact NH2-OE2 3.47Å; I74-E78 VanDerWaalsContact CG2-OE1 3.24Å; I74-E78 WeakPolarHBondContact CG2-OE1 3.4Å; I74-E78 WeakPolarHBondContact O-CG 3.23Å; I74-E78 PolarHBondContact O-N 3.35Å; L75-E78 PolarHBondContact O-N 3.1Å; A76-E78 VanDerWaalsContact C-N 3.32Å; A76-E78 PolarHBondContact O-N 3Å; E78-L81 PolarHBondContact O-N 3.06Å; E78-A82 WeakPolarHBondContact O-CB 3.44Å; E78-A82 PolarHBondContact O-N 2.76Å
79	Q	91.6	Very high	90	Very high	140 Å²	140	68.2 Å²	68.2	65%	0.654	40%	0.4	S	S	*	.	H	α-helix	trans	-63.7	-42.3	174.8	-75.3	173.8	-3.7	0	0	111.9	L75 A76 L81 A82 G83	L75-Q79 WeakPolarHBondContact O-CB 3.46Å; L75-Q79 VanDerWaalsContact O-CG 3.31Å; L75-Q79 WeakPolarHBondContact O-CG 3.34Å; L75-Q79 PolarHBondContact O-N 3.23Å; A76-Q79 PolarHBondContact O-N 3.19Å; Q79-L81 PolarHBondContact O-N 2.77Å; Q79-A82 PolarHBondContact O-N 3.02Å; Q79-G83 PolarHBondContact O-N 3.01Å
80	V	89.6	Confident	89.8	Confident	87 Å²	87	66.7 Å²	66.7	53%	0.527	41%	0.41	S	S	.	.	H	α-helix	trans	-60.1	-46	175.5	168.8	0	0	0	0	110.7	A76 G77 G83 A84 F110	A76-V80 VanDerWaalsContact O-CG2 3.27Å; A76-V80 WeakPolarHBondContact O-CG2 3.42Å; A76-V80 PolarHBondContact O-N 2.65Å; G77-V80 PolarHBondContact O-N 2.9Å; V80-G83 PolarHBondContact O-N 3.47Å; V80-A84 WeakPolarHBondContact O-CB 3.46Å; V80-A84 PolarHBondContact O-N 3.18Å; V80-F110 HydrophobicContact CG1-CD2 4.14Å; V80-F110 HydrophobicContact CG1-CE2 4.09Å
81	L	90.6	Very high	89.7	Confident	37 Å²	37	66.5 Å²	66.5	19%	0.194	41%	0.409	C	S	.	.	H	α-helix	trans	-67	-37.5	177.1	-70.5	174.3	0	0	0	112.3	G77 E78 Q79 A84 M106 R109 F110 L113	G77-L81 WeakPolarHBondContact O-CG 3.35Å; G77-L81 PolarHBondContact O-N 3.23Å; E78-L81 PolarHBondContact O-N 3.06Å; Q79-L81 PolarHBondContact O-N 2.77Å; L81-A84 WeakPolarHBondContact O-CB 3.3Å; L81-A84 PolarHBondContact O-N 2.82Å; L81-M106 HydrophobicContact CD1-SD 4.06Å; L81-R109 HydrophobicContact CD2-CB 4.45Å; L81-R109 HydrophobicContact CD2-CG 4.3Å; L81-F110 HydrophobicContact CD2-CB 3.85Å; L81-F110 HydrophobicContact CD2-CD2 4.36Å; L81-L113 HydrophobicContact CB-CD1 4.23Å; L81-L113 HydrophobicContact CD2-CD1 4.14Å; L81-L113 WeakPolarHBondContact O-CD1 3.31Å
82	A	91.2	Very high	89.6	Confident	83 Å²	83	68 Å²	68	69%	0.686	42%	0.421	S	S	*	.	H	α-helix	trans	-64.8	-38.2	177.8	0	0	0	0	0	112.5	E78 Q79	E78-A82 WeakPolarHBondContact O-CB 3.44Å; E78-A82 PolarHBondContact O-N 2.76Å; Q79-A82 PolarHBondContact O-N 3.02Å
83	G	91.9	Very high	89.4	Confident	30 Å²	30	65.6 Å²	65.6	31%	0.309	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-1.2	176.5	0	0	0	0	0	114.8	Q79 V80 G85 D86 D87	Q79-G83 PolarHBondContact O-N 3.01Å; V80-G83 PolarHBondContact O-N 3.47Å; G83-G85 PolarHBondContact O-N 3.24Å; G83-G85 VanDerWaalsContact O-N 3.14Å; G83-D86 PolarHBondContact O-N 2.86Å; G83-D87 PolarHBondContact O-N 3.36Å
84	A	90	Very high	89.2	Confident	1 Å²	1	66.1 Å²	66.1	1%	0.008	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-29.9	-173.5	0	0	0	0	0	113.3	V80 L81 F110 L113 R114	V80-A84 WeakPolarHBondContact O-CB 3.46Å; V80-A84 PolarHBondContact O-N 3.18Å; L81-A84 WeakPolarHBondContact O-CB 3.3Å; L81-A84 PolarHBondContact O-N 2.82Å; A84-F110 HydrophobicContact CB-CD2 3.56Å; A84-F110 HydrophobicContact CB-CE2 3.57Å; A84-F110 HydrophobicContact CB-CG 4.5Å; A84-L113 HydrophobicContact CB-CB 4.06Å; A84-L113 HydrophobicContact CB-CD1 4.39Å; A84-R114 HydrophobicContact CB-CG 4.49Å; A84-R114 WeakPolarHBondContact O-CD 3.43Å; A84-R114 WeakPolarHBondContact O-CG 3.5Å
85	G	88.7	Confident	89	Confident	23 Å²	23	63.8 Å²	63.8	24%	0.237	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-26.2	178	0	0	0	0	0	114.4	G83 A117	G83-G85 PolarHBondContact O-N 3.24Å; G83-G85 VanDerWaalsContact O-N 3.14Å; G85-A117 VanDerWaalsContact CA-CB 3.46Å; G85-A117 WeakPolarHBondContact O-CB 3.47Å
86	D	90.1	Very high	88.2	Confident	148 Å²	148	62 Å²	62	79%	0.791	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-13.6	-176.2	-60.2	-36.4	0	0	0	112.5	G83 A88	G83-D86 PolarHBondContact O-N 2.86Å; D86-A88 PolarHBondContact O-N 3Å
87	D	85.1	Confident	87.1	Confident	58 Å²	58	64.3 Å²	64.3	31%	0.31	39%	0.39	S	S	.	.			trans	-86.9	102.6	179.6	179.3	21.1	0	0	0	112.3	G83 T89 R114	G83-D87 PolarHBondContact O-N 3.36Å; D87-T89 VanDerWaalsContact C-N 3.3Å; D87-T89 PolarHBondContact O-N 3.46Å; D87-T89 WeakPolarHBondContact OD1-CB 3.49Å; D87-T89 PolarHBondContact OD1-N 3.18Å; D87-T89 PolarHBondContact OD1-OG1 3.32Å; D87-R114 PolarHBondContact O-NH1 3.35Å; D87-R114 VanDerWaalsContact O-NH1 3.12Å; D87-R114 IonicContact OD2-NH1 3.57Å
88	A	87.3	Confident	85.9	Confident	60 Å²	60	66 Å²	66	50%	0.496	39%	0.388	S	S	.	.			trans	-82.9	1.5	176	0	0	0	0	0	114.3	D86	D86-A88 PolarHBondContact O-N 3Å
89	T	89.5	Confident	84.8	Confident	83 Å²	83	65.9 Å²	65.9	51%	0.509	39%	0.388	S	S	.	.	S	Bend	trans	-60.9	133	-179.5	-51	0	0	0	0	110	D87 T91 R114	D87-T89 VanDerWaalsContact C-N 3.3Å; D87-T89 PolarHBondContact O-N 3.46Å; D87-T89 WeakPolarHBondContact OD1-CB 3.49Å; D87-T89 PolarHBondContact OD1-N 3.18Å; D87-T89 PolarHBondContact OD1-OG1 3.32Å; T89-T91 PolarHBondContact O-N 2.88Å; T89-T91 PolarHBondContact O-OG1 3.3Å; T89-T91 VanDerWaalsContact O-OG1 3.1Å; T89-R114 PolarHBondContact O-NH1 2.72Å; T89-R114 PolarHBondContact O-NH2 2.76Å
90	P	87.7	Confident	83.5	Confident	127 Å²	127	68 Å²	68	83%	0.825	39%	0.39	S	S	*	.			trans	-58.8	121.5	170.3	-25	35.1	0	0	0	110.6
91	T	88.4	Confident	82.5	Confident	34 Å²	34	69.8 Å²	69.8	21%	0.209	40%	0.401	C	S	.	.			trans	-129.1	124.6	-171.2	-61.5	0	0	0	0	110.9	T89 F110 R114 V121 E122	T89-T91 PolarHBondContact O-N 2.88Å; T89-T91 PolarHBondContact O-OG1 3.3Å; T89-T91 VanDerWaalsContact O-OG1 3.1Å; T91-F110 HydrophobicContact CG2-CE1 4.44Å; T91-R114 PolarHBondContact OG1-NH1 3.33Å; T91-V121 HydrophobicContact CG2-CG1 4.35Å; T91-V121 CarbonylContact O-C 3.49Å; T91-V121 WeakPolarHBondContact O-CA 3.48Å; T91-V121 WeakPolarHBondContact O-CB 3.42Å; T91-E122 PolarHBondContact O-N 2.84Å
92	L	89.7	Confident	81.7	Confident	88 Å²	88	71.3 Å²	71.3	46%	0.461	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-101.4	118.7	164.8	174.8	65.5	0	0	0	108.5	L94 E122 L127	L92-L94 HydrophobicContact CD2-CD2 4.13Å; L92-L94 HydrophobicContact CG-CD2 4.09Å; L92-E122 HydrophobicContact CB-CB 4.37Å; L92-E122 HydrophobicContact CD1-CB 4.07Å; L92-E122 HydrophobicContact CD1-CG 4.44Å; L92-L127 HydrophobicContact CD1-CB 4.26Å; L92-L127 HydrophobicContact CD1-CD2 4.45Å
93	L	88.9	Confident	81.2	Confident	30 Å²	30	70.2 Å²	70.2	16%	0.157	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-100.9	120.6	179.8	-171.1	61.6	0	0	0	110.2	H107 F110 P126 L127	L93-H107 HydrophobicContact CD2-CB 3.67Å; L93-H107 HydrophobicContact CG-CB 4.48Å; L93-F110 HydrophobicContact CD2-CD1 4.19Å; L93-P126 HydrophobicContact CD2-CB 4.3Å; L93-P126 HydrophobicContact CD2-CG 4.1Å; L93-P126 HydrophobicContact CG-CB 4.32Å; L93-P126 CarbonylContact O-C 3.46Å; L93-P126 WeakPolarHBondContact O-CA 3.34Å; L93-L127 PolarHBondContact O-N 2.94Å
94	L	85.3	Confident	80.9	Confident	90 Å²	90	70 Å²	70	47%	0.471	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	135.4	176.7	-56.6	-177.4	0	0	0	110.3	L92 L127 I129	L92-L94 HydrophobicContact CD2-CD2 4.13Å; L92-L94 HydrophobicContact CG-CD2 4.09Å; L94-L127 WeakPolarHBondContact CA-O 3.48Å; L94-L127 HydrophobicContact CD2-CB 3.89Å; L94-L127 HydrophobicContact CD2-CD2 3.74Å; L94-L127 HydrophobicContact CD2-CG 4.22Å; L94-I129 HydrophobicContact CB-CD1 4.13Å; L94-I129 HydrophobicContact CD1-CD1 4.36Å
95	Q	82.9	Confident	80.7	Confident	15 Å²	15	78.1 Å²	78.1	7%	0.07	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	134	-178	-179.2	176.7	-32.1	0	0	110.5	N104 P126 L127 V128 I129	Q95-N104 HydrophobicContact CG-CB 4.35Å; Q95-N104 WeakPolarHBondContact CG-OD1 3.38Å; Q95-N104 PolarHBondContact NE2-ND2 3.31Å; Q95-N104 VanDerWaalsContact NE2-ND2 3.18Å; Q95-P126 HydrophobicContact CB-CB 3.8Å; Q95-P126 VanDerWaalsContact OE1-CG 3.24Å; Q95-L127 PolarHBondContact N-O 2.88Å; Q95-V128 HydrophobicContact CB-CG2 4.33Å; Q95-V128 CarbonylContact O-C 3.5Å; Q95-V128 VanDerWaalsContact O-CA 3.23Å; Q95-V128 WeakPolarHBondContact O-CA 3.41Å; Q95-I129 PolarHBondContact O-N 3.22Å
96	A	74.7	Confident	80.7	Confident	17 Å²	17	81.3 Å²	81.3	14%	0.14	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	127.6	171.1	0	0	0	0	0	109.5	E98 E99 N104	A96-E98 VanDerWaalsContact C-N 3.3Å; A96-E98 PolarHBondContact O-N 3.13Å; A96-E99 HydrophobicContact CB-CB 4.01Å; A96-E99 PolarHBondContact O-N 3.26Å; A96-N104 PolarHBondContact O-ND2 3.47Å; A96-N104 PolarHBondContact O-OD1 2.84Å
97	E	68	Low	80.7	Confident	95 Å²	95	76.5 Å²	76.5	44%	0.444	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-42.7	-170.9	-175.2	162.4	-152.6	0	0	113.2	N104 V128 I129 K130	E97-N104 PolarHBondContact O-ND2 3.03Å; E97-V128 HydrophobicContact CB-CG1 3.61Å; E97-V128 HydrophobicContact CG-CG1 4.22Å; E97-I129 PolarHBondContact N-O 2.93Å; E97-K130 IonicContact OE1-NZ 3.38Å; E97-K130 PolarHBondContact OE1-NZ 3.01Å; E97-K130 WeakPolarHBondContact OE2-CD 3.38Å; E97-K130 WeakPolarHBondContact OE2-CE 3.39Å; E97-K130 WeakPolarHBondContact OE2-CG 3.32Å; E97-K130 IonicContact OE2-NZ 2.92Å; E97-K130 PolarHBondContact OE2-NZ 3.26Å
98	E	63.7	Low	80.9	Confident	72 Å²	72	77 Å²	77	34%	0.336	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.5	23.9	-174.3	-56.5	-157.4	155.2	0	0	114.6	A96 R100 I374 L375	A96-E98 VanDerWaalsContact C-N 3.3Å; A96-E98 PolarHBondContact O-N 3.13Å; E98-R100 PolarHBondContact O-N 3.13Å; E98-I374 VanDerWaalsContact C-CD1 3.46Å; E98-I374 HydrophobicContact CB-CB 4.11Å; E98-I374 HydrophobicContact CB-CD1 3.71Å; E98-I374 HydrophobicContact CB-CG1 4.47Å; E98-I374 HydrophobicContact CB-CG2 3.71Å; E98-I374 HydrophobicContact CG-CG2 4.49Å; E98-I374 VanDerWaalsContact O-CD1 3.28Å; E98-I374 WeakPolarHBondContact O-CD1 3.27Å; E98-I374 WeakPolarHBondContact OE2-CG2 3.23Å; E98-L375 WeakPolarHBondContact OE1-CD1 3.19Å; E98-L375 WeakPolarHBondContact OE2-CD1 3.25Å; E98-L375 WeakPolarHBondContact OE2-CD2 3.35Å; E98-L375 WeakPolarHBondContact OE2-CG 3.43Å
99	E	66.3	Low	81.1	Confident	65 Å²	65	79.9 Å²	79.9	30%	0.304	40%	0.399	S	S	.	.			trans	-56.6	136	177.3	-175.1	51.9	-99.5	0	0	111.8	A96 V101 V102	A96-E99 HydrophobicContact CB-CB 4.01Å; A96-E99 PolarHBondContact O-N 3.26Å; E99-V101 WeakPolarHBondContact OE1-CB 3.28Å; E99-V101 PolarHBondContact OE1-N 3.28Å; E99-V102 HydrophobicContact CG-CB 3.71Å; E99-V102 HydrophobicContact CG-CG2 4.03Å
100	R	63.8	Low	81.2	Confident	186 Å²	186	77.2 Å²	77.2	70%	0.702	38%	0.381	S	S	*	.	S	Bend	trans	-110.7	-14.3	-179.1	-63.8	-172.6	-178.9	-171.7	-0.4	113	E98	E98-R100 PolarHBondContact O-N 3.13Å
101	V	68.1	Low	81.3	Confident	124 Å²	124	71.4 Å²	71.4	75%	0.752	34%	0.343	S	S	*	.	S	Bend	trans	-93.6	-36.8	-179.3	-177.6	0	0	0	0	111.6	E99	E99-V101 WeakPolarHBondContact OE1-CB 3.28Å; E99-V101 PolarHBondContact OE1-N 3.28Å
102	V	75	Confident	81.5	Confident	68 Å²	68	74.8 Å²	74.8	41%	0.412	36%	0.356	S	S	.	.	S	Bend	trans	-102.7	133	178.4	-174.2	0	0	0	0	109.4	E99 N104	E99-V102 HydrophobicContact CG-CB 3.71Å; E99-V102 HydrophobicContact CG-CG2 4.03Å; V102-N104 PolarHBondContact O-N 3.36Å
103	D	79.4	Confident	81.6	Confident	61 Å²	61	73 Å²	73	33%	0.326	35%	0.347	S	S	.	.			trans	-81.6	100.3	177.3	-169	-12.4	0	0	0	110.5	R105 M106	D103-R105 PolarHBondContact O-N 3.06Å; D103-R105 VanDerWaalsContact O-N 3.07Å; D103-R105 WeakPolarHBondContact OD1-CB 3.43Å; D103-R105 IonicContact OD1-CZ 3.6Å; D103-R105 PolarHBondContact OD1-N 2.79Å; D103-R105 IonicContact OD1-NE 3.93Å; D103-R105 PolarHBondContact OD1-NE 3.27Å; D103-R105 IonicContact OD1-NH2 3.01Å; D103-R105 IonicContact OD2-CZ 2.7Å; D103-R105 IonicContact OD2-NE 3.97Å; D103-R105 PolarHBondContact OD2-NE 3.39Å; D103-R105 IonicContact OD2-NH2 3.89Å; D103-R105 PolarHBondContact OD2-NH2 3.15Å; D103-M106 HydrophobicContact CB-CG 4.04Å; D103-M106 WeakPolarHBondContact O-CB 3.09Å; D103-M106 PolarHBondContact O-N 3.33Å
104	N	85.7	Confident	81.8	Confident	25 Å²	25	71.8 Å²	71.8	13%	0.134	34%	0.34	C	S	.	.	H	α-helix	trans	-49.5	-31.9	176.1	-82.5	-2.3	0	0	0	113.9	Q95 A96 E97 V102 M106 H107 D108	Q95-N104 HydrophobicContact CG-CB 4.35Å; Q95-N104 WeakPolarHBondContact CG-OD1 3.38Å; Q95-N104 PolarHBondContact NE2-ND2 3.31Å; Q95-N104 VanDerWaalsContact NE2-ND2 3.18Å; A96-N104 PolarHBondContact O-ND2 3.47Å; A96-N104 PolarHBondContact O-OD1 2.84Å; E97-N104 PolarHBondContact O-ND2 3.03Å; V102-N104 PolarHBondContact O-N 3.36Å; N104-M106 PolarHBondContact O-N 3.38Å; N104-H107 WeakPolarHBondContact O-CB 3.4Å; N104-H107 PolarHBondContact O-N 2.66Å; N104-H107 VanDerWaalsContact O-N 3.07Å; N104-D108 PolarHBondContact O-N 2.86Å
105	R	86.5	Confident	82.1	Confident	171 Å²	171	70.7 Å²	70.7	65%	0.645	34%	0.337	S	S	*	.	H	α-helix	trans	-65.6	-25.2	178.9	-61.4	171.3	-67.3	-179.1	2.7	112.8	D103 R109	D103-R105 PolarHBondContact O-N 3.06Å; D103-R105 VanDerWaalsContact O-N 3.07Å; D103-R105 WeakPolarHBondContact OD1-CB 3.43Å; D103-R105 IonicContact OD1-CZ 3.6Å; D103-R105 PolarHBondContact OD1-N 2.79Å; D103-R105 IonicContact OD1-NE 3.93Å; D103-R105 PolarHBondContact OD1-NE 3.27Å; D103-R105 IonicContact OD1-NH2 3.01Å; D103-R105 IonicContact OD2-CZ 2.7Å; D103-R105 IonicContact OD2-NE 3.97Å; D103-R105 PolarHBondContact OD2-NE 3.39Å; D103-R105 IonicContact OD2-NH2 3.89Å; D103-R105 PolarHBondContact OD2-NH2 3.15Å; R105-R109 WeakPolarHBondContact O-CB 3.32Å; R105-R109 PolarHBondContact O-N 3.39Å
106	M	87.8	Confident	82.5	Confident	91 Å²	91	74.3 Å²	74.3	45%	0.448	37%	0.37	S	S	.	.	H	α-helix	trans	-75.1	-31.3	176	-60.9	-60.2	124.1	0	0	111.5	L81 D103 N104 R109 F110	L81-M106 HydrophobicContact CD1-SD 4.06Å; D103-M106 HydrophobicContact CB-CG 4.04Å; D103-M106 WeakPolarHBondContact O-CB 3.09Å; D103-M106 PolarHBondContact O-N 3.33Å; N104-M106 PolarHBondContact O-N 3.38Å; M106-R109 PolarHBondContact O-N 2.98Å; M106-F110 WeakPolarHBondContact O-CB 3.4Å; M106-F110 PolarHBondContact O-N 3.41Å
107	H	90.6	Very high	83.4	Confident	46 Å²	46	75.7 Å²	75.7	21%	0.213	38%	0.381	C	S	.	.	H	α-helix	trans	-65.7	-47	171.7	-69.4	-178.4	0	0	0	110.9	L93 N104 R109 F110 C111 P126	L93-H107 HydrophobicContact CD2-CB 3.67Å; L93-H107 HydrophobicContact CG-CB 4.48Å; N104-H107 WeakPolarHBondContact O-CB 3.4Å; N104-H107 PolarHBondContact O-N 2.66Å; N104-H107 VanDerWaalsContact O-N 3.07Å; H107-R109 VanDerWaalsContact C-N 3.3Å; H107-R109 PolarHBondContact O-N 3.09Å; H107-F110 WeakPolarHBondContact O-CB 3.28Å; H107-F110 PolarHBondContact O-N 3.15Å; H107-C111 PolarHBondContact O-N 3.19Å; H107-C111 PolarHBondContact O-SG 3.15Å; H107-C111 VanDerWaalsContact O-SG 3.38Å; H107-P126 HydrophobicContact CB-CG 4.09Å
108	D	89.9	Confident	84.5	Confident	68 Å²	68	73.7 Å²	73.7	36%	0.364	39%	0.386	S	S	.	.	H	α-helix	trans	-56.2	-47.1	175.1	-63.9	-40.5	0	0	0	110.8	N104 F110 C111 E112	N104-D108 PolarHBondContact O-N 2.86Å; D108-F110 PolarHBondContact O-N 3.39Å; D108-C111 WeakPolarHBondContact O-CB 3.46Å; D108-C111 PolarHBondContact O-N 3.25Å; D108-E112 WeakPolarHBondContact O-CG 3.47Å; D108-E112 PolarHBondContact O-N 3.04Å
109	R	90.6	Very high	85.8	Confident	122 Å²	122	74 Å²	74	46%	0.46	39%	0.387	S	S	.	.	H	α-helix	trans	-62.7	-39	178.6	-173.3	56.1	177.1	171.8	3.2	113.2	L81 R105 M106 H107 E112 L113	L81-R109 HydrophobicContact CD2-CB 4.45Å; L81-R109 HydrophobicContact CD2-CG 4.3Å; R105-R109 WeakPolarHBondContact O-CB 3.32Å; R105-R109 PolarHBondContact O-N 3.39Å; M106-R109 PolarHBondContact O-N 2.98Å; H107-R109 VanDerWaalsContact C-N 3.3Å; H107-R109 PolarHBondContact O-N 3.09Å; R109-E112 VanDerWaalsContact CD-OE2 3.32Å; R109-E112 WeakPolarHBondContact CD-OE2 3.44Å; R109-E112 IonicContact CZ-OE2 3.99Å; R109-E112 IonicContact NH1-OE2 3.51Å; R109-E112 PolarHBondContact NH1-OE2 3.47Å; R109-E112 PolarHBondContact O-N 2.82Å; R109-L113 HydrophobicContact CG-CD1 4.31Å; R109-L113 WeakPolarHBondContact O-CG 3.26Å; R109-L113 PolarHBondContact O-N 2.86Å; R109-L113 VanDerWaalsContact O-N 3.13Å
110	F	91.5	Very high	86.9	Confident	27 Å²	27	74.2 Å²	74.2	12%	0.118	39%	0.394	C	S	.	.	H	α-helix	trans	-61.4	-44.9	174.9	178.4	-93.4	0	0	0	111.2	V80 L81 A84 T91 L93 M106 H107 D108 E112 L113 R114 V121	V80-F110 HydrophobicContact CG1-CD2 4.14Å; V80-F110 HydrophobicContact CG1-CE2 4.09Å; L81-F110 HydrophobicContact CD2-CB 3.85Å; L81-F110 HydrophobicContact CD2-CD2 4.36Å; A84-F110 HydrophobicContact CB-CD2 3.56Å; A84-F110 HydrophobicContact CB-CE2 3.57Å; A84-F110 HydrophobicContact CB-CG 4.5Å; T91-F110 HydrophobicContact CG2-CE1 4.44Å; L93-F110 HydrophobicContact CD2-CD1 4.19Å; M106-F110 WeakPolarHBondContact O-CB 3.4Å; M106-F110 PolarHBondContact O-N 3.41Å; H107-F110 WeakPolarHBondContact O-CB 3.28Å; H107-F110 PolarHBondContact O-N 3.15Å; D108-F110 PolarHBondContact O-N 3.39Å; F110-E112 PolarHBondContact O-N 2.85Å; F110-L113 PolarHBondContact O-N 3.33Å; F110-R114 HydrophobicContact CD1-CG 4.12Å; F110-R114 HydrophobicContact CE1-CG 3.71Å; F110-R114 HydrophobicContact CE2-CG 4.4Å; F110-R114 HydrophobicContact CZ-CG 3.87Å; F110-R114 WeakPolarHBondContact O-CB 3.43Å; F110-R114 WeakPolarHBondContact O-CG 3.26Å; F110-R114 PolarHBondContact O-N 3.2Å; F110-V121 HydrophobicContact CD1-CG1 4.43Å; F110-V121 HydrophobicContact CE1-CG1 4.2Å
111	C	91.5	Very high	88.1	Confident	4 Å²	4	65.5 Å²	65.5	3%	0.027	36%	0.362	C	S	.	.	H	α-helix	trans	-62.5	-40.9	176.7	-66.7	0	0	0	0	112.8	H107 D108 T115 V121 P126	H107-C111 PolarHBondContact O-N 3.19Å; H107-C111 PolarHBondContact O-SG 3.15Å; H107-C111 VanDerWaalsContact O-SG 3.38Å; D108-C111 WeakPolarHBondContact O-CB 3.46Å; D108-C111 PolarHBondContact O-N 3.25Å; C111-T115 VanDerWaalsContact O-CB 3.3Å; C111-T115 WeakPolarHBondContact O-CB 3.5Å; C111-T115 PolarHBondContact O-N 2.99Å; C111-T115 PolarHBondContact O-OG1 3.46Å; C111-V121 HydrophobicContact CB-CG2 4.02Å; C111-V121 WeakPolarHBondContact SG-CG2 3.3Å; C111-P126 VanDerWaalsContact SG-CD 3.55Å
112	E	91.6	Very high	88.9	Confident	105 Å²	105	66 Å²	66	49%	0.491	36%	0.356	S	S	.	.	H	α-helix	trans	-58.8	-48.6	174.9	-72.2	174	179.2	0	0	111.8	D108 R109 F110 T115 A116	D108-E112 WeakPolarHBondContact O-CG 3.47Å; D108-E112 PolarHBondContact O-N 3.04Å; R109-E112 VanDerWaalsContact CD-OE2 3.32Å; R109-E112 WeakPolarHBondContact CD-OE2 3.44Å; R109-E112 IonicContact CZ-OE2 3.99Å; R109-E112 IonicContact NH1-OE2 3.51Å; R109-E112 PolarHBondContact NH1-OE2 3.47Å; R109-E112 PolarHBondContact O-N 2.82Å; F110-E112 PolarHBondContact O-N 2.85Å; E112-T115 PolarHBondContact O-N 3.37Å; E112-A116 WeakPolarHBondContact O-CB 3.46Å; E112-A116 PolarHBondContact O-N 2.84Å
113	L	92.5	Very high	89.2	Confident	52 Å²	52	66.2 Å²	66.2	27%	0.272	37%	0.372	S	S	.	.	H	α-helix	trans	-64.4	-45.6	-178.4	-69.9	169.3	0	0	0	112	L81 A84 R109 F110 T115 A116 A117	L81-L113 HydrophobicContact CB-CD1 4.23Å; L81-L113 HydrophobicContact CD2-CD1 4.14Å; L81-L113 WeakPolarHBondContact O-CD1 3.31Å; A84-L113 HydrophobicContact CB-CB 4.06Å; A84-L113 HydrophobicContact CB-CD1 4.39Å; R109-L113 HydrophobicContact CG-CD1 4.31Å; R109-L113 WeakPolarHBondContact O-CG 3.26Å; R109-L113 PolarHBondContact O-N 2.86Å; R109-L113 VanDerWaalsContact O-N 3.13Å; F110-L113 PolarHBondContact O-N 3.33Å; L113-T115 VanDerWaalsContact C-N 3.34Å; L113-T115 PolarHBondContact O-N 2.91Å; L113-A116 PolarHBondContact O-N 3.41Å; L113-A117 PolarHBondContact O-N 3.25Å
114	R	93.1	Very high	89.4	Confident	4 Å²	4	65.1 Å²	65.1	2%	0.015	38%	0.375	C	S	.	.	H	α-helix	trans	-56.7	-45.3	173.2	-82.5	-84.5	-50.7	-145.8	9.3	112.3	A84 D87 T89 T91 F110 A117 G118 H119 P120	A84-R114 HydrophobicContact CB-CG 4.49Å; A84-R114 WeakPolarHBondContact O-CD 3.43Å; A84-R114 WeakPolarHBondContact O-CG 3.5Å; D87-R114 PolarHBondContact O-NH1 3.35Å; D87-R114 VanDerWaalsContact O-NH1 3.12Å; D87-R114 IonicContact OD2-NH1 3.57Å; T89-R114 PolarHBondContact O-NH1 2.72Å; T89-R114 PolarHBondContact O-NH2 2.76Å; T91-R114 PolarHBondContact OG1-NH1 3.33Å; F110-R114 HydrophobicContact CD1-CG 4.12Å; F110-R114 HydrophobicContact CE1-CG 3.71Å; F110-R114 HydrophobicContact CE2-CG 4.4Å; F110-R114 HydrophobicContact CZ-CG 3.87Å; F110-R114 WeakPolarHBondContact O-CB 3.43Å; F110-R114 WeakPolarHBondContact O-CG 3.26Å; F110-R114 PolarHBondContact O-N 3.2Å; R114-A117 PolarHBondContact O-N 2.87Å; R114-G118 PolarHBondContact O-N 3.26Å; R114-H119 CarbonylContact C-O 3.58Å; R114-H119 WeakPolarHBondContact CB-O 3.46Å; R114-H119 PolarHBondContact NE-O 2.85Å; R114-H119 PolarHBondContact NH2-O 2.99Å; R114-H119 CarbonylContact O-C 3.55Å; R114-H119 VanDerWaalsContact O-C 3.27Å; R114-H119 PolarHBondContact O-N 2.69Å; R114-P120 PolarHBondContact NH2-O 3.34Å
115	T	91.4	Very high	89.5	Confident	66 Å²	66	72.9 Å²	72.9	41%	0.405	40%	0.403	S	S	.	.	H	α-helix	trans	-65.8	-43.9	179.4	-58.6	0	0	0	0	111.1	C111 E112 L113 A117 G118 P120	C111-T115 VanDerWaalsContact O-CB 3.3Å; C111-T115 WeakPolarHBondContact O-CB 3.5Å; C111-T115 PolarHBondContact O-N 2.99Å; C111-T115 PolarHBondContact O-OG1 3.46Å; E112-T115 PolarHBondContact O-N 3.37Å; L113-T115 VanDerWaalsContact C-N 3.34Å; L113-T115 PolarHBondContact O-N 2.91Å; T115-A117 PolarHBondContact O-N 3.31Å; T115-G118 PolarHBondContact O-N 3.06Å; T115-G118 VanDerWaalsContact O-N 3.09Å; T115-P120 HydrophobicContact CG2-CB 4.45Å
116	A	91.5	Very high	89.5	Confident	91 Å²	91	65 Å²	65	75%	0.752	37%	0.374	S	S	*	.	H	α-helix	trans	-63	-29.7	176.7	0	0	0	0	0	113.1	E112 L113 G118	E112-A116 WeakPolarHBondContact O-CB 3.46Å; E112-A116 PolarHBondContact O-N 2.84Å; L113-A116 PolarHBondContact O-N 3.41Å; A116-G118 VanDerWaalsContact C-N 3.32Å
117	A	92.3	Very high	89.2	Confident	46 Å²	46	64 Å²	64	38%	0.38	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-0.9	175.5	0	0	0	0	0	114.4	G85 L113 R114 T115	G85-A117 VanDerWaalsContact CA-CB 3.46Å; G85-A117 WeakPolarHBondContact O-CB 3.47Å; L113-A117 PolarHBondContact O-N 3.25Å; R114-A117 PolarHBondContact O-N 2.87Å; T115-A117 PolarHBondContact O-N 3.31Å
118	G	91.5	Very high	88.6	Confident	54 Å²	54	63.7 Å²	63.7	56%	0.557	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.8	9.5	179	0	0	0	0	0	115	R114 T115 A116 P120	R114-G118 PolarHBondContact O-N 3.26Å; T115-G118 PolarHBondContact O-N 3.06Å; T115-G118 VanDerWaalsContact O-N 3.09Å; A116-G118 VanDerWaalsContact C-N 3.32Å; G118-P120 WeakPolarHBondContact O-CD 3.42Å
119	H	91.3	Very high	87.5	Confident	77 Å²	77	64.1 Å²	64.1	36%	0.356	37%	0.373	S	S	.	.			trans	-122.8	64.6	178.8	-58.3	-51.5	0	0	0	110	R114	R114-H119 CarbonylContact C-O 3.58Å; R114-H119 WeakPolarHBondContact CB-O 3.46Å; R114-H119 PolarHBondContact NE-O 2.85Å; R114-H119 PolarHBondContact NH2-O 2.99Å; R114-H119 CarbonylContact O-C 3.55Å; R114-H119 VanDerWaalsContact O-C 3.27Å; R114-H119 PolarHBondContact O-N 2.69Å
120	P	90	Very high	85.9	Confident	70 Å²	70	62.4 Å²	62.4	46%	0.455	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-57.4	148.6	-178	26.4	-34.8	0	0	0	111.3	R114 T115 G118	R114-P120 PolarHBondContact NH2-O 3.34Å; T115-P120 HydrophobicContact CG2-CB 4.45Å; G118-P120 WeakPolarHBondContact O-CD 3.42Å
121	V	88	Confident	84.1	Confident	3 Å²	3	64.2 Å²	64.2	2%	0.018	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-63.1	158.8	165.6	-62.8	0	0	0	0	109.5	T91 F110 C111 G123 G124	T91-V121 HydrophobicContact CG2-CG1 4.35Å; T91-V121 CarbonylContact O-C 3.49Å; T91-V121 WeakPolarHBondContact O-CA 3.48Å; T91-V121 WeakPolarHBondContact O-CB 3.42Å; F110-V121 HydrophobicContact CD1-CG1 4.43Å; F110-V121 HydrophobicContact CE1-CG1 4.2Å; C111-V121 HydrophobicContact CB-CG2 4.02Å; C111-V121 WeakPolarHBondContact SG-CG2 3.3Å; V121-G123 PolarHBondContact O-N 3.05Å; V121-G124 WeakPolarHBondContact O-CA 3.46Å; V121-G124 PolarHBondContact O-N 3.29Å
122	E	86.1	Confident	81.9	Confident	134 Å²	134	65.5 Å²	65.5	63%	0.626	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-55.7	125.1	176.1	-170.9	172.4	178.5	0	0	110.7	T91 L92 G124	T91-E122 PolarHBondContact O-N 2.84Å; L92-E122 HydrophobicContact CB-CB 4.37Å; L92-E122 HydrophobicContact CD1-CB 4.07Å; L92-E122 HydrophobicContact CD1-CG 4.44Å; E122-G124 VanDerWaalsContact C-N 3.27Å; E122-G124 PolarHBondContact O-N 3.48Å
123	G	79.7	Confident	79.8	Confident	73 Å²	73	63.3 Å²	63.3	75%	0.753	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	77.7	1.1	-174.4	0	0	0	0	0	115.7	V121 R125	V121-G123 PolarHBondContact O-N 3.05Å; G123-R125 PolarHBondContact O-N 3.02Å
124	G	84.2	Confident	78.1	Confident	38 Å²	38	63.4 Å²	63.4	39%	0.392	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	73.2	0.1	176	0	0	0	0	0	115.5	V121 E122	V121-G124 WeakPolarHBondContact O-CA 3.46Å; V121-G124 PolarHBondContact O-N 3.29Å; E122-G124 VanDerWaalsContact C-N 3.27Å; E122-G124 PolarHBondContact O-N 3.48Å
125	R	87.7	Confident	76.3	Confident	189 Å²	189	65.6 Å²	65.6	71%	0.713	40%	0.4	S	S	*	.	S	Bend	trans	-154.7	164.8	-179.2	62.8	178.6	177.1	170.1	-1	110.1	G123 L127	G123-R125 PolarHBondContact O-N 3.02Å; R125-L127 PolarHBondContact O-N 3.28Å
126	P	86.3	Confident	74.5	Confident	6 Å²	6	63.9 Å²	63.9	4%	0.039	39%	0.39	C	S	.	.			trans	-59.7	137.7	172	-16.5	29	0	0	0	111.2	L93 Q95 H107 C111 V128	L93-P126 HydrophobicContact CD2-CB 4.3Å; L93-P126 HydrophobicContact CD2-CG 4.1Å; L93-P126 HydrophobicContact CG-CB 4.32Å; L93-P126 CarbonylContact O-C 3.46Å; L93-P126 WeakPolarHBondContact O-CA 3.34Å; Q95-P126 HydrophobicContact CB-CB 3.8Å; Q95-P126 VanDerWaalsContact OE1-CG 3.24Å; H107-P126 HydrophobicContact CB-CG 4.09Å; C111-P126 VanDerWaalsContact SG-CD 3.55Å; P126-V128 PolarHBondContact O-N 2.91Å
127	L	82.3	Confident	72.5	Confident	69 Å²	69	65.7 Å²	65.7	36%	0.361	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	103.3	169	-175.4	66.5	0	0	0	108.6	L92 L93 L94 Q95 R125 I129 Y144	L92-L127 HydrophobicContact CD1-CB 4.26Å; L92-L127 HydrophobicContact CD1-CD2 4.45Å; L93-L127 PolarHBondContact O-N 2.94Å; L94-L127 WeakPolarHBondContact CA-O 3.48Å; L94-L127 HydrophobicContact CD2-CB 3.89Å; L94-L127 HydrophobicContact CD2-CD2 3.74Å; L94-L127 HydrophobicContact CD2-CG 4.22Å; Q95-L127 PolarHBondContact N-O 2.88Å; R125-L127 PolarHBondContact O-N 3.28Å; L127-I129 PolarHBondContact O-N 3.36Å; L127-Y144 HydrophobicContact CD1-CE2 4.09Å
128	V	78.2	Confident	70.4	Confident	40 Å²	40	68.2 Å²	68.2	24%	0.242	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	113.8	-178.4	-175.3	0	0	0	0	110.3	Q95 E97 P126 K130	Q95-V128 HydrophobicContact CB-CG2 4.33Å; Q95-V128 CarbonylContact O-C 3.5Å; Q95-V128 VanDerWaalsContact O-CA 3.23Å; Q95-V128 WeakPolarHBondContact O-CA 3.41Å; E97-V128 HydrophobicContact CB-CG1 3.61Å; E97-V128 HydrophobicContact CG-CG1 4.22Å; P126-V128 PolarHBondContact O-N 2.91Å; V128-K130 HydrophobicContact CG1-CG 4.11Å
129	I	65.9	Low	68.7	Low	77 Å²	77	70.7 Å²	70.7	40%	0.395	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	119	170.7	-55.8	173.5	0	0	0	108	L94 Q95 E97 L127	L94-I129 HydrophobicContact CB-CD1 4.13Å; L94-I129 HydrophobicContact CD1-CD1 4.36Å; Q95-I129 PolarHBondContact O-N 3.22Å; E97-I129 PolarHBondContact N-O 2.93Å; L127-I129 PolarHBondContact O-N 3.36Å
130	K	57.1	Low	67.3	Low	85 Å²	85	70.3 Å²	70.3	37%	0.37	40%	0.402	S	S	.	.			trans	-116.5	159.3	179.3	-54.9	-165.8	172.3	-134.3	0	111.5	E97 V128	E97-K130 IonicContact OE1-NZ 3.38Å; E97-K130 PolarHBondContact OE1-NZ 3.01Å; E97-K130 WeakPolarHBondContact OE2-CD 3.38Å; E97-K130 WeakPolarHBondContact OE2-CE 3.39Å; E97-K130 WeakPolarHBondContact OE2-CG 3.32Å; E97-K130 IonicContact OE2-NZ 2.92Å; E97-K130 PolarHBondContact OE2-NZ 3.26Å; V128-K130 HydrophobicContact CG1-CG 4.11Å
131	D	53.5	Low	66.3	Low	65 Å²	65	67.9 Å²	67.9	35%	0.348	39%	0.385	S	S	.	.			trans	-83.4	134.1	-166.4	-69.3	-24.5	0	0	0	117.2	V371	D131-V371 HydrophobicContact CB-CG1 4.38Å; D131-V371 WeakPolarHBondContact OD1-CG1 3.08Å
132	G	45.7	Very low	65.5	Low	31 Å²	31	69.2 Å²	69.2	32%	0.32	39%	0.394	S	S	.	.	S	Bend		79.6	78.5	122.5	0	0	0	0	0	122
133	T	48.7	Very low	65	Low	59 Å²	59	68 Å²	68	36%	0.362	40%	0.397	S	S	.	.	S	Bend	trans	69.1	155.6	-179.7	-4.2	0	0	0	0	113	L135 M352	T133-L135 PolarHBondContact O-N 3.18Å; T133-M352 HydrophobicContact CG2-CE 4.21Å; T133-M352 HydrophobicContact CG2-CG 4.02Å; T133-M352 HydrophobicContact CG2-SD 4.05Å; T133-M352 VanDerWaalsContact N-CE 3.33Å
134	L	54.9	Low	64.6	Low	55 Å²	55	70 Å²	70	29%	0.288	38%	0.383	S	S	.	.	S	Bend	trans	-51.8	-40.5	-165.1	-170.7	75.9	0	0	0	113	L141 A145 L149 F161 L177	L134-L141 HydrophobicContact CB-CD1 4.48Å; L134-L141 HydrophobicContact CD1-CD1 3.8Å; L134-L141 HydrophobicContact CD2-CD1 3.8Å; L134-L141 HydrophobicContact CG-CD1 3.34Å; L134-L141 WeakPolarHBondContact O-CD1 3.45Å; L134-A145 HydrophobicContact CD1-CB 3.92Å; L134-L149 HydrophobicContact CD1-CD1 3.98Å; L134-L149 HydrophobicContact CD1-CD2 4.08Å; L134-L149 HydrophobicContact CD1-CG 4.09Å; L134-L149 HydrophobicContact CD2-CD1 4.38Å; L134-F161 HydrophobicContact CD2-CD1 3.69Å; L134-F161 HydrophobicContact CD2-CE1 3.18Å; L134-F161 HydrophobicContact CD2-CZ 3.92Å; L134-L177 HydrophobicContact CD2-CD2 3.99Å
135	L	56.4	Low	64.4	Low	50 Å²	50	68.7 Å²	68.7	26%	0.262	37%	0.369	S	S	.	.	B	Isolated β-bridge	trans	-95.7	135.9	175.9	-60.3	173	0	0	0	111.5	T133 T140 L141 I173	T133-L135 PolarHBondContact O-N 3.18Å; L135-T140 CarbonylContact C-O 3.56Å; L135-T140 VanDerWaalsContact CA-O 3.27Å; L135-T140 WeakPolarHBondContact CA-O 3.46Å; L135-L141 HydrophobicContact CD2-CB 4.21Å; L135-L141 HydrophobicContact CD2-CD1 4.16Å; L135-I173 HydrophobicContact CD1-CD1 3.89Å; L135-I173 HydrophobicContact CD1-CG2 4.3Å; L135-I173 HydrophobicContact CD2-CG2 4.09Å
136	S	54.5	Low	64.2	Low	29 Å²	29	61.7 Å²	61.7	20%	0.203	34%	0.344	C	S	.	.			trans	-69.5	167.5	168.6	42	0	0	0	0	111.6	D138 H139 T140	S136-D138 WeakPolarHBondContact CB-OD1 3.47Å; S136-D138 PolarHBondContact O-N 2.83Å; S136-D138 VanDerWaalsContact O-N 3.09Å; S136-D138 PolarHBondContact OG-OD1 2.95Å; S136-H139 WeakPolarHBondContact O-CA 3.28Å; S136-H139 PolarHBondContact O-N 2.82Å; S136-T140 PolarHBondContact N-O 2.99Å; S136-T140 PolarHBondContact OG-O 3.31Å; S136-T140 PolarHBondContact OG-OG1 3.26Å
137	P	47.5	Very low	64.1	Low	130 Å²	130	66 Å²	66	84%	0.844	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-22.4	-177.5	-27.2	35.8	0	0	0	115.5	H139	P137-H139 PolarHBondContact O-N 3.3Å
138	D	49	Very low	64.2	Low	99 Å²	99	64.9 Å²	64.9	53%	0.529	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	9.9	172.8	65	-32.9	0	0	0	113.3	S136 T140	S136-D138 WeakPolarHBondContact CB-OD1 3.47Å; S136-D138 PolarHBondContact O-N 2.83Å; S136-D138 VanDerWaalsContact O-N 3.09Å; S136-D138 PolarHBondContact OG-OD1 2.95Å; D138-T140 PolarHBondContact O-N 3.06Å; D138-T140 PolarHBondContact OD1-OG1 2.92Å; D138-T140 VanDerWaalsContact OD1-OG1 3.06Å; D138-T140 WeakPolarHBondContact OD2-CG2 3.33Å; D138-T140 PolarHBondContact OD2-OG1 3.49Å
139	H	55.7	Low	64.7	Low	105 Å²	105	63.2 Å²	63.2	49%	0.486	35%	0.349	S	S	.	.	S	Bend	trans	61.1	20.8	-177.9	-52.3	-47.8	0	0	0	114.6	S136 P137 R165	S136-H139 WeakPolarHBondContact O-CA 3.28Å; S136-H139 PolarHBondContact O-N 2.82Å; P137-H139 PolarHBondContact O-N 3.3Å; H139-R165 PolarHBondContact CD2-NH2 2.97Å; H139-R165 PolarHBondContact CE1-NH2 2.77Å; H139-R165 PolarHBondContact ND1-NH2 2.86Å; H139-R165 VanDerWaalsContact ND1-NH2 3.12Å; H139-R165 PolarHBondContact NE2-NH2 2.97Å; H139-R165 VanDerWaalsContact NE2-NH2 3.17Å
140	T	62.4	Low	65.8	Low	70 Å²	70	63.3 Å²	63.3	43%	0.429	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-95.5	159.4	172.8	68.9	0	0	0	0	111.1	L135 S136 D138	L135-T140 CarbonylContact C-O 3.56Å; L135-T140 VanDerWaalsContact CA-O 3.27Å; L135-T140 WeakPolarHBondContact CA-O 3.46Å; S136-T140 PolarHBondContact N-O 2.99Å; S136-T140 PolarHBondContact OG-O 3.31Å; S136-T140 PolarHBondContact OG-OG1 3.26Å; D138-T140 PolarHBondContact O-N 3.06Å; D138-T140 PolarHBondContact OD1-OG1 2.92Å; D138-T140 VanDerWaalsContact OD1-OG1 3.06Å; D138-T140 WeakPolarHBondContact OD2-CG2 3.33Å; D138-T140 PolarHBondContact OD2-OG1 3.49Å
141	L	68.8	Low	67.3	Low	19 Å²	19	62.9 Å²	62.9	10%	0.099	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-96.8	118.8	178.2	-170.8	72.6	0	0	0	108.3	L134 L135 A145 K146 L149 L177	L134-L141 HydrophobicContact CB-CD1 4.48Å; L134-L141 HydrophobicContact CD1-CD1 3.8Å; L134-L141 HydrophobicContact CD2-CD1 3.8Å; L134-L141 HydrophobicContact CG-CD1 3.34Å; L134-L141 WeakPolarHBondContact O-CD1 3.45Å; L135-L141 HydrophobicContact CD2-CB 4.21Å; L135-L141 HydrophobicContact CD2-CD1 4.16Å; L141-A145 HydrophobicContact CD1-CB 3.9Å; L141-A145 HydrophobicContact CG-CB 4.19Å; L141-K146 HydrophobicContact CB-CG 4.33Å; L141-K146 HydrophobicContact CD2-CB 4.44Å; L141-K146 HydrophobicContact CD2-CD 4.28Å; L141-K146 HydrophobicContact CD2-CG 3.32Å; L141-K146 HydrophobicContact CG-CG 3.71Å; L141-L149 HydrophobicContact CD2-CD1 4.18Å; L141-L177 HydrophobicContact CD1-CD2 4.23Å; L141-L177 HydrophobicContact CD2-CD2 3.62Å; L141-L177 HydrophobicContact CD2-CG 4.31Å
142	S	70.9	Confident	69.1	Low	31 Å²	31	62.8 Å²	62.8	22%	0.217	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-61.9	149	-178.8	75.9	0	0	0	0	111.2	Y144 A145 K146	S142-Y144 PolarHBondContact O-N 3.09Å; S142-Y144 VanDerWaalsContact O-N 3.17Å; S142-A145 WeakPolarHBondContact O-CB 3.37Å; S142-A145 PolarHBondContact O-N 3.14Å; S142-A145 WeakPolarHBondContact OG-CB 3.37Å; S142-A145 PolarHBondContact OG-N 3.46Å; S142-A145 VanDerWaalsContact OG-N 3.09Å; S142-K146 PolarHBondContact O-N 2.88Å
143	P	75.7	Confident	71.2	Confident	107 Å²	107	63.9 Å²	63.9	70%	0.695	35%	0.348	S	S	*	.	H	α-helix	trans	-55.5	-33.7	175.2	-27.4	35.1	0	0	0	113.3	K146 E147	P143-K146 PolarHBondContact O-N 3.15Å; P143-E147 WeakPolarHBondContact O-CB 3.49Å; P143-E147 PolarHBondContact O-N 2.97Å
144	Y	72.5	Confident	73.2	Confident	115 Å²	115	65.4 Å²	65.4	45%	0.451	37%	0.366	S	S	.	.	H	α-helix	trans	-66.1	-44.7	175.2	178.9	-93	0	0	0	112.1	L127 S142 E147 T148	L127-Y144 HydrophobicContact CD1-CE2 4.09Å; S142-Y144 PolarHBondContact O-N 3.09Å; S142-Y144 VanDerWaalsContact O-N 3.17Å; Y144-E147 PolarHBondContact O-N 2.84Å; Y144-T148 WeakPolarHBondContact O-CB 3.37Å; Y144-T148 PolarHBondContact O-N 3.12Å; Y144-T148 PolarHBondContact O-OG1 3.29Å
145	A	79.3	Confident	75	Confident	12 Å²	12	71.2 Å²	71.2	10%	0.099	38%	0.384	C	S	.	.	H	α-helix	trans	-61.5	-45.7	175.4	0	0	0	0	0	110.9	L134 L141 S142 E147 T148 L149	L134-A145 HydrophobicContact CD1-CB 3.92Å; L141-A145 HydrophobicContact CD1-CB 3.9Å; L141-A145 HydrophobicContact CG-CB 4.19Å; S142-A145 WeakPolarHBondContact O-CB 3.37Å; S142-A145 PolarHBondContact O-N 3.14Å; S142-A145 WeakPolarHBondContact OG-CB 3.37Å; S142-A145 PolarHBondContact OG-N 3.46Å; S142-A145 VanDerWaalsContact OG-N 3.09Å; A145-E147 PolarHBondContact O-N 2.89Å; A145-T148 PolarHBondContact O-N 3.32Å; A145-L149 VanDerWaalsContact O-CG 3.31Å; A145-L149 WeakPolarHBondContact O-CG 3.47Å; A145-L149 PolarHBondContact O-N 3.13Å
146	K	83	Confident	76.7	Confident	41 Å²	41	71.4 Å²	71.4	18%	0.178	40%	0.398	C	S	.	.	H	α-helix	trans	-54.3	-50.9	174.2	-76.6	-177.2	173.2	-151.6	0	112.5	L141 S142 P143 T148 L149 K150 N176 E178	L141-K146 HydrophobicContact CB-CG 4.33Å; L141-K146 HydrophobicContact CD2-CB 4.44Å; L141-K146 HydrophobicContact CD2-CD 4.28Å; L141-K146 HydrophobicContact CD2-CG 3.32Å; L141-K146 HydrophobicContact CG-CG 3.71Å; S142-K146 PolarHBondContact O-N 2.88Å; P143-K146 PolarHBondContact O-N 3.15Å; K146-T148 VanDerWaalsContact C-N 3.34Å; K146-T148 PolarHBondContact O-N 3.3Å; K146-L149 PolarHBondContact O-N 3.27Å; K146-K150 WeakPolarHBondContact O-CG 3.31Å; K146-K150 PolarHBondContact O-N 2.68Å; K146-N176 WeakPolarHBondContact CE-O 3.5Å; K146-N176 PolarHBondContact NZ-O 2.91Å; K146-E178 IonicContact NZ-OE1 2.83Å; K146-E178 PolarHBondContact NZ-OE1 2.7Å
147	E	84.6	Confident	78.4	Confident	97 Å²	97	74 Å²	74	45%	0.453	41%	0.409	S	S	.	.	H	α-helix	trans	-64.5	-40.6	-179.4	-173.9	59.2	-163.2	0	0	111.7	P143 Y144 A145 L149 K150 L151	P143-E147 WeakPolarHBondContact O-CB 3.49Å; P143-E147 PolarHBondContact O-N 2.97Å; Y144-E147 PolarHBondContact O-N 2.84Å; A145-E147 PolarHBondContact O-N 2.89Å; E147-L149 PolarHBondContact O-N 3Å; E147-K150 PolarHBondContact O-N 2.57Å; E147-L151 HydrophobicContact CG-CD1 4.04Å; E147-L151 HydrophobicContact CG-CG 4.38Å; E147-L151 WeakPolarHBondContact O-CB 3.46Å; E147-L151 VanDerWaalsContact O-CG 3.3Å; E147-L151 WeakPolarHBondContact O-CG 3.36Å; E147-L151 PolarHBondContact O-N 2.73Å
148	T	84	Confident	80.6	Confident	46 Å²	46	71.8 Å²	71.8	28%	0.282	39%	0.39	S	S	.	.	H	α-helix	trans	-59.6	-48.1	175.8	-58.3	0	0	0	0	111.1	Y144 A145 K146 K150 L151 L152	Y144-T148 WeakPolarHBondContact O-CB 3.37Å; Y144-T148 PolarHBondContact O-N 3.12Å; Y144-T148 PolarHBondContact O-OG1 3.29Å; A145-T148 PolarHBondContact O-N 3.32Å; K146-T148 VanDerWaalsContact C-N 3.34Å; K146-T148 PolarHBondContact O-N 3.3Å; T148-K150 VanDerWaalsContact C-N 3.33Å; T148-K150 PolarHBondContact O-N 3.37Å; T148-L151 PolarHBondContact O-N 3.09Å; T148-L152 HydrophobicContact CG2-CD1 3.73Å; T148-L152 WeakPolarHBondContact O-CD1 3.36Å; T148-L152 PolarHBondContact O-N 3.46Å
149	L	88.4	Confident	82.6	Confident	5 Å²	5	69 Å²	69	3%	0.026	37%	0.373	C	S	.	.	H	α-helix	trans	-57.7	-45.1	176.3	-70.6	-179.6	0	0	0	111.8	L134 L141 A145 K146 E147 L152 T153 F159 F161 L177 I179	L134-L149 HydrophobicContact CD1-CD1 3.98Å; L134-L149 HydrophobicContact CD1-CD2 4.08Å; L134-L149 HydrophobicContact CD1-CG 4.09Å; L134-L149 HydrophobicContact CD2-CD1 4.38Å; L141-L149 HydrophobicContact CD2-CD1 4.18Å; A145-L149 VanDerWaalsContact O-CG 3.31Å; A145-L149 WeakPolarHBondContact O-CG 3.47Å; A145-L149 PolarHBondContact O-N 3.13Å; K146-L149 PolarHBondContact O-N 3.27Å; E147-L149 PolarHBondContact O-N 3Å; L149-L152 PolarHBondContact O-N 3.28Å; L149-T153 VanDerWaalsContact O-CB 3.27Å; L149-T153 WeakPolarHBondContact O-CB 3.31Å; L149-T153 PolarHBondContact O-N 3.36Å; L149-T153 PolarHBondContact O-OG1 2.89Å; L149-F159 HydrophobicContact CD2-CD1 3.54Å; L149-F159 HydrophobicContact CD2-CD2 4.26Å; L149-F159 HydrophobicContact CD2-CE1 3.34Å; L149-F159 HydrophobicContact CD2-CE2 4.08Å; L149-F159 HydrophobicContact CD2-CG 4Å; L149-F159 HydrophobicContact CD2-CZ 3.62Å; L149-F161 HydrophobicContact CD1-CZ 4.02Å; L149-F161 HydrophobicContact CD2-CE1 4.43Å; L149-F161 HydrophobicContact CD2-CZ 4.09Å; L149-L177 HydrophobicContact CD1-CD2 3.47Å; L149-L177 VanDerWaalsContact CD1-CD2 3.47Å; L149-I179 HydrophobicContact CB-CD1 3.99Å; L149-I179 HydrophobicContact CB-CG1 4.5Å; L149-I179 HydrophobicContact CB-CG2 4.48Å; L149-I179 HydrophobicContact CD1-CD1 4.16Å; L149-I179 HydrophobicContact CD1-CG1 4.43Å; L149-I179 HydrophobicContact CD2-CD1 4.24Å; L149-I179 HydrophobicContact CG-CD1 4.37Å
150	K	89	Confident	84.5	Confident	79 Å²	79	66 Å²	66	34%	0.343	36%	0.362	S	S	.	.	H	α-helix	trans	-62	-47.9	177.1	-73.2	178.3	-179.6	179.3	0	112.2	K146 E147 T148 L152 T153 A154 E178 I179	K146-K150 WeakPolarHBondContact O-CG 3.31Å; K146-K150 PolarHBondContact O-N 2.68Å; E147-K150 PolarHBondContact O-N 2.57Å; T148-K150 VanDerWaalsContact C-N 3.33Å; T148-K150 PolarHBondContact O-N 3.37Å; K150-L152 VanDerWaalsContact C-N 3.34Å; K150-L152 PolarHBondContact O-N 2.92Å; K150-T153 PolarHBondContact O-N 2.97Å; K150-A154 WeakPolarHBondContact O-CB 3.27Å; K150-A154 PolarHBondContact O-N 2.8Å; K150-E178 WeakPolarHBondContact CE-OE2 3.27Å; K150-E178 IonicContact NZ-OE2 3.57Å; K150-E178 PolarHBondContact NZ-OE2 2.87Å; K150-I179 HydrophobicContact CG-CG2 4.3Å
151	L	89.4	Confident	85.9	Confident	75 Å²	75	64.3 Å²	64.3	39%	0.393	35%	0.349	S	S	.	.	H	α-helix	trans	-61.2	-41	-179.6	-76.7	174.3	0	0	0	112.2	E147 T148 R155	E147-L151 HydrophobicContact CG-CD1 4.04Å; E147-L151 HydrophobicContact CG-CG 4.38Å; E147-L151 WeakPolarHBondContact O-CB 3.46Å; E147-L151 VanDerWaalsContact O-CG 3.3Å; E147-L151 WeakPolarHBondContact O-CG 3.36Å; E147-L151 PolarHBondContact O-N 2.73Å; T148-L151 PolarHBondContact O-N 3.09Å; L151-R155 WeakPolarHBondContact O-CG 3.48Å; L151-R155 PolarHBondContact O-NH1 3.06Å
152	L	90.2	Very high	87.1	Confident	64 Å²	64	64.7 Å²	64.7	34%	0.335	36%	0.355	S	S	.	.	H	α-helix	trans	-74.3	-38.8	177.4	-86.9	84	0	0	0	111.8	T148 L149 K150 A154 R155 G156 I157 F159	T148-L152 HydrophobicContact CG2-CD1 3.73Å; T148-L152 WeakPolarHBondContact O-CD1 3.36Å; T148-L152 PolarHBondContact O-N 3.46Å; L149-L152 PolarHBondContact O-N 3.28Å; K150-L152 VanDerWaalsContact C-N 3.34Å; K150-L152 PolarHBondContact O-N 2.92Å; L152-A154 VanDerWaalsContact C-N 3.3Å; L152-A154 PolarHBondContact O-N 2.97Å; L152-R155 CarbonylContact O-C 3.58Å; L152-R155 WeakPolarHBondContact O-CA 3.28Å; L152-R155 WeakPolarHBondContact O-CB 3.44Å; L152-R155 PolarHBondContact O-N 2.96Å; L152-G156 PolarHBondContact O-N 2.87Å; L152-I157 HydrophobicContact CB-CB 4.14Å; L152-I157 HydrophobicContact CB-CG1 4.3Å; L152-I157 HydrophobicContact CD2-CG2 4.4Å; L152-I157 WeakPolarHBondContact O-CB 3.42Å; L152-I157 PolarHBondContact O-N 2.93Å; L152-I157 VanDerWaalsContact O-N 3.13Å; L152-F159 HydrophobicContact CB-CE2 3.68Å; L152-F159 HydrophobicContact CB-CZ 3.53Å; L152-F159 HydrophobicContact CD2-CZ 3.9Å; L152-F159 HydrophobicContact CG-CZ 4.29Å
153	T	89.9	Confident	88	Confident	54 Å²	54	64.7 Å²	64.7	33%	0.331	35%	0.354	S	S	.	.	H	α-helix	trans	-60.8	-41.1	174.9	-57.8	0	0	0	0	110.9	L149 K150 R155 G156 I179	L149-T153 VanDerWaalsContact O-CB 3.27Å; L149-T153 WeakPolarHBondContact O-CB 3.31Å; L149-T153 PolarHBondContact O-N 3.36Å; L149-T153 PolarHBondContact O-OG1 2.89Å; K150-T153 PolarHBondContact O-N 2.97Å; T153-R155 PolarHBondContact O-N 2.89Å; T153-R155 VanDerWaalsContact O-N 3.16Å; T153-G156 PolarHBondContact O-N 3.36Å; T153-I179 HydrophobicContact CG2-CG2 4.49Å
154	A	91.1	Very high	88.6	Confident	90 Å²	90	60.1 Å²	60.1	74%	0.744	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-18.9	175	0	0	0	0	0	113.7	K150 L152	K150-A154 WeakPolarHBondContact O-CB 3.27Å; K150-A154 PolarHBondContact O-N 2.8Å; L152-A154 VanDerWaalsContact C-N 3.3Å; L152-A154 PolarHBondContact O-N 2.97Å
155	R	92.9	Very high	89.3	Confident	178 Å²	178	57.8 Å²	57.8	67%	0.672	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	7.4	174	-67.5	173.3	175.9	83.7	-5.8	113	L151 L152 T153	L151-R155 WeakPolarHBondContact O-CG 3.48Å; L151-R155 PolarHBondContact O-NH1 3.06Å; L152-R155 CarbonylContact O-C 3.58Å; L152-R155 WeakPolarHBondContact O-CA 3.28Å; L152-R155 WeakPolarHBondContact O-CB 3.44Å; L152-R155 PolarHBondContact O-N 2.96Å; T153-R155 PolarHBondContact O-N 2.89Å; T153-R155 VanDerWaalsContact O-N 3.16Å
156	G	91	Very high	89.8	Confident	53 Å²	53	57.4 Å²	57.4	55%	0.546	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.2	14.8	179.1	0	0	0	0	0	114.7	L152 T153	L152-G156 PolarHBondContact O-N 2.87Å; T153-G156 PolarHBondContact O-N 3.36Å
157	I	91.8	Very high	90.1	Very high	84 Å²	84	56.8 Å²	56.8	43%	0.431	31%	0.31	S	S	.	.			trans	-79.6	127.4	175.1	-54.4	-59	0	0	0	109.7	L152 F159	L152-I157 HydrophobicContact CB-CB 4.14Å; L152-I157 HydrophobicContact CB-CG1 4.3Å; L152-I157 HydrophobicContact CD2-CG2 4.4Å; L152-I157 WeakPolarHBondContact O-CB 3.42Å; L152-I157 PolarHBondContact O-N 2.93Å; L152-I157 VanDerWaalsContact O-N 3.13Å; I157-F159 HydrophobicContact CG2-CE2 4.39Å; I157-F159 HydrophobicContact CG2-CZ 4.46Å
158	N	92.1	Very high	90.1	Very high	83 Å²	83	55 Å²	55	44%	0.444	31%	0.305	S	S	.	.			trans	-84.4	139.5	176.5	-64.1	-71	0	0	0	111	L323 Y325	N158-L323 HydrophobicContact CB-CD1 4.14Å; N158-Y325 WeakPolarHBondContact ND2-CE2 3.46Å
159	F	92.2	Very high	89.9	Confident	42 Å²	42	55.9 Å²	55.9	18%	0.184	31%	0.308	C	S	.	.			trans	-112.4	136.9	175.4	-72.7	-84.1	0	0	0	111.5	L149 L152 I157 F161 I179 S181 Y182	L149-F159 HydrophobicContact CD2-CD1 3.54Å; L149-F159 HydrophobicContact CD2-CD2 4.26Å; L149-F159 HydrophobicContact CD2-CE1 3.34Å; L149-F159 HydrophobicContact CD2-CE2 4.08Å; L149-F159 HydrophobicContact CD2-CG 4Å; L149-F159 HydrophobicContact CD2-CZ 3.62Å; L152-F159 HydrophobicContact CB-CE2 3.68Å; L152-F159 HydrophobicContact CB-CZ 3.53Å; L152-F159 HydrophobicContact CD2-CZ 3.9Å; L152-F159 HydrophobicContact CG-CZ 4.29Å; I157-F159 HydrophobicContact CG2-CE2 4.39Å; I157-F159 HydrophobicContact CG2-CZ 4.46Å; F159-F161 HydrophobicContact CB-CE2 4.28Å; F159-F161 HydrophobicContact CB-CZ 4.07Å; F159-I179 HydrophobicContact CB-CD1 3.93Å; F159-I179 HydrophobicContact CD2-CD1 3.72Å; F159-I179 HydrophobicContact CE2-CD1 4.49Å; F159-I179 HydrophobicContact CG-CD1 3.95Å; F159-S181 WeakPolarHBondContact O-CB 3.36Å; F159-Y182 PolarHBondContact O-N 3.22Å
160	V	94.4	Very high	89.6	Confident	41 Å²	41	55.9 Å²	55.9	25%	0.248	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	122.1	174.2	-173.1	0	0	0	0	107.4	Y182 I184 L316 V319	V160-Y182 WeakPolarHBondContact CA-O 3.42Å; V160-I184 HydrophobicContact CG1-CD1 3.5Å; V160-I184 VanDerWaalsContact CG1-CD1 3.5Å; V160-I184 HydrophobicContact CG1-CG1 3.82Å; V160-L316 HydrophobicContact CB-CD1 4.24Å; V160-L316 HydrophobicContact CG1-CD1 4.27Å; V160-L316 HydrophobicContact CG2-CD1 4.35Å; V160-V319 HydrophobicContact CG1-CG1 4.09Å; V160-V319 HydrophobicContact CG2-CG1 3.62Å
161	F	92.7	Very high	89.1	Confident	34 Å²	34	52.8 Å²	52.8	15%	0.149	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	129.2	177.4	-60.2	-65.3	0	0	0	110.1	L134 L149 F159 L177 I179 S181 Y182 M183 I184	L134-F161 HydrophobicContact CD2-CD1 3.69Å; L134-F161 HydrophobicContact CD2-CE1 3.18Å; L134-F161 HydrophobicContact CD2-CZ 3.92Å; L149-F161 HydrophobicContact CD1-CZ 4.02Å; L149-F161 HydrophobicContact CD2-CE1 4.43Å; L149-F161 HydrophobicContact CD2-CZ 4.09Å; F159-F161 HydrophobicContact CB-CE2 4.28Å; F159-F161 HydrophobicContact CB-CZ 4.07Å; F161-L177 HydrophobicContact CD2-CD1 3.48Å; F161-L177 VanDerWaalsContact CD2-CD1 3.48Å; F161-L177 HydrophobicContact CE1-CD2 4.24Å; F161-L177 HydrophobicContact CE2-CD1 3.31Å; F161-L177 HydrophobicContact CE2-CD2 3.73Å; F161-L177 HydrophobicContact CE2-CG 4.11Å; F161-L177 HydrophobicContact CG-CD1 4.28Å; F161-L177 HydrophobicContact CZ-CD1 4.03Å; F161-L177 HydrophobicContact CZ-CD2 3.58Å; F161-L177 HydrophobicContact CZ-CG 4.45Å; F161-I179 HydrophobicContact CE2-CD1 4.31Å; F161-I179 HydrophobicContact CZ-CD1 4.23Å; F161-S181 WeakPolarHBondContact CD2-OG 3.07Å; F161-S181 VanDerWaalsContact CE2-CB 3.46Å; F161-S181 WeakPolarHBondContact CE2-OG 3.29Å; F161-Y182 PolarHBondContact N-O 3.28Å; F161-M183 HydrophobicContact CB-CE 4.18Å; F161-M183 HydrophobicContact CB-SD 3.74Å; F161-M183 HydrophobicContact CD2-SD 3.85Å; F161-M183 HydrophobicContact CG-SD 4.26Å; F161-I184 PolarHBondContact O-N 3.36Å
162	A	93.4	Very high	88.3	Confident	27 Å²	27	56.3 Å²	56.3	22%	0.223	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	119.5	-176.2	0	0	0	0	0	112.6	I184 K312 M342	A162-I184 WeakPolarHBondContact CA-O 3.46Å; A162-I184 HydrophobicContact CB-CB 3.93Å; A162-I184 HydrophobicContact CB-CD1 4.23Å; A162-I184 HydrophobicContact CB-CG2 4.2Å; A162-K312 HydrophobicContact CB-CB 4.14Å; A162-K312 HydrophobicContact CB-CD 3.88Å; A162-K312 HydrophobicContact CB-CG 4.09Å; A162-K312 PolarHBondContact O-NZ 3.47Å; A162-M342 HydrophobicContact CB-SD 3.79Å
163	T	90.1	Very high	87.7	Confident	32 Å²	32	54.6 Å²	54.6	20%	0.196	30%	0.304	C	S	.	.			trans	-137.3	153.6	-172.6	-173.7	0	0	0	0	112.8	R165 V170 I184 T185 S186 N187	T163-R165 VanDerWaalsContact C-N 3.28Å; T163-R165 HydrophobicContact CG2-CB 4.05Å; T163-R165 WeakPolarHBondContact OG1-CB 3.36Å; T163-R165 PolarHBondContact OG1-N 2.75Å; T163-R165 VanDerWaalsContact OG1-N 3.09Å; T163-V170 HydrophobicContact CG2-CG1 3.91Å; T163-I184 WeakPolarHBondContact CG2-O 3.43Å; T163-I184 PolarHBondContact N-O 3.13Å; T163-T185 HydrophobicContact CG2-CG2 3.87Å; T163-T185 CarbonylContact O-C 3.53Å; T163-T185 WeakPolarHBondContact O-CA 3.3Å; T163-S186 PolarHBondContact O-N 2.92Å; T163-N187 PolarHBondContact O-N 2.87Å
164	G	88.3	Confident	87.3	Confident	10 Å²	10	56.1 Å²	56.1	10%	0.103	30%	0.304	C	S	.	.	S	Bend	trans	-78.1	-13.2	167.1	0	0	0	0	0	113.3	N187 K267	G164-N187 WeakPolarHBondContact CA-OD1 3.43Å; G164-K267 PolarHBondContact O-NZ 3.38Å
165	R	88.2	Confident	86.7	Confident	67 Å²	67	57 Å²	57	25%	0.253	30%	0.296	S	S	.	.	S	Bend	trans	-67.7	157	-179.4	-68.3	-179	-178.5	-159.1	0.5	112.3	H139 T163 D169 V170 T185 S186	H139-R165 PolarHBondContact CD2-NH2 2.97Å; H139-R165 PolarHBondContact CE1-NH2 2.77Å; H139-R165 PolarHBondContact ND1-NH2 2.86Å; H139-R165 VanDerWaalsContact ND1-NH2 3.12Å; H139-R165 PolarHBondContact NE2-NH2 2.97Å; H139-R165 VanDerWaalsContact NE2-NH2 3.17Å; T163-R165 VanDerWaalsContact C-N 3.28Å; T163-R165 HydrophobicContact CG2-CB 4.05Å; T163-R165 WeakPolarHBondContact OG1-CB 3.36Å; T163-R165 PolarHBondContact OG1-N 2.75Å; T163-R165 VanDerWaalsContact OG1-N 3.09Å; R165-D169 HydrophobicContact CB-CB 4.47Å; R165-D169 VanDerWaalsContact CD-OD2 3.29Å; R165-D169 WeakPolarHBondContact CD-OD2 3.1Å; R165-D169 WeakPolarHBondContact CG-OD2 3.5Å; R165-D169 IonicContact NE-OD2 3.59Å; R165-V170 HydrophobicContact CB-CG1 3.69Å; R165-V170 HydrophobicContact CG-CG1 4.48Å; R165-T185 WeakPolarHBondContact O-CB 3.23Å; R165-S186 PolarHBondContact O-N 2.6Å
166	H	89.1	Confident	86	Confident	3 Å²	3	52.1 Å²	52.1	1%	0.014	28%	0.283	C	S	.	.			trans	-67.9	153	173.4	-163.3	-96.2	0	0	0	110.8	V168 D169 V170 Y227 D229 D230 F250	H166-V168 VanDerWaalsContact C-N 3.32Å; H166-V168 PolarHBondContact ND1-N 3.28Å; H166-V168 PolarHBondContact O-N 3.32Å; H166-D169 HydrophobicContact CB-CB 4.14Å; H166-D169 PolarHBondContact O-N 2.99Å; H166-D169 VanDerWaalsContact O-N 3.12Å; H166-V170 PolarHBondContact O-N 3.32Å; H166-Y227 HydrophobicContact CB-CD2 3.98Å; H166-Y227 HydrophobicContact CB-CE2 3.61Å; H166-Y227 AromaticContact CD2-CD2 3.65Å; H166-Y227 AromaticContact CD2-CG 3.87Å; H166-D229 PolarHBondContact CE1-O 2.84Å; H166-D229 PolarHBondContact NE2-O 3.09Å; H166-D230 IonicContact CE1-OD1 3.33Å; H166-F250 HydrophobicContact CB-CD1 4.3Å; H166-F250 HydrophobicContact CB-CE1 3.59Å; H166-F250 HydrophobicContact CB-CZ 3.81Å; H166-F250 AromaticContact CG-CE1 3.8Å; H166-F250 AromaticContact CG-CZ 3.45Å; H166-F250 VanDerWaalsContact CG-CZ 3.45Å; H166-F250 AromaticContact ND1-CE2 3.77Å; H166-F250 AromaticContact ND1-CZ 3.55Å
167	H	88.9	Confident	85.5	Confident	29 Å²	29	49.7 Å²	49.7	13%	0.134	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-43.9	178.5	-179.9	69.7	0	0	0	112.4	D169 V170 T185 H192	H167-D169 VanDerWaalsContact C-N 3.27Å; H167-D169 PolarHBondContact O-N 2.75Å; H167-V170 VanDerWaalsContact O-CG2 3.22Å; H167-V170 WeakPolarHBondContact O-CG2 3.37Å; H167-V170 PolarHBondContact O-N 2.98Å; H167-T185 HydrophobicContact CB-CG2 4.43Å; H167-H192 AromaticContact CD2-CE1 3.94Å; H167-H192 AromaticContact CD2-NE2 3.81Å; H167-H192 AromaticContact CE1-CD2 3.67Å; H167-H192 AromaticContact CE1-CE1 3.95Å; H167-H192 AromaticContact CE1-CG 3.53Å; H167-H192 AromaticContact CE1-ND1 3.73Å; H167-H192 AromaticContact CE1-NE2 3.94Å; H167-H192 AromaticContact CG-CE1 3.43Å; H167-H192 VanDerWaalsContact CG-CE1 3.43Å; H167-H192 AromaticContact CG-ND1 3.77Å; H167-H192 AromaticContact CG-NE2 3.78Å; H167-H192 AromaticContact ND1-CD2 3.94Å; H167-H192 AromaticContact ND1-CE1 3.46Å; H167-H192 PolarHBondContact ND1-CE1 2.5Å; H167-H192 AromaticContact ND1-CG 3.6Å; H167-H192 AromaticContact ND1-ND1 3.28Å; H167-H192 PolarHBondContact ND1-ND1 3.2Å; H167-H192 AromaticContact ND1-NE2 3.88Å; H167-H192 AromaticContact NE2-CD2 3.89Å; H167-H192 AromaticContact NE2-NE2 3.96Å
168	V	85.9	Confident	85	Confident	58 Å²	58	50.6 Å²	50.6	35%	0.352	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-59.3	-38.3	176.4	179.1	0	0	0	0	111.8	H166 V170 G171 D230 F250	H166-V168 VanDerWaalsContact C-N 3.32Å; H166-V168 PolarHBondContact ND1-N 3.28Å; H166-V168 PolarHBondContact O-N 3.32Å; V168-V170 VanDerWaalsContact C-N 3.31Å; V168-V170 PolarHBondContact O-N 2.96Å; V168-G171 PolarHBondContact O-N 3.38Å; V168-D230 HydrophobicContact CG2-CB 4.38Å; V168-F250 HydrophobicContact CB-CD2 3.96Å; V168-F250 HydrophobicContact CB-CE2 4.19Å; V168-F250 HydrophobicContact CG1-CB 4.48Å; V168-F250 HydrophobicContact CG1-CD2 3.8Å; V168-F250 HydrophobicContact CG1-CE2 4.45Å; V168-F250 HydrophobicContact CG1-CG 4.42Å
169	D	80	Confident	84.7	Confident	65 Å²	65	47.9 Å²	47.9	35%	0.348	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-73	-21.1	-176.9	-171.8	44.7	0	0	0	113.2	R165 H166 H167 F250	R165-D169 HydrophobicContact CB-CB 4.47Å; R165-D169 VanDerWaalsContact CD-OD2 3.29Å; R165-D169 WeakPolarHBondContact CD-OD2 3.1Å; R165-D169 WeakPolarHBondContact CG-OD2 3.5Å; R165-D169 IonicContact NE-OD2 3.59Å; H166-D169 HydrophobicContact CB-CB 4.14Å; H166-D169 PolarHBondContact O-N 2.99Å; H166-D169 VanDerWaalsContact O-N 3.12Å; H167-D169 VanDerWaalsContact C-N 3.27Å; H167-D169 PolarHBondContact O-N 2.75Å; D169-F250 HydrophobicContact CB-CD1 4.33Å
170	V	80.4	Confident	84.5	Confident	5 Å²	5	52.4 Å²	52.4	3%	0.03	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-96.1	2.7	176.3	-62.9	0	0	0	0	114.4	T163 R165 H166 H167 V168 Q172 I173 R174 M183 T185	T163-V170 HydrophobicContact CG2-CG1 3.91Å; R165-V170 HydrophobicContact CB-CG1 3.69Å; R165-V170 HydrophobicContact CG-CG1 4.48Å; H166-V170 PolarHBondContact O-N 3.32Å; H167-V170 VanDerWaalsContact O-CG2 3.22Å; H167-V170 WeakPolarHBondContact O-CG2 3.37Å; H167-V170 PolarHBondContact O-N 2.98Å; V168-V170 VanDerWaalsContact C-N 3.31Å; V168-V170 PolarHBondContact O-N 2.96Å; V170-Q172 VanDerWaalsContact C-N 3.34Å; V170-Q172 PolarHBondContact O-N 2.84Å; V170-I173 HydrophobicContact CG1-CD1 4.41Å; V170-I173 PolarHBondContact O-N 3.27Å; V170-I173 VanDerWaalsContact O-N 3.08Å; V170-R174 WeakPolarHBondContact O-CB 3.49Å; V170-R174 PolarHBondContact O-N 2.83Å; V170-M183 HydrophobicContact CB-CE 4.11Å; V170-M183 HydrophobicContact CG2-CE 3.74Å; V170-T185 HydrophobicContact CG2-CG2 3.89Å
171	G	79	Confident	84.2	Confident	14 Å²	14	50.8 Å²	50.8	14%	0.144	26%	0.256	C	S	.	.	H	α-helix	trans	-52.6	-49.7	-179.9	0	0	0	0	0	112.5	V168 I173 R174 D175	V168-G171 PolarHBondContact O-N 3.38Å; G171-I173 VanDerWaalsContact C-N 3.32Å; G171-I173 PolarHBondContact O-N 2.88Å; G171-R174 WeakPolarHBondContact O-CB 3.01Å; G171-R174 PolarHBondContact O-N 3.37Å; G171-D175 PolarHBondContact O-N 2.86Å
172	Q	73.5	Confident	84.3	Confident	149 Å²	149	50.2 Å²	50.2	70%	0.696	25%	0.253	S	S	*	.	H	α-helix	trans	-66.1	-32.7	179.7	-166.6	178.4	8	0	0	113.1	V170 N176	V170-Q172 VanDerWaalsContact C-N 3.34Å; V170-Q172 PolarHBondContact O-N 2.84Å; Q172-N176 WeakPolarHBondContact O-CB 3.49Å; Q172-N176 VanDerWaalsContact O-CG 3.28Å; Q172-N176 PolarHBondContact O-N 3.22Å; Q172-N176 PolarHBondContact O-ND2 3.42Å
173	I	76.1	Confident	84.3	Confident	28 Å²	28	49.2 Å²	49.2	14%	0.144	24%	0.243	C	C	.	.	H	α-helix	trans	-70.2	-45.8	176.7	-65.2	166.9	0	0	0	109.6	L135 V170 G171 D175 N176 L177	L135-I173 HydrophobicContact CD1-CD1 3.89Å; L135-I173 HydrophobicContact CD1-CG2 4.3Å; L135-I173 HydrophobicContact CD2-CG2 4.09Å; V170-I173 HydrophobicContact CG1-CD1 4.41Å; V170-I173 PolarHBondContact O-N 3.27Å; V170-I173 VanDerWaalsContact O-N 3.08Å; G171-I173 VanDerWaalsContact C-N 3.32Å; G171-I173 PolarHBondContact O-N 2.88Å; I173-D175 VanDerWaalsContact C-N 3.34Å; I173-D175 PolarHBondContact O-N 3.08Å; I173-N176 PolarHBondContact O-N 3.17Å; I173-L177 HydrophobicContact CG2-CD1 4.49Å; I173-L177 WeakPolarHBondContact O-CG 3.39Å; I173-L177 PolarHBondContact O-N 3.13Å; I173-L177 VanDerWaalsContact O-N 3.15Å
174	R	81.4	Confident	84.6	Confident	87 Å²	87	47.7 Å²	47.7	33%	0.328	23%	0.234	S	C	.	.	H	α-helix	trans	-56	-48.8	176.3	-176.2	-165	63.6	-157.5	-7.1	111.4	V170 G171 N176 L177	V170-R174 WeakPolarHBondContact O-CB 3.49Å; V170-R174 PolarHBondContact O-N 2.83Å; G171-R174 WeakPolarHBondContact O-CB 3.01Å; G171-R174 PolarHBondContact O-N 3.37Å; R174-N176 PolarHBondContact O-N 2.74Å; R174-L177 WeakPolarHBondContact O-CB 3.42Å; R174-L177 PolarHBondContact O-N 2.74Å
175	D	79.7	Confident	84.9	Confident	108 Å²	108	47.2 Å²	47.2	58%	0.578	23%	0.229	S	C	*	.	H	α-helix	trans	-67.4	-25.9	-177	-59.6	-10.1	0	0	0	111.7	G171 I173	G171-D175 PolarHBondContact O-N 2.86Å; I173-D175 VanDerWaalsContact C-N 3.34Å; I173-D175 PolarHBondContact O-N 3.08Å
176	N	79.1	Confident	85.3	Confident	75 Å²	75	44 Å²	44	40%	0.401	22%	0.217	S	C	.	.	H	α-helix	trans	-85.8	-10.3	176.9	-79	-37	0	0	0	115.1	K146 Q172 I173 R174 E178	K146-N176 WeakPolarHBondContact CE-O 3.5Å; K146-N176 PolarHBondContact NZ-O 2.91Å; Q172-N176 WeakPolarHBondContact O-CB 3.49Å; Q172-N176 VanDerWaalsContact O-CG 3.28Å; Q172-N176 PolarHBondContact O-N 3.22Å; Q172-N176 PolarHBondContact O-ND2 3.42Å; I173-N176 PolarHBondContact O-N 3.17Å; R174-N176 PolarHBondContact O-N 2.74Å; N176-E178 VanDerWaalsContact C-N 3.25Å; N176-E178 PolarHBondContact O-N 3.5Å
177	L	79.9	Confident	85.6	Confident	2 Å²	2	43.9 Å²	43.9	1%	0.01	22%	0.217	C	C	.	.	S	Bend	trans	-70	-21.9	-177.6	-84	163.1	0	0	0	113.1	L134 L141 L149 F161 I173 R174 I179	L134-L177 HydrophobicContact CD2-CD2 3.99Å; L141-L177 HydrophobicContact CD1-CD2 4.23Å; L141-L177 HydrophobicContact CD2-CD2 3.62Å; L141-L177 HydrophobicContact CD2-CG 4.31Å; L149-L177 HydrophobicContact CD1-CD2 3.47Å; L149-L177 VanDerWaalsContact CD1-CD2 3.47Å; F161-L177 HydrophobicContact CD2-CD1 3.48Å; F161-L177 VanDerWaalsContact CD2-CD1 3.48Å; F161-L177 HydrophobicContact CE1-CD2 4.24Å; F161-L177 HydrophobicContact CE2-CD1 3.31Å; F161-L177 HydrophobicContact CE2-CD2 3.73Å; F161-L177 HydrophobicContact CE2-CG 4.11Å; F161-L177 HydrophobicContact CG-CD1 4.28Å; F161-L177 HydrophobicContact CZ-CD1 4.03Å; F161-L177 HydrophobicContact CZ-CD2 3.58Å; F161-L177 HydrophobicContact CZ-CG 4.45Å; I173-L177 HydrophobicContact CG2-CD1 4.49Å; I173-L177 WeakPolarHBondContact O-CG 3.39Å; I173-L177 PolarHBondContact O-N 3.13Å; I173-L177 VanDerWaalsContact O-N 3.15Å; R174-L177 WeakPolarHBondContact O-CB 3.42Å; R174-L177 PolarHBondContact O-N 2.74Å; L177-I179 HydrophobicContact CB-CG1 4.27Å; L177-I179 PolarHBondContact O-N 2.89Å
178	E	81.7	Confident	86	Confident	104 Å²	104	42.6 Å²	42.6	49%	0.486	21%	0.211	S	C	.	.			trans	56.7	14.3	-179.2	-62.7	172.6	-142.1	0	0	114.4	K146 K150 N176	K146-E178 IonicContact NZ-OE1 2.83Å; K146-E178 PolarHBondContact NZ-OE1 2.7Å; K150-E178 WeakPolarHBondContact CE-OE2 3.27Å; K150-E178 IonicContact NZ-OE2 3.57Å; K150-E178 PolarHBondContact NZ-OE2 2.87Å; N176-E178 VanDerWaalsContact C-N 3.25Å; N176-E178 PolarHBondContact O-N 3.5Å
179	I	84.5	Confident	86.5	Confident	25 Å²	25	39.9 Å²	39.9	13%	0.128	19%	0.194	C	C	.	.	S	Bend	trans	-135.1	149	173.3	61.2	156.7	0	0	0	109.6	L149 K150 T153 F159 F161 L177	L149-I179 HydrophobicContact CB-CD1 3.99Å; L149-I179 HydrophobicContact CB-CG1 4.5Å; L149-I179 HydrophobicContact CB-CG2 4.48Å; L149-I179 HydrophobicContact CD1-CD1 4.16Å; L149-I179 HydrophobicContact CD1-CG1 4.43Å; L149-I179 HydrophobicContact CD2-CD1 4.24Å; L149-I179 HydrophobicContact CG-CD1 4.37Å; K150-I179 HydrophobicContact CG-CG2 4.3Å; T153-I179 HydrophobicContact CG2-CG2 4.49Å; F159-I179 HydrophobicContact CB-CD1 3.93Å; F159-I179 HydrophobicContact CD2-CD1 3.72Å; F159-I179 HydrophobicContact CE2-CD1 4.49Å; F159-I179 HydrophobicContact CG-CD1 3.95Å; F161-I179 HydrophobicContact CE2-CD1 4.31Å; F161-I179 HydrophobicContact CZ-CD1 4.23Å; L177-I179 HydrophobicContact CB-CG1 4.27Å; L177-I179 PolarHBondContact O-N 2.89Å
180	K	87.5	Confident	87.3	Confident	137 Å²	137	37.4 Å²	37.4	60%	0.596	18%	0.18	S	C	*	.			trans	-77.3	134.6	168.6	-68.1	-165	173.9	-162.3	0	109.3	L194 D195	K180-L194 HydrophobicContact CB-CB 4.12Å; K180-L194 HydrophobicContact CB-CD2 4.09Å; K180-L194 HydrophobicContact CD-CB 4.18Å; K180-D195 IonicContact NZ-OD1 3.48Å; K180-D195 PolarHBondContact NZ-OD1 2.93Å
181	S	89.8	Confident	88.1	Confident	8 Å²	8	37.2 Å²	37.2	6%	0.056	18%	0.179	C	C	.	.			trans	-152.1	154.7	-177.4	54.4	0	0	0	0	111.2	F159 F161 L194	F159-S181 WeakPolarHBondContact O-CB 3.36Å; F161-S181 WeakPolarHBondContact CD2-OG 3.07Å; F161-S181 VanDerWaalsContact CE2-CB 3.46Å; F161-S181 WeakPolarHBondContact CE2-OG 3.29Å; S181-L194 VanDerWaalsContact C-CD2 3.47Å
182	Y	93.8	Very high	88.9	Confident	21 Å²	21	37.4 Å²	37.4	8%	0.082	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	140.9	169.7	-83.5	-96.1	0	0	0	109.7	F159 V160 F161 V191 H192 D193 L194 I199 V319 K322 L323	F159-Y182 PolarHBondContact O-N 3.22Å; V160-Y182 WeakPolarHBondContact CA-O 3.42Å; F161-Y182 PolarHBondContact N-O 3.28Å; Y182-V191 HydrophobicContact CD1-CG1 4.22Å; Y182-H192 WeakPolarHBondContact CD1-O 3.29Å; Y182-D193 HydrophobicContact CD1-CB 4.33Å; Y182-D193 HydrophobicContact CE1-CB 3.82Å; Y182-L194 HydrophobicContact CD2-CD2 3.87Å; Y182-L194 HydrophobicContact CD2-CG 4.34Å; Y182-L194 HydrophobicContact CE2-CD2 4.1Å; Y182-L194 HydrophobicContact CE2-CG 4.1Å; Y182-I199 HydrophobicContact CE1-CG1 4.49Å; Y182-V319 HydrophobicContact CD1-CG1 3.9Å; Y182-V319 HydrophobicContact CD1-CG2 4.16Å; Y182-V319 HydrophobicContact CD2-CG1 4.05Å; Y182-V319 HydrophobicContact CE1-CG1 4.49Å; Y182-V319 HydrophobicContact CG-CG1 3.65Å; Y182-K322 HydrophobicContact CE1-CD 4.47Å; Y182-K322 PolarHBondContact OH-NZ 2.92Å; Y182-L323 HydrophobicContact CD2-CD1 4.22Å; Y182-L323 HydrophobicContact CD2-CD2 4.36Å; Y182-L323 HydrophobicContact CD2-CG 4.46Å; Y182-L323 HydrophobicContact CE2-CD1 4.25Å; Y182-L323 HydrophobicContact CE2-CD2 3.65Å; Y182-L323 HydrophobicContact CE2-CG 3.99Å
183	M	94.4	Very high	89.8	Confident	6 Å²	6	31.5 Å²	31.5	3%	0.03	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	110.1	-178.9	-66.8	-62.5	-62.6	0	0	110.6	F161 V170 V191 H192	F161-M183 HydrophobicContact CB-CE 4.18Å; F161-M183 HydrophobicContact CB-SD 3.74Å; F161-M183 HydrophobicContact CD2-SD 3.85Å; F161-M183 HydrophobicContact CG-SD 4.26Å; V170-M183 HydrophobicContact CB-CE 4.11Å; V170-M183 HydrophobicContact CG2-CE 3.74Å; M183-V191 WeakPolarHBondContact O-CA 3.29Å; M183-H192 HydrophobicContact CB-CB 4.44Å; M183-H192 PolarHBondContact N-O 2.72Å; M183-H192 PolarHBondContact O-N 3.23Å
184	I	96.2	Very high	90.4	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	118.3	169.7	-59.6	171.6	0	0	0	107.8	V160 F161 A162 T163 V191 A315 L316 V319	V160-I184 HydrophobicContact CG1-CD1 3.5Å; V160-I184 VanDerWaalsContact CG1-CD1 3.5Å; V160-I184 HydrophobicContact CG1-CG1 3.82Å; F161-I184 PolarHBondContact O-N 3.36Å; A162-I184 WeakPolarHBondContact CA-O 3.46Å; A162-I184 HydrophobicContact CB-CB 3.93Å; A162-I184 HydrophobicContact CB-CD1 4.23Å; A162-I184 HydrophobicContact CB-CG2 4.2Å; T163-I184 WeakPolarHBondContact CG2-O 3.43Å; T163-I184 PolarHBondContact N-O 3.13Å; I184-V191 HydrophobicContact CB-CG2 4.47Å; I184-V191 HydrophobicContact CG1-CG2 3.95Å; I184-V191 HydrophobicContact CG2-CG2 4.5Å; I184-A315 HydrophobicContact CB-CB 4.43Å; I184-A315 HydrophobicContact CD1-CB 3.88Å; I184-A315 HydrophobicContact CG1-CB 4.07Å; I184-A315 HydrophobicContact CG2-CB 3.52Å; I184-L316 HydrophobicContact CD1-CB 4.13Å; I184-V319 HydrophobicContact CD1-CG2 4.31Å; I184-V319 HydrophobicContact CG1-CG2 4.23Å
185	T	95	Very high	90.7	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	164.6	-174.5	51.8	0	0	0	0	110.8	T163 R165 H167 V170 N187 G188 A189 R190	T163-T185 HydrophobicContact CG2-CG2 3.87Å; T163-T185 CarbonylContact O-C 3.53Å; T163-T185 WeakPolarHBondContact O-CA 3.3Å; R165-T185 WeakPolarHBondContact O-CB 3.23Å; H167-T185 HydrophobicContact CB-CG2 4.43Å; V170-T185 HydrophobicContact CG2-CG2 3.89Å; T185-N187 VanDerWaalsContact C-N 3.27Å; T185-N187 PolarHBondContact O-N 2.82Å; T185-G188 PolarHBondContact O-N 3.32Å; T185-A189 PolarHBondContact O-N 3.18Å; T185-R190 PolarHBondContact N-O 3.26Å; T185-R190 PolarHBondContact O-N 3.23Å; T185-R190 VanDerWaalsContact OG1-CB 3.27Å; T185-R190 WeakPolarHBondContact OG1-CB 3.46Å; T185-R190 PolarHBondContact OG1-O 3.3Å
186	S	95.2	Very high	91.1	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	48.3	47.2	-174	-64.3	0	0	0	0	113	T163 R165 G188 A189 S266	T163-S186 PolarHBondContact O-N 2.92Å; R165-S186 PolarHBondContact O-N 2.6Å; S186-G188 PolarHBondContact O-N 3.45Å; S186-G188 VanDerWaalsContact O-N 3.13Å; S186-A189 WeakPolarHBondContact O-CB 3.49Å; S186-A189 PolarHBondContact O-N 3.01Å; S186-A189 VanDerWaalsContact O-N 3.13Å; S186-S266 PolarHBondContact OG-OG 3.19Å
187	N	95.2	Very high	91.7	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.005	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	53.5	29.4	-178.1	-60.2	-42.9	0	0	0	114.9	T163 G164 T185 E304 M306 S311 K312 N338	T163-N187 PolarHBondContact O-N 2.87Å; G164-N187 WeakPolarHBondContact CA-OD1 3.43Å; T185-N187 VanDerWaalsContact C-N 3.27Å; T185-N187 PolarHBondContact O-N 2.82Å; N187-E304 PolarHBondContact ND2-OE2 3.46Å; N187-M306 HydrophobicContact CB-CE 3.71Å; N187-M306 HydrophobicContact CB-CG 4.18Å; N187-M306 HydrophobicContact CB-SD 3.84Å; N187-M306 PolarHBondContact ND2-SD 2.72Å; N187-S311 CarbonylContact O-C 3.25Å; N187-S311 WeakPolarHBondContact O-CA 3.35Å; N187-K312 HydrophobicContact CB-CG 4.5Å; N187-K312 PolarHBondContact O-N 2.82Å; N187-K312 WeakPolarHBondContact OD1-CE 3.4Å; N187-N338 PolarHBondContact OD1-ND2 3.01Å
188	G	96.8	Very high	92.4	Very high	2 Å²	2	36 Å²	36	2%	0.021	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	107.9	-8.7	179.7	0	0	0	0	0	114.9	T185 S186 R190 F200 V310	T185-G188 PolarHBondContact O-N 3.32Å; S186-G188 PolarHBondContact O-N 3.45Å; S186-G188 VanDerWaalsContact O-N 3.13Å; G188-R190 PolarHBondContact O-N 3.39Å; G188-F200 WeakPolarHBondContact O-CE2 3.41Å; G188-V310 VanDerWaalsContact C-CG1 3.46Å
189	A	97.7	Very high	93.1	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-17.3	178.9	0	0	0	0	0	113.4	T185 S186 A201 H202 S266 V310	T185-A189 PolarHBondContact O-N 3.18Å; S186-A189 WeakPolarHBondContact O-CB 3.49Å; S186-A189 PolarHBondContact O-N 3.01Å; S186-A189 VanDerWaalsContact O-N 3.13Å; A189-A201 WeakPolarHBondContact O-CA 3.32Å; A189-H202 WeakPolarHBondContact CB-O 3.45Å; A189-H202 PolarHBondContact O-N 2.89Å; A189-S266 VanDerWaalsContact CB-O 3.32Å; A189-S266 WeakPolarHBondContact CB-O 3.44Å; A189-V310 HydrophobicContact CB-CG1 3.98Å; A189-V310 VanDerWaalsContact N-CG1 3.34Å
190	R	97.5	Very high	93.7	Very high	13 Å²	13	34.4 Å²	34.4	5%	0.049	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	134.5	-179.7	-65.7	-67	-177.6	-80	0	110.2	T185 G188 L198 N203 G264	T185-R190 PolarHBondContact N-O 3.26Å; T185-R190 PolarHBondContact O-N 3.23Å; T185-R190 VanDerWaalsContact OG1-CB 3.27Å; T185-R190 WeakPolarHBondContact OG1-CB 3.46Å; T185-R190 PolarHBondContact OG1-O 3.3Å; G188-R190 PolarHBondContact O-N 3.39Å; R190-L198 HydrophobicContact CB-CD1 4.43Å; R190-N203 PolarHBondContact NH1-OD1 2.91Å; R190-N203 PolarHBondContact NH2-OD1 3.31Å; R190-G264 PolarHBondContact NH2-O 3.31Å
191	V	96.8	Very high	94.1	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.006	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	129.4	172.1	172.9	0	0	0	0	109.9	Y182 M183 I184 I199 F200 A315 V319	Y182-V191 HydrophobicContact CD1-CG1 4.22Å; M183-V191 WeakPolarHBondContact O-CA 3.29Å; I184-V191 HydrophobicContact CB-CG2 4.47Å; I184-V191 HydrophobicContact CG1-CG2 3.95Å; I184-V191 HydrophobicContact CG2-CG2 4.5Å; V191-I199 HydrophobicContact CG1-CB 4.25Å; V191-I199 HydrophobicContact CG1-CG1 4.46Å; V191-I199 PolarHBondContact O-N 3.09Å; V191-F200 HydrophobicContact CB-CD1 4Å; V191-F200 HydrophobicContact CB-CE1 3.6Å; V191-F200 HydrophobicContact CB-CE2 4.35Å; V191-F200 HydrophobicContact CB-CZ 3.81Å; V191-F200 HydrophobicContact CG1-CE1 4.26Å; V191-F200 HydrophobicContact CG2-CD1 4.25Å; V191-F200 HydrophobicContact CG2-CE1 3.4Å; V191-F200 HydrophobicContact CG2-CE2 3.82Å; V191-F200 HydrophobicContact CG2-CZ 3.14Å; V191-F200 PolarHBondContact N-O 3.42Å; V191-A315 HydrophobicContact CG2-CB 4.01Å; V191-V319 HydrophobicContact CG1-CG2 3.56Å; V191-V319 HydrophobicContact CG2-CG2 4.31Å
192	H	95.1	Very high	94.5	Very high	18 Å²	18	34 Å²	34	8%	0.083	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	145.5	173.4	-61.6	76.5	0	0	0	110.5	H167 Y182 M183 G196 N197 L198	H167-H192 AromaticContact CD2-CE1 3.94Å; H167-H192 AromaticContact CD2-NE2 3.81Å; H167-H192 AromaticContact CE1-CD2 3.67Å; H167-H192 AromaticContact CE1-CE1 3.95Å; H167-H192 AromaticContact CE1-CG 3.53Å; H167-H192 AromaticContact CE1-ND1 3.73Å; H167-H192 AromaticContact CE1-NE2 3.94Å; H167-H192 AromaticContact CG-CE1 3.43Å; H167-H192 VanDerWaalsContact CG-CE1 3.43Å; H167-H192 AromaticContact CG-ND1 3.77Å; H167-H192 AromaticContact CG-NE2 3.78Å; H167-H192 AromaticContact ND1-CD2 3.94Å; H167-H192 AromaticContact ND1-CE1 3.46Å; H167-H192 PolarHBondContact ND1-CE1 2.5Å; H167-H192 AromaticContact ND1-CG 3.6Å; H167-H192 AromaticContact ND1-ND1 3.28Å; H167-H192 PolarHBondContact ND1-ND1 3.2Å; H167-H192 AromaticContact ND1-NE2 3.88Å; H167-H192 AromaticContact NE2-CD2 3.89Å; H167-H192 AromaticContact NE2-NE2 3.96Å; Y182-H192 WeakPolarHBondContact CD1-O 3.29Å; M183-H192 HydrophobicContact CB-CB 4.44Å; M183-H192 PolarHBondContact N-O 2.72Å; M183-H192 PolarHBondContact O-N 3.23Å; H192-G196 PolarHBondContact CD2-O 3.04Å; H192-N197 CarbonylContact C-O 2.94Å; H192-N197 VanDerWaalsContact CA-O 3.23Å; H192-N197 WeakPolarHBondContact CA-O 3.02Å; H192-L198 WeakPolarHBondContact NE2-CD1 3.47Å
193	D	92.7	Very high	94.7	Very high	25 Å²	25	35.6 Å²	35.6	13%	0.134	19%	0.194	C	C	.	.			trans	-82.5	-172	177.8	70.1	17.7	0	0	0	113.6	Y182 D195 G196 N197 I199	Y182-D193 HydrophobicContact CD1-CB 4.33Å; Y182-D193 HydrophobicContact CE1-CB 3.82Å; D193-D195 PolarHBondContact O-N 3.13Å; D193-D195 PolarHBondContact OD1-N 3.44Å; D193-G196 PolarHBondContact O-N 2.88Å; D193-G196 VanDerWaalsContact O-N 3.09Å; D193-G196 PolarHBondContact OD1-N 3.14Å; D193-N197 PolarHBondContact N-O 2.97Å; D193-N197 PolarHBondContact OD1-N 2.69Å; D193-N197 PolarHBondContact OD1-ND2 3.18Å; D193-N197 WeakPolarHBondContact OD2-CB 3.42Å; D193-N197 PolarHBondContact OD2-ND2 3.14Å; D193-N197 VanDerWaalsContact OD2-ND2 3.13Å; D193-I199 HydrophobicContact CB-CD1 3.88Å; D193-I199 HydrophobicContact CB-CG1 3.99Å
194	L	87.5	Confident	94.9	Very high	75 Å²	75	35.7 Å²	35.7	39%	0.393	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-22.2	-178.1	-57.4	-176.9	0	0	0	114.1	K180 S181 Y182	K180-L194 HydrophobicContact CB-CB 4.12Å; K180-L194 HydrophobicContact CB-CD2 4.09Å; K180-L194 HydrophobicContact CD-CB 4.18Å; S181-L194 VanDerWaalsContact C-CD2 3.47Å; Y182-L194 HydrophobicContact CD2-CD2 3.87Å; Y182-L194 HydrophobicContact CD2-CG 4.34Å; Y182-L194 HydrophobicContact CE2-CD2 4.1Å; Y182-L194 HydrophobicContact CE2-CG 4.1Å
195	D	88.3	Confident	94.9	Very high	112 Å²	112	39.1 Å²	39.1	60%	0.599	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106.3	3.9	-179.9	-59.8	-48.3	0	0	0	111.5	K180 D193	K180-D195 IonicContact NZ-OD1 3.48Å; K180-D195 PolarHBondContact NZ-OD1 2.93Å; D193-D195 PolarHBondContact O-N 3.13Å; D193-D195 PolarHBondContact OD1-N 3.44Å
196	G	87.6	Confident	95	Very high	25 Å²	25	46 Å²	46	26%	0.258	24%	0.239	S	C	.	.	S	Bend	trans	83.2	12.9	179.3	0	0	0	0	0	114.2	H192 D193	H192-G196 PolarHBondContact CD2-O 3.04Å; D193-G196 PolarHBondContact O-N 2.88Å; D193-G196 VanDerWaalsContact O-N 3.09Å; D193-G196 PolarHBondContact OD1-N 3.14Å
197	N	93.2	Very high	95	Very high	90 Å²	90	49.6 Å²	49.6	48%	0.481	26%	0.259	S	S	.	.			trans	-77.9	136.6	175.9	-50.6	-65.4	0	0	0	110.5	H192 D193 I199	H192-N197 CarbonylContact C-O 2.94Å; H192-N197 VanDerWaalsContact CA-O 3.23Å; H192-N197 WeakPolarHBondContact CA-O 3.02Å; D193-N197 PolarHBondContact N-O 2.97Å; D193-N197 PolarHBondContact OD1-N 2.69Å; D193-N197 PolarHBondContact OD1-ND2 3.18Å; D193-N197 WeakPolarHBondContact OD2-CB 3.42Å; D193-N197 PolarHBondContact OD2-ND2 3.14Å; D193-N197 VanDerWaalsContact OD2-ND2 3.13Å; N197-I199 PolarHBondContact O-N 3.15Å
198	L	94.8	Very high	95.1	Very high	92 Å²	92	49.5 Å²	49.5	48%	0.482	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	120	174.6	-176.5	69.5	0	0	0	110.2	R190 H192 F200 A201	R190-L198 HydrophobicContact CB-CD1 4.43Å; H192-L198 WeakPolarHBondContact NE2-CD1 3.47Å; L198-F200 WeakPolarHBondContact CD1-O 3.35Å; L198-A201 HydrophobicContact CD2-CB 4.29Å
199	I	95.3	Very high	95.1	Very high	60 Å²	60	49.4 Å²	49.4	31%	0.308	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	-44.4	178	-61.1	-53.4	0	0	0	111.1	Y182 V191 D193 N197 K322	Y182-I199 HydrophobicContact CE1-CG1 4.49Å; V191-I199 HydrophobicContact CG1-CB 4.25Å; V191-I199 HydrophobicContact CG1-CG1 4.46Å; V191-I199 PolarHBondContact O-N 3.09Å; D193-I199 HydrophobicContact CB-CD1 3.88Å; D193-I199 HydrophobicContact CB-CG1 3.99Å; N197-I199 PolarHBondContact O-N 3.15Å; I199-K322 HydrophobicContact CG2-CD 4.02Å
200	F	96.8	Very high	95	Very high	36 Å²	36	52.2 Å²	52.2	16%	0.158	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	157.2	174.3	66.7	-104.8	0	0	0	112.1	G188 V191 L198 H202 A315 A318	G188-F200 WeakPolarHBondContact O-CE2 3.41Å; V191-F200 HydrophobicContact CB-CD1 4Å; V191-F200 HydrophobicContact CB-CE1 3.6Å; V191-F200 HydrophobicContact CB-CE2 4.35Å; V191-F200 HydrophobicContact CB-CZ 3.81Å; V191-F200 HydrophobicContact CG1-CE1 4.26Å; V191-F200 HydrophobicContact CG2-CD1 4.25Å; V191-F200 HydrophobicContact CG2-CE1 3.4Å; V191-F200 HydrophobicContact CG2-CE2 3.82Å; V191-F200 HydrophobicContact CG2-CZ 3.14Å; V191-F200 PolarHBondContact N-O 3.42Å; L198-F200 WeakPolarHBondContact CD1-O 3.35Å; F200-H202 AromaticContact CD2-CD2 3.82Å; F200-H202 AromaticContact CD2-CE1 3.55Å; F200-H202 AromaticContact CD2-CG 3.85Å; F200-H202 AromaticContact CD2-ND1 3.69Å; F200-H202 AromaticContact CD2-NE2 3.63Å; F200-H202 AromaticContact CE2-CE1 3.68Å; F200-H202 AromaticContact CE2-ND1 3.59Å; F200-H202 AromaticContact CG-NE2 3.99Å; F200-A315 HydrophobicContact CZ-CB 4.14Å; F200-A318 HydrophobicContact CE1-CB 3.86Å; F200-A318 HydrophobicContact CZ-CB 4.35Å
201	A	97.2	Very high	94.9	Very high	43 Å²	43	54.6 Å²	54.6	36%	0.355	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	112.3	173.4	0	0	0	0	0	109.6	A189 L198	A189-A201 WeakPolarHBondContact O-CA 3.32Å; L198-A201 HydrophobicContact CD2-CB 4.29Å
202	H	97.3	Very high	94.9	Very high	95 Å²	95	54.5 Å²	54.5	44%	0.44	29%	0.29	S	S	.	.			trans	-106.7	107.9	174.6	-62.7	162.7	0	0	0	108.8	A189 F200 V310	A189-H202 WeakPolarHBondContact CB-O 3.45Å; A189-H202 PolarHBondContact O-N 2.89Å; F200-H202 AromaticContact CD2-CD2 3.82Å; F200-H202 AromaticContact CD2-CE1 3.55Å; F200-H202 AromaticContact CD2-CG 3.85Å; F200-H202 AromaticContact CD2-ND1 3.69Å; F200-H202 AromaticContact CD2-NE2 3.63Å; F200-H202 AromaticContact CE2-CE1 3.68Å; F200-H202 AromaticContact CE2-ND1 3.59Å; F200-H202 AromaticContact CG-NE2 3.99Å; H202-V310 HydrophobicContact CB-CG2 3.6Å
203	N	97.9	Very high	94.9	Very high	53 Å²	53	53.8 Å²	53.8	28%	0.283	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-98.7	159.1	-175.2	-66.7	-37.3	0	0	0	111.5	R190 G264 V265 A307	R190-N203 PolarHBondContact NH1-OD1 2.91Å; R190-N203 PolarHBondContact NH2-OD1 3.31Å; N203-G264 PolarHBondContact OD1-O 3.41Å; N203-V265 CarbonylContact C-O 3.16Å; N203-V265 VanDerWaalsContact CA-O 3.22Å; N203-V265 WeakPolarHBondContact CA-O 3.43Å; N203-V265 WeakPolarHBondContact CB-O 3.45Å; N203-V265 PolarHBondContact OD1-O 3.25Å; N203-A307 VanDerWaalsContact O-CB 3.3Å; N203-A307 WeakPolarHBondContact O-CB 3.34Å
204	L	97.9	Very high	94.8	Very high	8 Å²	8	54.3 Å²	54.3	4%	0.042	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-58.3	144.5	165.6	-82.1	162.7	0	0	0	110.7	I208 A209 L212 V265 V268 V293 V305 M306 A307	L204-I208 HydrophobicContact CD2-CG2 4.11Å; L204-A209 HydrophobicContact CB-CB 4.11Å; L204-L212 HydrophobicContact CD1-CD1 3.96Å; L204-L212 HydrophobicContact CD2-CD1 4.36Å; L204-V265 HydrophobicContact CD1-CG1 3.97Å; L204-V265 PolarHBondContact N-O 3Å; L204-V268 HydrophobicContact CD1-CB 4.48Å; L204-V268 HydrophobicContact CD1-CG2 3.9Å; L204-V293 HydrophobicContact CD2-CG1 4.29Å; L204-V305 HydrophobicContact CD2-CG1 4.4Å; L204-M306 VanDerWaalsContact CD2-C 3.48Å; L204-A307 HydrophobicContact CD2-CB 4.46Å
205	D	97.5	Very high	95	Very high	72 Å²	72	53.2 Å²	53.2	39%	0.385	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-60	141.3	171.5	-68.1	-20.4	0	0	0	110	D207 I208 A209 R292	D205-D207 VanDerWaalsContact C-N 3.28Å; D205-D207 VanDerWaalsContact CB-OD1 3.31Å; D205-D207 WeakPolarHBondContact CB-OD1 3.34Å; D205-D207 PolarHBondContact O-N 3.5Å; D205-I208 HydrophobicContact CB-CB 4.48Å; D205-I208 HydrophobicContact CB-CD1 4.05Å; D205-I208 HydrophobicContact CB-CG1 4.07Å; D205-I208 PolarHBondContact O-N 2.93Å; D205-A209 PolarHBondContact O-N 3.43Å; D205-R292 IonicContact OD2-CZ 3.35Å; D205-R292 IonicContact OD2-NE 3.4Å; D205-R292 PolarHBondContact OD2-NE 2.52Å; D205-R292 IonicContact OD2-NH2 3.03Å; D205-R292 PolarHBondContact OD2-NH2 3.19Å
206	R	96.8	Very high	95.2	Very high	145 Å²	145	48.9 Å²	48.9	55%	0.547	27%	0.271	S	S	.	.	H	α-helix	trans	-54.7	-41.8	-172.4	-168.9	-179	-179.3	-95.6	-2.9	113.2	S210 E261 P262	R206-S210 WeakPolarHBondContact O-CB 3.04Å; R206-S210 PolarHBondContact O-N 2.76Å; R206-S210 VanDerWaalsContact O-N 3.13Å; R206-E261 IonicContact NE-OE1 3.74Å; R206-E261 IonicContact NH2-OE1 3.84Å; R206-P262 HydrophobicContact CG-CB 3.83Å; R206-P262 HydrophobicContact CG-CG 3.5Å; R206-P262 WeakPolarHBondContact O-CB 3.46Å
207	D	95.7	Very high	95.2	Very high	75 Å²	75	49.5 Å²	49.5	40%	0.401	27%	0.269	S	S	.	.	H	α-helix	trans	-65.9	-42	178.2	60.9	-48.9	0	0	0	111.9	D205 D211 R292	D205-D207 VanDerWaalsContact C-N 3.28Å; D205-D207 VanDerWaalsContact CB-OD1 3.31Å; D205-D207 WeakPolarHBondContact CB-OD1 3.34Å; D205-D207 PolarHBondContact O-N 3.5Å; D207-D211 PolarHBondContact O-N 3.37Å; D207-D211 VanDerWaalsContact O-N 3.16Å; D207-R292 VanDerWaalsContact CG-NH2 3.33Å; D207-R292 IonicContact OD1-CZ 3.05Å; D207-R292 IonicContact OD1-NH1 3.99Å; D207-R292 IonicContact OD1-NH2 2.67Å; D207-R292 PolarHBondContact OD1-NH2 3.43Å; D207-R292 IonicContact OD2-CZ 2.8Å; D207-R292 IonicContact OD2-NH1 2.76Å; D207-R292 PolarHBondContact OD2-NH1 2.93Å; D207-R292 IonicContact OD2-NH2 2.63Å; D207-R292 PolarHBondContact OD2-NH2 3Å
208	I	97.1	Very high	95	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-69.1	-45.9	179.4	-54.5	-178.2	0	0	0	110.6	L204 D205 S210 D211 L212 W289 R292 V293	L204-I208 HydrophobicContact CD2-CG2 4.11Å; D205-I208 HydrophobicContact CB-CB 4.48Å; D205-I208 HydrophobicContact CB-CD1 4.05Å; D205-I208 HydrophobicContact CB-CG1 4.07Å; D205-I208 PolarHBondContact O-N 2.93Å; I208-S210 VanDerWaalsContact C-N 3.34Å; I208-S210 PolarHBondContact O-N 3.05Å; I208-D211 PolarHBondContact O-N 2.89Å; I208-L212 HydrophobicContact CG2-CD1 3.78Å; I208-L212 HydrophobicContact CG2-CG 4.17Å; I208-L212 WeakPolarHBondContact O-CB 3.39Å; I208-L212 VanDerWaalsContact O-CG 3.29Å; I208-L212 WeakPolarHBondContact O-CG 3.38Å; I208-L212 PolarHBondContact O-N 3.09Å; I208-W289 HydrophobicContact CD1-CG 4.29Å; I208-W289 HydrophobicContact CG1-CG 4.39Å; I208-W289 HydrophobicContact CG2-CD2 4.08Å; I208-W289 HydrophobicContact CG2-CG 4.31Å; I208-W289 HydrophobicContact CG2-CZ2 4.39Å; I208-R292 HydrophobicContact CD1-CB 3.63Å; I208-V293 HydrophobicContact CD1-CG1 4.01Å; I208-V293 HydrophobicContact CG2-CG1 3.7Å
209	A	97	Very high	94.8	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-57.2	-48.2	177.9	0	0	0	0	0	111.4	L204 D205 D211 L212 F213 P262 V265	L204-A209 HydrophobicContact CB-CB 4.11Å; D205-A209 PolarHBondContact O-N 3.43Å; A209-D211 VanDerWaalsContact C-N 3.31Å; A209-D211 PolarHBondContact O-N 3.15Å; A209-L212 PolarHBondContact O-N 2.9Å; A209-F213 HydrophobicContact CB-CE1 4.45Å; A209-F213 HydrophobicContact CB-CZ 4.3Å; A209-F213 WeakPolarHBondContact O-CD1 3.4Å; A209-F213 WeakPolarHBondContact O-CE1 3.45Å; A209-F213 WeakPolarHBondContact O-CG 3.48Å; A209-F213 PolarHBondContact O-N 3.16Å; A209-P262 HydrophobicContact CB-CB 3.98Å; A209-V265 HydrophobicContact CB-CB 4.22Å; A209-V265 HydrophobicContact CB-CG1 4.48Å; A209-V265 HydrophobicContact CB-CG2 4.09Å
210	S	95.1	Very high	94.5	Very high	58 Å²	58	52.5 Å²	52.5	41%	0.406	29%	0.292	S	S	.	.	H	α-helix	trans	-59	-40.5	177.9	-171.4	0	0	0	0	112.5	R206 I208	R206-S210 WeakPolarHBondContact O-CB 3.04Å; R206-S210 PolarHBondContact O-N 2.76Å; R206-S210 VanDerWaalsContact O-N 3.13Å; I208-S210 VanDerWaalsContact C-N 3.34Å; I208-S210 PolarHBondContact O-N 3.05Å
211	D	95.2	Very high	94.2	Very high	63 Å²	63	55.1 Å²	55.1	34%	0.337	31%	0.307	S	S	.	.	H	α-helix	trans	-69.5	-43	178.5	-80.5	-14.9	0	0	0	111.9	D207 I208 A209 F213 G214 V215 R288 W289	D207-D211 PolarHBondContact O-N 3.37Å; D207-D211 VanDerWaalsContact O-N 3.16Å; I208-D211 PolarHBondContact O-N 2.89Å; A209-D211 VanDerWaalsContact C-N 3.31Å; A209-D211 PolarHBondContact O-N 3.15Å; D211-F213 PolarHBondContact O-N 3.21Å; D211-G214 PolarHBondContact O-N 2.82Å; D211-G214 VanDerWaalsContact O-N 3.1Å; D211-V215 PolarHBondContact O-N 3.35Å; D211-R288 VanDerWaalsContact CG-NH2 3.3Å; D211-R288 IonicContact OD1-NH2 2.71Å; D211-R288 IonicContact OD2-CZ 3.74Å; D211-R288 IonicContact OD2-NE 2.67Å; D211-R288 IonicContact OD2-NH2 3.25Å; D211-R288 PolarHBondContact OD2-NH2 3.33Å; D211-W289 HydrophobicContact CB-CH2 4.11Å; D211-W289 HydrophobicContact CB-CZ2 3.57Å
212	L	96.5	Very high	94	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-63.1	-28.9	-179.4	-73.7	171.6	0	0	0	112.6	L204 I208 A209 G214 V215 V268 F270 I285 W289 V305	L204-L212 HydrophobicContact CD1-CD1 3.96Å; L204-L212 HydrophobicContact CD2-CD1 4.36Å; I208-L212 HydrophobicContact CG2-CD1 3.78Å; I208-L212 HydrophobicContact CG2-CG 4.17Å; I208-L212 WeakPolarHBondContact O-CB 3.39Å; I208-L212 VanDerWaalsContact O-CG 3.29Å; I208-L212 WeakPolarHBondContact O-CG 3.38Å; I208-L212 PolarHBondContact O-N 3.09Å; A209-L212 PolarHBondContact O-N 2.9Å; L212-G214 PolarHBondContact O-N 3.02Å; L212-V215 HydrophobicContact CD2-CG1 4.5Å; L212-V215 WeakPolarHBondContact O-CG1 3.03Å; L212-V268 HydrophobicContact CB-CB 4.24Å; L212-V268 HydrophobicContact CB-CG1 4.1Å; L212-V268 HydrophobicContact CB-CG2 4.06Å; L212-V268 HydrophobicContact CD1-CB 4.19Å; L212-V268 HydrophobicContact CD1-CG2 4.16Å; L212-F270 HydrophobicContact CD2-CE2 4.21Å; L212-F270 HydrophobicContact CD2-CZ 3.97Å; L212-I285 HydrophobicContact CD2-CD1 4.1Å; L212-I285 HydrophobicContact CD2-CG1 4.45Å; L212-I285 HydrophobicContact CD2-CG2 4.47Å; L212-W289 HydrophobicContact CD2-CH2 3.8Å; L212-W289 HydrophobicContact CD2-CZ3 3.64Å; L212-W289 HydrophobicContact CG-CH2 4.13Å; L212-W289 HydrophobicContact CG-CZ3 4.31Å; L212-V305 HydrophobicContact CD1-CB 4.11Å; L212-V305 HydrophobicContact CD1-CG1 3.71Å; L212-V305 HydrophobicContact CD2-CG1 4.49Å; L212-V305 HydrophobicContact CD2-CG2 4.44Å
213	F	95.4	Very high	93.8	Very high	3 Å²	3	49.4 Å²	49.4	1%	0.013	27%	0.273	C	S	.	.	H	α-helix	trans	-61.4	-32.3	174.9	-63.3	-11.4	0	0	0	112.8	A209 D211 V226 Y255 L260 P262 V265 V268	A209-F213 HydrophobicContact CB-CE1 4.45Å; A209-F213 HydrophobicContact CB-CZ 4.3Å; A209-F213 WeakPolarHBondContact O-CD1 3.4Å; A209-F213 WeakPolarHBondContact O-CE1 3.45Å; A209-F213 WeakPolarHBondContact O-CG 3.48Å; A209-F213 PolarHBondContact O-N 3.16Å; D211-F213 PolarHBondContact O-N 3.21Å; F213-V226 HydrophobicContact CD1-CG1 4.44Å; F213-V226 HydrophobicContact CD1-CG2 3.6Å; F213-V226 HydrophobicContact CE1-CB 4.19Å; F213-V226 HydrophobicContact CE1-CG1 3.53Å; F213-V226 HydrophobicContact CE1-CG2 3.54Å; F213-V226 HydrophobicContact CZ-CG1 4.01Å; F213-Y255 HydrophobicContact CB-CE2 3.92Å; F213-Y255 HydrophobicContact CG-CE2 4.31Å; F213-Y255 PolarHBondContact O-OH 3.15Å; F213-Y255 VanDerWaalsContact O-OH 3.14Å; F213-L260 HydrophobicContact CD1-CD2 4.44Å; F213-L260 HydrophobicContact CD2-CB 4.11Å; F213-L260 HydrophobicContact CD2-CD2 4.23Å; F213-L260 HydrophobicContact CD2-CG 4.41Å; F213-L260 HydrophobicContact CE1-CD2 4.07Å; F213-L260 HydrophobicContact CE2-CB 3.91Å; F213-L260 HydrophobicContact CE2-CD2 3.81Å; F213-L260 HydrophobicContact CE2-CG 3.81Å; F213-L260 HydrophobicContact CZ-CD2 3.71Å; F213-L260 HydrophobicContact CZ-CG 4.05Å; F213-P262 HydrophobicContact CE2-CB 4.19Å; F213-V265 HydrophobicContact CE1-CG1 4.49Å; F213-V265 HydrophobicContact CE1-CG2 4.24Å; F213-V265 HydrophobicContact CZ-CG2 3.74Å; F213-V268 HydrophobicContact CD1-CG2 4.21Å; F213-V268 HydrophobicContact CE1-CG2 3.96Å
214	G	91.1	Very high	93.7	Very high	35 Å²	35	46.9 Å²	46.9	36%	0.361	26%	0.26	S	S	.	.	H	α-helix	trans	-106.6	-12.6	-175.3	0	0	0	0	0	115.3	D211 L212 V216 N217	D211-G214 PolarHBondContact O-N 2.82Å; D211-G214 VanDerWaalsContact O-N 3.1Å; L212-G214 PolarHBondContact O-N 3.02Å; G214-V216 PolarHBondContact O-N 3.34Å; G214-N217 PolarHBondContact O-N 3.12Å; G214-N217 VanDerWaalsContact O-N 3.11Å
215	V	92.3	Very high	93.6	Very high	53 Å²	53	46.6 Å²	46.6	32%	0.321	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-29.9	-164	69.2	0	0	0	0	115.2	D211 L212 F270	D211-V215 PolarHBondContact O-N 3.35Å; L212-V215 HydrophobicContact CD2-CG1 4.5Å; L212-V215 WeakPolarHBondContact O-CG1 3.03Å; V215-F270 HydrophobicContact CG1-CE1 3.7Å; V215-F270 HydrophobicContact CG1-CZ 3.6Å
216	V	92	Very high	93.5	Very high	20 Å²	20	43.1 Å²	43.1	12%	0.121	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.1	24.7	179.1	-69.2	0	0	0	0	112.3	G214 D218 N219 I222 F270 L281	G214-V216 PolarHBondContact O-N 3.34Å; V216-D218 PolarHBondContact O-N 2.74Å; V216-N219 HydrophobicContact CB-CB 4.38Å; V216-N219 WeakPolarHBondContact O-CB 3.47Å; V216-N219 PolarHBondContact O-N 3.29Å; V216-I222 HydrophobicContact CG2-CB 4.32Å; V216-I222 HydrophobicContact CG2-CG2 3.84Å; V216-F270 HydrophobicContact CG2-CD1 3.65Å; V216-F270 HydrophobicContact CG2-CE1 3.71Å; V216-L281 HydrophobicContact CG1-CD1 3.63Å; V216-L281 HydrophobicContact CG1-CD2 4.02Å; V216-L281 HydrophobicContact CG1-CG 4.45Å
217	N	87.5	Confident	93.4	Very high	39 Å²	39	37.2 Å²	37.2	21%	0.209	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-28.6	-176.3	-167.5	55.9	0	0	0	112.7	G214 N219 N235 R236 P257	G214-N217 PolarHBondContact O-N 3.12Å; G214-N217 VanDerWaalsContact O-N 3.11Å; N217-N219 VanDerWaalsContact C-N 3.26Å; N217-N219 PolarHBondContact O-N 3.04Å; N217-N235 PolarHBondContact OD1-ND2 3.15Å; N217-R236 PolarHBondContact O-NH1 3.4Å; N217-R236 PolarHBondContact O-NH2 2.73Å; N217-R236 PolarHBondContact OD1-NH2 3.26Å; N217-P257 HydrophobicContact CB-CG 4.17Å
218	D	88.4	Confident	93.4	Very high	160 Å²	160	36 Å²	36	86%	0.856	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-8.7	177.5	-62	-29	0	0	0	113.6	V216 P220	V216-D218 PolarHBondContact O-N 2.74Å; D218-P220 WeakPolarHBondContact O-CD 3.29Å
219	N	90.9	Very high	93.1	Very high	47 Å²	47	39.4 Å²	39.4	25%	0.251	23%	0.226	S	C	.	.			trans	-86.9	118.3	177.8	-170	-28.9	0	0	0	110.5	V216 N217 D221 I222 R236	V216-N219 HydrophobicContact CB-CB 4.38Å; V216-N219 WeakPolarHBondContact O-CB 3.47Å; V216-N219 PolarHBondContact O-N 3.29Å; N217-N219 VanDerWaalsContact C-N 3.26Å; N217-N219 PolarHBondContact O-N 3.04Å; N219-D221 VanDerWaalsContact C-N 3.32Å; N219-D221 PolarHBondContact O-N 3.17Å; N219-D221 WeakPolarHBondContact OD1-CB 3.35Å; N219-D221 PolarHBondContact OD1-N 3.43Å; N219-I222 HydrophobicContact CB-CB 4.47Å; N219-I222 WeakPolarHBondContact ND2-CD1 3.34Å; N219-R236 PolarHBondContact O-NH1 3.39Å
220	P	88.5	Confident	92.8	Very high	98 Å²	98	44.5 Å²	44.5	64%	0.636	25%	0.253	S	S	*	.	S	Bend	trans	-72.1	-22.3	179.2	29.9	-35.3	0	0	0	114	D218	D218-P220 WeakPolarHBondContact O-CD 3.29Å
221	D	90.8	Very high	92.6	Very high	90 Å²	90	46.3 Å²	46.3	48%	0.481	26%	0.255	S	S	.	.	S	Bend	trans	-88.9	-15.2	-173.6	-65.6	-14.9	0	0	0	113.1	N219 C272 Q277	N219-D221 VanDerWaalsContact C-N 3.32Å; N219-D221 PolarHBondContact O-N 3.17Å; N219-D221 WeakPolarHBondContact OD1-CB 3.35Å; N219-D221 PolarHBondContact OD1-N 3.43Å; D221-C272 PolarHBondContact O-SG 3.04Å; D221-Q277 PolarHBondContact OD2-NE2 3.12Å; D221-Q277 PolarHBondContact OD2-OE1 3.49Å
222	I	93.6	Very high	92.5	Very high	4 Å²	4	45.3 Å²	45.3	2%	0.021	25%	0.247	C	C	.	.			trans	-112.9	127.7	-177.5	-54.9	178.2	0	0	0	109.7	V216 N219 F270 C272 L278 L281	V216-I222 HydrophobicContact CG2-CB 4.32Å; V216-I222 HydrophobicContact CG2-CG2 3.84Å; N219-I222 HydrophobicContact CB-CB 4.47Å; N219-I222 WeakPolarHBondContact ND2-CD1 3.34Å; I222-F270 HydrophobicContact CG2-CB 3.86Å; I222-F270 HydrophobicContact CG2-CD1 4.21Å; I222-F270 HydrophobicContact CG2-CG 4.46Å; I222-C272 HydrophobicContact CG1-CB 4.15Å; I222-L278 HydrophobicContact CD1-CD2 4.29Å; I222-L278 HydrophobicContact CG1-CD2 4.48Å; I222-L278 HydrophobicContact CG2-CD2 4.25Å; I222-L281 HydrophobicContact CD1-CD2 4.42Å
223	I	93.1	Very high	92.3	Very high	14 Å²	14	46.4 Å²	46.4	7%	0.072	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	129.3	179.4	-64.3	177	0	0	0	109.3	N225 M234 R236 R238 F270 T271	I223-N225 PolarHBondContact O-ND2 2.87Å; I223-M234 HydrophobicContact CG2-CE 3.58Å; I223-R236 HydrophobicContact CD1-CG 4.28Å; I223-R236 HydrophobicContact CG1-CG 4.01Å; I223-R238 HydrophobicContact CD1-CB 4.31Å; I223-R238 HydrophobicContact CD1-CG 3.1Å; I223-R238 HydrophobicContact CG1-CG 4.49Å; I223-F270 WeakPolarHBondContact O-CA 3.28Å; I223-T271 PolarHBondContact N-O 3.32Å; I223-T271 PolarHBondContact O-N 3.08Å
224	T	95.6	Very high	92.2	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	122.4	-178.1	-55.5	0	0	0	0	109.1	M234 N235 Y255 V268 F270	T224-M234 WeakPolarHBondContact O-CA 3.27Å; T224-N235 PolarHBondContact N-OD1 2.88Å; T224-N235 PolarHBondContact O-N 3.18Å; T224-N235 PolarHBondContact O-OD1 3.05Å; T224-Y255 WeakPolarHBondContact CG2-OH 3.09Å; T224-V268 HydrophobicContact CG2-CG1 3.74Å; T224-F270 HydrophobicContact CG2-CD1 4.1Å; T224-F270 HydrophobicContact CG2-CE1 3.64Å; T224-F270 HydrophobicContact CG2-CZ 4.46Å; T224-F270 WeakPolarHBondContact OG1-CE1 3.42Å
225	N	95.2	Very high	92.2	Very high	2 Å²	2	45.1 Å²	45.1	1%	0.011	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	142.8	-179.3	-54.5	-101.3	0	0	0	109.4	I223 W232 F233 M234 V268 F269 T271	I223-N225 PolarHBondContact O-ND2 2.87Å; N225-W232 PolarHBondContact OD1-NE1 3.27Å; N225-F233 CarbonylContact C-O 3.52Å; N225-F233 VanDerWaalsContact CA-O 3.27Å; N225-F233 WeakPolarHBondContact CA-O 3.29Å; N225-M234 WeakPolarHBondContact OD1-CG 3.48Å; N225-V268 CarbonylContact O-C 3.54Å; N225-V268 WeakPolarHBondContact O-CA 3.39Å; N225-V268 WeakPolarHBondContact O-CG1 3.45Å; N225-F269 HydrophobicContact CB-CD1 3.71Å; N225-F269 HydrophobicContact CB-CD2 3.57Å; N225-F269 HydrophobicContact CB-CE1 3.39Å; N225-F269 HydrophobicContact CB-CE2 3.24Å; N225-F269 HydrophobicContact CB-CG 3.8Å; N225-F269 HydrophobicContact CB-CZ 3.16Å; N225-F269 WeakPolarHBondContact CB-O 3.47Å; N225-F269 PolarHBondContact N-O 2.96Å; N225-F269 PolarHBondContact ND2-O 3.13Å; N225-F269 VanDerWaalsContact ND2-O 3.09Å; N225-F269 PolarHBondContact O-N 3.06Å; N225-T271 PolarHBondContact ND2-OG1 3.49Å
226	V	95.9	Very high	92.1	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	131	-176.8	-175.4	0	0	0	0	109	F213 R228 W232 F233 Y255 L260 V265 V268	F213-V226 HydrophobicContact CD1-CG1 4.44Å; F213-V226 HydrophobicContact CD1-CG2 3.6Å; F213-V226 HydrophobicContact CE1-CB 4.19Å; F213-V226 HydrophobicContact CE1-CG1 3.53Å; F213-V226 HydrophobicContact CE1-CG2 3.54Å; F213-V226 HydrophobicContact CZ-CG1 4.01Å; V226-R228 HydrophobicContact CG1-CB 4.5Å; V226-W232 CarbonylContact O-C 3.43Å; V226-W232 WeakPolarHBondContact O-CA 3.33Å; V226-F233 HydrophobicContact CB-CB 4.22Å; V226-F233 PolarHBondContact N-O 3.46Å; V226-F233 PolarHBondContact O-N 3.18Å; V226-Y255 HydrophobicContact CG2-CE1 4.01Å; V226-L260 HydrophobicContact CB-CD2 4.04Å; V226-L260 HydrophobicContact CG1-CD2 3.98Å; V226-L260 HydrophobicContact CG2-CD2 3.99Å; V226-V265 HydrophobicContact CG1-CG1 3.8Å; V226-V265 HydrophobicContact CG1-CG2 4.21Å; V226-V268 HydrophobicContact CG1-CG2 4.4Å; V226-V268 HydrophobicContact CG2-CG1 4.4Å; V226-V268 HydrophobicContact CG2-CG2 4.29Å
227	Y	95.4	Very high	91.7	Very high	20 Å²	20	49.6 Å²	49.6	8%	0.078	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	111	166.7	-73.2	-8.4	0	0	0	109.3	H166 E231 W232 F250 V265 S266 K267 F269	H166-Y227 HydrophobicContact CB-CD2 3.98Å; H166-Y227 HydrophobicContact CB-CE2 3.61Å; H166-Y227 AromaticContact CD2-CD2 3.65Å; H166-Y227 AromaticContact CD2-CG 3.87Å; Y227-E231 WeakPolarHBondContact CA-O 3.2Å; Y227-W232 HydrophobicContact CD1-CB 3.92Å; Y227-W232 AromaticContact CD1-CD1 3.83Å; Y227-W232 AromaticContact CD1-CG 3.97Å; Y227-W232 HydrophobicContact CD1-CG 3.97Å; Y227-W232 HydrophobicContact CE1-CB 3.82Å; Y227-W232 AromaticContact CE1-CD1 3.58Å; Y227-W232 HydrophobicContact CE1-CD2 4.11Å; Y227-W232 AromaticContact CE1-CG 3.56Å; Y227-W232 HydrophobicContact CE1-CG 3.56Å; Y227-F250 HydrophobicContact CD1-CE1 4.32Å; Y227-F250 HydrophobicContact CD1-CZ 4.47Å; Y227-F250 AromaticContact CE1-CE1 3.69Å; Y227-F250 HydrophobicContact CE1-CE1 3.69Å; Y227-F250 HydrophobicContact CE1-CZ 4.27Å; Y227-F250 AromaticContact CZ-CE1 3.9Å; Y227-V265 WeakPolarHBondContact O-CA 3.41Å; Y227-S266 VanDerWaalsContact CB-OG 3.31Å; Y227-S266 WeakPolarHBondContact CB-OG 3.15Å; Y227-S266 PolarHBondContact O-N 3.5Å; Y227-S266 PolarHBondContact O-OG 3.36Å; Y227-S266 VanDerWaalsContact O-OG 3.14Å; Y227-K267 HydrophobicContact CD2-CD 4.17Å; Y227-K267 HydrophobicContact CD2-CG 4.01Å; Y227-K267 HydrophobicContact CG-CG 4.33Å; Y227-K267 PolarHBondContact N-O 3.34Å; Y227-F269 AromaticContact CD1-CE1 3.7Å; Y227-F269 HydrophobicContact CD1-CE1 3.7Å; Y227-F269 HydrophobicContact CD1-CZ 4.27Å; Y227-F269 HydrophobicContact CD2-CE1 4.3Å; Y227-F269 AromaticContact CE1-CE1 3.49Å; Y227-F269 HydrophobicContact CE1-CE1 3.49Å; Y227-F269 VanDerWaalsContact CE1-CE1 3.49Å; Y227-F269 AromaticContact CE1-CZ 3.62Å; Y227-F269 HydrophobicContact CE1-CZ 3.62Å; Y227-F269 HydrophobicContact CE2-CE1 4.12Å; Y227-F269 HydrophobicContact CG-CE1 4.09Å; Y227-F269 AromaticContact CZ-CE1 3.72Å; Y227-F269 AromaticContact CZ-CZ 3.78Å
228	R	94.6	Very high	91	Very high	51 Å²	51	50 Å²	50	19%	0.192	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	117.4	-179.4	179.1	-177.4	-179.4	-80	-10	108.3	V226 D230 E231 F233 E261 E263 G264	V226-R228 HydrophobicContact CG1-CB 4.5Å; R228-D230 PolarHBondContact O-N 3.11Å; R228-D230 VanDerWaalsContact O-N 3.12Å; R228-E231 PolarHBondContact N-O 3.15Å; R228-E231 IonicContact NH1-OE2 3.69Å; R228-E231 WeakPolarHBondContact O-CA 3.44Å; R228-E231 WeakPolarHBondContact O-CB 3.06Å; R228-E231 PolarHBondContact O-N 3.46Å; R228-F233 HydrophobicContact CB-CD2 4.22Å; R228-F233 HydrophobicContact CB-CE2 4.07Å; R228-E261 WeakPolarHBondContact CD-O 3.27Å; R228-E261 PolarHBondContact NE-O 3.27Å; R228-E263 WeakPolarHBondContact CG-O 3.47Å; R228-E263 PolarHBondContact NE-O 2.9Å; R228-G264 WeakPolarHBondContact CA-O 3.47Å
229	D	91.9	Very high	89.6	Confident	71 Å²	71	48 Å²	48	38%	0.38	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.3	-115.4	-172.7	-58.1	-44.7	0	0	0	111.5	H166 G264	H166-D229 PolarHBondContact CE1-O 2.84Å; H166-D229 PolarHBondContact NE2-O 3.09Å; D229-G264 PolarHBondContact N-O 2.88Å
230	D	89.9	Confident	88.1	Confident	106 Å²	106	53.7 Å²	53.7	57%	0.567	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	13.8	177.2	-71.8	-42.5	0	0	0	114	H166 V168 R228 F250	H166-D230 IonicContact CE1-OD1 3.33Å; V168-D230 HydrophobicContact CG2-CB 4.38Å; R228-D230 PolarHBondContact O-N 3.11Å; R228-D230 VanDerWaalsContact O-N 3.12Å; D230-F250 WeakPolarHBondContact O-CE2 3.21Å
231	E	91.1	Very high	86.5	Confident	96 Å²	96	51.6 Å²	51.6	45%	0.449	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	145.4	-174.6	-59.8	-178	109.4	0	0	111.9	Y227 R228 F233	Y227-E231 WeakPolarHBondContact CA-O 3.2Å; R228-E231 PolarHBondContact N-O 3.15Å; R228-E231 IonicContact NH1-OE2 3.69Å; R228-E231 WeakPolarHBondContact O-CA 3.44Å; R228-E231 WeakPolarHBondContact O-CB 3.06Å; R228-E231 PolarHBondContact O-N 3.46Å; E231-F233 HydrophobicContact CB-CD2 4.2Å; E231-F233 HydrophobicContact CB-CE2 3.46Å; E231-F233 VanDerWaalsContact CB-CE2 3.46Å; E231-F233 HydrophobicContact CB-CZ 3.97Å; E231-F233 HydrophobicContact CG-CE2 4.38Å
232	W	92.4	Very high	84.6	Confident	42 Å²	42	53.2 Å²	53.2	16%	0.159	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	127.3	171.1	172.7	22.7	0	0	0	109.5	N225 V226 Y227 M234 F250 Y252 A253 F269	N225-W232 PolarHBondContact OD1-NE1 3.27Å; V226-W232 CarbonylContact O-C 3.43Å; V226-W232 WeakPolarHBondContact O-CA 3.33Å; Y227-W232 HydrophobicContact CD1-CB 3.92Å; Y227-W232 AromaticContact CD1-CD1 3.83Å; Y227-W232 AromaticContact CD1-CG 3.97Å; Y227-W232 HydrophobicContact CD1-CG 3.97Å; Y227-W232 HydrophobicContact CE1-CB 3.82Å; Y227-W232 AromaticContact CE1-CD1 3.58Å; Y227-W232 HydrophobicContact CE1-CD2 4.11Å; Y227-W232 AromaticContact CE1-CG 3.56Å; Y227-W232 HydrophobicContact CE1-CG 3.56Å; W232-M234 HydrophobicContact CH2-SD 4.25Å; W232-M234 HydrophobicContact CZ2-CG 4.07Å; W232-M234 HydrophobicContact CZ2-SD 3.51Å; W232-M234 VanDerWaalsContact CZ2-SD 3.51Å; W232-F250 HydrophobicContact CB-CD1 4.43Å; W232-F250 HydrophobicContact CB-CE1 3.64Å; W232-F250 HydrophobicContact CB-CE2 4.3Å; W232-F250 HydrophobicContact CB-CZ 3.57Å; W232-F250 HydrophobicContact CD2-CE1 4.43Å; W232-F250 HydrophobicContact CE3-CD1 4.04Å; W232-F250 HydrophobicContact CE3-CE1 4.23Å; W232-F250 HydrophobicContact CG-CE1 4.26Å; W232-Y252 HydrophobicContact CE3-CD1 4.44Å; W232-Y252 AromaticContact CH2-CD1 3.83Å; W232-Y252 HydrophobicContact CH2-CD1 3.83Å; W232-Y252 HydrophobicContact CZ2-CD1 4.1Å; W232-Y252 HydrophobicContact CZ3-CD1 4.02Å; W232-Y252 CarbonylContact O-C 3.49Å; W232-Y252 WeakPolarHBondContact O-CA 3.43Å; W232-A253 PolarHBondContact O-N 2.95Å; W232-F269 AromaticContact NE1-CZ 3.9Å
233	F	93.5	Very high	82.2	Confident	23 Å²	23	63.9 Å²	63.9	10%	0.101	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	146.8	175.1	-62.9	-90.4	0	0	0	111.9	N225 V226 R228 E231 A253 Y255 L260	N225-F233 CarbonylContact C-O 3.52Å; N225-F233 VanDerWaalsContact CA-O 3.27Å; N225-F233 WeakPolarHBondContact CA-O 3.29Å; V226-F233 HydrophobicContact CB-CB 4.22Å; V226-F233 PolarHBondContact N-O 3.46Å; V226-F233 PolarHBondContact O-N 3.18Å; R228-F233 HydrophobicContact CB-CD2 4.22Å; R228-F233 HydrophobicContact CB-CE2 4.07Å; E231-F233 HydrophobicContact CB-CD2 4.2Å; E231-F233 HydrophobicContact CB-CE2 3.46Å; E231-F233 VanDerWaalsContact CB-CE2 3.46Å; E231-F233 HydrophobicContact CB-CZ 3.97Å; E231-F233 HydrophobicContact CG-CE2 4.38Å; F233-A253 CarbonylContact C-O 3.5Å; F233-A253 WeakPolarHBondContact CA-O 3.37Å; F233-A253 HydrophobicContact CD1-CB 3.81Å; F233-A253 HydrophobicContact CE1-CB 3.84Å; F233-Y255 HydrophobicContact CB-CD1 3.69Å; F233-Y255 HydrophobicContact CB-CE1 4.31Å; F233-Y255 HydrophobicContact CB-CG 4.41Å; F233-L260 HydrophobicContact CB-CD2 4.03Å; F233-L260 HydrophobicContact CD1-CD1 3.82Å; F233-L260 HydrophobicContact CD2-CD1 3.75Å; F233-L260 HydrophobicContact CD2-CD2 4.29Å; F233-L260 HydrophobicContact CE1-CD1 3.85Å; F233-L260 HydrophobicContact CE2-CD1 3.77Å; F233-L260 HydrophobicContact CG-CD1 3.77Å; F233-L260 HydrophobicContact CG-CD2 4.12Å; F233-L260 HydrophobicContact CZ-CD1 3.83Å
234	M	92.6	Very high	79.7	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	141.5	174	-69	-179	71.4	0	0	110.7	I223 T224 N225 W232 R236 R238 Y252 A253 L254 Y255	I223-M234 HydrophobicContact CG2-CE 3.58Å; T224-M234 WeakPolarHBondContact O-CA 3.27Å; N225-M234 WeakPolarHBondContact OD1-CG 3.48Å; W232-M234 HydrophobicContact CH2-SD 4.25Å; W232-M234 HydrophobicContact CZ2-CG 4.07Å; W232-M234 HydrophobicContact CZ2-SD 3.51Å; W232-M234 VanDerWaalsContact CZ2-SD 3.51Å; M234-R236 VanDerWaalsContact C-N 3.3Å; M234-R236 PolarHBondContact O-N 3Å; M234-R238 HydrophobicContact CE-CG 4.42Å; M234-Y252 HydrophobicContact CB-CD2 4.07Å; M234-Y252 HydrophobicContact CB-CG 4.38Å; M234-Y252 HydrophobicContact CG-CD1 4.37Å; M234-Y252 HydrophobicContact CG-CD2 4.05Å; M234-Y252 HydrophobicContact CG-CG 3.86Å; M234-Y252 HydrophobicContact SD-CD1 3.27Å; M234-Y252 WeakPolarHBondContact SD-CD1 3.22Å; M234-Y252 HydrophobicContact SD-CD2 3.7Å; M234-Y252 HydrophobicContact SD-CE1 3.59Å; M234-Y252 VanDerWaalsContact SD-CE1 3.59Å; M234-Y252 HydrophobicContact SD-CE2 4Å; M234-Y252 HydrophobicContact SD-CG 3.34Å; M234-A253 PolarHBondContact N-O 3.49Å; M234-L254 HydrophobicContact CB-CD2 4.13Å; M234-L254 VanDerWaalsContact O-CA 3.28Å; M234-L254 WeakPolarHBondContact O-CA 3.47Å; M234-L254 WeakPolarHBondContact O-CD2 3.49Å; M234-Y255 VanDerWaalsContact C-CE1 3.45Å; M234-Y255 VanDerWaalsContact O-CD1 3.31Å; M234-Y255 WeakPolarHBondContact O-CD1 3.14Å; M234-Y255 PolarHBondContact O-N 3.27Å
235	N	91.8	Very high	77.3	Confident	11 Å²	11	73.6 Å²	73.6	6%	0.059	34%	0.339	C	S	.	.	S	Bend	trans	-75.4	-18.2	178.9	72	-33.7	0	0	0	113.4	N217 T224 Y255	N217-N235 PolarHBondContact OD1-ND2 3.15Å; T224-N235 PolarHBondContact N-OD1 2.88Å; T224-N235 PolarHBondContact O-N 3.18Å; T224-N235 PolarHBondContact O-OD1 3.05Å; N235-Y255 HydrophobicContact CB-CE1 3.84Å; N235-Y255 HydrophobicContact CB-CE2 4.47Å; N235-Y255 VanDerWaalsContact N-CE1 3.31Å
236	R	89	Confident	74.8	Confident	71 Å²	71	82.4 Å²	82.4	27%	0.268	38%	0.377	S	S	.	.	S	Bend	trans	-164	164.1	175.1	62.2	-164.6	60.9	171.8	-4.8	111.5	N217 N219 I223 M234	N217-R236 PolarHBondContact O-NH1 3.4Å; N217-R236 PolarHBondContact O-NH2 2.73Å; N217-R236 PolarHBondContact OD1-NH2 3.26Å; N219-R236 PolarHBondContact O-NH1 3.39Å; I223-R236 HydrophobicContact CD1-CG 4.28Å; I223-R236 HydrophobicContact CG1-CG 4.01Å; M234-R236 VanDerWaalsContact C-N 3.3Å; M234-R236 PolarHBondContact O-N 3Å
237	H	83.5	Confident	72.3	Confident	96 Å²	96	90.5 Å²	90.5	44%	0.444	42%	0.415	S	S	.	.			trans	-69.2	145.7	174.5	-68.1	-63.8	0	0	0	112.8	Y252 L254	H237-Y252 AromaticContact CE1-CE2 4Å; H237-Y252 AromaticContact ND1-CE2 3.66Å; H237-Y252 AromaticContact ND1-CZ 3.71Å; H237-Y252 PolarHBondContact ND1-OH 2.9Å; H237-L254 VanDerWaalsContact NE2-CD1 3.34Å; H237-L254 WeakPolarHBondContact NE2-CD1 3.45Å
238	R	73.4	Confident	70.3	Confident	49 Å²	49	91.7 Å²	91.7	19%	0.185	43%	0.428	C	S	.	.			trans	-88	127.1	157	-84.5	-179.4	163.1	176	-13.2	110.7	I223 M234 E240 E241 T271	I223-R238 HydrophobicContact CD1-CB 4.31Å; I223-R238 HydrophobicContact CD1-CG 3.1Å; I223-R238 HydrophobicContact CG1-CG 4.49Å; M234-R238 HydrophobicContact CE-CG 4.42Å; R238-E240 PolarHBondContact O-N 3.22Å; R238-E240 VanDerWaalsContact O-N 3.15Å; R238-E241 HydrophobicContact CB-CB 3.95Å; R238-E241 HydrophobicContact CB-CG 3.86Å; R238-E241 WeakPolarHBondContact CD-OE1 3.19Å; R238-E241 IonicContact CZ-OE1 3.92Å; R238-E241 IonicContact NE-OE1 3.55Å; R238-E241 IonicContact NH1-OE1 3.79Å; R238-E241 PolarHBondContact NH1-OE1 3.04Å; R238-E241 PolarHBondContact O-N 3.4Å; R238-T271 PolarHBondContact NH1-OG1 3.1Å; R238-T271 PolarHBondContact NH2-OG1 3.25Å
239	P	60.2	Low	68.8	Low	116 Å²	116	95.7 Å²	95.7	75%	0.753	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-33.8	178.4	-26	33.6	0	0	0	113.8
240	E	58.2	Low	68	Low	167 Å²	167	93.2 Å²	93.2	78%	0.78	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-34.2	-178.9	-61.2	-161.4	161.1	0	0	113.6	R238 M242	R238-E240 PolarHBondContact O-N 3.22Å; R238-E240 VanDerWaalsContact O-N 3.15Å; E240-M242 VanDerWaalsContact C-N 3.29Å; E240-M242 PolarHBondContact O-N 3.09Å
241	E	55.7	Low	67.6	Low	55 Å²	55	93.4 Å²	93.4	26%	0.257	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-75.3	-18	-174.4	-69.1	175.5	-176.2	0	0	113	R238 R243 F244 F245	R238-E241 HydrophobicContact CB-CB 3.95Å; R238-E241 HydrophobicContact CB-CG 3.86Å; R238-E241 WeakPolarHBondContact CD-OE1 3.19Å; R238-E241 IonicContact CZ-OE1 3.92Å; R238-E241 IonicContact NE-OE1 3.55Å; R238-E241 IonicContact NH1-OE1 3.79Å; R238-E241 PolarHBondContact NH1-OE1 3.04Å; R238-E241 PolarHBondContact O-N 3.4Å; E241-R243 PolarHBondContact O-N 3.04Å; E241-R243 VanDerWaalsContact O-N 3.1Å; E241-F244 PolarHBondContact O-N 2.72Å; E241-F244 VanDerWaalsContact O-N 3.13Å; E241-F245 PolarHBondContact O-N 2.81Å
242	M	49.9	Very low	67.3	Low	123 Å²	123	89.8 Å²	89.8	61%	0.606	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-56.7	-26.5	175.4	-80.3	-167.6	66.3	0	0	113.7	E240	E240-M242 VanDerWaalsContact C-N 3.29Å; E240-M242 PolarHBondContact O-N 3.09Å
243	R	43.8	Very low	67.2	Low	228 Å²	228	89.9 Å²	89.9	86%	0.86	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-81.1	-27.4	179.4	-74.8	-175.5	-178.8	178.6	1.5	113.8	E241	E241-R243 PolarHBondContact O-N 3.04Å; E241-R243 VanDerWaalsContact O-N 3.1Å
244	F	41	Very low	67.1	Low	156 Å²	156	92.7 Å²	92.7	68%	0.684	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	-16.8	-176.4	-68.7	-79.7	0	0	0	113.6	E241 K246 E247	E241-F244 PolarHBondContact O-N 2.72Å; E241-F244 VanDerWaalsContact O-N 3.13Å; F244-K246 PolarHBondContact O-N 3.04Å; F244-E247 PolarHBondContact O-N 3.34Å; F244-E247 VanDerWaalsContact O-N 3.12Å
245	F	44.9	Very low	67.1	Low	63 Å²	63	93.3 Å²	93.3	28%	0.276	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-26.3	-177.9	-172.4	-101.5	0	0	0	115.1	E241 E247 K251 Y252	E241-F245 PolarHBondContact O-N 2.81Å; F245-E247 VanDerWaalsContact C-N 3.28Å; F245-E247 PolarHBondContact O-N 3.48Å; F245-K251 HydrophobicContact CE1-CB 4.5Å; F245-K251 HydrophobicContact CE1-CD 4.08Å; F245-K251 HydrophobicContact CE1-CG 4.31Å; F245-K251 HydrophobicContact CE2-CB 3.82Å; F245-K251 HydrophobicContact CE2-CG 4.05Å; F245-K251 HydrophobicContact CZ-CB 3.65Å; F245-K251 HydrophobicContact CZ-CD 4.06Å; F245-K251 HydrophobicContact CZ-CG 3.88Å; F245-Y252 AromaticContact CD2-CD1 3.69Å; F245-Y252 HydrophobicContact CD2-CD1 3.69Å; F245-Y252 AromaticContact CD2-CE1 3.35Å; F245-Y252 HydrophobicContact CD2-CE1 3.35Å; F245-Y252 AromaticContact CD2-CZ 3.98Å; F245-Y252 AromaticContact CE2-CD1 3.37Å; F245-Y252 HydrophobicContact CE2-CD1 3.37Å; F245-Y252 HydrophobicContact CE2-CD2 4.28Å; F245-Y252 AromaticContact CE2-CE1 3.43Å; F245-Y252 HydrophobicContact CE2-CE1 3.43Å; F245-Y252 VanDerWaalsContact CE2-CE1 3.43Å; F245-Y252 HydrophobicContact CE2-CE2 4.31Å; F245-Y252 AromaticContact CE2-CG 3.82Å; F245-Y252 HydrophobicContact CE2-CG 3.82Å; F245-Y252 AromaticContact CE2-CZ 3.91Å; F245-Y252 HydrophobicContact CG-CE1 4.41Å; F245-Y252 WeakPolarHBondContact CZ-O 3.46Å
246	K	42.1	Very low	66.7	Low	186 Å²	186	98.8 Å²	98.8	81%	0.809	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-25.2	-179	-76.3	-171.9	176.9	-177.7	0	113.7	F244	F244-K246 PolarHBondContact O-N 3.04Å
247	E	42.9	Very low	66	Low	171 Å²	171	97.6 Å²	97.6	80%	0.799	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	-10.9	-172.1	-64.4	-179.8	173	0	0	113.5	F244 F245	F244-E247 PolarHBondContact O-N 3.34Å; F244-E247 VanDerWaalsContact O-N 3.12Å; F245-E247 VanDerWaalsContact C-N 3.28Å; F245-E247 PolarHBondContact O-N 3.48Å
248	A	54.8	Low	65.9	Low	44 Å²	44	96.4 Å²	96.4	36%	0.364	49%	0.49	S	S	.	.			trans	-74.3	132.6	-179.8	0	0	0	0	0	112	F250 K251	A248-F250 VanDerWaalsContact C-N 3.33Å; A248-K251 WeakPolarHBondContact O-CE 3.44Å
249	V	62.9	Low	66.6	Low	136 Å²	136	100.8 Å²	100.8	82%	0.824	52%	0.517	S	S	*	.	S	Bend	trans	-67.8	-36.9	173.3	179.6	0	0	0	0	110.7
250	F	75.1	Confident	68.2	Low	19 Å²	19	96.1 Å²	96.1	8%	0.083	49%	0.485	C	S	.	.	S	Bend	trans	-103.3	111.2	178.9	-169.4	-128.7	0	0	0	110.1	H166 V168 D169 Y227 D230 W232 A248	H166-F250 HydrophobicContact CB-CD1 4.3Å; H166-F250 HydrophobicContact CB-CE1 3.59Å; H166-F250 HydrophobicContact CB-CZ 3.81Å; H166-F250 AromaticContact CG-CE1 3.8Å; H166-F250 AromaticContact CG-CZ 3.45Å; H166-F250 VanDerWaalsContact CG-CZ 3.45Å; H166-F250 AromaticContact ND1-CE2 3.77Å; H166-F250 AromaticContact ND1-CZ 3.55Å; V168-F250 HydrophobicContact CB-CD2 3.96Å; V168-F250 HydrophobicContact CB-CE2 4.19Å; V168-F250 HydrophobicContact CG1-CB 4.48Å; V168-F250 HydrophobicContact CG1-CD2 3.8Å; V168-F250 HydrophobicContact CG1-CE2 4.45Å; V168-F250 HydrophobicContact CG1-CG 4.42Å; D169-F250 HydrophobicContact CB-CD1 4.33Å; Y227-F250 HydrophobicContact CD1-CE1 4.32Å; Y227-F250 HydrophobicContact CD1-CZ 4.47Å; Y227-F250 AromaticContact CE1-CE1 3.69Å; Y227-F250 HydrophobicContact CE1-CE1 3.69Å; Y227-F250 HydrophobicContact CE1-CZ 4.27Å; Y227-F250 AromaticContact CZ-CE1 3.9Å; D230-F250 WeakPolarHBondContact O-CE2 3.21Å; W232-F250 HydrophobicContact CB-CD1 4.43Å; W232-F250 HydrophobicContact CB-CE1 3.64Å; W232-F250 HydrophobicContact CB-CE2 4.3Å; W232-F250 HydrophobicContact CB-CZ 3.57Å; W232-F250 HydrophobicContact CD2-CE1 4.43Å; W232-F250 HydrophobicContact CE3-CD1 4.04Å; W232-F250 HydrophobicContact CE3-CE1 4.23Å; W232-F250 HydrophobicContact CG-CE1 4.26Å; A248-F250 VanDerWaalsContact C-N 3.33Å
251	K	79.8	Confident	69.8	Low	110 Å²	110	91.7 Å²	91.7	48%	0.478	47%	0.465	S	S	.	.			trans	-108.8	145.5	-173.6	-70.5	178.7	-178.4	172.8	0	110.6	F245 A248	F245-K251 HydrophobicContact CE1-CB 4.5Å; F245-K251 HydrophobicContact CE1-CD 4.08Å; F245-K251 HydrophobicContact CE1-CG 4.31Å; F245-K251 HydrophobicContact CE2-CB 3.82Å; F245-K251 HydrophobicContact CE2-CG 4.05Å; F245-K251 HydrophobicContact CZ-CB 3.65Å; F245-K251 HydrophobicContact CZ-CD 4.06Å; F245-K251 HydrophobicContact CZ-CG 3.88Å; A248-K251 WeakPolarHBondContact O-CE 3.44Å
252	Y	86	Confident	71.7	Confident	20 Å²	20	89.5 Å²	89.5	8%	0.078	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	150.9	169.9	67	-98.3	0	0	0	112.8	W232 M234 H237 F245 L254	W232-Y252 HydrophobicContact CE3-CD1 4.44Å; W232-Y252 AromaticContact CH2-CD1 3.83Å; W232-Y252 HydrophobicContact CH2-CD1 3.83Å; W232-Y252 HydrophobicContact CZ2-CD1 4.1Å; W232-Y252 HydrophobicContact CZ3-CD1 4.02Å; W232-Y252 CarbonylContact O-C 3.49Å; W232-Y252 WeakPolarHBondContact O-CA 3.43Å; M234-Y252 HydrophobicContact CB-CD2 4.07Å; M234-Y252 HydrophobicContact CB-CG 4.38Å; M234-Y252 HydrophobicContact CG-CD1 4.37Å; M234-Y252 HydrophobicContact CG-CD2 4.05Å; M234-Y252 HydrophobicContact CG-CG 3.86Å; M234-Y252 HydrophobicContact SD-CD1 3.27Å; M234-Y252 WeakPolarHBondContact SD-CD1 3.22Å; M234-Y252 HydrophobicContact SD-CD2 3.7Å; M234-Y252 HydrophobicContact SD-CE1 3.59Å; M234-Y252 VanDerWaalsContact SD-CE1 3.59Å; M234-Y252 HydrophobicContact SD-CE2 4Å; M234-Y252 HydrophobicContact SD-CG 3.34Å; H237-Y252 AromaticContact CE1-CE2 4Å; H237-Y252 AromaticContact ND1-CE2 3.66Å; H237-Y252 AromaticContact ND1-CZ 3.71Å; H237-Y252 PolarHBondContact ND1-OH 2.9Å; F245-Y252 AromaticContact CD2-CD1 3.69Å; F245-Y252 HydrophobicContact CD2-CD1 3.69Å; F245-Y252 AromaticContact CD2-CE1 3.35Å; F245-Y252 HydrophobicContact CD2-CE1 3.35Å; F245-Y252 AromaticContact CD2-CZ 3.98Å; F245-Y252 AromaticContact CE2-CD1 3.37Å; F245-Y252 HydrophobicContact CE2-CD1 3.37Å; F245-Y252 HydrophobicContact CE2-CD2 4.28Å; F245-Y252 AromaticContact CE2-CE1 3.43Å; F245-Y252 HydrophobicContact CE2-CE1 3.43Å; F245-Y252 VanDerWaalsContact CE2-CE1 3.43Å; F245-Y252 HydrophobicContact CE2-CE2 4.31Å; F245-Y252 AromaticContact CE2-CG 3.82Å; F245-Y252 HydrophobicContact CE2-CG 3.82Å; F245-Y252 AromaticContact CE2-CZ 3.91Å; F245-Y252 HydrophobicContact CG-CE1 4.41Å; F245-Y252 WeakPolarHBondContact CZ-O 3.46Å; Y252-L254 HydrophobicContact CD2-CD2 4.28Å; Y252-L254 HydrophobicContact CE2-CD2 4Å; Y252-L254 HydrophobicContact CE2-CG 4.43Å
253	A	89.3	Confident	73.8	Confident	44 Å²	44	89.2 Å²	89.2	36%	0.364	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	150.1	160.1	0	0	0	0	0	109.7	W232 F233 M234	W232-A253 PolarHBondContact O-N 2.95Å; F233-A253 CarbonylContact C-O 3.5Å; F233-A253 WeakPolarHBondContact CA-O 3.37Å; F233-A253 HydrophobicContact CD1-CB 3.81Å; F233-A253 HydrophobicContact CE1-CB 3.84Å; M234-A253 PolarHBondContact N-O 3.49Å
254	L	91.3	Very high	76.3	Confident	81 Å²	81	78.9 Å²	78.9	42%	0.424	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	148.1	170.4	-70.2	-176.1	0	0	0	110.5	M234 H237 Y252	M234-L254 HydrophobicContact CB-CD2 4.13Å; M234-L254 VanDerWaalsContact O-CA 3.28Å; M234-L254 WeakPolarHBondContact O-CA 3.47Å; M234-L254 WeakPolarHBondContact O-CD2 3.49Å; H237-L254 VanDerWaalsContact NE2-CD1 3.34Å; H237-L254 WeakPolarHBondContact NE2-CD1 3.45Å; Y252-L254 HydrophobicContact CD2-CD2 4.28Å; Y252-L254 HydrophobicContact CE2-CD2 4Å; Y252-L254 HydrophobicContact CE2-CG 4.43Å
255	Y	92.5	Very high	79	Confident	13 Å²	13	71.5 Å²	71.5	5%	0.051	38%	0.384	C	S	.	.			trans	-131.4	150.1	168.8	78.9	-82.3	0	0	0	110.8	F213 T224 V226 F233 M234 N235 L260	F213-Y255 HydrophobicContact CB-CE2 3.92Å; F213-Y255 HydrophobicContact CG-CE2 4.31Å; F213-Y255 PolarHBondContact O-OH 3.15Å; F213-Y255 VanDerWaalsContact O-OH 3.14Å; T224-Y255 WeakPolarHBondContact CG2-OH 3.09Å; V226-Y255 HydrophobicContact CG2-CE1 4.01Å; F233-Y255 HydrophobicContact CB-CD1 3.69Å; F233-Y255 HydrophobicContact CB-CE1 4.31Å; F233-Y255 HydrophobicContact CB-CG 4.41Å; M234-Y255 VanDerWaalsContact C-CE1 3.45Å; M234-Y255 VanDerWaalsContact O-CD1 3.31Å; M234-Y255 WeakPolarHBondContact O-CD1 3.14Å; M234-Y255 PolarHBondContact O-N 3.27Å; N235-Y255 HydrophobicContact CB-CE1 3.84Å; N235-Y255 HydrophobicContact CB-CE2 4.47Å; N235-Y255 VanDerWaalsContact N-CE1 3.31Å; Y255-L260 HydrophobicContact CD1-CD2 4.13Å; Y255-L260 HydrophobicContact CD2-CB 3.78Å; Y255-L260 HydrophobicContact CD2-CD2 4.04Å; Y255-L260 HydrophobicContact CE1-CD2 4.38Å; Y255-L260 HydrophobicContact CE2-CD2 4.35Å; Y255-L260 HydrophobicContact CG-CB 4.1Å; Y255-L260 HydrophobicContact CG-CD2 3.92Å
256	E	85.1	Confident	81.5	Confident	127 Å²	127	68.5 Å²	68.5	59%	0.593	37%	0.371	S	S	*	.			trans	-95.7	137.6	166.4	-69.6	-69.3	165.3	0	0	108.9	G258 L259	E256-G258 PolarHBondContact O-N 3.45Å; E256-L259 HydrophobicContact CB-CD1 3.8Å; E256-L259 HydrophobicContact CB-CG 4.25Å; E256-L259 HydrophobicContact CG-CD1 4.41Å; E256-L259 PolarHBondContact O-N 2.92Å
257	P	74.5	Confident	84.1	Confident	46 Å²	46	59.8 Å²	59.8	30%	0.299	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	132.4	176.6	-26.1	33.9	0	0	0	112.1	N217	N217-P257 HydrophobicContact CB-CG 4.17Å
258	G	81.1	Confident	86.7	Confident	70 Å²	70	51.7 Å²	51.7	72%	0.722	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.5	-9.5	-177.2	0	0	0	0	0	115.5	E256	E256-G258 PolarHBondContact O-N 3.45Å
259	L	87.9	Confident	88.7	Confident	142 Å²	142	50.3 Å²	50.3	74%	0.743	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	-18.1	174.8	-62	-178	0	0	0	113.8	E256	E256-L259 HydrophobicContact CB-CD1 3.8Å; E256-L259 HydrophobicContact CB-CG 4.25Å; E256-L259 HydrophobicContact CG-CD1 4.41Å; E256-L259 PolarHBondContact O-N 2.92Å
260	L	92.7	Very high	90.3	Very high	17 Å²	17	43.8 Å²	43.8	9%	0.089	24%	0.242	C	C	.	.	S	Bend	trans	-81.9	130.5	178.1	-174.5	61.6	0	0	0	110.5	F213 V226 F233 Y255 P262	F213-L260 HydrophobicContact CD1-CD2 4.44Å; F213-L260 HydrophobicContact CD2-CB 4.11Å; F213-L260 HydrophobicContact CD2-CD2 4.23Å; F213-L260 HydrophobicContact CD2-CG 4.41Å; F213-L260 HydrophobicContact CE1-CD2 4.07Å; F213-L260 HydrophobicContact CE2-CB 3.91Å; F213-L260 HydrophobicContact CE2-CD2 3.81Å; F213-L260 HydrophobicContact CE2-CG 3.81Å; F213-L260 HydrophobicContact CZ-CD2 3.71Å; F213-L260 HydrophobicContact CZ-CG 4.05Å; V226-L260 HydrophobicContact CB-CD2 4.04Å; V226-L260 HydrophobicContact CG1-CD2 3.98Å; V226-L260 HydrophobicContact CG2-CD2 3.99Å; F233-L260 HydrophobicContact CB-CD2 4.03Å; F233-L260 HydrophobicContact CD1-CD1 3.82Å; F233-L260 HydrophobicContact CD2-CD1 3.75Å; F233-L260 HydrophobicContact CD2-CD2 4.29Å; F233-L260 HydrophobicContact CE1-CD1 3.85Å; F233-L260 HydrophobicContact CE2-CD1 3.77Å; F233-L260 HydrophobicContact CG-CD1 3.77Å; F233-L260 HydrophobicContact CG-CD2 4.12Å; F233-L260 HydrophobicContact CZ-CD1 3.83Å; Y255-L260 HydrophobicContact CD1-CD2 4.13Å; Y255-L260 HydrophobicContact CD2-CB 3.78Å; Y255-L260 HydrophobicContact CD2-CD2 4.04Å; Y255-L260 HydrophobicContact CE1-CD2 4.38Å; Y255-L260 HydrophobicContact CE2-CD2 4.35Å; Y255-L260 HydrophobicContact CG-CB 4.1Å; Y255-L260 HydrophobicContact CG-CD2 3.92Å; L260-P262 VanDerWaalsContact O-CD 3.28Å; L260-P262 WeakPolarHBondContact O-CD 3.46Å
261	E	93.6	Very high	91.2	Very high	75 Å²	75	43.4 Å²	43.4	35%	0.35	24%	0.241	S	C	.	.			trans	-67.6	120.5	177.2	177.8	56.9	-116.6	0	0	110.7	R206 R228 E263	R206-E261 IonicContact NE-OE1 3.74Å; R206-E261 IonicContact NH2-OE1 3.84Å; R228-E261 WeakPolarHBondContact CD-O 3.27Å; R228-E261 PolarHBondContact NE-O 3.27Å; E261-E263 HydrophobicContact CG-CB 4.09Å; E261-E263 PolarHBondContact O-N 3.38Å; E261-E263 PolarHBondContact OE1-N 2.76Å
262	P	94.2	Very high	91.8	Very high	9 Å²	9	38.3 Å²	38.3	6%	0.058	22%	0.219	C	C	.	.			trans	-72.7	-5.7	-179.3	27	-37.1	0	0	0	115.5	R206 A209 F213 L260 V265	R206-P262 HydrophobicContact CG-CB 3.83Å; R206-P262 HydrophobicContact CG-CG 3.5Å; R206-P262 WeakPolarHBondContact O-CB 3.46Å; A209-P262 HydrophobicContact CB-CB 3.98Å; F213-P262 HydrophobicContact CE2-CB 4.19Å; L260-P262 VanDerWaalsContact O-CD 3.28Å; L260-P262 WeakPolarHBondContact O-CD 3.46Å; P262-V265 WeakPolarHBondContact O-CG2 3.46Å
263	E	95.1	Very high	92	Very high	117 Å²	117	44.6 Å²	44.6	55%	0.547	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	152	171.6	-67.3	-177.2	-176	0	0	112.7	R228 E261 V265	R228-E263 WeakPolarHBondContact CG-O 3.47Å; R228-E263 PolarHBondContact NE-O 2.9Å; E261-E263 HydrophobicContact CG-CB 4.09Å; E261-E263 PolarHBondContact O-N 3.38Å; E261-E263 PolarHBondContact OE1-N 2.76Å; E263-V265 VanDerWaalsContact C-N 3.31Å; E263-V265 PolarHBondContact O-N 3.48Å
264	G	95.6	Very high	92	Very high	11 Å²	11	44.3 Å²	44.3	11%	0.113	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.6	3.6	177.5	0	0	0	0	0	115	R190 N203 R228 D229 S266	R190-G264 PolarHBondContact NH2-O 3.31Å; N203-G264 PolarHBondContact OD1-O 3.41Å; R228-G264 WeakPolarHBondContact CA-O 3.47Å; D229-G264 PolarHBondContact N-O 2.88Å; G264-S266 PolarHBondContact O-N 3.48Å
265	V	97.6	Very high	92	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	107.9	-172.5	-176	0	0	0	0	111.6	N203 L204 A209 F213 V226 Y227 P262 E263 V268	N203-V265 CarbonylContact C-O 3.16Å; N203-V265 VanDerWaalsContact CA-O 3.22Å; N203-V265 WeakPolarHBondContact CA-O 3.43Å; N203-V265 WeakPolarHBondContact CB-O 3.45Å; N203-V265 PolarHBondContact OD1-O 3.25Å; L204-V265 HydrophobicContact CD1-CG1 3.97Å; L204-V265 PolarHBondContact N-O 3Å; A209-V265 HydrophobicContact CB-CB 4.22Å; A209-V265 HydrophobicContact CB-CG1 4.48Å; A209-V265 HydrophobicContact CB-CG2 4.09Å; F213-V265 HydrophobicContact CE1-CG1 4.49Å; F213-V265 HydrophobicContact CE1-CG2 4.24Å; F213-V265 HydrophobicContact CZ-CG2 3.74Å; V226-V265 HydrophobicContact CG1-CG1 3.8Å; V226-V265 HydrophobicContact CG1-CG2 4.21Å; Y227-V265 WeakPolarHBondContact O-CA 3.41Å; P262-V265 WeakPolarHBondContact O-CG2 3.46Å; E263-V265 VanDerWaalsContact C-N 3.31Å; E263-V265 PolarHBondContact O-N 3.48Å; V265-V268 HydrophobicContact CG1-CG2 3.93Å
266	S	97.3	Very high	92	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	-37.4	177.4	66.3	0	0	0	0	112.8	S186 A189 Y227 G264	S186-S266 PolarHBondContact OG-OG 3.19Å; A189-S266 VanDerWaalsContact CB-O 3.32Å; A189-S266 WeakPolarHBondContact CB-O 3.44Å; Y227-S266 VanDerWaalsContact CB-OG 3.31Å; Y227-S266 WeakPolarHBondContact CB-OG 3.15Å; Y227-S266 PolarHBondContact O-N 3.5Å; Y227-S266 PolarHBondContact O-OG 3.36Å; Y227-S266 VanDerWaalsContact O-OG 3.14Å; G264-S266 PolarHBondContact O-N 3.48Å
267	K	97.3	Very high	92.4	Very high	4 Å²	4	46.7 Å²	46.7	2%	0.017	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.6	157	173.9	66.8	173.9	-168.4	172.3	0	112.1	G164 Y227 F269 E304 V305 M306	G164-K267 PolarHBondContact O-NZ 3.38Å; Y227-K267 HydrophobicContact CD2-CD 4.17Å; Y227-K267 HydrophobicContact CD2-CG 4.01Å; Y227-K267 HydrophobicContact CG-CG 4.33Å; Y227-K267 PolarHBondContact N-O 3.34Å; K267-F269 HydrophobicContact CD-CD1 4.25Å; K267-F269 HydrophobicContact CG-CD1 4.27Å; K267-E304 WeakPolarHBondContact CD-OE2 3.35Å; K267-E304 IonicContact NZ-OE1 3.31Å; K267-E304 IonicContact NZ-OE2 2.8Å; K267-E304 PolarHBondContact NZ-OE2 2.84Å; K267-V305 VanDerWaalsContact CA-O 3.3Å; K267-V305 WeakPolarHBondContact CA-O 3.31Å; K267-V305 WeakPolarHBondContact CB-O 3.12Å; K267-M306 HydrophobicContact CB-CG 4.06Å; K267-M306 HydrophobicContact CB-SD 4.32Å
268	V	97.6	Very high	93.4	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	137.2	163.8	-178.9	0	0	0	0	108	L204 L212 F213 T224 N225 V226 V265 F270 V305	L204-V268 HydrophobicContact CD1-CB 4.48Å; L204-V268 HydrophobicContact CD1-CG2 3.9Å; L212-V268 HydrophobicContact CB-CB 4.24Å; L212-V268 HydrophobicContact CB-CG1 4.1Å; L212-V268 HydrophobicContact CB-CG2 4.06Å; L212-V268 HydrophobicContact CD1-CB 4.19Å; L212-V268 HydrophobicContact CD1-CG2 4.16Å; F213-V268 HydrophobicContact CD1-CG2 4.21Å; F213-V268 HydrophobicContact CE1-CG2 3.96Å; T224-V268 HydrophobicContact CG2-CG1 3.74Å; N225-V268 CarbonylContact O-C 3.54Å; N225-V268 WeakPolarHBondContact O-CA 3.39Å; N225-V268 WeakPolarHBondContact O-CG1 3.45Å; V226-V268 HydrophobicContact CG1-CG2 4.4Å; V226-V268 HydrophobicContact CG2-CG1 4.4Å; V226-V268 HydrophobicContact CG2-CG2 4.29Å; V265-V268 HydrophobicContact CG1-CG2 3.93Å; V268-F270 HydrophobicContact CG1-CE1 4.3Å; V268-F270 HydrophobicContact CG1-CE2 4.3Å; V268-F270 HydrophobicContact CG1-CZ 3.9Å; V268-V305 PolarHBondContact N-O 3.1Å; V268-V305 PolarHBondContact O-N 3.36Å
269	F	97	Very high	94.1	Very high	15 Å²	15	43.7 Å²	43.7	7%	0.066	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	137.4	178.9	60.7	-78.7	0	0	0	112.9	N225 Y227 W232 K267 T271 L303 E304	N225-F269 HydrophobicContact CB-CD1 3.71Å; N225-F269 HydrophobicContact CB-CD2 3.57Å; N225-F269 HydrophobicContact CB-CE1 3.39Å; N225-F269 HydrophobicContact CB-CE2 3.24Å; N225-F269 HydrophobicContact CB-CG 3.8Å; N225-F269 HydrophobicContact CB-CZ 3.16Å; N225-F269 WeakPolarHBondContact CB-O 3.47Å; N225-F269 PolarHBondContact N-O 2.96Å; N225-F269 PolarHBondContact ND2-O 3.13Å; N225-F269 VanDerWaalsContact ND2-O 3.09Å; N225-F269 PolarHBondContact O-N 3.06Å; Y227-F269 AromaticContact CD1-CE1 3.7Å; Y227-F269 HydrophobicContact CD1-CE1 3.7Å; Y227-F269 HydrophobicContact CD1-CZ 4.27Å; Y227-F269 HydrophobicContact CD2-CE1 4.3Å; Y227-F269 AromaticContact CE1-CE1 3.49Å; Y227-F269 HydrophobicContact CE1-CE1 3.49Å; Y227-F269 VanDerWaalsContact CE1-CE1 3.49Å; Y227-F269 AromaticContact CE1-CZ 3.62Å; Y227-F269 HydrophobicContact CE1-CZ 3.62Å; Y227-F269 HydrophobicContact CE2-CE1 4.12Å; Y227-F269 HydrophobicContact CG-CE1 4.09Å; Y227-F269 AromaticContact CZ-CE1 3.72Å; Y227-F269 AromaticContact CZ-CZ 3.78Å; W232-F269 AromaticContact NE1-CZ 3.9Å; K267-F269 HydrophobicContact CD-CD1 4.25Å; K267-F269 HydrophobicContact CG-CD1 4.27Å; F269-T271 HydrophobicContact CD2-CG2 3.84Å; F269-T271 HydrophobicContact CE2-CG2 4.24Å; F269-L303 CarbonylContact C-O 3.49Å; F269-L303 VanDerWaalsContact CA-O 3.23Å; F269-L303 WeakPolarHBondContact CA-O 3.46Å; F269-E304 HydrophobicContact CB-CB 4.13Å; F269-E304 HydrophobicContact CB-CG 3.8Å
270	F	96.6	Very high	94.5	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	126.1	-175.8	-55	-78.9	0	0	0	109.5	L212 V215 V216 I222 I223 T224 V268 L278 L281 I285 C302 L303 V305	L212-F270 HydrophobicContact CD2-CE2 4.21Å; L212-F270 HydrophobicContact CD2-CZ 3.97Å; V215-F270 HydrophobicContact CG1-CE1 3.7Å; V215-F270 HydrophobicContact CG1-CZ 3.6Å; V216-F270 HydrophobicContact CG2-CD1 3.65Å; V216-F270 HydrophobicContact CG2-CE1 3.71Å; I222-F270 HydrophobicContact CG2-CB 3.86Å; I222-F270 HydrophobicContact CG2-CD1 4.21Å; I222-F270 HydrophobicContact CG2-CG 4.46Å; I223-F270 WeakPolarHBondContact O-CA 3.28Å; T224-F270 HydrophobicContact CG2-CD1 4.1Å; T224-F270 HydrophobicContact CG2-CE1 3.64Å; T224-F270 HydrophobicContact CG2-CZ 4.46Å; T224-F270 WeakPolarHBondContact OG1-CE1 3.42Å; V268-F270 HydrophobicContact CG1-CE1 4.3Å; V268-F270 HydrophobicContact CG1-CE2 4.3Å; V268-F270 HydrophobicContact CG1-CZ 3.9Å; F270-L278 HydrophobicContact CB-CD2 4.07Å; F270-L281 HydrophobicContact CB-CD2 3.97Å; F270-L281 HydrophobicContact CD1-CD2 4.05Å; F270-L281 HydrophobicContact CD2-CD2 3.85Å; F270-L281 HydrophobicContact CE2-CD2 4.36Å; F270-L281 HydrophobicContact CG-CD2 3.67Å; F270-I285 HydrophobicContact CD2-CD1 4.26Å; F270-I285 HydrophobicContact CE2-CD1 3.62Å; F270-I285 HydrophobicContact CZ-CD1 4.3Å; F270-C302 WeakPolarHBondContact O-CA 3.42Å; F270-L303 HydrophobicContact CB-CB 4.45Å; F270-L303 HydrophobicContact CD2-CD2 4.47Å; F270-L303 PolarHBondContact N-O 3.01Å; F270-L303 PolarHBondContact O-N 2.92Å; F270-V305 HydrophobicContact CD2-CG2 4.42Å; F270-V305 HydrophobicContact CE2-CG2 3.87Å
271	T	93.7	Very high	94.7	Very high	10 Å²	10	40.6 Å²	40.6	6%	0.061	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	131.6	-177.3	60.5	0	0	0	0	111.1	I223 N225 R238 F269 T301 C302	I223-T271 PolarHBondContact N-O 3.32Å; I223-T271 PolarHBondContact O-N 3.08Å; N225-T271 PolarHBondContact ND2-OG1 3.49Å; R238-T271 PolarHBondContact NH1-OG1 3.1Å; R238-T271 PolarHBondContact NH2-OG1 3.25Å; F269-T271 HydrophobicContact CD2-CG2 3.84Å; F269-T271 HydrophobicContact CE2-CG2 4.24Å; T271-T301 VanDerWaalsContact CA-O 3.28Å; T271-T301 WeakPolarHBondContact CA-O 3.49Å; T271-C302 HydrophobicContact CG2-CB 4.31Å
272	C	91.9	Very high	94.8	Very high	3 Å²	3	37.7 Å²	37.7	2%	0.02	20%	0.198	C	C	.	.			trans	-152.7	142.5	-175.9	-175	0	0	0	0	110.2	D221 I222 S274 L278 T301	D221-C272 PolarHBondContact O-SG 3.04Å; I222-C272 HydrophobicContact CG1-CB 4.15Å; C272-S274 PolarHBondContact O-N 3.29Å; C272-L278 HydrophobicContact CB-CD1 4.05Å; C272-L278 HydrophobicContact CB-CD2 3.89Å; C272-L278 HydrophobicContact CB-CG 3.85Å; C272-T301 PolarHBondContact N-O 3.15Å; C272-T301 VanDerWaalsContact O-CA 3.29Å; C272-T301 WeakPolarHBondContact O-CA 3.2Å; C272-T301 WeakPolarHBondContact O-CB 3.36Å; C272-T301 VanDerWaalsContact O-CG2 3.3Å; C272-T301 WeakPolarHBondContact O-CG2 3.27Å
273	D	89.3	Confident	94.9	Very high	152 Å²	152	43.7 Å²	43.7	81%	0.813	23%	0.226	S	C	*	.	S	Bend	trans	-68.4	-21.2	179	-64.8	-24.5	0	0	0	112.8
274	S	90.1	Very high	95	Very high	39 Å²	39	40.9 Å²	40.9	27%	0.273	22%	0.222	S	C	.	.			trans	-105.7	112.6	178.9	-178.2	0	0	0	0	111.7	C272 E276 Q277	C272-S274 PolarHBondContact O-N 3.29Å; S274-E276 PolarHBondContact O-N 3.49Å; S274-Q277 PolarHBondContact O-N 3.37Å
275	H	91.6	Very high	95.1	Very high	47 Å²	47	40.4 Å²	40.4	22%	0.218	22%	0.217	C	C	.	.	H	α-helix	trans	-57	-38.2	172.5	-179.4	57.8	0	0	0	112.5	Q277 L278 L279 F297 L300	H275-Q277 PolarHBondContact O-N 2.8Å; H275-L278 PolarHBondContact O-N 3.31Å; H275-L279 PolarHBondContact O-N 3.12Å; H275-F297 AromaticContact CE1-CE1 3.77Å; H275-F297 AromaticContact CE1-CE2 3.97Å; H275-F297 AromaticContact CE1-CZ 3.66Å; H275-F297 AromaticContact ND1-CE1 3.66Å; H275-F297 AromaticContact ND1-CZ 3.9Å; H275-L300 WeakPolarHBondContact CA-O 3.34Å; H275-L300 HydrophobicContact CB-CB 4.23Å; H275-L300 HydrophobicContact CB-CD2 4.16Å; H275-L300 WeakPolarHBondContact CB-O 3.35Å; H275-L300 VanDerWaalsContact CG-CD2 3.49Å; H275-L300 PolarHBondContact ND1-O 3.25Å
276	E	93.3	Very high	95.1	Very high	156 Å²	156	43.4 Å²	43.4	73%	0.729	23%	0.233	S	C	*	.	H	α-helix	trans	-63.3	-26.8	-178.6	-65	-175.2	169.3	0	0	112.5	S274 P280	S274-E276 PolarHBondContact O-N 3.49Å; E276-P280 WeakPolarHBondContact O-CD 3.46Å
277	Q	92.4	Very high	95.1	Very high	67 Å²	67	47.7 Å²	47.7	31%	0.313	27%	0.269	S	S	.	.	H	α-helix	trans	-76.2	-26.6	175.6	-68.4	-161.3	47.6	0	0	113	D221 S274 H275	D221-Q277 PolarHBondContact OD2-NE2 3.12Å; D221-Q277 PolarHBondContact OD2-OE1 3.49Å; S274-Q277 PolarHBondContact O-N 3.37Å; H275-Q277 PolarHBondContact O-N 2.8Å
278	L	95.8	Very high	95.1	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-83.8	-23.4	179.9	-66.6	177	0	0	0	112.9	I222 F270 C272 H275 L281 E282 F297 L303	I222-L278 HydrophobicContact CD1-CD2 4.29Å; I222-L278 HydrophobicContact CG1-CD2 4.48Å; I222-L278 HydrophobicContact CG2-CD2 4.25Å; F270-L278 HydrophobicContact CB-CD2 4.07Å; C272-L278 HydrophobicContact CB-CD1 4.05Å; C272-L278 HydrophobicContact CB-CD2 3.89Å; C272-L278 HydrophobicContact CB-CG 3.85Å; H275-L278 PolarHBondContact O-N 3.31Å; L278-L281 HydrophobicContact CD2-CD2 4.32Å; L278-L281 WeakPolarHBondContact O-CB 3.31Å; L278-L281 PolarHBondContact O-N 2.92Å; L278-E282 PolarHBondContact O-N 2.87Å; L278-F297 HydrophobicContact CB-CE1 3.64Å; L278-F297 HydrophobicContact CB-CZ 3.67Å; L278-F297 HydrophobicContact CD1-CE1 3.89Å; L278-F297 HydrophobicContact CG-CE1 4.43Å; L278-L303 HydrophobicContact CB-CB 4.49Å; L278-L303 HydrophobicContact CD1-CB 4.3Å; L278-L303 HydrophobicContact CD2-CB 4.44Å
279	L	95.4	Very high	95.1	Very high	54 Å²	54	55.6 Å²	55.6	28%	0.283	30%	0.298	S	S	.	.	H	α-helix	trans	-61.1	-45.9	-180	-71.3	171.6	0	0	0	113.6	H275 L281 E282 Q283 F297	H275-L279 PolarHBondContact O-N 3.12Å; L279-L281 VanDerWaalsContact C-N 3.28Å; L279-L281 PolarHBondContact O-N 3.2Å; L279-E282 WeakPolarHBondContact O-CB 3.42Å; L279-E282 PolarHBondContact O-N 3.24Å; L279-Q283 WeakPolarHBondContact O-CG 3.36Å; L279-Q283 PolarHBondContact O-N 3.3Å; L279-Q283 VanDerWaalsContact O-N 3.17Å; L279-F297 HydrophobicContact CD2-CE2 4.04Å; L279-F297 HydrophobicContact CD2-CZ 4.26Å
280	P	95.9	Very high	95	Very high	77 Å²	77	56.4 Å²	56.4	50%	0.5	31%	0.311	S	S	.	.	H	α-helix	trans	-63.2	-34	174.1	-23.3	34.1	0	0	0	112.9	E276 Q283 A284	E276-P280 WeakPolarHBondContact O-CD 3.46Å; P280-Q283 PolarHBondContact O-N 3.2Å; P280-A284 WeakPolarHBondContact O-CB 3.3Å; P280-A284 PolarHBondContact O-N 3.03Å
281	L	96.4	Very high	95	Very high	16 Å²	16	64.1 Å²	64.1	8%	0.084	35%	0.352	C	S	.	.	H	α-helix	trans	-66.2	-45.3	176.9	-177.7	60.2	0	0	0	111	V216 I222 F270 L278 L279 Q283 A284 I285 L303	V216-L281 HydrophobicContact CG1-CD1 3.63Å; V216-L281 HydrophobicContact CG1-CD2 4.02Å; V216-L281 HydrophobicContact CG1-CG 4.45Å; I222-L281 HydrophobicContact CD1-CD2 4.42Å; F270-L281 HydrophobicContact CB-CD2 3.97Å; F270-L281 HydrophobicContact CD1-CD2 4.05Å; F270-L281 HydrophobicContact CD2-CD2 3.85Å; F270-L281 HydrophobicContact CE2-CD2 4.36Å; F270-L281 HydrophobicContact CG-CD2 3.67Å; L278-L281 HydrophobicContact CD2-CD2 4.32Å; L278-L281 WeakPolarHBondContact O-CB 3.31Å; L278-L281 PolarHBondContact O-N 2.92Å; L279-L281 VanDerWaalsContact C-N 3.28Å; L279-L281 PolarHBondContact O-N 3.2Å; L281-Q283 VanDerWaalsContact C-N 3.3Å; L281-Q283 PolarHBondContact O-N 3.43Å; L281-A284 PolarHBondContact O-N 2.95Å; L281-I285 HydrophobicContact CD1-CD1 3.85Å; L281-I285 HydrophobicContact CD1-CG1 4.01Å; L281-I285 HydrophobicContact CG-CD1 3.8Å; L281-I285 HydrophobicContact CG-CG1 4.34Å; L281-I285 VanDerWaalsContact O-CG1 3.24Å; L281-I285 WeakPolarHBondContact O-CG1 3.39Å; L281-I285 PolarHBondContact O-N 3.37Å; L281-L303 HydrophobicContact CB-CD2 4.27Å; L281-L303 HydrophobicContact CD2-CD2 4.24Å; L281-L303 HydrophobicContact CG-CD2 4.09Å
282	E	97	Very high	95.2	Very high	14 Å²	14	68.3 Å²	68.3	7%	0.065	37%	0.367	C	S	.	.	H	α-helix	trans	-53	-48.2	172.5	176.1	-174.2	-143.4	0	0	111.3	L278 L279 N286 V295 F297 L303 R358	L278-E282 PolarHBondContact O-N 2.87Å; L279-E282 WeakPolarHBondContact O-CB 3.42Å; L279-E282 PolarHBondContact O-N 3.24Å; E282-N286 WeakPolarHBondContact O-CB 3.39Å; E282-N286 PolarHBondContact O-N 2.75Å; E282-N286 VanDerWaalsContact O-N 3.1Å; E282-N286 PolarHBondContact O-ND2 2.72Å; E282-V295 HydrophobicContact CB-CG1 4.47Å; E282-V295 HydrophobicContact CG-CG1 4.01Å; E282-F297 HydrophobicContact CB-CE2 4.2Å; E282-F297 HydrophobicContact CG-CE2 4.38Å; E282-F297 WeakPolarHBondContact OE2-CE2 3.46Å; E282-L303 HydrophobicContact CB-CD1 4Å; E282-L303 HydrophobicContact CB-CD2 3.93Å; E282-L303 HydrophobicContact CG-CD1 4.24Å; E282-R358 VanDerWaalsContact CD-NH1 3.34Å; E282-R358 IonicContact OE1-CZ 2.82Å; E282-R358 VanDerWaalsContact OE1-CZ 3.29Å; E282-R358 IonicContact OE1-NH1 2.85Å; E282-R358 PolarHBondContact OE1-NH1 2.95Å; E282-R358 IonicContact OE1-NH2 3.99Å; E282-R358 PolarHBondContact OE1-NH2 3.22Å; E282-R358 IonicContact OE2-CZ 3.91Å; E282-R358 IonicContact OE2-NH1 3.69Å; E282-R358 PolarHBondContact OE2-NH1 3.43Å; E282-R358 IonicContact OE2-NH2 3.89Å; E282-R358 PolarHBondContact OE2-NH2 3.44Å
283	Q	96.6	Very high	95.4	Very high	136 Å²	136	68.7 Å²	68.7	64%	0.636	37%	0.369	S	S	*	.	H	α-helix	trans	-63.8	-43.8	179.6	-68.7	176.7	3.8	0	0	112.1	L279 P280 L281 A287	L279-Q283 WeakPolarHBondContact O-CG 3.36Å; L279-Q283 PolarHBondContact O-N 3.3Å; L279-Q283 VanDerWaalsContact O-N 3.17Å; P280-Q283 PolarHBondContact O-N 3.2Å; L281-Q283 VanDerWaalsContact C-N 3.3Å; L281-Q283 PolarHBondContact O-N 3.43Å; Q283-A287 VanDerWaalsContact O-CB 3.28Å; Q283-A287 WeakPolarHBondContact O-CB 3.32Å; Q283-A287 PolarHBondContact O-N 3.23Å
284	A	96.8	Very high	95.8	Very high	57 Å²	57	62.6 Å²	62.6	47%	0.471	34%	0.336	S	S	.	.	H	α-helix	trans	-65.1	-42.4	-179.4	0	0	0	0	0	112.6	P280 L281 A287 R288	P280-A284 WeakPolarHBondContact O-CB 3.3Å; P280-A284 PolarHBondContact O-N 3.03Å; L281-A284 PolarHBondContact O-N 2.95Å; A284-A287 PolarHBondContact O-N 2.95Å; A284-R288 WeakPolarHBondContact O-CB 3.3Å; A284-R288 PolarHBondContact O-N 3.18Å
285	I	97.4	Very high	96.2	Very high	2 Å²	2	61.3 Å²	61.3	1%	0.01	33%	0.327	C	S	.	.	H	α-helix	trans	-64.6	-48.8	178	-65.1	176.4	0	0	0	110	L212 F270 L281 A287 R288 W289 V293 V295 V305	L212-I285 HydrophobicContact CD2-CD1 4.1Å; L212-I285 HydrophobicContact CD2-CG1 4.45Å; L212-I285 HydrophobicContact CD2-CG2 4.47Å; F270-I285 HydrophobicContact CD2-CD1 4.26Å; F270-I285 HydrophobicContact CE2-CD1 3.62Å; F270-I285 HydrophobicContact CZ-CD1 4.3Å; L281-I285 HydrophobicContact CD1-CD1 3.85Å; L281-I285 HydrophobicContact CD1-CG1 4.01Å; L281-I285 HydrophobicContact CG-CD1 3.8Å; L281-I285 HydrophobicContact CG-CG1 4.34Å; L281-I285 VanDerWaalsContact O-CG1 3.24Å; L281-I285 WeakPolarHBondContact O-CG1 3.39Å; L281-I285 PolarHBondContact O-N 3.37Å; I285-A287 VanDerWaalsContact C-N 3.35Å; I285-A287 PolarHBondContact O-N 3.25Å; I285-R288 PolarHBondContact O-N 3.35Å; I285-W289 HydrophobicContact CB-CE3 4.25Å; I285-W289 HydrophobicContact CB-CZ3 4.13Å; I285-W289 HydrophobicContact CG1-CZ3 4.04Å; I285-W289 HydrophobicContact CG2-CE3 3.65Å; I285-W289 HydrophobicContact CG2-CZ3 3.77Å; I285-W289 PolarHBondContact O-N 3.46Å; I285-W289 VanDerWaalsContact O-N 3.12Å; I285-V293 HydrophobicContact CG2-CG2 4.26Å; I285-V295 HydrophobicContact CB-CG2 4.25Å; I285-V295 HydrophobicContact CG2-CG2 3.44Å; I285-V295 VanDerWaalsContact CG2-CG2 3.44Å; I285-V305 HydrophobicContact CD1-CG2 3.99Å; I285-V305 HydrophobicContact CG2-CG1 4.35Å; I285-V305 HydrophobicContact CG2-CG2 4.27Å
286	N	96.8	Very high	96.4	Very high	62 Å²	62	59.5 Å²	59.5	33%	0.332	32%	0.32	S	S	.	.	H	α-helix	trans	-60.5	-42.7	177.5	-78.1	-47.2	0	0	0	112.1	E282 R288 G290 V295	E282-N286 WeakPolarHBondContact O-CB 3.39Å; E282-N286 PolarHBondContact O-N 2.75Å; E282-N286 VanDerWaalsContact O-N 3.1Å; E282-N286 PolarHBondContact O-ND2 2.72Å; N286-R288 VanDerWaalsContact C-N 3.31Å; N286-R288 PolarHBondContact O-N 2.86Å; N286-G290 WeakPolarHBondContact O-CA 3.34Å; N286-G290 PolarHBondContact O-N 2.68Å; N286-V295 VanDerWaalsContact OD1-CG2 3.32Å; N286-V295 WeakPolarHBondContact OD1-CG2 3.35Å
287	A	97.2	Very high	96.4	Very high	91 Å²	91	52.5 Å²	52.5	75%	0.752	29%	0.287	S	S	*	.	H	α-helix	trans	-66.6	-31.5	178.4	0	0	0	0	0	113.2	Q283 A284 I285	Q283-A287 VanDerWaalsContact O-CB 3.28Å; Q283-A287 WeakPolarHBondContact O-CB 3.32Å; Q283-A287 PolarHBondContact O-N 3.23Å; A284-A287 PolarHBondContact O-N 2.95Å; I285-A287 VanDerWaalsContact C-N 3.35Å; I285-A287 PolarHBondContact O-N 3.25Å
288	R	97.6	Very high	96.1	Very high	145 Å²	145	50.9 Å²	50.9	55%	0.547	28%	0.283	S	S	.	.	H	α-helix	trans	-78	-42.9	-177.9	-177.9	172.8	175.7	163.3	-2.1	113.1	D211 A284 I285 N286	D211-R288 VanDerWaalsContact CG-NH2 3.3Å; D211-R288 IonicContact OD1-NH2 2.71Å; D211-R288 IonicContact OD2-CZ 3.74Å; D211-R288 IonicContact OD2-NE 2.67Å; D211-R288 IonicContact OD2-NH2 3.25Å; D211-R288 PolarHBondContact OD2-NH2 3.33Å; A284-R288 WeakPolarHBondContact O-CB 3.3Å; A284-R288 PolarHBondContact O-N 3.18Å; I285-R288 PolarHBondContact O-N 3.35Å; N286-R288 VanDerWaalsContact C-N 3.31Å; N286-R288 PolarHBondContact O-N 2.86Å
289	W	97.4	Very high	95.6	Very high	24 Å²	24	54.3 Å²	54.3	9%	0.091	30%	0.304	C	S	.	.	H	α-helix	trans	-115.3	-14.8	-170.8	-65.9	-70.2	0	0	0	115	I208 D211 L212 I285 D291 R292 V293	I208-W289 HydrophobicContact CD1-CG 4.29Å; I208-W289 HydrophobicContact CG1-CG 4.39Å; I208-W289 HydrophobicContact CG2-CD2 4.08Å; I208-W289 HydrophobicContact CG2-CG 4.31Å; I208-W289 HydrophobicContact CG2-CZ2 4.39Å; D211-W289 HydrophobicContact CB-CH2 4.11Å; D211-W289 HydrophobicContact CB-CZ2 3.57Å; L212-W289 HydrophobicContact CD2-CH2 3.8Å; L212-W289 HydrophobicContact CD2-CZ3 3.64Å; L212-W289 HydrophobicContact CG-CH2 4.13Å; L212-W289 HydrophobicContact CG-CZ3 4.31Å; I285-W289 HydrophobicContact CB-CE3 4.25Å; I285-W289 HydrophobicContact CB-CZ3 4.13Å; I285-W289 HydrophobicContact CG1-CZ3 4.04Å; I285-W289 HydrophobicContact CG2-CE3 3.65Å; I285-W289 HydrophobicContact CG2-CZ3 3.77Å; I285-W289 PolarHBondContact O-N 3.46Å; I285-W289 VanDerWaalsContact O-N 3.12Å; W289-D291 PolarHBondContact O-N 2.88Å; W289-R292 HydrophobicContact CB-CB 4.44Å; W289-R292 WeakPolarHBondContact O-CB 3.44Å; W289-R292 PolarHBondContact O-N 2.79Å; W289-R292 VanDerWaalsContact O-N 3.1Å; W289-V293 HydrophobicContact CB-CB 4.45Å; W289-V293 HydrophobicContact CB-CG1 3.87Å; W289-V293 HydrophobicContact CB-CG2 3.77Å; W289-V293 HydrophobicContact CG-CG1 4.33Å
290	G	95.7	Very high	95.2	Very high	32 Å²	32	55.4 Å²	55.4	33%	0.33	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	49.5	-129.9	177.8	0	0	0	0	0	112.6	N286 R292 V293	N286-G290 WeakPolarHBondContact O-CA 3.34Å; N286-G290 PolarHBondContact O-N 2.68Å; G290-R292 PolarHBondContact O-N 3.39Å; G290-V293 WeakPolarHBondContact O-CG2 3.06Å; G290-V293 PolarHBondContact O-N 3.06Å; G290-V293 VanDerWaalsContact O-N 3.15Å
291	D	95.8	Very high	94.9	Very high	162 Å²	162	54.5 Å²	54.5	87%	0.866	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-63.2	-9.1	-176.9	-60	-19.8	0	0	0	114.8	W289 V293 G308	W289-D291 PolarHBondContact O-N 2.88Å; D291-V293 VanDerWaalsContact C-N 3.25Å; D291-V293 PolarHBondContact O-N 3.02Å; D291-G308 WeakPolarHBondContact O-CA 3.33Å
292	R	97.8	Very high	94.7	Very high	98 Å²	98	54.4 Å²	54.4	37%	0.37	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-76.7	-10.4	175.3	-60.5	-176.1	65.7	-156.6	-2.8	113.3	D205 D207 I208 W289 G290 G308	D205-R292 IonicContact OD2-CZ 3.35Å; D205-R292 IonicContact OD2-NE 3.4Å; D205-R292 PolarHBondContact OD2-NE 2.52Å; D205-R292 IonicContact OD2-NH2 3.03Å; D205-R292 PolarHBondContact OD2-NH2 3.19Å; D207-R292 VanDerWaalsContact CG-NH2 3.33Å; D207-R292 IonicContact OD1-CZ 3.05Å; D207-R292 IonicContact OD1-NH1 3.99Å; D207-R292 IonicContact OD1-NH2 2.67Å; D207-R292 PolarHBondContact OD1-NH2 3.43Å; D207-R292 IonicContact OD2-CZ 2.8Å; D207-R292 IonicContact OD2-NH1 2.76Å; D207-R292 PolarHBondContact OD2-NH1 2.93Å; D207-R292 IonicContact OD2-NH2 2.63Å; D207-R292 PolarHBondContact OD2-NH2 3Å; I208-R292 HydrophobicContact CD1-CB 3.63Å; W289-R292 HydrophobicContact CB-CB 4.44Å; W289-R292 WeakPolarHBondContact O-CB 3.44Å; W289-R292 PolarHBondContact O-N 2.79Å; W289-R292 VanDerWaalsContact O-N 3.1Å; G290-R292 PolarHBondContact O-N 3.39Å; R292-G308 VanDerWaalsContact C-N 3.31Å; R292-G308 PolarHBondContact O-N 2.94Å
293	V	98.2	Very high	94.7	Very high	11 Å²	11	53.8 Å²	53.8	7%	0.067	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	152.3	178.1	-65.8	0	0	0	0	111.6	L204 I208 I285 W289 G290 D291 V295 V305 M306	L204-V293 HydrophobicContact CD2-CG1 4.29Å; I208-V293 HydrophobicContact CD1-CG1 4.01Å; I208-V293 HydrophobicContact CG2-CG1 3.7Å; I285-V293 HydrophobicContact CG2-CG2 4.26Å; W289-V293 HydrophobicContact CB-CB 4.45Å; W289-V293 HydrophobicContact CB-CG1 3.87Å; W289-V293 HydrophobicContact CB-CG2 3.77Å; W289-V293 HydrophobicContact CG-CG1 4.33Å; G290-V293 WeakPolarHBondContact O-CG2 3.06Å; G290-V293 PolarHBondContact O-N 3.06Å; G290-V293 VanDerWaalsContact O-N 3.15Å; D291-V293 VanDerWaalsContact C-N 3.25Å; D291-V293 PolarHBondContact O-N 3.02Å; V293-V295 HydrophobicContact CB-CG2 4.41Å; V293-V295 HydrophobicContact CG2-CG2 3.9Å; V293-V305 HydrophobicContact CB-CG1 4.02Å; V293-V305 HydrophobicContact CG1-CG1 4.04Å; V293-M306 CarbonylContact C-O 3.57Å; V293-M306 WeakPolarHBondContact CA-O 3.33Å
294	N	97.6	Very high	94.8	Very high	24 Å²	24	47.7 Å²	47.7	13%	0.128	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	117.2	162	-177	3.5	0	0	0	108.9	V305 M306 V310 S311 E341	N294-V305 WeakPolarHBondContact O-CA 3.12Å; N294-M306 HydrophobicContact CB-CB 4.5Å; N294-M306 HydrophobicContact CB-CE 4.34Å; N294-M306 PolarHBondContact N-O 2.8Å; N294-M306 PolarHBondContact O-N 2.95Å; N294-V310 WeakPolarHBondContact CB-O 3.47Å; N294-V310 PolarHBondContact ND2-O 2.79Å; N294-S311 WeakPolarHBondContact ND2-CB 3.47Å; N294-E341 PolarHBondContact ND2-OE1 3.34Å; N294-E341 PolarHBondContact OD1-OE1 2.92Å
295	V	97.4	Very high	94.8	Very high	12 Å²	12	45 Å²	45	7%	0.073	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	120.9	-179	-173.5	0	0	0	0	109.4	E282 I285 N286 V293 L303 E304 V305	E282-V295 HydrophobicContact CB-CG1 4.47Å; E282-V295 HydrophobicContact CG-CG1 4.01Å; I285-V295 HydrophobicContact CB-CG2 4.25Å; I285-V295 HydrophobicContact CG2-CG2 3.44Å; I285-V295 VanDerWaalsContact CG2-CG2 3.44Å; N286-V295 VanDerWaalsContact OD1-CG2 3.32Å; N286-V295 WeakPolarHBondContact OD1-CG2 3.35Å; V293-V295 HydrophobicContact CB-CG2 4.41Å; V293-V295 HydrophobicContact CG2-CG2 3.9Å; V295-L303 HydrophobicContact CG1-CD1 3.56Å; V295-L303 HydrophobicContact CG1-CD2 4.38Å; V295-L303 HydrophobicContact CG1-CG 4.09Å; V295-E304 WeakPolarHBondContact CA-O 3.47Å; V295-V305 HydrophobicContact CG1-CG2 4.42Å; V295-V305 HydrophobicContact CG2-CG1 4.33Å; V295-V305 HydrophobicContact CG2-CG2 4.36Å
296	S	95	Very high	94.9	Very high	10 Å²	10	45 Å²	45	7%	0.07	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	138.2	-176.3	-79.7	0	0	0	0	112.9	E304	S296-E304 PolarHBondContact N-O 2.99Å; S296-E304 PolarHBondContact O-N 3.05Å
297	F	93.7	Very high	95	Very high	9 Å²	9	42.4 Å²	42.4	4%	0.039	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	126.8	168.2	-79.6	-81.7	0	0	0	111.1	H275 L278 L279 E282 T299 C302 L303 M337 N338	H275-F297 AromaticContact CE1-CE1 3.77Å; H275-F297 AromaticContact CE1-CE2 3.97Å; H275-F297 AromaticContact CE1-CZ 3.66Å; H275-F297 AromaticContact ND1-CE1 3.66Å; H275-F297 AromaticContact ND1-CZ 3.9Å; L278-F297 HydrophobicContact CB-CE1 3.64Å; L278-F297 HydrophobicContact CB-CZ 3.67Å; L278-F297 HydrophobicContact CD1-CE1 3.89Å; L278-F297 HydrophobicContact CG-CE1 4.43Å; L279-F297 HydrophobicContact CD2-CE2 4.04Å; L279-F297 HydrophobicContact CD2-CZ 4.26Å; E282-F297 HydrophobicContact CB-CE2 4.2Å; E282-F297 HydrophobicContact CG-CE2 4.38Å; E282-F297 WeakPolarHBondContact OE2-CE2 3.46Å; F297-T299 WeakPolarHBondContact CD1-O 3.37Å; F297-C302 WeakPolarHBondContact CA-O 3.13Å; F297-C302 WeakPolarHBondContact CD1-O 3.45Å; F297-L303 HydrophobicContact CD1-CB 4.19Å; F297-L303 HydrophobicContact CD1-CD1 4.16Å; F297-L303 HydrophobicContact CD2-CD1 3.81Å; F297-L303 HydrophobicContact CE1-CB 3.9Å; F297-L303 HydrophobicContact CE1-CD1 4.07Å; F297-L303 HydrophobicContact CE2-CD1 3.7Å; F297-L303 HydrophobicContact CG-CD1 4.05Å; F297-L303 HydrophobicContact CZ-CB 4.32Å; F297-L303 HydrophobicContact CZ-CD1 3.84Å; F297-M337 HydrophobicContact CB-CB 4.38Å; F297-M337 HydrophobicContact CB-CG 4.36Å; F297-M337 VanDerWaalsContact O-CB 3.28Å; F297-M337 WeakPolarHBondContact O-CB 3.37Å; F297-M337 PolarHBondContact O-N 3.17Å; F297-N338 PolarHBondContact O-N 2.63Å
298	S	86.6	Confident	94.9	Very high	33 Å²	33	39.6 Å²	39.6	23%	0.231	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	-39.2	169.1	57.3	0	0	0	0	111.8	C302 E304	S298-C302 PolarHBondContact N-O 3.33Å; S298-C302 VanDerWaalsContact N-O 3.15Å; S298-E304 WeakPolarHBondContact CB-OE1 3.31Å; S298-E304 PolarHBondContact OG-OE1 2.82Å
299	T	85.2	Confident	94.8	Very high	71 Å²	71	35.1 Å²	35.1	44%	0.436	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	171.3	167.3	69.8	0	0	0	0	109	F297 T301 C302	F297-T299 WeakPolarHBondContact CD1-O 3.37Å; T299-T301 PolarHBondContact O-N 3.28Å; T299-T301 VanDerWaalsContact O-N 3.13Å; T299-T301 PolarHBondContact OG1-N 3.05Å; T299-T301 PolarHBondContact OG1-OG1 3.38Å; T299-C302 PolarHBondContact O-N 3.43Å; T299-C302 WeakPolarHBondContact OG1-CB 3.49Å; T299-C302 PolarHBondContact OG1-N 3.23Å
300	L	87	Confident	94.9	Very high	77 Å²	77	34.2 Å²	34.2	40%	0.403	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-24.9	174.4	-79.3	172.4	0	0	0	113.4	H275 H356	H275-L300 WeakPolarHBondContact CA-O 3.34Å; H275-L300 HydrophobicContact CB-CB 4.23Å; H275-L300 HydrophobicContact CB-CD2 4.16Å; H275-L300 WeakPolarHBondContact CB-O 3.35Å; H275-L300 VanDerWaalsContact CG-CD2 3.49Å; H275-L300 PolarHBondContact ND1-O 3.25Å; L300-H356 WeakPolarHBondContact CD2-NE2 3.44Å; L300-H356 WeakPolarHBondContact CG-NE2 3.24Å
301	T	90.2	Very high	94.9	Very high	59 Å²	59	32.8 Å²	32.8	36%	0.362	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	6.9	-174.8	54.9	0	0	0	0	113.4	T271 C272 T299	T271-T301 VanDerWaalsContact CA-O 3.28Å; T271-T301 WeakPolarHBondContact CA-O 3.49Å; C272-T301 PolarHBondContact N-O 3.15Å; C272-T301 VanDerWaalsContact O-CA 3.29Å; C272-T301 WeakPolarHBondContact O-CA 3.2Å; C272-T301 WeakPolarHBondContact O-CB 3.36Å; C272-T301 VanDerWaalsContact O-CG2 3.3Å; C272-T301 WeakPolarHBondContact O-CG2 3.27Å; T299-T301 PolarHBondContact O-N 3.28Å; T299-T301 VanDerWaalsContact O-N 3.13Å; T299-T301 PolarHBondContact OG1-N 3.05Å; T299-T301 PolarHBondContact OG1-OG1 3.38Å
302	C	92.4	Very high	95	Very high	14 Å²	14	25.6 Å²	25.6	10%	0.095	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	111.3	-176.8	-170.5	0	0	0	0	111.4	F270 T271 F297 S298 T299	F270-C302 WeakPolarHBondContact O-CA 3.42Å; T271-C302 HydrophobicContact CG2-CB 4.31Å; F297-C302 WeakPolarHBondContact CA-O 3.13Å; F297-C302 WeakPolarHBondContact CD1-O 3.45Å; S298-C302 PolarHBondContact N-O 3.33Å; S298-C302 VanDerWaalsContact N-O 3.15Å; T299-C302 PolarHBondContact O-N 3.43Å; T299-C302 WeakPolarHBondContact OG1-CB 3.49Å; T299-C302 PolarHBondContact OG1-N 3.23Å
303	L	97	Very high	95	Very high	0 Å²	0	21 Å²	21	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	121.5	175.1	-179.8	66.3	0	0	0	109.4	F269 F270 L278 L281 E282 V295 F297	F269-L303 CarbonylContact C-O 3.49Å; F269-L303 VanDerWaalsContact CA-O 3.23Å; F269-L303 WeakPolarHBondContact CA-O 3.46Å; F270-L303 HydrophobicContact CB-CB 4.45Å; F270-L303 HydrophobicContact CD2-CD2 4.47Å; F270-L303 PolarHBondContact N-O 3.01Å; F270-L303 PolarHBondContact O-N 2.92Å; L278-L303 HydrophobicContact CB-CB 4.49Å; L278-L303 HydrophobicContact CD1-CB 4.3Å; L278-L303 HydrophobicContact CD2-CB 4.44Å; L281-L303 HydrophobicContact CB-CD2 4.27Å; L281-L303 HydrophobicContact CD2-CD2 4.24Å; L281-L303 HydrophobicContact CG-CD2 4.09Å; E282-L303 HydrophobicContact CB-CD1 4Å; E282-L303 HydrophobicContact CB-CD2 3.93Å; E282-L303 HydrophobicContact CG-CD1 4.24Å; V295-L303 HydrophobicContact CG1-CD1 3.56Å; V295-L303 HydrophobicContact CG1-CD2 4.38Å; V295-L303 HydrophobicContact CG1-CG 4.09Å; F297-L303 HydrophobicContact CD1-CB 4.19Å; F297-L303 HydrophobicContact CD1-CD1 4.16Å; F297-L303 HydrophobicContact CD2-CD1 3.81Å; F297-L303 HydrophobicContact CE1-CB 3.9Å; F297-L303 HydrophobicContact CE1-CD1 4.07Å; F297-L303 HydrophobicContact CE2-CD1 3.7Å; F297-L303 HydrophobicContact CG-CD1 4.05Å; F297-L303 HydrophobicContact CZ-CB 4.32Å; F297-L303 HydrophobicContact CZ-CD1 3.84Å
304	E	97.6	Very high	95	Very high	9 Å²	9	24.1 Å²	24.1	4%	0.042	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	142.6	-174.4	-47.3	-165.6	-170.2	0	0	111.3	N187 K267 F269 V295 S296 S298 M306	N187-E304 PolarHBondContact ND2-OE2 3.46Å; K267-E304 WeakPolarHBondContact CD-OE2 3.35Å; K267-E304 IonicContact NZ-OE1 3.31Å; K267-E304 IonicContact NZ-OE2 2.8Å; K267-E304 PolarHBondContact NZ-OE2 2.84Å; F269-E304 HydrophobicContact CB-CB 4.13Å; F269-E304 HydrophobicContact CB-CG 3.8Å; V295-E304 WeakPolarHBondContact CA-O 3.47Å; S296-E304 PolarHBondContact N-O 2.99Å; S296-E304 PolarHBondContact O-N 3.05Å; S298-E304 WeakPolarHBondContact CB-OE1 3.31Å; S298-E304 PolarHBondContact OG-OE1 2.82Å; E304-M306 HydrophobicContact CB-SD 4.03Å
305	V	98.3	Very high	95	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	122	-179.5	-170.9	0	0	0	0	109.5	L204 L212 K267 V268 F270 I285 V293 N294 V295	L204-V305 HydrophobicContact CD2-CG1 4.4Å; L212-V305 HydrophobicContact CD1-CB 4.11Å; L212-V305 HydrophobicContact CD1-CG1 3.71Å; L212-V305 HydrophobicContact CD2-CG1 4.49Å; L212-V305 HydrophobicContact CD2-CG2 4.44Å; K267-V305 VanDerWaalsContact CA-O 3.3Å; K267-V305 WeakPolarHBondContact CA-O 3.31Å; K267-V305 WeakPolarHBondContact CB-O 3.12Å; V268-V305 PolarHBondContact N-O 3.1Å; V268-V305 PolarHBondContact O-N 3.36Å; F270-V305 HydrophobicContact CD2-CG2 4.42Å; F270-V305 HydrophobicContact CE2-CG2 3.87Å; I285-V305 HydrophobicContact CD1-CG2 3.99Å; I285-V305 HydrophobicContact CG2-CG1 4.35Å; I285-V305 HydrophobicContact CG2-CG2 4.27Å; V293-V305 HydrophobicContact CB-CG1 4.02Å; V293-V305 HydrophobicContact CG1-CG1 4.04Å; N294-V305 WeakPolarHBondContact O-CA 3.12Å; V295-V305 HydrophobicContact CG1-CG2 4.42Å; V295-V305 HydrophobicContact CG2-CG1 4.33Å; V295-V305 HydrophobicContact CG2-CG2 4.36Å
306	M	98.2	Very high	95	Very high	1 Å²	1	23.2 Å²	23.2	1%	0.005	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	171.8	174.3	-64	75.2	60.1	0	0	109.7	N187 L204 K267 V293 N294 E304 V310	N187-M306 HydrophobicContact CB-CE 3.71Å; N187-M306 HydrophobicContact CB-CG 4.18Å; N187-M306 HydrophobicContact CB-SD 3.84Å; N187-M306 PolarHBondContact ND2-SD 2.72Å; L204-M306 VanDerWaalsContact CD2-C 3.48Å; K267-M306 HydrophobicContact CB-CG 4.06Å; K267-M306 HydrophobicContact CB-SD 4.32Å; V293-M306 CarbonylContact C-O 3.57Å; V293-M306 WeakPolarHBondContact CA-O 3.33Å; N294-M306 HydrophobicContact CB-CB 4.5Å; N294-M306 HydrophobicContact CB-CE 4.34Å; N294-M306 PolarHBondContact N-O 2.8Å; N294-M306 PolarHBondContact O-N 2.95Å; E304-M306 HydrophobicContact CB-SD 4.03Å; M306-V310 HydrophobicContact CB-CB 4.14Å; M306-V310 HydrophobicContact CB-CG1 4.11Å; M306-V310 HydrophobicContact CG-CG1 4.49Å
307	A	98.1	Very high	95.1	Very high	9 Å²	9	25.6 Å²	25.6	7%	0.074	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64	155.3	173.3	0	0	0	0	0	112.4	N203 L204 G309 V310	N203-A307 VanDerWaalsContact O-CB 3.3Å; N203-A307 WeakPolarHBondContact O-CB 3.34Å; L204-A307 HydrophobicContact CD2-CB 4.46Å; A307-G309 PolarHBondContact O-N 3.35Å; A307-V310 HydrophobicContact CB-CB 4.5Å; A307-V310 HydrophobicContact CB-CG2 3.82Å; A307-V310 VanDerWaalsContact O-CB 3.27Å; A307-V310 WeakPolarHBondContact O-CB 3.45Å; A307-V310 PolarHBondContact O-N 3.24Å
308	G	96.8	Very high	95.3	Very high	31 Å²	31	27 Å²	27	32%	0.32	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	136.3	172	0	0	0	0	0	111.9	D291 R292 V310	D291-G308 WeakPolarHBondContact O-CA 3.33Å; R292-G308 VanDerWaalsContact C-N 3.31Å; R292-G308 PolarHBondContact O-N 2.94Å; G308-V310 PolarHBondContact O-N 3.04Å
309	G	95.5	Very high	95.7	Very high	51 Å²	51	25.5 Å²	25.5	53%	0.526	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.6	4.5	-175.5	0	0	0	0	0	115	A307 H314	A307-G309 PolarHBondContact O-N 3.35Å; G309-H314 WeakPolarHBondContact O-CB 3.14Å; G309-H314 PolarHBondContact O-ND1 3.02Å
310	V	97.8	Very high	96.3	Very high	6 Å²	6	22.4 Å²	22.4	4%	0.036	14%	0.144	C	C	.	.			trans	-99.6	112.6	173.6	-178.4	0	0	0	0	109.8	G188 A189 H202 N294 M306 A307 G308	G188-V310 VanDerWaalsContact C-CG1 3.46Å; A189-V310 HydrophobicContact CB-CG1 3.98Å; A189-V310 VanDerWaalsContact N-CG1 3.34Å; H202-V310 HydrophobicContact CB-CG2 3.6Å; N294-V310 WeakPolarHBondContact CB-O 3.47Å; N294-V310 PolarHBondContact ND2-O 2.79Å; M306-V310 HydrophobicContact CB-CB 4.14Å; M306-V310 HydrophobicContact CB-CG1 4.11Å; M306-V310 HydrophobicContact CG-CG1 4.49Å; A307-V310 HydrophobicContact CB-CB 4.5Å; A307-V310 HydrophobicContact CB-CG2 3.82Å; A307-V310 VanDerWaalsContact O-CB 3.27Å; A307-V310 WeakPolarHBondContact O-CB 3.45Å; A307-V310 PolarHBondContact O-N 3.24Å; G308-V310 PolarHBondContact O-N 3.04Å
311	S	97.5	Very high	96.7	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.007	15%	0.152	C	C	.	.	S	Bend	trans	-149.1	169.2	170	76.1	0	0	0	0	109.8	N187 N294 G313 H314 A315 E341	N187-S311 CarbonylContact O-C 3.25Å; N187-S311 WeakPolarHBondContact O-CA 3.35Å; N294-S311 WeakPolarHBondContact ND2-CB 3.47Å; S311-G313 PolarHBondContact O-N 3.4Å; S311-G313 PolarHBondContact OG-N 3.17Å; S311-H314 PolarHBondContact O-N 2.88Å; S311-H314 PolarHBondContact OG-N 2.76Å; S311-H314 PolarHBondContact OG-ND1 3.06Å; S311-A315 PolarHBondContact O-N 3.2Å; S311-E341 WeakPolarHBondContact OG-CB 3.27Å
312	K	97.5	Very high	96.9	Very high	12 Å²	12	27 Å²	27	5%	0.052	16%	0.156	C	C	.	.	H	α-helix	trans	-57.7	-33.3	173	-66.2	-176.4	-171.9	-179.2	0	111.5	A162 N187 L316 N338 D339 M342	A162-K312 HydrophobicContact CB-CB 4.14Å; A162-K312 HydrophobicContact CB-CD 3.88Å; A162-K312 HydrophobicContact CB-CG 4.09Å; A162-K312 PolarHBondContact O-NZ 3.47Å; N187-K312 HydrophobicContact CB-CG 4.5Å; N187-K312 PolarHBondContact O-N 2.82Å; N187-K312 WeakPolarHBondContact OD1-CE 3.4Å; K312-L316 VanDerWaalsContact O-CB 3.28Å; K312-L316 WeakPolarHBondContact O-CB 3.06Å; K312-L316 PolarHBondContact O-N 2.91Å; K312-N338 WeakPolarHBondContact CD-O 3.19Å; K312-N338 WeakPolarHBondContact CE-ND2 3.1Å; K312-N338 PolarHBondContact NZ-ND2 3.33Å; K312-D339 VanDerWaalsContact CD-OD1 3.26Å; K312-D339 WeakPolarHBondContact CD-OD1 3.36Å; K312-D339 WeakPolarHBondContact CE-OD1 3.09Å; K312-D339 IonicContact NZ-OD1 3.52Å; K312-D339 PolarHBondContact NZ-OD1 3.26Å; K312-M342 HydrophobicContact CB-CB 3.94Å; K312-M342 HydrophobicContact CB-CG 4.4Å; K312-M342 HydrophobicContact CB-SD 4.05Å
313	G	97.2	Very high	96.9	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-68.8	-46.6	178	0	0	0	0	0	113.7	S311 A315 L316 E317 M342	S311-G313 PolarHBondContact O-N 3.4Å; S311-G313 PolarHBondContact OG-N 3.17Å; G313-A315 VanDerWaalsContact C-N 3.33Å; G313-A315 PolarHBondContact O-N 3.06Å; G313-L316 WeakPolarHBondContact O-CB 3.04Å; G313-L316 PolarHBondContact O-N 3.49Å; G313-E317 PolarHBondContact O-N 2.84Å; G313-M342 VanDerWaalsContact CA-CA 3.48Å
314	H	97.7	Very high	96.8	Very high	78 Å²	78	32 Å²	32	36%	0.361	20%	0.198	S	C	.	.	H	α-helix	trans	-65	-37.9	176.1	-65.2	97.2	0	0	0	112	G309 S311 E317 A318	G309-H314 WeakPolarHBondContact O-CB 3.14Å; G309-H314 PolarHBondContact O-ND1 3.02Å; S311-H314 PolarHBondContact O-N 2.88Å; S311-H314 PolarHBondContact OG-N 2.76Å; S311-H314 PolarHBondContact OG-ND1 3.06Å; H314-E317 WeakPolarHBondContact O-CB 3.06Å; H314-E317 PolarHBondContact O-N 3.2Å; H314-A318 PolarHBondContact O-N 3.1Å; H314-A318 VanDerWaalsContact O-N 3.08Å
315	A	97.7	Very high	96.7	Very high	2 Å²	2	37.1 Å²	37.1	2%	0.017	22%	0.218	C	C	.	.	H	α-helix	trans	-67.1	-39.4	174	0	0	0	0	0	112.1	I184 V191 F200 S311 G313 E317 A318 V319	I184-A315 HydrophobicContact CB-CB 4.43Å; I184-A315 HydrophobicContact CD1-CB 3.88Å; I184-A315 HydrophobicContact CG1-CB 4.07Å; I184-A315 HydrophobicContact CG2-CB 3.52Å; V191-A315 HydrophobicContact CG2-CB 4.01Å; F200-A315 HydrophobicContact CZ-CB 4.14Å; S311-A315 PolarHBondContact O-N 3.2Å; G313-A315 VanDerWaalsContact C-N 3.33Å; G313-A315 PolarHBondContact O-N 3.06Å; A315-E317 VanDerWaalsContact C-N 3.32Å; A315-E317 PolarHBondContact O-N 2.74Å; A315-A318 PolarHBondContact O-N 3.25Å; A315-V319 WeakPolarHBondContact O-CG2 3.28Å; A315-V319 PolarHBondContact O-N 2.64Å
316	L	97.8	Very high	96.6	Very high	14 Å²	14	39.6 Å²	39.6	7%	0.073	24%	0.235	C	C	.	.	H	α-helix	trans	-61.2	-41.7	173.4	177.7	63.2	0	0	0	111.2	V160 I184 K312 G313 A318 V319 A320 L327 C330 M342	V160-L316 HydrophobicContact CB-CD1 4.24Å; V160-L316 HydrophobicContact CG1-CD1 4.27Å; V160-L316 HydrophobicContact CG2-CD1 4.35Å; I184-L316 HydrophobicContact CD1-CB 4.13Å; K312-L316 VanDerWaalsContact O-CB 3.28Å; K312-L316 WeakPolarHBondContact O-CB 3.06Å; K312-L316 PolarHBondContact O-N 2.91Å; G313-L316 WeakPolarHBondContact O-CB 3.04Å; G313-L316 PolarHBondContact O-N 3.49Å; L316-A318 PolarHBondContact O-N 3.23Å; L316-V319 PolarHBondContact O-N 2.96Å; L316-A320 VanDerWaalsContact O-CB 3.3Å; L316-A320 WeakPolarHBondContact O-CB 3.21Å; L316-A320 PolarHBondContact O-N 3.36Å; L316-L327 HydrophobicContact CD2-CD2 4.28Å; L316-L327 HydrophobicContact CG-CD2 4.18Å; L316-C330 HydrophobicContact CD2-CB 4.19Å; L316-M342 HydrophobicContact CD2-CG 3.82Å
317	E	97.8	Very high	96.6	Very high	60 Å²	60	40.9 Å²	40.9	28%	0.28	24%	0.242	S	C	.	.	H	α-helix	trans	-59	-46.6	175	-171.6	-172.5	-167.4	0	0	111.7	G313 H314 A315 V319 A320 K321 L327 M345	G313-E317 PolarHBondContact O-N 2.84Å; H314-E317 WeakPolarHBondContact O-CB 3.06Å; H314-E317 PolarHBondContact O-N 3.2Å; A315-E317 VanDerWaalsContact C-N 3.32Å; A315-E317 PolarHBondContact O-N 2.74Å; E317-V319 PolarHBondContact O-N 3.16Å; E317-A320 PolarHBondContact O-N 3.29Å; E317-K321 HydrophobicContact CG-CD 4.33Å; E317-K321 WeakPolarHBondContact O-CG 3.39Å; E317-K321 PolarHBondContact O-N 2.88Å; E317-K321 VanDerWaalsContact OE1-CE 3.28Å; E317-K321 WeakPolarHBondContact OE1-CE 3.12Å; E317-K321 IonicContact OE1-NZ 2.95Å; E317-K321 PolarHBondContact OE1-NZ 3.44Å; E317-K321 IonicContact OE2-NZ 2.87Å; E317-L327 HydrophobicContact CB-CD1 3.88Å; E317-L327 HydrophobicContact CB-CD2 4Å; E317-L327 HydrophobicContact CB-CG 3.95Å; E317-L327 HydrophobicContact CG-CD1 3.75Å; E317-L327 HydrophobicContact CG-CG 3.93Å; E317-M345 HydrophobicContact CB-CE 4.44Å
318	A	96.7	Very high	96.5	Very high	39 Å²	39	49.1 Å²	49.1	32%	0.322	28%	0.276	S	S	.	.	H	α-helix	trans	-62.5	-42.4	178.1	0	0	0	0	0	112	F200 H314 A315 L316 K322	F200-A318 HydrophobicContact CE1-CB 3.86Å; F200-A318 HydrophobicContact CZ-CB 4.35Å; H314-A318 PolarHBondContact O-N 3.1Å; H314-A318 VanDerWaalsContact O-N 3.08Å; A315-A318 PolarHBondContact O-N 3.25Å; L316-A318 PolarHBondContact O-N 3.23Å; A318-K322 WeakPolarHBondContact O-CB 3.19Å; A318-K322 PolarHBondContact O-N 3.11Å; A318-K322 VanDerWaalsContact O-N 3.09Å
319	V	96.4	Very high	96.5	Very high	2 Å²	2	52.6 Å²	52.6	1%	0.012	29%	0.287	C	S	.	.	H	α-helix	trans	-65.6	-45.5	176.2	173.4	0	0	0	0	111.3	V160 Y182 I184 V191 A315 L316 E317 K321 K322 L323	V160-V319 HydrophobicContact CG1-CG1 4.09Å; V160-V319 HydrophobicContact CG2-CG1 3.62Å; Y182-V319 HydrophobicContact CD1-CG1 3.9Å; Y182-V319 HydrophobicContact CD1-CG2 4.16Å; Y182-V319 HydrophobicContact CD2-CG1 4.05Å; Y182-V319 HydrophobicContact CE1-CG1 4.49Å; Y182-V319 HydrophobicContact CG-CG1 3.65Å; I184-V319 HydrophobicContact CD1-CG2 4.31Å; I184-V319 HydrophobicContact CG1-CG2 4.23Å; V191-V319 HydrophobicContact CG1-CG2 3.56Å; V191-V319 HydrophobicContact CG2-CG2 4.31Å; A315-V319 WeakPolarHBondContact O-CG2 3.28Å; A315-V319 PolarHBondContact O-N 2.64Å; L316-V319 PolarHBondContact O-N 2.96Å; E317-V319 PolarHBondContact O-N 3.16Å; V319-K321 PolarHBondContact O-N 3.49Å; V319-K322 PolarHBondContact O-N 3.28Å; V319-K322 VanDerWaalsContact O-N 3.17Å; V319-L323 HydrophobicContact CG1-CD1 4.01Å; V319-L323 PolarHBondContact O-N 3.27Å
320	A	96.4	Very high	96.5	Very high	5 Å²	5	51.3 Å²	51.3	4%	0.041	27%	0.269	C	S	.	.	H	α-helix	trans	-59.3	-47	178.6	0	0	0	0	0	111.2	L316 E317 K322 L323 G324 Y325	L316-A320 VanDerWaalsContact O-CB 3.3Å; L316-A320 WeakPolarHBondContact O-CB 3.21Å; L316-A320 PolarHBondContact O-N 3.36Å; E317-A320 PolarHBondContact O-N 3.29Å; A320-K322 VanDerWaalsContact C-N 3.32Å; A320-K322 PolarHBondContact O-N 3.25Å; A320-L323 CarbonylContact O-C 3.56Å; A320-L323 PolarHBondContact O-N 3.37Å; A320-L323 VanDerWaalsContact O-N 3.09Å; A320-G324 PolarHBondContact O-N 3.18Å; A320-G324 VanDerWaalsContact O-N 3.15Å; A320-Y325 CarbonylContact C-O 3.53Å; A320-Y325 VanDerWaalsContact C-O 3.25Å; A320-Y325 PolarHBondContact O-N 3.19Å; A320-Y325 VanDerWaalsContact O-O 3.13Å
321	K	96.2	Very high	96.4	Very high	129 Å²	129	55.8 Å²	55.8	56%	0.561	29%	0.292	S	S	*	.	H	α-helix	trans	-58.1	-42.7	175	-75	174.1	-175.8	164.8	0	112	E317 V319 L323 G324 Y325	E317-K321 HydrophobicContact CG-CD 4.33Å; E317-K321 WeakPolarHBondContact O-CG 3.39Å; E317-K321 PolarHBondContact O-N 2.88Å; E317-K321 VanDerWaalsContact OE1-CE 3.28Å; E317-K321 WeakPolarHBondContact OE1-CE 3.12Å; E317-K321 IonicContact OE1-NZ 2.95Å; E317-K321 PolarHBondContact OE1-NZ 3.44Å; E317-K321 IonicContact OE2-NZ 2.87Å; V319-K321 PolarHBondContact O-N 3.49Å; K321-L323 VanDerWaalsContact C-N 3.27Å; K321-L323 PolarHBondContact O-N 2.88Å; K321-G324 PolarHBondContact O-N 2.95Å; K321-Y325 WeakPolarHBondContact CA-O 3.46Å; K321-Y325 PolarHBondContact N-O 3.43Å
322	K	93.9	Very high	96.3	Very high	105 Å²	105	56 Å²	56	46%	0.457	29%	0.294	S	S	.	.	H	α-helix	trans	-65.6	-29.7	177.9	-169.1	166.2	-176.6	-99.3	0	112.8	Y182 I199 A318 V319 A320 G324	Y182-K322 HydrophobicContact CE1-CD 4.47Å; Y182-K322 PolarHBondContact OH-NZ 2.92Å; I199-K322 HydrophobicContact CG2-CD 4.02Å; A318-K322 WeakPolarHBondContact O-CB 3.19Å; A318-K322 PolarHBondContact O-N 3.11Å; A318-K322 VanDerWaalsContact O-N 3.09Å; V319-K322 PolarHBondContact O-N 3.28Å; V319-K322 VanDerWaalsContact O-N 3.17Å; A320-K322 VanDerWaalsContact C-N 3.32Å; A320-K322 PolarHBondContact O-N 3.25Å; K322-G324 VanDerWaalsContact C-N 3.3Å
323	L	92.4	Very high	96.1	Very high	48 Å²	48	60.1 Å²	60.1	25%	0.251	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-2.3	173	-72.9	171.6	0	0	0	113.7	N158 Y182 V319 A320 K321 Y325	N158-L323 HydrophobicContact CB-CD1 4.14Å; Y182-L323 HydrophobicContact CD2-CD1 4.22Å; Y182-L323 HydrophobicContact CD2-CD2 4.36Å; Y182-L323 HydrophobicContact CD2-CG 4.46Å; Y182-L323 HydrophobicContact CE2-CD1 4.25Å; Y182-L323 HydrophobicContact CE2-CD2 3.65Å; Y182-L323 HydrophobicContact CE2-CG 3.99Å; V319-L323 HydrophobicContact CG1-CD1 4.01Å; V319-L323 PolarHBondContact O-N 3.27Å; A320-L323 CarbonylContact O-C 3.56Å; A320-L323 PolarHBondContact O-N 3.37Å; A320-L323 VanDerWaalsContact O-N 3.09Å; K321-L323 VanDerWaalsContact C-N 3.27Å; K321-L323 PolarHBondContact O-N 2.88Å; L323-Y325 HydrophobicContact CB-CD2 3.67Å; L323-Y325 HydrophobicContact CB-CE2 4.09Å; L323-Y325 WeakPolarHBondContact O-CD2 3.49Å; L323-Y325 WeakPolarHBondContact O-CE2 3.23Å
324	G	94.8	Very high	95.8	Very high	69 Å²	69	60.2 Å²	60.2	71%	0.711	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.7	16.7	-178.2	0	0	0	0	0	114.7	A320 K321 K322	A320-G324 PolarHBondContact O-N 3.18Å; A320-G324 VanDerWaalsContact O-N 3.15Å; K321-G324 PolarHBondContact O-N 2.95Å; K322-G324 VanDerWaalsContact C-N 3.3Å
325	Y	96.5	Very high	95.4	Very high	118 Å²	118	59.4 Å²	59.4	46%	0.463	31%	0.312	S	S	.	.			trans	-113.4	173.5	178.5	-60.3	-72.2	0	0	0	112.1	N158 A320 K321 L323 D329	N158-Y325 WeakPolarHBondContact ND2-CE2 3.46Å; A320-Y325 CarbonylContact C-O 3.53Å; A320-Y325 VanDerWaalsContact C-O 3.25Å; A320-Y325 PolarHBondContact O-N 3.19Å; A320-Y325 VanDerWaalsContact O-O 3.13Å; K321-Y325 WeakPolarHBondContact CA-O 3.46Å; K321-Y325 PolarHBondContact N-O 3.43Å; L323-Y325 HydrophobicContact CB-CD2 3.67Å; L323-Y325 HydrophobicContact CB-CE2 4.09Å; L323-Y325 WeakPolarHBondContact O-CD2 3.49Å; L323-Y325 WeakPolarHBondContact O-CE2 3.23Å; Y325-D329 HydrophobicContact CD1-CB 4.16Å; Y325-D329 HydrophobicContact CG-CB 4.4Å
326	S	96.7	Very high	95	Very high	51 Å²	51	59.5 Å²	59.5	36%	0.357	31%	0.313	S	S	.	.			trans	-112.8	168.4	171	74.4	0	0	0	0	110.9	K328 D329	S326-K328 PolarHBondContact O-N 3.46Å; S326-K328 VanDerWaalsContact O-N 3.14Å; S326-K328 PolarHBondContact OG-N 3.01Å; S326-D329 WeakPolarHBondContact CA-OD2 3.37Å; S326-D329 WeakPolarHBondContact CB-OD2 3.07Å; S326-D329 PolarHBondContact N-OD2 3.42Å; S326-D329 WeakPolarHBondContact O-CB 3.17Å; S326-D329 PolarHBondContact O-N 2.95Å; S326-D329 PolarHBondContact OG-OD2 3.48Å
327	L	96.8	Very high	94.8	Very high	29 Å²	29	59.6 Å²	59.6	15%	0.152	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-57.9	-26.5	173	-77.3	166.9	0	0	0	113.1	L316 E317 D329 C330 M345 G347	L316-L327 HydrophobicContact CD2-CD2 4.28Å; L316-L327 HydrophobicContact CG-CD2 4.18Å; E317-L327 HydrophobicContact CB-CD1 3.88Å; E317-L327 HydrophobicContact CB-CD2 4Å; E317-L327 HydrophobicContact CB-CG 3.95Å; E317-L327 HydrophobicContact CG-CD1 3.75Å; E317-L327 HydrophobicContact CG-CG 3.93Å; L327-D329 PolarHBondContact O-N 3.23Å; L327-C330 WeakPolarHBondContact O-CB 3.33Å; L327-C330 PolarHBondContact O-N 2.93Å; L327-M345 WeakPolarHBondContact CB-O 3.39Å; L327-M345 HydrophobicContact CD1-CB 4.03Å; L327-M345 HydrophobicContact CD1-CE 3.89Å; L327-M345 HydrophobicContact CD2-CB 4.42Å; L327-G347 PolarHBondContact O-N 2.8Å
328	K	96.6	Very high	94.6	Very high	182 Å²	182	57.3 Å²	57.3	79%	0.791	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-64.4	-23.3	177	-64.3	-176.5	178.1	179.7	0	112.8	S326 C330	S326-K328 PolarHBondContact O-N 3.46Å; S326-K328 VanDerWaalsContact O-N 3.14Å; S326-K328 PolarHBondContact OG-N 3.01Å; K328-C330 VanDerWaalsContact C-N 3.29Å
329	D	95.7	Very high	94.6	Very high	103 Å²	103	55.8 Å²	55.8	55%	0.551	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-87.1	-2.1	178.2	-50.7	-66.5	0	0	0	112	Y325 S326 L327	Y325-D329 HydrophobicContact CD1-CB 4.16Å; Y325-D329 HydrophobicContact CG-CB 4.4Å; S326-D329 WeakPolarHBondContact CA-OD2 3.37Å; S326-D329 WeakPolarHBondContact CB-OD2 3.07Å; S326-D329 PolarHBondContact N-OD2 3.42Å; S326-D329 WeakPolarHBondContact O-CB 3.17Å; S326-D329 PolarHBondContact O-N 2.95Å; S326-D329 PolarHBondContact OG-OD2 3.48Å; L327-D329 PolarHBondContact O-N 3.23Å
330	C	96.6	Very high	94.6	Very high	24 Å²	24	56 Å²	56	16%	0.162	29%	0.291	C	S	.	.			trans	-98	136	-177.9	-57.5	0	0	0	0	112.3	L316 L327 K328 A346 G347 K348	L316-C330 HydrophobicContact CD2-CB 4.19Å; L327-C330 WeakPolarHBondContact O-CB 3.33Å; L327-C330 PolarHBondContact O-N 2.93Å; K328-C330 VanDerWaalsContact C-N 3.29Å; C330-A346 HydrophobicContact CB-CB 4.19Å; C330-G347 PolarHBondContact O-N 3.3Å; C330-G347 VanDerWaalsContact O-N 3.1Å; C330-K348 PolarHBondContact O-N 2.74Å
331	I	95.5	Very high	94.6	Very high	100 Å²	100	57.8 Å²	57.8	51%	0.513	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	129.2	160.4	-176	168.5	0	0	0	108.9	F333 K348	I331-F333 HydrophobicContact CD1-CE1 4.32Å; I331-F333 HydrophobicContact CD1-CE2 4.08Å; I331-F333 HydrophobicContact CD1-CZ 3.56Å; I331-F333 HydrophobicContact CG1-CE2 3.8Å; I331-F333 HydrophobicContact CG1-CZ 3.75Å; I331-F333 HydrophobicContact CG2-CE2 4.17Å; I331-K348 CarbonylContact C-O 3.47Å; I331-K348 VanDerWaalsContact CA-O 3.3Å; I331-K348 WeakPolarHBondContact CA-O 3.46Å; I331-K348 HydrophobicContact CB-CB 4.27Å; I331-K348 HydrophobicContact CD1-CB 4.44Å; I331-K348 HydrophobicContact CD1-CG 3.97Å; I331-K348 HydrophobicContact CG1-CB 4.03Å; I331-K348 HydrophobicContact CG1-CG 3.94Å
332	A	95.7	Very high	94.7	Very high	5 Å²	5	52.2 Å²	52.2	4%	0.041	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	144.7	-176.4	0	0	0	0	0	111.7	M342 L343 A346 K348 C350	A332-M342 HydrophobicContact CB-CE 4.45Å; A332-M342 HydrophobicContact CB-CG 3.93Å; A332-M342 HydrophobicContact CB-SD 4.48Å; A332-L343 HydrophobicContact CB-CD2 4.05Å; A332-L343 WeakPolarHBondContact O-CD2 3.31Å; A332-A346 HydrophobicContact CB-CB 3.63Å; A332-K348 PolarHBondContact N-O 2.83Å; A332-C350 PolarHBondContact O-N 3.14Å
333	F	93.7	Very high	94.8	Very high	99 Å²	99	47.2 Å²	47.2	43%	0.434	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	136.7	179.8	-55.7	-93.3	0	0	0	109.6	I331 M342 C350 I369	I331-F333 HydrophobicContact CD1-CE1 4.32Å; I331-F333 HydrophobicContact CD1-CE2 4.08Å; I331-F333 HydrophobicContact CD1-CZ 3.56Å; I331-F333 HydrophobicContact CG1-CE2 3.8Å; I331-F333 HydrophobicContact CG1-CZ 3.75Å; I331-F333 HydrophobicContact CG2-CE2 4.17Å; F333-M342 WeakPolarHBondContact O-CE 3.48Å; F333-C350 WeakPolarHBondContact CA-O 3.47Å; F333-C350 HydrophobicContact CD1-CB 3.6Å; F333-C350 HydrophobicContact CE1-CB 3.87Å; F333-C350 HydrophobicContact CG-CB 4.41Å; F333-I369 HydrophobicContact CD1-CD1 4.01Å; F333-I369 HydrophobicContact CE1-CD1 3.71Å
334	G	90.2	Very high	95.1	Very high	3 Å²	3	47.7 Å²	47.7	3%	0.031	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.2	162.8	-174.1	0	0	0	0	0	114.1	D339 C350 M352	G334-D339 WeakPolarHBondContact CA-OD2 3.27Å; G334-C350 PolarHBondContact N-O 3.42Å; G334-M352 WeakPolarHBondContact O-CG 3.4Å; G334-M352 PolarHBondContact O-N 3.15Å
335	D	89.7	Confident	95.2	Very high	60 Å²	60	46.8 Å²	46.8	32%	0.321	24%	0.238	S	C	.	.			trans	-139	-15.7	-172.7	83.9	-47.1	0	0	0	115.6	D339 M352 A355 H356	D335-D339 PolarHBondContact N-OD2 3.38Å; D335-M352 HydrophobicContact CB-CB 3.87Å; D335-M352 HydrophobicContact CB-CG 3.97Å; D335-A355 HydrophobicContact CB-CB 3.87Å; D335-A355 VanDerWaalsContact O-CA 3.29Å; D335-A355 WeakPolarHBondContact O-CA 3.29Å; D335-A355 VanDerWaalsContact O-CB 3.29Å; D335-A355 WeakPolarHBondContact O-CB 3.1Å; D335-H356 PolarHBondContact O-N 3.41Å
336	G	89.1	Confident	95.2	Very high	4 Å²	4	41.7 Å²	41.7	4%	0.041	22%	0.22	C	C	.	.	S	Bend	trans	-103.5	169.5	179.4	0	0	0	0	0	113.9	N338 D339 L359	G336-N338 VanDerWaalsContact C-N 3.25Å; G336-N338 PolarHBondContact O-N 2.81Å; G336-D339 PolarHBondContact N-OD2 3.4Å; G336-D339 WeakPolarHBondContact O-CB 3.39Å; G336-D339 PolarHBondContact O-N 3.49Å; G336-D339 VanDerWaalsContact O-N 3.15Å; G336-L359 WeakPolarHBondContact O-CD2 3.49Å
337	M	94.4	Very high	95.2	Very high	17 Å²	17	41.6 Å²	41.6	8%	0.084	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-67.7	-29.3	176.3	-67.4	-62.5	-54.6	0	0	112.1	F297 D339 A340 R358 L359 L362	F297-M337 HydrophobicContact CB-CB 4.38Å; F297-M337 HydrophobicContact CB-CG 4.36Å; F297-M337 VanDerWaalsContact O-CB 3.28Å; F297-M337 WeakPolarHBondContact O-CB 3.37Å; F297-M337 PolarHBondContact O-N 3.17Å; M337-D339 PolarHBondContact O-N 3.47Å; M337-D339 VanDerWaalsContact O-N 3.15Å; M337-A340 WeakPolarHBondContact O-CB 3.41Å; M337-A340 PolarHBondContact O-N 2.98Å; M337-R358 HydrophobicContact CE-CG 4.01Å; M337-R358 VanDerWaalsContact SD-C 3.59Å; M337-R358 HydrophobicContact SD-CB 3.67Å; M337-R358 HydrophobicContact SD-CG 3.59Å; M337-R358 VanDerWaalsContact SD-CG 3.59Å; M337-L359 HydrophobicContact SD-CB 3.95Å; M337-L359 PolarHBondContact SD-N 3.43Å; M337-L359 VanDerWaalsContact SD-N 3.39Å; M337-L362 HydrophobicContact CE-CD2 3.74Å
338	N	93.1	Very high	95.1	Very high	12 Å²	12	44.3 Å²	44.3	6%	0.064	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-67.6	-3.2	172.9	61.8	-31.5	0	0	0	114.5	N187 F297 K312 G336	N187-N338 PolarHBondContact OD1-ND2 3.01Å; F297-N338 PolarHBondContact O-N 2.63Å; K312-N338 WeakPolarHBondContact CD-O 3.19Å; K312-N338 WeakPolarHBondContact CE-ND2 3.1Å; K312-N338 PolarHBondContact NZ-ND2 3.33Å; G336-N338 VanDerWaalsContact C-N 3.25Å; G336-N338 PolarHBondContact O-N 2.81Å
339	D	95.7	Very high	95.1	Very high	7 Å²	7	35.8 Å²	35.8	4%	0.037	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-97.4	-9.8	170.9	-60.3	-48.8	0	0	0	112.8	K312 G334 D335 G336 M337 E341 M342 L343	K312-D339 VanDerWaalsContact CD-OD1 3.26Å; K312-D339 WeakPolarHBondContact CD-OD1 3.36Å; K312-D339 WeakPolarHBondContact CE-OD1 3.09Å; K312-D339 IonicContact NZ-OD1 3.52Å; K312-D339 PolarHBondContact NZ-OD1 3.26Å; G334-D339 WeakPolarHBondContact CA-OD2 3.27Å; D335-D339 PolarHBondContact N-OD2 3.38Å; G336-D339 PolarHBondContact N-OD2 3.4Å; G336-D339 WeakPolarHBondContact O-CB 3.39Å; G336-D339 PolarHBondContact O-N 3.49Å; G336-D339 VanDerWaalsContact O-N 3.15Å; M337-D339 PolarHBondContact O-N 3.47Å; M337-D339 VanDerWaalsContact O-N 3.15Å; D339-E341 PolarHBondContact O-N 2.71Å; D339-M342 HydrophobicContact CB-CE 4.21Å; D339-M342 WeakPolarHBondContact O-CB 3.45Å; D339-M342 PolarHBondContact O-N 3.07Å; D339-M342 VanDerWaalsContact O-N 3.09Å; D339-L343 HydrophobicContact CB-CD1 3.98Å; D339-L343 HydrophobicContact CB-CG 4.19Å; D339-L343 WeakPolarHBondContact O-CB 3.42Å; D339-L343 VanDerWaalsContact O-CG 3.26Å; D339-L343 WeakPolarHBondContact O-CG 3.37Å; D339-L343 PolarHBondContact O-N 3.38Å
340	A	96.4	Very high	94.9	Very high	6 Å²	6	31 Å²	31	5%	0.05	18%	0.177	C	C	.	.	H	α-helix	trans	-53	-52.4	-170.5	0	0	0	0	0	112.3	M337 M342 L343 S344 L359 L362	M337-A340 WeakPolarHBondContact O-CB 3.41Å; M337-A340 PolarHBondContact O-N 2.98Å; A340-M342 PolarHBondContact O-N 3.49Å; A340-L343 PolarHBondContact O-N 3.18Å; A340-S344 PolarHBondContact O-N 2.96Å; A340-S344 PolarHBondContact O-OG 3.05Å; A340-L359 HydrophobicContact CB-CD1 3.77Å; A340-L362 HydrophobicContact CB-CD2 4.03Å
341	E	96.9	Very high	94.6	Very high	42 Å²	42	29.9 Å²	29.9	20%	0.196	17%	0.169	C	C	.	.	H	α-helix	trans	-66.2	-39.2	-179.4	-53.7	94.5	137.1	0	0	111.5	N294 S311 D339 L343 S344 M345	N294-E341 PolarHBondContact ND2-OE1 3.34Å; N294-E341 PolarHBondContact OD1-OE1 2.92Å; S311-E341 WeakPolarHBondContact OG-CB 3.27Å; D339-E341 PolarHBondContact O-N 2.71Å; E341-L343 VanDerWaalsContact C-N 3.31Å; E341-L343 PolarHBondContact O-N 2.86Å; E341-S344 PolarHBondContact O-N 3.01Å; E341-S344 PolarHBondContact O-OG 3.09Å; E341-M345 HydrophobicContact CB-SD 3.98Å; E341-M345 WeakPolarHBondContact O-CB 3.41Å; E341-M345 WeakPolarHBondContact O-CG 3.42Å; E341-M345 PolarHBondContact O-N 3.33Å
342	M	97.5	Very high	94.2	Very high	13 Å²	13	25.6 Å²	25.6	6%	0.064	15%	0.147	C	C	.	.	H	α-helix	trans	-61.1	-42.9	177.5	-175.1	-178.4	62.2	0	0	111.5	A162 K312 G313 L316 A332 F333 D339 A340 A346	A162-M342 HydrophobicContact CB-SD 3.79Å; K312-M342 HydrophobicContact CB-CB 3.94Å; K312-M342 HydrophobicContact CB-CG 4.4Å; K312-M342 HydrophobicContact CB-SD 4.05Å; G313-M342 VanDerWaalsContact CA-CA 3.48Å; L316-M342 HydrophobicContact CD2-CG 3.82Å; A332-M342 HydrophobicContact CB-CE 4.45Å; A332-M342 HydrophobicContact CB-CG 3.93Å; A332-M342 HydrophobicContact CB-SD 4.48Å; F333-M342 WeakPolarHBondContact O-CE 3.48Å; D339-M342 HydrophobicContact CB-CE 4.21Å; D339-M342 WeakPolarHBondContact O-CB 3.45Å; D339-M342 PolarHBondContact O-N 3.07Å; D339-M342 VanDerWaalsContact O-N 3.09Å; A340-M342 PolarHBondContact O-N 3.49Å; M342-A346 VanDerWaalsContact O-CB 3.29Å; M342-A346 WeakPolarHBondContact O-CB 3.17Å; M342-A346 PolarHBondContact O-N 3.38Å
343	L	97.6	Very high	93.4	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-71.2	-40.5	-179.1	-66.4	175.4	0	0	0	112.1	A332 D339 A340 E341 G349 C350 I351 L359 L366	A332-L343 HydrophobicContact CB-CD2 4.05Å; A332-L343 WeakPolarHBondContact O-CD2 3.31Å; D339-L343 HydrophobicContact CB-CD1 3.98Å; D339-L343 HydrophobicContact CB-CG 4.19Å; D339-L343 WeakPolarHBondContact O-CB 3.42Å; D339-L343 VanDerWaalsContact O-CG 3.26Å; D339-L343 WeakPolarHBondContact O-CG 3.37Å; D339-L343 PolarHBondContact O-N 3.38Å; A340-L343 PolarHBondContact O-N 3.18Å; E341-L343 VanDerWaalsContact C-N 3.31Å; E341-L343 PolarHBondContact O-N 2.86Å; L343-G349 VanDerWaalsContact O-CA 3.26Å; L343-G349 WeakPolarHBondContact O-CA 3.48Å; L343-C350 WeakPolarHBondContact CD2-O 3.17Å; L343-I351 HydrophobicContact CD1-CG1 3.95Å; L343-L359 HydrophobicContact CD1-CD1 4.35Å; L343-L359 HydrophobicContact CD1-CD2 3.92Å; L343-L366 HydrophobicContact CB-CD1 3.67Å
344	S	97.1	Very high	92.5	Very high	58 Å²	58	22.1 Å²	22.1	41%	0.406	14%	0.137	S	C	.	.	H	α-helix	trans	-77.2	-28.9	179.4	66.2	0	0	0	0	113.5	A340 E341 H363	A340-S344 PolarHBondContact O-N 2.96Å; A340-S344 PolarHBondContact O-OG 3.05Å; E341-S344 PolarHBondContact O-N 3.01Å; E341-S344 PolarHBondContact O-OG 3.09Å; S344-H363 VanDerWaalsContact CB-CE1 3.44Å; S344-H363 WeakPolarHBondContact CB-CE1 3.24Å
345	M	97.4	Very high	92.2	Very high	50 Å²	50	22.3 Å²	22.3	25%	0.246	14%	0.138	C	C	.	.	H	α-helix	trans	-82.4	-31.9	-179.2	-70.3	169.5	67.6	0	0	112.8	E317 L327 E341	E317-M345 HydrophobicContact CB-CE 4.44Å; L327-M345 WeakPolarHBondContact CB-O 3.39Å; L327-M345 HydrophobicContact CD1-CB 4.03Å; L327-M345 HydrophobicContact CD1-CE 3.89Å; L327-M345 HydrophobicContact CD2-CB 4.42Å; E341-M345 HydrophobicContact CB-SD 3.98Å; E341-M345 WeakPolarHBondContact O-CB 3.41Å; E341-M345 WeakPolarHBondContact O-CG 3.42Å; E341-M345 PolarHBondContact O-N 3.33Å
346	A	97.2	Very high	91.9	Very high	10 Å²	10	22.5 Å²	22.5	8%	0.083	14%	0.136	C	C	.	.	S	Bend	trans	-65.8	150.8	179.3	0	0	0	0	0	112	C330 A332 M342 K348	C330-A346 HydrophobicContact CB-CB 4.19Å; A332-A346 HydrophobicContact CB-CB 3.63Å; M342-A346 VanDerWaalsContact O-CB 3.29Å; M342-A346 WeakPolarHBondContact O-CB 3.17Å; M342-A346 PolarHBondContact O-N 3.38Å; A346-K348 PolarHBondContact O-N 3.4Å; A346-K348 VanDerWaalsContact O-N 3.17Å
347	G	96.1	Very high	91.9	Very high	49 Å²	49	27.3 Å²	27.3	51%	0.505	16%	0.158	S	C	.	.	S	Bend	trans	-57.5	-30.4	176	0	0	0	0	0	113	L327 C330	L327-G347 PolarHBondContact O-N 2.8Å; C330-G347 PolarHBondContact O-N 3.3Å; C330-G347 VanDerWaalsContact O-N 3.1Å
348	K	95.7	Very high	91.8	Very high	87 Å²	87	30.9 Å²	30.9	38%	0.378	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	109	169.1	-179.8	64.2	176.1	-178.4	0	111	C330 I331 A332 A346 E367	C330-K348 PolarHBondContact O-N 2.74Å; I331-K348 CarbonylContact C-O 3.47Å; I331-K348 VanDerWaalsContact CA-O 3.3Å; I331-K348 WeakPolarHBondContact CA-O 3.46Å; I331-K348 HydrophobicContact CB-CB 4.27Å; I331-K348 HydrophobicContact CD1-CB 4.44Å; I331-K348 HydrophobicContact CD1-CG 3.97Å; I331-K348 HydrophobicContact CG1-CB 4.03Å; I331-K348 HydrophobicContact CG1-CG 3.94Å; A332-K348 PolarHBondContact N-O 2.83Å; A346-K348 PolarHBondContact O-N 3.4Å; A346-K348 VanDerWaalsContact O-N 3.17Å; K348-E367 VanDerWaalsContact CE-OE2 3.28Å; K348-E367 WeakPolarHBondContact CE-OE2 3.46Å; K348-E367 IonicContact NZ-OE2 2.7Å; K348-E367 PolarHBondContact NZ-OE2 3.42Å
349	G	95.2	Very high	91.7	Very high	3 Å²	3	30.3 Å²	30.3	3%	0.031	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	133.2	169.8	0	0	0	0	0	112.7	L343	L343-G349 VanDerWaalsContact O-CA 3.26Å; L343-G349 WeakPolarHBondContact O-CA 3.48Å
350	C	92.7	Very high	91.6	Very high	3 Å²	3	31.9 Å²	31.9	2%	0.02	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	114.8	178.6	-67.7	0	0	0	0	110.7	A332 F333 G334 L343 E367 I369	A332-C350 PolarHBondContact O-N 3.14Å; F333-C350 WeakPolarHBondContact CA-O 3.47Å; F333-C350 HydrophobicContact CD1-CB 3.6Å; F333-C350 HydrophobicContact CE1-CB 3.87Å; F333-C350 HydrophobicContact CG-CB 4.41Å; G334-C350 PolarHBondContact N-O 3.42Å; L343-C350 WeakPolarHBondContact CD2-O 3.17Å; C350-E367 CarbonylContact C-O 3.53Å; C350-E367 WeakPolarHBondContact CA-O 2.94Å; C350-I369 HydrophobicContact CB-CD1 3.48Å; C350-I369 VanDerWaalsContact CB-CD1 3.48Å; C350-I369 HydrophobicContact CB-CG1 3.99Å
351	I	90.8	Very high	91.5	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	130.7	177.5	-63.7	172.5	0	0	0	109.3	L343 A355 L359 K360 H363 L366 E367 V368 I369	L343-I351 HydrophobicContact CD1-CG1 3.95Å; I351-A355 HydrophobicContact CG2-CB 3.44Å; I351-A355 VanDerWaalsContact CG2-CB 3.44Å; I351-L359 HydrophobicContact CD1-CG 4.35Å; I351-L359 HydrophobicContact CG1-CD2 4.4Å; I351-L359 HydrophobicContact CG1-CG 4.5Å; I351-L359 HydrophobicContact CG2-CD2 4.13Å; I351-K360 HydrophobicContact CG2-CG 3.8Å; I351-H363 HydrophobicContact CD1-CB 4.16Å; I351-L366 HydrophobicContact CD1-CB 3.83Å; I351-L366 HydrophobicContact CD1-CD1 4.17Å; I351-L366 HydrophobicContact CG1-CB 4.06Å; I351-L366 HydrophobicContact CG1-CD1 4.2Å; I351-E367 PolarHBondContact N-O 3.14Å; I351-V368 HydrophobicContact CB-CG2 4.31Å; I351-V368 CarbonylContact O-C 3.58Å; I351-V368 VanDerWaalsContact O-CA 3.32Å; I351-V368 WeakPolarHBondContact O-CA 3.45Å; I351-I369 PolarHBondContact O-N 3.27Å
352	M	87.2	Confident	91.4	Very high	9 Å²	9	39.1 Å²	39.1	4%	0.044	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64	139.8	174.4	-59.5	-53	-65	0	0	110.8	T133 G334 D335 S354 A355 V371	T133-M352 HydrophobicContact CG2-CE 4.21Å; T133-M352 HydrophobicContact CG2-CG 4.02Å; T133-M352 HydrophobicContact CG2-SD 4.05Å; T133-M352 VanDerWaalsContact N-CE 3.33Å; G334-M352 WeakPolarHBondContact O-CG 3.4Å; G334-M352 PolarHBondContact O-N 3.15Å; D335-M352 HydrophobicContact CB-CB 3.87Å; D335-M352 HydrophobicContact CB-CG 3.97Å; M352-S354 PolarHBondContact O-N 3.49Å; M352-A355 HydrophobicContact CB-CB 4.43Å; M352-A355 WeakPolarHBondContact O-CB 3.39Å; M352-A355 PolarHBondContact O-N 2.91Å; M352-V371 HydrophobicContact CE-CG2 4.05Å
353	G	78.4	Confident	91.3	Very high	13 Å²	13	39.8 Å²	39.8	13%	0.134	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-24.5	176.5	0	0	0	0	0	112.9	K360 I369	G353-K360 PolarHBondContact O-NZ 3.23Å; G353-I369 WeakPolarHBondContact CA-O 3.42Å; G353-I369 PolarHBondContact N-O 2.84Å
354	S	75.2	Confident	91	Very high	19 Å²	19	44.6 Å²	44.6	13%	0.133	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-3.3	178.4	73.7	0	0	0	0	114.7	M352 Q373 R376	M352-S354 PolarHBondContact O-N 3.49Å; S354-Q373 VanDerWaalsContact CA-NE2 3.32Å; S354-R376 VanDerWaalsContact CB-NH2 3.31Å; S354-R376 PolarHBondContact O-NH1 3.42Å; S354-R376 PolarHBondContact OG-NH2 2.96Å
355	A	84	Confident	90.9	Very high	7 Å²	7	48 Å²	48	6%	0.058	26%	0.256	C	S	.	.	S	Bend	trans	-63.2	157.2	-176.4	0	0	0	0	0	113.8	D335 I351 M352 L359 K360	D335-A355 HydrophobicContact CB-CB 3.87Å; D335-A355 VanDerWaalsContact O-CA 3.29Å; D335-A355 WeakPolarHBondContact O-CA 3.29Å; D335-A355 VanDerWaalsContact O-CB 3.29Å; D335-A355 WeakPolarHBondContact O-CB 3.1Å; I351-A355 HydrophobicContact CG2-CB 3.44Å; I351-A355 VanDerWaalsContact CG2-CB 3.44Å; M352-A355 HydrophobicContact CB-CB 4.43Å; M352-A355 WeakPolarHBondContact O-CB 3.39Å; M352-A355 PolarHBondContact O-N 2.91Å; A355-L359 HydrophobicContact CB-CD2 4.1Å; A355-K360 PolarHBondContact O-NZ 3.18Å
356	H	83.3	Confident	90.7	Very high	63 Å²	63	47 Å²	47	29%	0.292	25%	0.252	S	S	.	.			trans	-55.7	136.5	177.5	-159.4	-98.2	0	0	0	111.1	L300 D335 R358 L359 K360	L300-H356 WeakPolarHBondContact CD2-NE2 3.44Å; L300-H356 WeakPolarHBondContact CG-NE2 3.24Å; D335-H356 PolarHBondContact O-N 3.41Å; H356-R358 VanDerWaalsContact ND1-CB 3.32Å; H356-R358 WeakPolarHBondContact ND1-CB 3.41Å; H356-R358 PolarHBondContact ND1-N 2.87Å; H356-R358 PolarHBondContact O-N 2.88Å; H356-L359 WeakPolarHBondContact O-CB 3.03Å; H356-L359 PolarHBondContact O-N 2.67Å; H356-K360 PolarHBondContact O-N 2.96Å
357	Q	89	Confident	90.3	Very high	106 Å²	106	51.2 Å²	51.2	50%	0.495	27%	0.27	S	S	.	.	H	α-helix	trans	-61.3	-37.1	-175.7	-171.5	59.9	49.9	0	0	111.4	L359 K360 D361	Q357-L359 PolarHBondContact O-N 3.48Å; Q357-K360 PolarHBondContact O-N 3.28Å; Q357-K360 VanDerWaalsContact O-N 3.15Å; Q357-D361 PolarHBondContact NE2-OD1 3.49Å; Q357-D361 WeakPolarHBondContact O-CB 3.48Å; Q357-D361 PolarHBondContact O-N 2.68Å
358	R	91.5	Very high	90	Very high	92 Å²	92	51.9 Å²	51.9	35%	0.347	26%	0.264	S	S	.	.	H	α-helix	trans	-56.4	-35.2	175.2	-169	-179.7	170.6	179.7	-8.3	113	E282 M337 H356 L362	E282-R358 VanDerWaalsContact CD-NH1 3.34Å; E282-R358 IonicContact OE1-CZ 2.82Å; E282-R358 VanDerWaalsContact OE1-CZ 3.29Å; E282-R358 IonicContact OE1-NH1 2.85Å; E282-R358 PolarHBondContact OE1-NH1 2.95Å; E282-R358 IonicContact OE1-NH2 3.99Å; E282-R358 PolarHBondContact OE1-NH2 3.22Å; E282-R358 IonicContact OE2-CZ 3.91Å; E282-R358 IonicContact OE2-NH1 3.69Å; E282-R358 PolarHBondContact OE2-NH1 3.43Å; E282-R358 IonicContact OE2-NH2 3.89Å; E282-R358 PolarHBondContact OE2-NH2 3.44Å; M337-R358 HydrophobicContact CE-CG 4.01Å; M337-R358 VanDerWaalsContact SD-C 3.59Å; M337-R358 HydrophobicContact SD-CB 3.67Å; M337-R358 HydrophobicContact SD-CG 3.59Å; M337-R358 VanDerWaalsContact SD-CG 3.59Å; H356-R358 VanDerWaalsContact ND1-CB 3.32Å; H356-R358 WeakPolarHBondContact ND1-CB 3.41Å; H356-R358 PolarHBondContact ND1-N 2.87Å; H356-R358 PolarHBondContact O-N 2.88Å; R358-L362 VanDerWaalsContact O-CB 3.3Å; R358-L362 WeakPolarHBondContact O-CB 3.11Å; R358-L362 PolarHBondContact O-N 2.97Å
359	L	91.7	Very high	89.2	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-69.8	-45.2	177.5	177.9	67.2	0	0	0	111.1	G336 M337 A340 L343 I351 A355 H356 Q357 D361 L362 H363	G336-L359 WeakPolarHBondContact O-CD2 3.49Å; M337-L359 HydrophobicContact SD-CB 3.95Å; M337-L359 PolarHBondContact SD-N 3.43Å; M337-L359 VanDerWaalsContact SD-N 3.39Å; A340-L359 HydrophobicContact CB-CD1 3.77Å; L343-L359 HydrophobicContact CD1-CD1 4.35Å; L343-L359 HydrophobicContact CD1-CD2 3.92Å; I351-L359 HydrophobicContact CD1-CG 4.35Å; I351-L359 HydrophobicContact CG1-CD2 4.4Å; I351-L359 HydrophobicContact CG1-CG 4.5Å; I351-L359 HydrophobicContact CG2-CD2 4.13Å; A355-L359 HydrophobicContact CB-CD2 4.1Å; H356-L359 WeakPolarHBondContact O-CB 3.03Å; H356-L359 PolarHBondContact O-N 2.67Å; Q357-L359 PolarHBondContact O-N 3.48Å; L359-D361 VanDerWaalsContact C-N 3.3Å; L359-D361 PolarHBondContact O-N 3.03Å; L359-L362 PolarHBondContact O-N 3.07Å; L359-H363 PolarHBondContact O-N 2.93Å
360	K	92.5	Very high	87.5	Confident	40 Å²	40	54.4 Å²	54.4	17%	0.174	28%	0.283	C	S	.	.	H	α-helix	trans	-63.4	-37.5	176.9	-66.8	169.9	-180	150.4	0	112.2	I351 G353 A355 H356 Q357 H363 V368	I351-K360 HydrophobicContact CG2-CG 3.8Å; G353-K360 PolarHBondContact O-NZ 3.23Å; A355-K360 PolarHBondContact O-NZ 3.18Å; H356-K360 PolarHBondContact O-N 2.96Å; Q357-K360 PolarHBondContact O-N 3.28Å; Q357-K360 VanDerWaalsContact O-N 3.15Å; K360-H363 CarbonylContact O-C 3.58Å; K360-V368 HydrophobicContact CG-CG2 4.5Å
361	D	94.7	Very high	85.6	Confident	106 Å²	106	55.8 Å²	55.8	57%	0.567	29%	0.292	S	S	*	.	H	α-helix	trans	-72.6	-32.2	178.2	-64.6	-16.4	0	0	0	111.6	Q357 L359	Q357-D361 PolarHBondContact NE2-OD1 3.49Å; Q357-D361 WeakPolarHBondContact O-CB 3.48Å; Q357-D361 PolarHBondContact O-N 2.68Å; L359-D361 VanDerWaalsContact C-N 3.3Å; L359-D361 PolarHBondContact O-N 3.03Å
362	L	94.4	Very high	83.1	Confident	94 Å²	94	59.5 Å²	59.5	49%	0.492	31%	0.312	S	S	.	.	H	α-helix	trans	-71.8	-38	176.6	-176.3	64.4	0	0	0	112.3	M337 A340 R358 L359 P364	M337-L362 HydrophobicContact CE-CD2 3.74Å; A340-L362 HydrophobicContact CB-CD2 4.03Å; R358-L362 VanDerWaalsContact O-CB 3.3Å; R358-L362 WeakPolarHBondContact O-CB 3.11Å; R358-L362 PolarHBondContact O-N 2.97Å; L359-L362 PolarHBondContact O-N 3.07Å; L362-P364 VanDerWaalsContact C-CD 3.43Å; L362-P364 WeakPolarHBondContact O-CD 3.49Å
363	H	94.8	Very high	80.7	Confident	26 Å²	26	61.5 Å²	61.5	12%	0.12	32%	0.321	C	S	.	.			trans	-124.8	65.6	-177.6	-69	-68.1	0	0	0	112.7	S344 I351 L359 K360 E365 L366	S344-H363 VanDerWaalsContact CB-CE1 3.44Å; S344-H363 WeakPolarHBondContact CB-CE1 3.24Å; I351-H363 HydrophobicContact CD1-CB 4.16Å; L359-H363 PolarHBondContact O-N 2.93Å; K360-H363 CarbonylContact O-C 3.58Å; H363-E365 VanDerWaalsContact CA-OE2 3.3Å; H363-E365 WeakPolarHBondContact CA-OE2 3.27Å; H363-E365 IonicContact CE1-OE1 3.5Å; H363-E365 IonicContact CG-OE1 3.79Å; H363-E365 IonicContact ND1-OE1 3.89Å; H363-E365 PolarHBondContact ND1-OE1 3.07Å; H363-E365 PolarHBondContact O-N 3.19Å; H363-L366 HydrophobicContact CB-CB 4.43Å; H363-L366 HydrophobicContact CB-CD1 3.67Å; H363-L366 HydrophobicContact CB-CG 3.91Å; H363-L366 PolarHBondContact O-N 3.23Å
364	P	92.4	Very high	78.5	Confident	102 Å²	102	62.8 Å²	62.8	66%	0.662	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-16.6	-179.5	29.4	-37	0	0	0	113.8	L362 L366	L362-P364 VanDerWaalsContact C-CD 3.43Å; L362-P364 WeakPolarHBondContact O-CD 3.49Å; P364-L366 VanDerWaalsContact C-N 3.35Å
365	E	94.1	Very high	76.7	Confident	128 Å²	128	66.7 Å²	66.7	60%	0.598	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-20.3	176.8	72.4	-74	175.4	0	0	113.9	H363	H363-E365 VanDerWaalsContact CA-OE2 3.3Å; H363-E365 WeakPolarHBondContact CA-OE2 3.27Å; H363-E365 IonicContact CE1-OE1 3.5Å; H363-E365 IonicContact CG-OE1 3.79Å; H363-E365 IonicContact ND1-OE1 3.89Å; H363-E365 PolarHBondContact ND1-OE1 3.07Å; H363-E365 PolarHBondContact O-N 3.19Å
366	L	93.3	Very high	74.3	Confident	29 Å²	29	73.8 Å²	73.8	15%	0.152	37%	0.368	C	S	.	.	S	Bend	trans	-81.9	149.7	-177.3	-64.6	-177.3	0	0	0	112	L343 I351 H363 P364 V368	L343-L366 HydrophobicContact CB-CD1 3.67Å; I351-L366 HydrophobicContact CD1-CB 3.83Å; I351-L366 HydrophobicContact CD1-CD1 4.17Å; I351-L366 HydrophobicContact CG1-CB 4.06Å; I351-L366 HydrophobicContact CG1-CD1 4.2Å; H363-L366 HydrophobicContact CB-CB 4.43Å; H363-L366 HydrophobicContact CB-CD1 3.67Å; H363-L366 HydrophobicContact CB-CG 3.91Å; H363-L366 PolarHBondContact O-N 3.23Å; P364-L366 VanDerWaalsContact C-N 3.35Å; L366-V368 PolarHBondContact O-N 3.2Å
367	E	90.4	Very high	71.8	Confident	100 Å²	100	79.1 Å²	79.1	47%	0.467	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	125.8	179.7	-175.7	177.7	158	0	0	110.5	K348 C350 I351	K348-E367 VanDerWaalsContact CE-OE2 3.28Å; K348-E367 WeakPolarHBondContact CE-OE2 3.46Å; K348-E367 IonicContact NZ-OE2 2.7Å; K348-E367 PolarHBondContact NZ-OE2 3.42Å; C350-E367 CarbonylContact C-O 3.53Å; C350-E367 WeakPolarHBondContact CA-O 2.94Å; I351-E367 PolarHBondContact N-O 3.14Å
368	V	87.9	Confident	69.2	Low	63 Å²	63	79.9 Å²	79.9	38%	0.382	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	105.7	173.6	-178.2	0	0	0	0	109.3	I351 K360 L366 V370	I351-V368 HydrophobicContact CB-CG2 4.31Å; I351-V368 CarbonylContact O-C 3.58Å; I351-V368 VanDerWaalsContact O-CA 3.32Å; I351-V368 WeakPolarHBondContact O-CA 3.45Å; K360-V368 HydrophobicContact CG-CG2 4.5Å; L366-V368 PolarHBondContact O-N 3.2Å; V368-V370 HydrophobicContact CG1-CG2 4.31Å; V368-V370 PolarHBondContact O-N 3.47Å; V368-V370 VanDerWaalsContact O-N 3.17Å
369	I	79.8	Confident	66.4	Low	52 Å²	52	78.2 Å²	78.2	27%	0.267	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	100.1	176.9	-56.6	-176.4	0	0	0	108.6	F333 C350 I351 G353 V371	F333-I369 HydrophobicContact CD1-CD1 4.01Å; F333-I369 HydrophobicContact CE1-CD1 3.71Å; C350-I369 HydrophobicContact CB-CD1 3.48Å; C350-I369 VanDerWaalsContact CB-CD1 3.48Å; C350-I369 HydrophobicContact CB-CG1 3.99Å; I351-I369 PolarHBondContact O-N 3.27Å; G353-I369 WeakPolarHBondContact CA-O 3.42Å; G353-I369 PolarHBondContact N-O 2.84Å; I369-V371 HydrophobicContact CG2-CG2 4.41Å; I369-V371 PolarHBondContact O-N 2.94Å
370	V	59.2	Low	63.7	Low	90 Å²	90	80.6 Å²	80.6	55%	0.545	42%	0.423	S	S	.	.			trans	-80	106.8	174	-172.9	0	0	0	0	108.4	V368	V368-V370 HydrophobicContact CG1-CG2 4.31Å; V368-V370 PolarHBondContact O-N 3.47Å; V368-V370 VanDerWaalsContact O-N 3.17Å
371	V	52.9	Low	61.2	Low	33 Å²	33	80.2 Å²	80.2	20%	0.2	43%	0.425	C	S	.	.			trans	-84.5	141.6	161	-157.1	0	0	0	0	107.3	D131 M352 I369 Q373	D131-V371 HydrophobicContact CB-CG1 4.38Å; D131-V371 WeakPolarHBondContact OD1-CG1 3.08Å; M352-V371 HydrophobicContact CE-CG2 4.05Å; I369-V371 HydrophobicContact CG2-CG2 4.41Å; I369-V371 PolarHBondContact O-N 2.94Å; V371-Q373 PolarHBondContact O-N 3.28Å
372	N	39	Very low	58.4	Low	78 Å²	78	79.3 Å²	79.3	42%	0.417	42%	0.42	S	S	.	.			trans	-52.7	98.6	-179.3	-94.5	-16.3	0	0	0	109.7	I374	N372-I374 PolarHBondContact O-N 3.17Å
373	Q	35.4	Very low	55.7	Low	50 Å²	50	80.1 Å²	80.1	23%	0.234	42%	0.424	C	S	.	.			trans	-73.6	73.1	178.3	-75.1	-171.9	-46.9	0	0	111	H42 S354 V371	H42-Q373 PolarHBondContact CE1-O 2.91Å; H42-Q373 VanDerWaalsContact CE1-O 3.22Å; H42-Q373 PolarHBondContact NE2-O 3.34Å; S354-Q373 VanDerWaalsContact CA-NE2 3.32Å; V371-Q373 PolarHBondContact O-N 3.28Å
374	I	33.6	Very low	53.2	Low	41 Å²	41	84.8 Å²	84.8	21%	0.21	44%	0.443	C	S	.	.			trans	-82.2	141.1	153.2	-43.6	-178.4	0	0	0	104.1	E98 N372	E98-I374 VanDerWaalsContact C-CD1 3.46Å; E98-I374 HydrophobicContact CB-CB 4.11Å; E98-I374 HydrophobicContact CB-CD1 3.71Å; E98-I374 HydrophobicContact CB-CG1 4.47Å; E98-I374 HydrophobicContact CB-CG2 3.71Å; E98-I374 HydrophobicContact CG-CG2 4.49Å; E98-I374 VanDerWaalsContact O-CD1 3.28Å; E98-I374 WeakPolarHBondContact O-CD1 3.27Å; E98-I374 WeakPolarHBondContact OE2-CG2 3.23Å; N372-I374 PolarHBondContact O-N 3.17Å
375	L	36.1	Very low	51	Low	101 Å²	101	85.4 Å²	85.4	53%	0.529	44%	0.438	S	S	.	.			trans	84	4.9	175.5	-49.3	176.4	0	0	0	122.5	E98 Y377	E98-L375 WeakPolarHBondContact OE1-CD1 3.19Å; E98-L375 WeakPolarHBondContact OE2-CD1 3.25Å; E98-L375 WeakPolarHBondContact OE2-CD2 3.35Å; E98-L375 WeakPolarHBondContact OE2-CG 3.43Å; L375-Y377 PolarHBondContact O-N 3.49Å; L375-Y377 VanDerWaalsContact O-N 3.15Å
376	R	34.5	Very low	49.2	Very low	155 Å²	155	86.9 Å²	86.9	59%	0.585	44%	0.442	S	S	*	.			trans	-76.7	13.5	164.2	-82.3	-152.3	177.6	-176.2	0.2	115.3	S354	S354-R376 VanDerWaalsContact CB-NH2 3.31Å; S354-R376 PolarHBondContact O-NH1 3.42Å; S354-R376 PolarHBondContact OG-NH2 2.96Å
377	Y	31.6	Very low	47.8	Very low	176 Å²	176	88 Å²	88	69%	0.69	45%	0.452	S	S	*	.	S	Bend	trans	-100.8	98.5	155.9	-114.5	-82.6	0	0	0	108.1	L375	L375-Y377 PolarHBondContact O-N 3.49Å; L375-Y377 VanDerWaalsContact O-N 3.15Å
378	N	33.7	Very low	46.8	Very low	122 Å²	122	84.6 Å²	84.6	65%	0.652	44%	0.437	S	S	*	.			trans	-11.4	137	165.1	-72.9	-17.3	0	0	0	113.9	S380 S381	N378-S380 VanDerWaalsContact CB-OG 3.24Å; N378-S380 WeakPolarHBondContact CB-OG 3.12Å; N378-S380 CarbonylContact O-C 3.51Å; N378-S380 WeakPolarHBondContact O-CA 3.42Å; N378-S380 PolarHBondContact O-N 3Å; N378-S380 PolarHBondContact O-OG 3.41Å; N378-S381 PolarHBondContact O-N 3.14Å
379	G	31.3	Very low	46	Very low	56 Å²	56	85.5 Å²	85.5	58%	0.577	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.6	-18.9	169.8	0	0	0	0	0	115.1	S381 I383	G379-S381 VanDerWaalsContact C-N 3.28Å; G379-S381 PolarHBondContact O-N 3.39Å; G379-I383 VanDerWaalsContact O-CB 3.27Å; G379-I383 WeakPolarHBondContact O-CB 3.4Å; G379-I383 VanDerWaalsContact O-CD1 3.24Å; G379-I383 WeakPolarHBondContact O-CD1 3.36Å; G379-I383 WeakPolarHBondContact O-CG1 3.22Å; G379-I383 PolarHBondContact O-N 2.91Å; G379-I383 VanDerWaalsContact O-N 3.14Å
380	S	36.6	Very low	45.8	Very low	51 Å²	51	84.9 Å²	84.9	36%	0.357	45%	0.446	S	S	.	.	H	α-helix	trans	-54.6	-24.5	163.4	75.2	0	0	0	0	117.1	N378 K384	N378-S380 VanDerWaalsContact CB-OG 3.24Å; N378-S380 WeakPolarHBondContact CB-OG 3.12Å; N378-S380 CarbonylContact O-C 3.51Å; N378-S380 WeakPolarHBondContact O-CA 3.42Å; N378-S380 PolarHBondContact O-N 3Å; N378-S380 PolarHBondContact O-OG 3.41Å; S380-K384 WeakPolarHBondContact O-CA 3.47Å; S380-K384 WeakPolarHBondContact O-CB 3.23Å; S380-K384 WeakPolarHBondContact O-CD 3.42Å; S380-K384 WeakPolarHBondContact O-CG 3.31Å; S380-K384 PolarHBondContact O-N 2.69Å
381	S	39.1	Very low	46.6	Very low	32 Å²	32	82.5 Å²	82.5	22%	0.224	43%	0.43	C	S	.	.	H	α-helix	trans	-85.7	-46	-174.6	-179	0	0	0	0	112.8	N378 G379 I383 K384 E385	N378-S381 PolarHBondContact O-N 3.14Å; G379-S381 VanDerWaalsContact C-N 3.28Å; G379-S381 PolarHBondContact O-N 3.39Å; S381-I383 VanDerWaalsContact C-N 3.32Å; S381-K384 CarbonylContact O-C 3.58Å; S381-K384 WeakPolarHBondContact O-CB 3.41Å; S381-K384 PolarHBondContact O-N 3.09Å; S381-K384 VanDerWaalsContact O-N 3.14Å; S381-E385 PolarHBondContact O-N 3.44Å
382	L	36.9	Very low	47.9	Very low	87 Å²	87	83.3 Å²	83.3	46%	0.455	43%	0.432	S	S	.	.	H	α-helix	trans	-65.8	-40.5	170.6	-102.1	154.7	0	0	0	109.8	K384 E385 F386	L382-K384 VanDerWaalsContact C-N 3.29Å; L382-K384 PolarHBondContact O-N 3.47Å; L382-E385 PolarHBondContact O-N 3.05Å; L382-F386 VanDerWaalsContact O-CB 3.3Å; L382-F386 WeakPolarHBondContact O-CB 3.45Å; L382-F386 PolarHBondContact O-N 3.19Å
383	I	37.1	Very low	49.9	Very low	111 Å²	111	84 Å²	84	57%	0.569	44%	0.435	S	S	*	.	H	α-helix	trans	-60.8	-39.1	169.5	-65.6	168.2	0	0	0	110.3	G379 S381 S387	G379-I383 VanDerWaalsContact O-CB 3.27Å; G379-I383 WeakPolarHBondContact O-CB 3.4Å; G379-I383 VanDerWaalsContact O-CD1 3.24Å; G379-I383 WeakPolarHBondContact O-CD1 3.36Å; G379-I383 WeakPolarHBondContact O-CG1 3.22Å; G379-I383 PolarHBondContact O-N 2.91Å; G379-I383 VanDerWaalsContact O-N 3.14Å; S381-I383 VanDerWaalsContact C-N 3.32Å; I383-S387 WeakPolarHBondContact O-CA 3.46Å; I383-S387 WeakPolarHBondContact O-CB 3.43Å; I383-S387 PolarHBondContact O-N 3.01Å; I383-S387 PolarHBondContact O-OG 3.21Å
384	K	42.2	Very low	52.2	Low	123 Å²	123	85.7 Å²	85.7	54%	0.535	45%	0.445	S	S	.	.	H	α-helix	trans	-67.2	-45.2	176.2	-87.6	169.1	-176	-179.2	0	112.8	S380 S381 L382 S387 I388	S380-K384 WeakPolarHBondContact O-CA 3.47Å; S380-K384 WeakPolarHBondContact O-CB 3.23Å; S380-K384 WeakPolarHBondContact O-CD 3.42Å; S380-K384 WeakPolarHBondContact O-CG 3.31Å; S380-K384 PolarHBondContact O-N 2.69Å; S381-K384 CarbonylContact O-C 3.58Å; S381-K384 WeakPolarHBondContact O-CB 3.41Å; S381-K384 PolarHBondContact O-N 3.09Å; S381-K384 VanDerWaalsContact O-N 3.14Å; L382-K384 VanDerWaalsContact C-N 3.29Å; L382-K384 PolarHBondContact O-N 3.47Å; K384-S387 CarbonylContact O-C 3.44Å; K384-S387 PolarHBondContact O-N 3.19Å; K384-I388 WeakPolarHBondContact O-CB 3.4Å; K384-I388 VanDerWaalsContact O-CD1 3.29Å; K384-I388 WeakPolarHBondContact O-CD1 3.48Å; K384-I388 WeakPolarHBondContact O-CG1 3.46Å; K384-I388 PolarHBondContact O-N 3.02Å
385	E	46.6	Very low	54.6	Low	116 Å²	116	83.7 Å²	83.7	54%	0.542	44%	0.435	S	S	.	.	H	α-helix	trans	-66.8	-45.6	177.2	-77.2	-173.2	168.1	0	0	111.4	S381 L382 S387 I388 V389	S381-E385 PolarHBondContact O-N 3.44Å; L382-E385 PolarHBondContact O-N 3.05Å; E385-S387 VanDerWaalsContact C-N 3.28Å; E385-S387 PolarHBondContact O-N 3.23Å; E385-I388 PolarHBondContact O-N 3.27Å; E385-V389 WeakPolarHBondContact O-CG2 3.38Å; E385-V389 PolarHBondContact O-N 2.95Å
386	F	55.2	Low	56.8	Low	158 Å²	158	82.6 Å²	82.6	69%	0.693	43%	0.432	S	S	*	.	H	α-helix	trans	-60.1	-40.2	171.4	-111.1	-92.8	0	0	0	111.3	L382 A390	L382-F386 VanDerWaalsContact O-CB 3.3Å; L382-F386 WeakPolarHBondContact O-CB 3.45Å; L382-F386 PolarHBondContact O-N 3.19Å; F386-A390 WeakPolarHBondContact O-CB 3.39Å; F386-A390 PolarHBondContact O-N 3.38Å
387	S	64.5	Low	59.2	Low	53 Å²	53	79.6 Å²	79.6	37%	0.371	43%	0.427	S	S	.	.	H	α-helix	trans	-64.9	-44.1	176.4	-66.9	0	0	0	0	110.5	I383 K384 E385 A390 L391	I383-S387 WeakPolarHBondContact O-CA 3.46Å; I383-S387 WeakPolarHBondContact O-CB 3.43Å; I383-S387 PolarHBondContact O-N 3.01Å; I383-S387 PolarHBondContact O-OG 3.21Å; K384-S387 CarbonylContact O-C 3.44Å; K384-S387 PolarHBondContact O-N 3.19Å; E385-S387 VanDerWaalsContact C-N 3.28Å; E385-S387 PolarHBondContact O-N 3.23Å; S387-A390 PolarHBondContact O-N 3.44Å; S387-L391 VanDerWaalsContact O-CB 3.31Å; S387-L391 WeakPolarHBondContact O-CB 3.42Å; S387-L391 WeakPolarHBondContact O-CG 3.46Å; S387-L391 PolarHBondContact O-N 2.94Å
388	I	69.1	Low	61.7	Low	29 Å²	29	72.8 Å²	72.8	15%	0.149	40%	0.402	C	S	.	.	H	α-helix	trans	-63.1	-48.8	179.5	-69	156.1	0	0	0	110	K384 E385 A390 L391 L392 Q616	K384-I388 WeakPolarHBondContact O-CB 3.4Å; K384-I388 VanDerWaalsContact O-CD1 3.29Å; K384-I388 WeakPolarHBondContact O-CD1 3.48Å; K384-I388 WeakPolarHBondContact O-CG1 3.46Å; K384-I388 PolarHBondContact O-N 3.02Å; E385-I388 PolarHBondContact O-N 3.27Å; I388-A390 VanDerWaalsContact C-N 3.34Å; I388-A390 PolarHBondContact O-N 2.85Å; I388-L391 PolarHBondContact O-N 2.87Å; I388-L392 HydrophobicContact CG2-CD1 4.19Å; I388-L392 VanDerWaalsContact O-CG 3.31Å; I388-L392 WeakPolarHBondContact O-CG 3.4Å; I388-L392 PolarHBondContact O-N 3.47Å; I388-Q616 HydrophobicContact CD1-CB 3.48Å; I388-Q616 VanDerWaalsContact CD1-CB 3.48Å; I388-Q616 HydrophobicContact CD1-CG 4.31Å; I388-Q616 HydrophobicContact CG1-CB 4.02Å
389	V	71.7	Confident	64.1	Low	81 Å²	81	68.6 Å²	68.6	49%	0.491	38%	0.377	S	S	.	.	H	α-helix	trans	-62.9	-42.9	177.9	175.3	0	0	0	0	110.5	E385 L392 I393	E385-V389 WeakPolarHBondContact O-CG2 3.38Å; E385-V389 PolarHBondContact O-N 2.95Å; V389-L392 PolarHBondContact O-N 3.38Å; V389-I393 HydrophobicContact CG1-CD1 3.71Å; V389-I393 HydrophobicContact CG1-CG1 4.3Å; V389-I393 VanDerWaalsContact O-CG1 3.28Å; V389-I393 WeakPolarHBondContact O-CG1 3.03Å; V389-I393 PolarHBondContact O-N 3.28Å
390	A	75.3	Confident	66.5	Low	40 Å²	40	68.5 Å²	68.5	33%	0.331	37%	0.371	S	S	.	.	H	α-helix	trans	-61.9	-43.9	175.3	0	0	0	0	0	112.2	F386 S387 I388 L392 I393 I394	F386-A390 WeakPolarHBondContact O-CB 3.39Å; F386-A390 PolarHBondContact O-N 3.38Å; S387-A390 PolarHBondContact O-N 3.44Å; I388-A390 VanDerWaalsContact C-N 3.34Å; I388-A390 PolarHBondContact O-N 2.85Å; A390-L392 VanDerWaalsContact C-N 3.31Å; A390-L392 PolarHBondContact O-N 3.36Å; A390-I393 PolarHBondContact O-N 3.41Å; A390-I394 WeakPolarHBondContact O-CB 3.41Å; A390-I394 WeakPolarHBondContact O-CD1 3.39Å; A390-I394 WeakPolarHBondContact O-CG1 3.5Å; A390-I394 PolarHBondContact O-N 3.11Å
391	L	76.7	Confident	68.9	Low	40 Å²	40	71.4 Å²	71.4	21%	0.209	38%	0.378	C	S	.	.	H	α-helix	trans	-58.4	-43.6	175.9	-72	173.2	0	0	0	110.9	S387 I388 T395 M609 Y612	S387-L391 VanDerWaalsContact O-CB 3.31Å; S387-L391 WeakPolarHBondContact O-CB 3.42Å; S387-L391 WeakPolarHBondContact O-CG 3.46Å; S387-L391 PolarHBondContact O-N 2.94Å; I388-L391 PolarHBondContact O-N 2.87Å; L391-T395 WeakPolarHBondContact O-CB 3.46Å; L391-T395 PolarHBondContact O-N 2.88Å; L391-T395 PolarHBondContact O-OG1 3.47Å; L391-M609 HydrophobicContact CB-CB 4.42Å; L391-M609 HydrophobicContact CB-CE 4.26Å; L391-M609 HydrophobicContact CD2-CB 4.16Å; L391-M609 HydrophobicContact CD2-CE 3.27Å; L391-M609 HydrophobicContact CD2-CG 3.89Å; L391-M609 HydrophobicContact CD2-SD 4.32Å; L391-M609 HydrophobicContact CG-CE 4.35Å; L391-Y612 HydrophobicContact CD1-CD1 3.9Å; L391-Y612 HydrophobicContact CD1-CE1 4.28Å
392	L	79.9	Confident	71.2	Confident	50 Å²	50	70.1 Å²	70.1	26%	0.262	37%	0.369	S	S	.	.	H	α-helix	trans	-68.5	-41.1	177.8	-66.1	174.3	0	0	0	112.3	I388 V389 A390 T395 T396 W610	I388-L392 HydrophobicContact CG2-CD1 4.19Å; I388-L392 VanDerWaalsContact O-CG 3.31Å; I388-L392 WeakPolarHBondContact O-CG 3.4Å; I388-L392 PolarHBondContact O-N 3.47Å; V389-L392 PolarHBondContact O-N 3.38Å; A390-L392 VanDerWaalsContact C-N 3.31Å; A390-L392 PolarHBondContact O-N 3.36Å; L392-T395 PolarHBondContact O-N 2.84Å; L392-T396 WeakPolarHBondContact O-CB 3.26Å; L392-T396 PolarHBondContact O-N 2.95Å; L392-T396 PolarHBondContact O-OG1 3.29Å; L392-W610 HydrophobicContact CD2-CD2 4.05Å; L392-W610 HydrophobicContact CD2-CE3 3.48Å; L392-W610 VanDerWaalsContact CD2-CE3 3.48Å; L392-W610 HydrophobicContact CD2-CH2 4.46Å; L392-W610 HydrophobicContact CD2-CZ3 3.72Å
393	I	81.4	Confident	73.5	Confident	93 Å²	93	68.2 Å²	68.2	48%	0.477	36%	0.357	S	S	.	.	H	α-helix	trans	-63.2	-50.8	175.6	-70	168.9	0	0	0	110.5	V389 A390 T395 T396 I397	V389-I393 HydrophobicContact CG1-CD1 3.71Å; V389-I393 HydrophobicContact CG1-CG1 4.3Å; V389-I393 VanDerWaalsContact O-CG1 3.28Å; V389-I393 WeakPolarHBondContact O-CG1 3.03Å; V389-I393 PolarHBondContact O-N 3.28Å; A390-I393 PolarHBondContact O-N 3.41Å; I393-T395 VanDerWaalsContact C-N 3.29Å; I393-T395 PolarHBondContact O-N 3.49Å; I393-T396 WeakPolarHBondContact O-CB 3.27Å; I393-T396 PolarHBondContact O-N 3.4Å; I393-T396 VanDerWaalsContact O-N 3.14Å; I393-I397 HydrophobicContact CG2-CD1 3.88Å; I393-I397 WeakPolarHBondContact O-CG1 3.5Å; I393-I397 PolarHBondContact O-N 3.24Å
394	I	83.3	Confident	75.9	Confident	84 Å²	84	64.8 Å²	64.8	43%	0.431	34%	0.343	S	S	.	.	H	α-helix	trans	-58.1	-45.6	178.9	-67.4	163.8	0	0	0	109.9	A390 T396 I397 L398 M609	A390-I394 WeakPolarHBondContact O-CB 3.41Å; A390-I394 WeakPolarHBondContact O-CD1 3.39Å; A390-I394 WeakPolarHBondContact O-CG1 3.5Å; A390-I394 PolarHBondContact O-N 3.11Å; I394-T396 VanDerWaalsContact C-N 3.33Å; I394-T396 PolarHBondContact O-N 2.91Å; I394-I397 PolarHBondContact O-N 2.8Å; I394-L398 HydrophobicContact CG2-CD1 4.06Å; I394-L398 HydrophobicContact CG2-CG 4.4Å; I394-L398 WeakPolarHBondContact O-CG 3.28Å; I394-L398 PolarHBondContact O-N 2.91Å; I394-M609 HydrophobicContact CB-CE 3.96Å; I394-M609 HydrophobicContact CD1-CE 4.31Å; I394-M609 HydrophobicContact CG2-CE 3.78Å
395	T	83.8	Confident	78.2	Confident	0 Å²	0	62 Å²	62	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-62.9	-41.5	178.4	-54.9	0	0	0	0	112	L391 L392 I393 I397 L398 W399 G606 M609 W610	L391-T395 WeakPolarHBondContact O-CB 3.46Å; L391-T395 PolarHBondContact O-N 2.88Å; L391-T395 PolarHBondContact O-OG1 3.47Å; L392-T395 PolarHBondContact O-N 2.84Å; I393-T395 VanDerWaalsContact C-N 3.29Å; I393-T395 PolarHBondContact O-N 3.49Å; T395-I397 VanDerWaalsContact C-N 3.33Å; T395-I397 PolarHBondContact O-N 3.31Å; T395-L398 PolarHBondContact O-N 3.47Å; T395-W399 HydrophobicContact CG2-CD2 3.84Å; T395-W399 VanDerWaalsContact CG2-CE2 3.49Å; T395-W399 HydrophobicContact CG2-CE3 4.31Å; T395-W399 HydrophobicContact CG2-CG 4.31Å; T395-W399 HydrophobicContact CG2-CH2 4.19Å; T395-W399 HydrophobicContact CG2-CZ2 3.68Å; T395-W399 HydrophobicContact CG2-CZ3 4.47Å; T395-W399 WeakPolarHBondContact O-CB 3.46Å; T395-W399 PolarHBondContact O-N 3.01Å; T395-G606 WeakPolarHBondContact CG2-O 3.12Å; T395-M609 WeakPolarHBondContact OG1-CB 3.29Å; T395-W610 HydrophobicContact CG2-CB 4.05Å; T395-W610 HydrophobicContact CG2-CE3 4.21Å
396	T	82.4	Confident	80.2	Confident	78 Å²	78	56.7 Å²	56.7	48%	0.479	31%	0.306	S	S	.	.	H	α-helix	trans	-61.4	-42.5	177.4	-57.3	0	0	0	0	111.2	L392 I393 I394 W399 A400	L392-T396 WeakPolarHBondContact O-CB 3.26Å; L392-T396 PolarHBondContact O-N 2.95Å; L392-T396 PolarHBondContact O-OG1 3.29Å; I393-T396 WeakPolarHBondContact O-CB 3.27Å; I393-T396 PolarHBondContact O-N 3.4Å; I393-T396 VanDerWaalsContact O-N 3.14Å; I394-T396 VanDerWaalsContact C-N 3.33Å; I394-T396 PolarHBondContact O-N 2.91Å; T396-W399 PolarHBondContact O-N 3.12Å; T396-A400 PolarHBondContact O-N 2.68Å
397	I	84.1	Confident	81.8	Confident	92 Å²	92	50 Å²	50	47%	0.472	28%	0.281	S	S	.	.	H	α-helix	trans	-63.3	-47.5	175.7	-66.5	168	0	0	0	110.6	I393 I394 T395 W399 A400 F401	I393-I397 HydrophobicContact CG2-CD1 3.88Å; I393-I397 WeakPolarHBondContact O-CG1 3.5Å; I393-I397 PolarHBondContact O-N 3.24Å; I394-I397 PolarHBondContact O-N 2.8Å; T395-I397 VanDerWaalsContact C-N 3.33Å; T395-I397 PolarHBondContact O-N 3.31Å; I397-W399 VanDerWaalsContact C-N 3.28Å; I397-W399 PolarHBondContact O-N 3.14Å; I397-A400 WeakPolarHBondContact O-CB 3.46Å; I397-A400 PolarHBondContact O-N 3.06Å; I397-F401 HydrophobicContact CG2-CD2 4.31Å; I397-F401 HydrophobicContact CG2-CE2 3.79Å; I397-F401 WeakPolarHBondContact O-CD2 3.47Å; I397-F401 PolarHBondContact O-N 3.49Å
398	L	83.9	Confident	82.9	Confident	33 Å²	33	53.3 Å²	53.3	17%	0.173	29%	0.291	C	S	.	.	H	α-helix	trans	-58.2	-40.3	177.3	-72.9	173.4	0	0	0	112.3	I394 T395 S402 F597 V601	I394-L398 HydrophobicContact CG2-CD1 4.06Å; I394-L398 HydrophobicContact CG2-CG 4.4Å; I394-L398 WeakPolarHBondContact O-CG 3.28Å; I394-L398 PolarHBondContact O-N 2.91Å; T395-L398 PolarHBondContact O-N 3.47Å; L398-S402 PolarHBondContact O-N 2.91Å; L398-S402 PolarHBondContact O-OG 3.38Å; L398-F597 HydrophobicContact CD2-CZ 4.31Å; L398-V601 HydrophobicContact CD1-CG1 4.24Å; L398-V601 HydrophobicContact CD2-CG1 3.81Å
399	W	84.5	Confident	84	Confident	33 Å²	33	56.3 Å²	56.3	13%	0.125	30%	0.301	C	S	.	.	H	α-helix	trans	-72.9	-34.7	179	-72.2	-2.5	0	0	0	112.8	T395 T396 I397 F401 S402 F403 F539 A602 Y607 W610	T395-W399 HydrophobicContact CG2-CD2 3.84Å; T395-W399 VanDerWaalsContact CG2-CE2 3.49Å; T395-W399 HydrophobicContact CG2-CE3 4.31Å; T395-W399 HydrophobicContact CG2-CG 4.31Å; T395-W399 HydrophobicContact CG2-CH2 4.19Å; T395-W399 HydrophobicContact CG2-CZ2 3.68Å; T395-W399 HydrophobicContact CG2-CZ3 4.47Å; T395-W399 WeakPolarHBondContact O-CB 3.46Å; T395-W399 PolarHBondContact O-N 3.01Å; T396-W399 PolarHBondContact O-N 3.12Å; I397-W399 VanDerWaalsContact C-N 3.28Å; I397-W399 PolarHBondContact O-N 3.14Å; W399-F401 VanDerWaalsContact C-N 3.29Å; W399-F401 PolarHBondContact O-N 3.42Å; W399-S402 WeakPolarHBondContact O-CA 3.46Å; W399-S402 VanDerWaalsContact O-CB 3.3Å; W399-S402 WeakPolarHBondContact O-CB 3.42Å; W399-S402 PolarHBondContact O-N 2.98Å; W399-F403 HydrophobicContact CB-CE2 4.43Å; W399-F403 WeakPolarHBondContact O-CD2 3.39Å; W399-F403 PolarHBondContact O-N 3.41Å; W399-F539 HydrophobicContact CH2-CE2 4.48Å; W399-F539 HydrophobicContact CH2-CZ 4.32Å; W399-F539 HydrophobicContact CZ3-CZ 4.5Å; W399-A602 PolarHBondContact NE1-O 3.34Å; W399-Y607 AromaticContact CE2-CD2 3.97Å; W399-Y607 AromaticContact CE2-CE2 3.71Å; W399-Y607 HydrophobicContact CH2-CD1 4.27Å; W399-Y607 HydrophobicContact CH2-CD2 4.5Å; W399-Y607 HydrophobicContact CH2-CE1 4.05Å; W399-Y607 HydrophobicContact CH2-CE2 4.21Å; W399-Y607 AromaticContact CZ2-CD1 3.95Å; W399-Y607 HydrophobicContact CZ2-CD1 3.95Å; W399-Y607 AromaticContact CZ2-CD2 3.48Å; W399-Y607 HydrophobicContact CZ2-CD2 3.48Å; W399-Y607 VanDerWaalsContact CZ2-CD2 3.48Å; W399-Y607 AromaticContact CZ2-CE1 3.92Å; W399-Y607 HydrophobicContact CZ2-CE1 3.92Å; W399-Y607 AromaticContact CZ2-CE2 3.36Å; W399-Y607 HydrophobicContact CZ2-CE2 3.36Å; W399-Y607 AromaticContact CZ2-CG 3.79Å; W399-Y607 HydrophobicContact CZ2-CG 3.79Å; W399-Y607 AromaticContact CZ2-CZ 3.65Å; W399-Y607 AromaticContact NE1-CD2 3.97Å; W399-Y607 AromaticContact NE1-CE2 3.84Å; W399-W610 HydrophobicContact CH2-CB 3.92Å; W399-W610 AromaticContact CH2-CD1 3.77Å; W399-W610 AromaticContact CH2-CD2 3.66Å; W399-W610 HydrophobicContact CH2-CD2 3.66Å; W399-W610 HydrophobicContact CH2-CE3 4.19Å; W399-W610 AromaticContact CH2-CG 3.52Å; W399-W610 HydrophobicContact CH2-CG 3.52Å; W399-W610 HydrophobicContact CZ2-CB 4.14Å; W399-W610 HydrophobicContact CZ2-CG 4.23Å; W399-W610 AromaticContact CZ3-CD2 3.85Å; W399-W610 HydrophobicContact CZ3-CD2 3.85Å; W399-W610 HydrophobicContact CZ3-CE3 4.05Å; W399-W610 HydrophobicContact CZ3-CG 4.21Å; W399-W610 HydrophobicContact CZ3-CZ2 4.47Å; W399-W610 HydrophobicContact CZ3-CZ3 4.44Å
400	A	82.7	Confident	85	Confident	55 Å²	55	52.5 Å²	52.5	46%	0.455	28%	0.278	S	S	.	.	H	α-helix	trans	-54.4	-45.7	175.2	0	0	0	0	0	111.7	T396 I397 S402	T396-A400 PolarHBondContact O-N 2.68Å; I397-A400 WeakPolarHBondContact O-CB 3.46Å; I397-A400 PolarHBondContact O-N 3.06Å; A400-S402 VanDerWaalsContact C-N 3.34Å; A400-S402 PolarHBondContact O-N 3.22Å
401	F	85.6	Confident	85.6	Confident	111 Å²	111	51.3 Å²	51.3	49%	0.487	27%	0.268	S	S	.	.	H	α-helix	trans	-67	-33.7	174.5	-67.1	-71.7	0	0	0	113.2	I397 W399 F403 S404 F405	I397-F401 HydrophobicContact CG2-CD2 4.31Å; I397-F401 HydrophobicContact CG2-CE2 3.79Å; I397-F401 WeakPolarHBondContact O-CD2 3.47Å; I397-F401 PolarHBondContact O-N 3.49Å; W399-F401 VanDerWaalsContact C-N 3.29Å; W399-F401 PolarHBondContact O-N 3.42Å; F401-F403 VanDerWaalsContact C-N 3.32Å; F401-F403 PolarHBondContact O-N 3.11Å; F401-S404 PolarHBondContact O-N 3.38Å; F401-F405 HydrophobicContact CB-CD2 4.35Å; F401-F405 HydrophobicContact CB-CE2 4.05Å; F401-F405 HydrophobicContact CB-CZ 4.34Å; F401-F405 WeakPolarHBondContact O-CB 3.3Å; F401-F405 VanDerWaalsContact O-CG 3.29Å; F401-F405 WeakPolarHBondContact O-CG 3.43Å; F401-F405 PolarHBondContact O-N 3.02Å
402	S	88.2	Confident	86.2	Confident	5 Å²	5	51.1 Å²	51.1	4%	0.035	28%	0.276	C	S	.	.	H	α-helix	trans	-63.3	-37.2	-177.1	-60.7	0	0	0	0	112.9	L398 W399 A400 Y406 A602	L398-S402 PolarHBondContact O-N 2.91Å; L398-S402 PolarHBondContact O-OG 3.38Å; W399-S402 WeakPolarHBondContact O-CA 3.46Å; W399-S402 VanDerWaalsContact O-CB 3.3Å; W399-S402 WeakPolarHBondContact O-CB 3.42Å; W399-S402 PolarHBondContact O-N 2.98Å; A400-S402 VanDerWaalsContact C-N 3.34Å; A400-S402 PolarHBondContact O-N 3.22Å; S402-Y406 PolarHBondContact O-N 3.2Å; S402-Y406 VanDerWaalsContact O-N 3.14Å; S402-A602 WeakPolarHBondContact OG-CB 3.28Å
403	F	85.2	Confident	86.7	Confident	48 Å²	48	54.4 Å²	54.4	21%	0.211	29%	0.29	C	S	.	.	H	α-helix	trans	-65.7	-43.6	178.7	-72.6	-79.2	0	0	0	111.7	W399 F401 G407 Y467 V472 L475 L476 T479	W399-F403 HydrophobicContact CB-CE2 4.43Å; W399-F403 WeakPolarHBondContact O-CD2 3.39Å; W399-F403 PolarHBondContact O-N 3.41Å; F401-F403 VanDerWaalsContact C-N 3.32Å; F401-F403 PolarHBondContact O-N 3.11Å; F403-G407 PolarHBondContact O-N 3.07Å; F403-Y467 WeakPolarHBondContact CA-OH 3.37Å; F403-Y467 VanDerWaalsContact CD1-OH 3.3Å; F403-Y467 WeakPolarHBondContact CD1-OH 3.49Å; F403-Y467 PolarHBondContact O-OH 3.19Å; F403-V472 HydrophobicContact CB-CG1 4.29Å; F403-L475 HydrophobicContact CD1-CD2 3.57Å; F403-L475 HydrophobicContact CE1-CD2 3.54Å; F403-L476 HydrophobicContact CB-CD2 3.95Å; F403-L476 HydrophobicContact CB-CG 4.36Å; F403-L476 HydrophobicContact CD1-CD2 4.06Å; F403-L476 HydrophobicContact CD2-CD2 3.45Å; F403-L476 VanDerWaalsContact CD2-CD2 3.45Å; F403-L476 HydrophobicContact CE1-CD2 4.46Å; F403-L476 HydrophobicContact CE2-CD2 3.9Å; F403-L476 HydrophobicContact CG-CD2 3.56Å; F403-L476 HydrophobicContact CG-CG 4.35Å; F403-L476 HydrophobicContact CZ-CD2 4.39Å; F403-T479 HydrophobicContact CE1-CG2 4.42Å
404	S	86.9	Confident	87.2	Confident	39 Å²	39	50.2 Å²	50.2	27%	0.273	27%	0.268	S	S	.	.	H	α-helix	trans	-70	-44.6	177.5	-57.8	0	0	0	0	111.8	F401 Y406 G407 E408	F401-S404 PolarHBondContact O-N 3.38Å; S404-Y406 VanDerWaalsContact C-N 3.34Å; S404-Y406 PolarHBondContact O-N 3.48Å; S404-G407 PolarHBondContact O-N 2.92Å; S404-E408 WeakPolarHBondContact O-CB 3.49Å; S404-E408 PolarHBondContact O-N 3.34Å
405	F	91.1	Very high	87.7	Confident	65 Å²	65	46.8 Å²	46.8	29%	0.285	25%	0.251	S	S	.	.	H	α-helix	trans	-60.5	-41.9	179.7	-73.1	-17.3	0	0	0	113.2	F401 Y409 I594 F597	F401-F405 HydrophobicContact CB-CD2 4.35Å; F401-F405 HydrophobicContact CB-CE2 4.05Å; F401-F405 HydrophobicContact CB-CZ 4.34Å; F401-F405 WeakPolarHBondContact O-CB 3.3Å; F401-F405 VanDerWaalsContact O-CG 3.29Å; F401-F405 WeakPolarHBondContact O-CG 3.43Å; F401-F405 PolarHBondContact O-N 3.02Å; F405-Y409 HydrophobicContact CD1-CE2 4.31Å; F405-Y409 WeakPolarHBondContact O-CB 3.3Å; F405-Y409 PolarHBondContact O-N 2.98Å; F405-I594 HydrophobicContact CB-CG2 3.83Å; F405-F597 AromaticContact CD2-CD1 3.83Å; F405-F597 HydrophobicContact CD2-CD1 3.83Å; F405-F597 AromaticContact CD2-CE1 3.85Å; F405-F597 HydrophobicContact CD2-CE1 3.85Å; F405-F597 AromaticContact CE2-CD1 3.99Å; F405-F597 HydrophobicContact CE2-CD1 3.99Å; F405-F597 AromaticContact CE2-CE1 3.82Å; F405-F597 HydrophobicContact CE2-CE1 3.82Å; F405-F597 HydrophobicContact CE2-CZ 4.34Å
406	Y	89.4	Confident	88.1	Confident	3 Å²	3	47.3 Å²	47.3	1%	0.012	25%	0.254	C	S	.	.	H	α-helix	trans	-69.1	-50.2	174	-176.5	-93.3	0	0	0	111.2	S402 S404 E408 L410 A411 S416 A419 F464 Y467 L598	S402-Y406 PolarHBondContact O-N 3.2Å; S402-Y406 VanDerWaalsContact O-N 3.14Å; S404-Y406 VanDerWaalsContact C-N 3.34Å; S404-Y406 PolarHBondContact O-N 3.48Å; Y406-E408 PolarHBondContact O-N 3.31Å; Y406-L410 HydrophobicContact CD2-CB 3.75Å; Y406-L410 HydrophobicContact CD2-CD1 3.78Å; Y406-L410 HydrophobicContact CD2-CG 4.4Å; Y406-L410 HydrophobicContact CE2-CB 3.92Å; Y406-L410 HydrophobicContact CE2-CD1 4.37Å; Y406-L410 HydrophobicContact CG-CB 4.38Å; Y406-L410 CarbonylContact O-C 3.57Å; Y406-L410 WeakPolarHBondContact O-CA 3.37Å; Y406-L410 WeakPolarHBondContact O-CB 3.41Å; Y406-L410 PolarHBondContact O-N 3.41Å; Y406-A411 HydrophobicContact CD1-CB 4.24Å; Y406-A411 HydrophobicContact CE1-CB 3.92Å; Y406-A411 PolarHBondContact O-N 3.04Å; Y406-S416 WeakPolarHBondContact OH-CB 3.34Å; Y406-A419 HydrophobicContact CE2-CB 3.79Å; Y406-F464 HydrophobicContact CD1-CD1 4.11Å; Y406-F464 HydrophobicContact CD1-CE1 4.15Å; Y406-F464 HydrophobicContact CD1-CG 4.4Å; Y406-F464 HydrophobicContact CD1-CZ 4.48Å; Y406-F464 HydrophobicContact CD2-CD1 4.34Å; Y406-F464 AromaticContact CD2-CD2 3.92Å; Y406-F464 HydrophobicContact CD2-CD2 3.92Å; Y406-F464 AromaticContact CD2-CE1 3.91Å; Y406-F464 HydrophobicContact CD2-CE1 3.91Å; Y406-F464 AromaticContact CD2-CE2 3.46Å; Y406-F464 HydrophobicContact CD2-CE2 3.46Å; Y406-F464 VanDerWaalsContact CD2-CE2 3.46Å; Y406-F464 HydrophobicContact CD2-CG 4.33Å; Y406-F464 AromaticContact CD2-CZ 3.42Å; Y406-F464 HydrophobicContact CD2-CZ 3.42Å; Y406-F464 VanDerWaalsContact CD2-CZ 3.42Å; Y406-F464 HydrophobicContact CE1-CB 4.02Å; Y406-F464 AromaticContact CE1-CD1 3.94Å; Y406-F464 HydrophobicContact CE1-CD1 3.94Å; Y406-F464 HydrophobicContact CE1-CD2 4.18Å; Y406-F464 HydrophobicContact CE1-CE1 4.37Å; Y406-F464 AromaticContact CE1-CG 3.81Å; Y406-F464 HydrophobicContact CE1-CG 3.81Å; Y406-F464 HydrophobicContact CE2-CB 4.45Å; Y406-F464 HydrophobicContact CE2-CD1 4.2Å; Y406-F464 AromaticContact CE2-CD2 3.23Å; Y406-F464 HydrophobicContact CE2-CD2 3.23Å; Y406-F464 HydrophobicContact CE2-CE1 4.17Å; Y406-F464 AromaticContact CE2-CE2 3.21Å; Y406-F464 HydrophobicContact CE2-CE2 3.21Å; Y406-F464 AromaticContact CE2-CG 3.75Å; Y406-F464 HydrophobicContact CE2-CG 3.75Å; Y406-F464 AromaticContact CE2-CZ 3.68Å; Y406-F464 HydrophobicContact CE2-CZ 3.68Å; Y406-F464 HydrophobicContact CG-CD1 4.3Å; Y406-F464 AromaticContact CG-CE1 3.9Å; Y406-F464 HydrophobicContact CG-CE1 3.9Å; Y406-F464 HydrophobicContact CG-CE2 4.28Å; Y406-F464 AromaticContact CG-CZ 3.87Å; Y406-F464 HydrophobicContact CG-CZ 3.87Å; Y406-F464 AromaticContact CZ-CD1 3.99Å; Y406-F464 AromaticContact CZ-CD2 3.38Å; Y406-F464 AromaticContact CZ-CE2 3.86Å; Y406-F464 AromaticContact CZ-CG 3.44Å; Y406-F464 VanDerWaalsContact CZ-CG 3.44Å; Y406-F464 WeakPolarHBondContact OH-CB 3.43Å; Y406-F464 PolarHBondContact OH-O 2.99Å; Y406-Y467 HydrophobicContact CD1-CD1 4.22Å; Y406-Y467 AromaticContact CD1-CD2 3.43Å; Y406-Y467 HydrophobicContact CD1-CD2 3.43Å; Y406-Y467 VanDerWaalsContact CD1-CD2 3.43Å; Y406-Y467 HydrophobicContact CD1-CE1 4.25Å; Y406-Y467 AromaticContact CD1-CE2 3.48Å; Y406-Y467 HydrophobicContact CD1-CE2 3.48Å; Y406-Y467 VanDerWaalsContact CD1-CE2 3.48Å; Y406-Y467 AromaticContact CD1-CG 3.79Å; Y406-Y467 HydrophobicContact CD1-CG 3.79Å; Y406-Y467 AromaticContact CD1-CZ 3.88Å; Y406-Y467 AromaticContact CE1-CD2 3.45Å; Y406-Y467 HydrophobicContact CE1-CD2 3.45Å; Y406-Y467 VanDerWaalsContact CE1-CD2 3.45Å; Y406-Y467 AromaticContact CE1-CE2 3.98Å; Y406-Y467 HydrophobicContact CE1-CE2 3.98Å; Y406-Y467 AromaticContact CE1-CG 3.77Å; Y406-Y467 HydrophobicContact CE1-CG 3.77Å; Y406-Y467 HydrophobicContact CG-CE2 4.47Å; Y406-L598 HydrophobicContact CD2-CD1 4.31Å
407	G	87.8	Confident	88.7	Confident	18 Å²	18	44.5 Å²	44.5	19%	0.186	24%	0.235	C	C	.	.	H	α-helix	trans	-64.7	-37.3	-173.2	0	0	0	0	0	114.9	F403 S404	F403-G407 PolarHBondContact O-N 3.07Å; S404-G407 PolarHBondContact O-N 2.92Å
408	E	88.7	Confident	89.2	Confident	122 Å²	122	41 Å²	41	57%	0.57	22%	0.216	S	C	*	.	H	α-helix	trans	-87.9	-32.9	-176.9	-67.1	-179.2	174.3	0	0	113.3	S404 Y406	S404-E408 WeakPolarHBondContact O-CB 3.49Å; S404-E408 PolarHBondContact O-N 3.34Å; Y406-E408 PolarHBondContact O-N 3.31Å
409	Y	91.6	Very high	89.7	Confident	93 Å²	93	39.4 Å²	39.4	37%	0.365	21%	0.208	S	C	.	.	H	α-helix	trans	-112.3	-22.1	-169.5	-59.6	-92	0	0	0	114.7	F405 L590 Q591 I594	F405-Y409 HydrophobicContact CD1-CE2 4.31Å; F405-Y409 WeakPolarHBondContact O-CB 3.3Å; F405-Y409 PolarHBondContact O-N 2.98Å; Y409-L590 HydrophobicContact CD1-CD2 3.69Å; Y409-L590 HydrophobicContact CD1-CG 4.44Å; Y409-L590 HydrophobicContact CE1-CD2 3.84Å; Y409-Q591 PolarHBondContact O-NE2 3.36Å; Y409-I594 VanDerWaalsContact CB-CD1 3.4Å; Y409-I594 HydrophobicContact CD1-CD1 4.07Å; Y409-I594 HydrophobicContact CD2-CD1 3.88Å; Y409-I594 HydrophobicContact CG-CD1 3.51Å
410	L	92	Very high	90.2	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.7	-40.5	-174.8	-63.5	177.6	0	0	0	112.9	Y406 G412 H413 V414 Q591 I594 L595 L598	Y406-L410 HydrophobicContact CD2-CB 3.75Å; Y406-L410 HydrophobicContact CD2-CD1 3.78Å; Y406-L410 HydrophobicContact CD2-CG 4.4Å; Y406-L410 HydrophobicContact CE2-CB 3.92Å; Y406-L410 HydrophobicContact CE2-CD1 4.37Å; Y406-L410 HydrophobicContact CG-CB 4.38Å; Y406-L410 CarbonylContact O-C 3.57Å; Y406-L410 WeakPolarHBondContact O-CA 3.37Å; Y406-L410 WeakPolarHBondContact O-CB 3.41Å; Y406-L410 PolarHBondContact O-N 3.41Å; L410-G412 PolarHBondContact O-N 3.38Å; L410-H413 PolarHBondContact O-N 3.33Å; L410-H413 VanDerWaalsContact O-N 3.13Å; L410-V414 HydrophobicContact CD2-CB 4.3Å; L410-V414 HydrophobicContact CD2-CG2 3.72Å; L410-V414 PolarHBondContact O-N 3.38Å; L410-Q591 HydrophobicContact CD2-CB 3.74Å; L410-Q591 HydrophobicContact CD2-CG 3.81Å; L410-I594 HydrophobicContact CD1-CB 4.45Å; L410-I594 HydrophobicContact CD1-CG2 3.65Å; L410-I594 HydrophobicContact CG-CG2 4.15Å; L410-L595 HydrophobicContact CD1-CD2 3.69Å; L410-L595 HydrophobicContact CD1-CG 4.02Å; L410-L595 HydrophobicContact CD2-CG 4.35Å; L410-L598 HydrophobicContact CD1-CD1 3.8Å
411	A	89.3	Confident	90.8	Very high	15 Å²	15	36.2 Å²	36.2	12%	0.124	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	132.8	-178.2	0	0	0	0	0	110.9	Y406 H413 Y467	Y406-A411 HydrophobicContact CD1-CB 4.24Å; Y406-A411 HydrophobicContact CE1-CB 3.92Å; Y406-A411 PolarHBondContact O-N 3.04Å; A411-H413 PolarHBondContact O-CD2 2.82Å; A411-H413 PolarHBondContact O-N 3.37Å; A411-Y467 HydrophobicContact CB-CD1 4.44Å; A411-Y467 HydrophobicContact CB-CG 4.34Å
412	G	87.6	Confident	91.3	Very high	36 Å²	36	32.1 Å²	32.1	37%	0.371	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.7	-34.2	-176.2	0	0	0	0	0	114.9	L410 K584	L410-G412 PolarHBondContact O-N 3.38Å; G412-K584 PolarHBondContact O-NZ 3.45Å
413	H	90.5	Very high	91.6	Very high	120 Å²	120	32.4 Å²	32.4	56%	0.556	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-40.9	-178	-61.2	-68.9	0	0	0	113.7	L410 A411	L410-H413 PolarHBondContact O-N 3.33Å; L410-H413 VanDerWaalsContact O-N 3.13Å; A411-H413 PolarHBondContact O-CD2 2.82Å; A411-H413 PolarHBondContact O-N 3.37Å
414	V	92.4	Very high	92.1	Very high	4 Å²	4	30.1 Å²	30.1	2%	0.024	16%	0.16	C	C	.	.	S	Bend	trans	-110.6	141.8	179.1	-180	0	0	0	0	109.2	L410 S416 F418 A419 K584 P586	L410-V414 HydrophobicContact CD2-CB 4.3Å; L410-V414 HydrophobicContact CD2-CG2 3.72Å; L410-V414 PolarHBondContact O-N 3.38Å; V414-S416 PolarHBondContact O-N 3.44Å; V414-F418 HydrophobicContact CG1-CD1 4.25Å; V414-A419 HydrophobicContact CG1-CB 4.33Å; V414-K584 CarbonylContact C-O 3.59Å; V414-K584 WeakPolarHBondContact CA-O 3.5Å; V414-P586 HydrophobicContact CG1-CG 3.85Å; V414-P586 HydrophobicContact CG2-CB 4.16Å; V414-P586 HydrophobicContact CG2-CG 4.11Å
415	D	93.3	Very high	92.5	Very high	13 Å²	13	28.8 Å²	28.8	7%	0.07	15%	0.152	C	C	.	.			trans	-56.6	127.3	174.4	179.1	69.1	0	0	0	110.6	Y417 F418 A419 N581 K584	D415-Y417 VanDerWaalsContact C-N 3.35Å; D415-Y417 PolarHBondContact O-N 2.85Å; D415-Y417 WeakPolarHBondContact OD2-CB 3.31Å; D415-Y417 PolarHBondContact OD2-N 2.98Å; D415-F418 HydrophobicContact CB-CB 3.87Å; D415-F418 PolarHBondContact O-N 3.4Å; D415-F418 PolarHBondContact OD2-N 2.88Å; D415-A419 WeakPolarHBondContact O-CB 3.45Å; D415-A419 PolarHBondContact O-N 2.87Å; D415-N581 HydrophobicContact CB-CB 4.45Å; D415-N581 VanDerWaalsContact CG-N 3.27Å; D415-N581 PolarHBondContact OD1-N 3.46Å; D415-K584 HydrophobicContact CB-CB 4.04Å; D415-K584 PolarHBondContact N-O 3.23Å
416	S	93.4	Very high	92.7	Very high	10 Å²	10	27.7 Å²	27.7	7%	0.07	15%	0.15	C	C	.	.	H	α-helix	trans	-64.6	-40.4	-175.1	52.1	0	0	0	0	111.6	Y406 V414 A419 V420	Y406-S416 WeakPolarHBondContact OH-CB 3.34Å; V414-S416 PolarHBondContact O-N 3.44Å; S416-A419 PolarHBondContact O-N 3.41Å; S416-V420 WeakPolarHBondContact O-CG2 3.4Å; S416-V420 PolarHBondContact O-N 3.33Å
417	Y	94.5	Very high	92.9	Very high	20 Å²	20	27.6 Å²	27.6	8%	0.078	15%	0.149	C	C	.	.	H	α-helix	trans	-66.3	-40.7	178.3	-59.5	-78.5	0	0	0	111.4	D415 V420 L421 M461 R465 A575 L579	D415-Y417 VanDerWaalsContact C-N 3.35Å; D415-Y417 PolarHBondContact O-N 2.85Å; D415-Y417 WeakPolarHBondContact OD2-CB 3.31Å; D415-Y417 PolarHBondContact OD2-N 2.98Å; Y417-V420 PolarHBondContact O-N 3.04Å; Y417-L421 WeakPolarHBondContact O-CB 3.04Å; Y417-L421 PolarHBondContact O-N 2.87Å; Y417-M461 HydrophobicContact CD1-CG 4.1Å; Y417-M461 HydrophobicContact CD1-SD 4.03Å; Y417-M461 HydrophobicContact CE1-CB 4.41Å; Y417-M461 HydrophobicContact CE1-CG 4.38Å; Y417-M461 HydrophobicContact CE1-SD 4.24Å; Y417-R465 PolarHBondContact OH-NH1 2.87Å; Y417-A575 HydrophobicContact CD1-CB 3.98Å; Y417-A575 HydrophobicContact CE1-CB 4.43Å; Y417-L579 HydrophobicContact CD2-CB 4.04Å; Y417-L579 WeakPolarHBondContact CD2-O 3.18Å; Y417-L579 HydrophobicContact CE1-CB 4.18Å; Y417-L579 HydrophobicContact CE1-CD1 4.02Å; Y417-L579 HydrophobicContact CE2-CB 3.61Å; Y417-L579 HydrophobicContact CG-CB 4.49Å
418	F	95	Very high	93.2	Very high	18 Å²	18	27.3 Å²	27.3	8%	0.079	15%	0.145	C	C	.	.	H	α-helix	trans	-61.8	-45.3	173.4	-173.3	-105.7	0	0	0	111.8	V414 D415 V420 L421 V422 W576 M585 P586 W592	V414-F418 HydrophobicContact CG1-CD1 4.25Å; D415-F418 HydrophobicContact CB-CB 3.87Å; D415-F418 PolarHBondContact O-N 3.4Å; D415-F418 PolarHBondContact OD2-N 2.88Å; F418-V420 VanDerWaalsContact C-N 3.31Å; F418-V420 PolarHBondContact O-N 3.46Å; F418-L421 HydrophobicContact CD2-CD2 4.45Å; F418-L421 WeakPolarHBondContact O-CB 3.08Å; F418-L421 PolarHBondContact O-N 3.35Å; F418-V422 HydrophobicContact CD1-CG2 4.13Å; F418-V422 HydrophobicContact CD2-CG2 4.48Å; F418-V422 HydrophobicContact CE1-CG2 3.57Å; F418-V422 HydrophobicContact CE2-CG2 3.97Å; F418-V422 HydrophobicContact CZ-CG2 3.48Å; F418-V422 VanDerWaalsContact CZ-CG2 3.48Å; F418-V422 WeakPolarHBondContact O-CG2 3.26Å; F418-V422 PolarHBondContact O-N 2.97Å; F418-W576 HydrophobicContact CD2-CD2 4.29Å; F418-W576 AromaticContact CD2-CE2 3.63Å; F418-W576 HydrophobicContact CD2-CH2 4.46Å; F418-W576 AromaticContact CD2-CZ2 3.74Å; F418-W576 HydrophobicContact CD2-CZ2 3.74Å; F418-W576 AromaticContact CD2-NE1 3.7Å; F418-W576 HydrophobicContact CE2-CZ2 4.23Å; F418-M585 HydrophobicContact CD1-CE 4.17Å; F418-M585 HydrophobicContact CD1-SD 3.96Å; F418-M585 HydrophobicContact CD2-CE 4Å; F418-M585 HydrophobicContact CD2-SD 3.91Å; F418-M585 HydrophobicContact CE1-CE 3.63Å; F418-M585 HydrophobicContact CE1-SD 4.05Å; F418-M585 HydrophobicContact CE2-CE 3.44Å; F418-M585 VanDerWaalsContact CE2-CE 3.44Å; F418-M585 HydrophobicContact CE2-SD 4Å; F418-M585 HydrophobicContact CG-CE 4.34Å; F418-M585 HydrophobicContact CG-SD 3.9Å; F418-M585 HydrophobicContact CZ-CE 3.23Å; F418-M585 HydrophobicContact CZ-SD 4.06Å; F418-P586 HydrophobicContact CD1-CG 4.22Å; F418-P586 HydrophobicContact CE1-CG 3.85Å; F418-W592 HydrophobicContact CE1-CH2 4.16Å; F418-W592 HydrophobicContact CZ-CH2 4.1Å
419	A	94.6	Very high	93.5	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-61.2	-40.3	177.4	0	0	0	0	0	111.8	Y406 V414 D415 S416 R423 F464 L595	Y406-A419 HydrophobicContact CE2-CB 3.79Å; V414-A419 HydrophobicContact CG1-CB 4.33Å; D415-A419 WeakPolarHBondContact O-CB 3.45Å; D415-A419 PolarHBondContact O-N 2.87Å; S416-A419 PolarHBondContact O-N 3.41Å; A419-R423 WeakPolarHBondContact O-CB 3.31Å; A419-R423 PolarHBondContact O-N 2.84Å; A419-F464 HydrophobicContact CB-CD2 4Å; A419-F464 HydrophobicContact CB-CE2 3.86Å; A419-L595 HydrophobicContact CB-CD2 3.89Å
420	V	94.5	Very high	93.5	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-62.6	-48.4	172.3	177	0	0	0	0	110.9	S416 Y417 F418 V422 R423 V424 M461 F464 A572	S416-V420 WeakPolarHBondContact O-CG2 3.4Å; S416-V420 PolarHBondContact O-N 3.33Å; Y417-V420 PolarHBondContact O-N 3.04Å; F418-V420 VanDerWaalsContact C-N 3.31Å; F418-V420 PolarHBondContact O-N 3.46Å; V420-V422 PolarHBondContact O-N 3.46Å; V420-R423 WeakPolarHBondContact O-CB 3.36Å; V420-R423 PolarHBondContact O-N 3.22Å; V420-R423 VanDerWaalsContact O-N 3.16Å; V420-V424 HydrophobicContact CG1-CG1 4.24Å; V420-V424 WeakPolarHBondContact O-CG2 2.98Å; V420-V424 PolarHBondContact O-N 3.06Å; V420-M461 HydrophobicContact CB-CG 4.38Å; V420-M461 HydrophobicContact CG1-CG 4.11Å; V420-M461 HydrophobicContact CG2-CG 4.23Å; V420-F464 HydrophobicContact CG2-CB 4.15Å; V420-F464 HydrophobicContact CG2-CD2 3.38Å; V420-F464 HydrophobicContact CG2-CE2 3.98Å; V420-F464 HydrophobicContact CG2-CG 3.87Å; V420-A572 HydrophobicContact CG1-CB 4.09Å
421	L	96	Very high	93.4	Very high	21 Å²	21	25 Å²	25	11%	0.11	14%	0.143	C	C	.	.	H	α-helix	trans	-54.6	-50.3	-180	174.7	64.2	0	0	0	111.9	Y417 F418 G425 F569 A572 V573 W576	Y417-L421 WeakPolarHBondContact O-CB 3.04Å; Y417-L421 PolarHBondContact O-N 2.87Å; F418-L421 HydrophobicContact CD2-CD2 4.45Å; F418-L421 WeakPolarHBondContact O-CB 3.08Å; F418-L421 PolarHBondContact O-N 3.35Å; L421-G425 WeakPolarHBondContact O-CA 3.31Å; L421-G425 PolarHBondContact O-N 3.17Å; L421-F569 HydrophobicContact CD1-CD2 3.93Å; L421-F569 HydrophobicContact CD1-CE2 3.48Å; L421-F569 VanDerWaalsContact CD1-CE2 3.48Å; L421-F569 HydrophobicContact CD1-CZ 4.22Å; L421-F569 HydrophobicContact CG-CE2 4.49Å; L421-A572 HydrophobicContact CB-CB 4.38Å; L421-A572 HydrophobicContact CD1-CB 4.23Å; L421-V573 HydrophobicContact CD1-CB 4.32Å; L421-V573 HydrophobicContact CD1-CG2 3.48Å; L421-V573 VanDerWaalsContact CD1-CG2 3.48Å; L421-W576 HydrophobicContact CD2-CB 4.14Å; L421-W576 HydrophobicContact CD2-CD2 3.86Å; L421-W576 HydrophobicContact CD2-CE3 3.65Å; L421-W576 HydrophobicContact CD2-CG 4.08Å; L421-W576 HydrophobicContact CD2-CZ3 4.33Å
422	V	95.3	Very high	93.5	Very high	25 Å²	25	28.4 Å²	28.4	15%	0.152	16%	0.159	C	C	.	.	H	α-helix	trans	-63.7	-45	177.2	175.5	0	0	0	0	110.6	F418 V420 G425 L426 L595	F418-V422 HydrophobicContact CD1-CG2 4.13Å; F418-V422 HydrophobicContact CD2-CG2 4.48Å; F418-V422 HydrophobicContact CE1-CG2 3.57Å; F418-V422 HydrophobicContact CE2-CG2 3.97Å; F418-V422 HydrophobicContact CZ-CG2 3.48Å; F418-V422 VanDerWaalsContact CZ-CG2 3.48Å; F418-V422 WeakPolarHBondContact O-CG2 3.26Å; F418-V422 PolarHBondContact O-N 2.97Å; V420-V422 PolarHBondContact O-N 3.46Å; V422-G425 PolarHBondContact O-N 2.99Å; V422-L426 HydrophobicContact CG1-CD1 3.77Å; V422-L426 HydrophobicContact CG1-CG 4.17Å; V422-L426 WeakPolarHBondContact O-CB 3.32Å; V422-L426 VanDerWaalsContact O-CG 3.28Å; V422-L426 WeakPolarHBondContact O-CG 3.46Å; V422-L426 PolarHBondContact O-N 3.24Å; V422-L595 HydrophobicContact CG1-CB 4.05Å; V422-L595 HydrophobicContact CG1-CD1 4.41Å
423	R	94.6	Very high	93.6	Very high	10 Å²	10	31.8 Å²	31.8	4%	0.038	18%	0.175	C	C	.	.	H	α-helix	trans	-58.8	-52.6	-179.2	-177.4	173.8	-170.9	155.9	7.6	112.2	A419 V420 A427 Y460 F464 L598 G599 S603	A419-R423 WeakPolarHBondContact O-CB 3.31Å; A419-R423 PolarHBondContact O-N 2.84Å; V420-R423 WeakPolarHBondContact O-CB 3.36Å; V420-R423 PolarHBondContact O-N 3.22Å; V420-R423 VanDerWaalsContact O-N 3.16Å; R423-A427 WeakPolarHBondContact O-CB 3.08Å; R423-A427 PolarHBondContact O-N 3.49Å; R423-Y460 VanDerWaalsContact CZ-CZ 3.48Å; R423-Y460 VanDerWaalsContact CZ-OH 3.27Å; R423-Y460 VanDerWaalsContact NE-CZ 3.33Å; R423-Y460 PolarHBondContact NE-OH 3.46Å; R423-Y460 PolarHBondContact NH2-OH 2.88Å; R423-Y460 VanDerWaalsContact NH2-OH 3.12Å; R423-F464 VanDerWaalsContact NH1-CZ 3.34Å; R423-L598 HydrophobicContact CG-CB 4.33Å; R423-L598 PolarHBondContact NE-O 2.83Å; R423-G599 VanDerWaalsContact O-CA 3.24Å; R423-G599 WeakPolarHBondContact O-CA 3.31Å; R423-S603 WeakPolarHBondContact CG-OG 3.4Å; R423-S603 PolarHBondContact NE-OG 3.05Å
424	V	94.9	Very high	93.4	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-75.6	-28.9	-179.4	-56.6	0	0	0	0	112.2	V420 A427 A428 Y460 A568 F569 A572	V420-V424 HydrophobicContact CG1-CG1 4.24Å; V420-V424 WeakPolarHBondContact O-CG2 2.98Å; V420-V424 PolarHBondContact O-N 3.06Å; V424-A427 PolarHBondContact O-N 3.31Å; V424-A428 WeakPolarHBondContact O-CB 3.35Å; V424-A428 PolarHBondContact O-N 2.76Å; V424-Y460 HydrophobicContact CG1-CD2 4.02Å; V424-Y460 HydrophobicContact CG1-CE2 4.43Å; V424-A568 HydrophobicContact CB-CB 4.3Å; V424-A568 HydrophobicContact CG1-CB 4.3Å; V424-F569 HydrophobicContact CG2-CB 4.26Å; V424-F569 HydrophobicContact CG2-CD2 4.22Å; V424-A572 HydrophobicContact CG2-CB 3.69Å
425	G	96.2	Very high	93.1	Very high	11 Å²	11	33.1 Å²	33.1	11%	0.113	18%	0.181	C	C	.	.	H	α-helix	trans	-67	-46.6	175.6	0	0	0	0	0	112.5	L421 V422 A427 A428 L429 F569	L421-G425 WeakPolarHBondContact O-CA 3.31Å; L421-G425 PolarHBondContact O-N 3.17Å; V422-G425 PolarHBondContact O-N 2.99Å; G425-A427 VanDerWaalsContact C-N 3.32Å; G425-A427 PolarHBondContact O-N 3.29Å; G425-A428 WeakPolarHBondContact O-CB 3.38Å; G425-A428 PolarHBondContact O-N 3.48Å; G425-L429 WeakPolarHBondContact O-CG 3.36Å; G425-L429 PolarHBondContact O-N 3.35Å; G425-F569 VanDerWaalsContact CA-CD2 3.43Å
426	L	95.7	Very high	92.6	Very high	43 Å²	43	40.6 Å²	40.6	23%	0.225	21%	0.208	C	C	.	.	H	α-helix	trans	-62.3	-40.8	173.6	-71	176.8	0	0	0	111.6	V422 L429 V430 V596 V600	V422-L426 HydrophobicContact CG1-CD1 3.77Å; V422-L426 HydrophobicContact CG1-CG 4.17Å; V422-L426 WeakPolarHBondContact O-CB 3.32Å; V422-L426 VanDerWaalsContact O-CG 3.28Å; V422-L426 WeakPolarHBondContact O-CG 3.46Å; V422-L426 PolarHBondContact O-N 3.24Å; L426-L429 HydrophobicContact CD2-CD1 4.34Å; L426-L429 WeakPolarHBondContact O-CB 3.4Å; L426-L429 PolarHBondContact O-N 2.57Å; L426-V430 WeakPolarHBondContact O-CG2 3.27Å; L426-V430 PolarHBondContact O-N 3.41Å; L426-V596 HydrophobicContact CD1-CB 4.42Å; L426-V596 HydrophobicContact CD1-CG2 4.11Å; L426-V600 HydrophobicContact CB-CG2 4.25Å
427	A	93.6	Very high	91.7	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-64	-39.5	174.8	0	0	0	0	0	112.2	R423 V424 G425 L429 V430 F431 Y565 G599	R423-A427 WeakPolarHBondContact O-CB 3.08Å; R423-A427 PolarHBondContact O-N 3.49Å; V424-A427 PolarHBondContact O-N 3.31Å; G425-A427 VanDerWaalsContact C-N 3.32Å; G425-A427 PolarHBondContact O-N 3.29Å; A427-L429 VanDerWaalsContact C-N 3.32Å; A427-L429 PolarHBondContact O-N 2.71Å; A427-V430 WeakPolarHBondContact O-CB 3.3Å; A427-V430 PolarHBondContact O-N 2.81Å; A427-F431 WeakPolarHBondContact O-CD2 3.37Å; A427-Y565 HydrophobicContact CB-CD1 3.59Å; A427-Y565 HydrophobicContact CB-CE1 3.21Å; A427-Y565 HydrophobicContact CB-CE2 4.2Å; A427-Y565 HydrophobicContact CB-CG 4.25Å; A427-G599 WeakPolarHBondContact CB-O 3.28Å
428	A	94	Very high	90.7	Very high	12 Å²	12	55 Å²	55	10%	0.099	27%	0.272	C	S	.	.	H	α-helix	trans	-61.5	-39.9	173.7	0	0	0	0	0	112	V424 G425 V430 F431 L432	V424-A428 WeakPolarHBondContact O-CB 3.35Å; V424-A428 PolarHBondContact O-N 2.76Å; G425-A428 WeakPolarHBondContact O-CB 3.38Å; G425-A428 PolarHBondContact O-N 3.48Å; A428-V430 VanDerWaalsContact C-N 3.32Å; A428-V430 PolarHBondContact O-N 3.36Å; A428-F431 PolarHBondContact O-N 2.99Å; A428-F431 VanDerWaalsContact O-N 3.16Å; A428-L432 PolarHBondContact O-N 2.93Å
429	L	94.1	Very high	89.7	Confident	106 Å²	106	58.2 Å²	58.2	56%	0.555	31%	0.31	S	S	*	.	H	α-helix	trans	-62.5	-36.1	176.7	-71.9	173.1	0	0	0	112.7	G425 L426 A427 F431 L432 P433	G425-L429 WeakPolarHBondContact O-CG 3.36Å; G425-L429 PolarHBondContact O-N 3.35Å; L426-L429 HydrophobicContact CD2-CD1 4.34Å; L426-L429 WeakPolarHBondContact O-CB 3.4Å; L426-L429 PolarHBondContact O-N 2.57Å; A427-L429 VanDerWaalsContact C-N 3.32Å; A427-L429 PolarHBondContact O-N 2.71Å; L429-F431 PolarHBondContact O-N 3.41Å; L429-L432 HydrophobicContact CD2-CD2 4.16Å; L429-L432 PolarHBondContact O-N 2.85Å; L429-P433 WeakPolarHBondContact O-CD 3.05Å
430	V	91.5	Very high	89	Confident	49 Å²	49	60.4 Å²	60.4	30%	0.297	32%	0.321	S	S	.	.	H	α-helix	trans	-60	-36.2	175	174.1	0	0	0	0	111.6	L426 A427 A428 V600	L426-V430 WeakPolarHBondContact O-CG2 3.27Å; L426-V430 PolarHBondContact O-N 3.41Å; A427-V430 WeakPolarHBondContact O-CB 3.3Å; A427-V430 PolarHBondContact O-N 2.81Å; A428-V430 VanDerWaalsContact C-N 3.32Å; A428-V430 PolarHBondContact O-N 3.36Å; V430-V600 HydrophobicContact CG2-CB 4.4Å; V430-V600 HydrophobicContact CG2-CG1 3.93Å; V430-V600 HydrophobicContact CG2-CG2 4.32Å
431	F	91.4	Very high	88.6	Confident	12 Å²	12	63.4 Å²	63.4	5%	0.053	34%	0.342	C	S	.	.	H	α-helix	trans	-97.3	-8.7	-177.7	-71.2	-84	0	0	0	114.5	A427 A428 L429 P433 F434 F561 A562 Y565 G604 F608	A427-F431 WeakPolarHBondContact O-CD2 3.37Å; A428-F431 PolarHBondContact O-N 2.99Å; A428-F431 VanDerWaalsContact O-N 3.16Å; L429-F431 PolarHBondContact O-N 3.41Å; F431-P433 VanDerWaalsContact C-CD 3.43Å; F431-F434 HydrophobicContact CD1-CD2 4.41Å; F431-F434 WeakPolarHBondContact O-CB 3.49Å; F431-F434 PolarHBondContact O-N 3.49Å; F431-F561 HydrophobicContact CD1-CB 3.73Å; F431-F561 HydrophobicContact CE1-CB 3.93Å; F431-F561 HydrophobicContact CE1-CG 4.47Å; F431-F561 HydrophobicContact CG-CB 4.07Å; F431-F561 HydrophobicContact CZ-CB 4.44Å; F431-A562 HydrophobicContact CB-CB 4.1Å; F431-A562 WeakPolarHBondContact O-CB 3.21Å; F431-Y565 AromaticContact CD2-CD2 3.63Å; F431-Y565 HydrophobicContact CD2-CD2 3.63Å; F431-Y565 AromaticContact CD2-CE2 3.63Å; F431-Y565 HydrophobicContact CD2-CE2 3.63Å; F431-Y565 HydrophobicContact CE2-CD2 4.19Å; F431-Y565 AromaticContact CE2-CE2 3.69Å; F431-Y565 HydrophobicContact CE2-CE2 3.69Å; F431-Y565 HydrophobicContact CG-CD2 4.32Å; F431-G604 VanDerWaalsContact CE2-O 3.29Å; F431-G604 WeakPolarHBondContact CE2-O 3.33Å; F431-F608 HydrophobicContact CE1-CB 4.36Å; F431-F608 AromaticContact CE1-CD2 3.59Å; F431-F608 HydrophobicContact CE1-CD2 3.59Å; F431-F608 HydrophobicContact CE1-CE2 4.09Å; F431-F608 HydrophobicContact CE1-CG 4.01Å; F431-F608 HydrophobicContact CE2-CB 4.41Å; F431-F608 HydrophobicContact CZ-CB 3.61Å; F431-F608 AromaticContact CZ-CD2 3.73Å; F431-F608 HydrophobicContact CZ-CD2 3.73Å; F431-F608 AromaticContact CZ-CG 3.72Å; F431-F608 HydrophobicContact CZ-CG 3.72Å
432	L	90.4	Very high	88.3	Confident	86 Å²	86	70 Å²	70	45%	0.45	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-55.8	-40	-179.3	-168.5	66.9	0	0	0	113.6	A428 L429 F434 L435	A428-L432 PolarHBondContact O-N 2.93Å; L429-L432 HydrophobicContact CD2-CD2 4.16Å; L429-L432 PolarHBondContact O-N 2.85Å; L432-F434 PolarHBondContact O-N 3.23Å; L432-F434 VanDerWaalsContact O-N 3.11Å; L432-L435 HydrophobicContact CD1-CD2 4.15Å; L432-L435 VanDerWaalsContact O-CB 3.27Å; L432-L435 WeakPolarHBondContact O-CB 3.42Å; L432-L435 PolarHBondContact O-N 2.85Å; L432-L435 VanDerWaalsContact O-N 3.11Å
433	P	89.4	Confident	88.1	Confident	108 Å²	108	76.7 Å²	76.7	70%	0.701	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-61.2	-19.8	176.1	-24.2	35.4	0	0	0	114.3	L429 F431	L429-P433 WeakPolarHBondContact O-CD 3.05Å; F431-P433 VanDerWaalsContact C-CD 3.43Å
434	F	86.3	Confident	87.9	Confident	98 Å²	98	77 Å²	77	43%	0.43	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-97.6	0.4	-178.4	-57.8	-76.2	0	0	0	113.2	F431 L432 R436 H558 N559	F431-F434 HydrophobicContact CD1-CD2 4.41Å; F431-F434 WeakPolarHBondContact O-CB 3.49Å; F431-F434 PolarHBondContact O-N 3.49Å; L432-F434 PolarHBondContact O-N 3.23Å; L432-F434 VanDerWaalsContact O-N 3.11Å; F434-R436 PolarHBondContact O-N 3.22Å; F434-H558 HydrophobicContact CB-CB 3.94Å; F434-H558 HydrophobicContact CD1-CB 4.13Å; F434-H558 HydrophobicContact CG-CB 3.97Å; F434-N559 PolarHBondContact O-OD1 2.93Å
435	L	87.4	Confident	87.8	Confident	54 Å²	54	77.9 Å²	77.9	28%	0.283	41%	0.412	S	S	.	.			trans	-67.3	114.8	-179.6	-172.5	72.2	0	0	0	110.5	L432 A562 W563 L566	L432-L435 HydrophobicContact CD1-CD2 4.15Å; L432-L435 VanDerWaalsContact O-CB 3.27Å; L432-L435 WeakPolarHBondContact O-CB 3.42Å; L432-L435 PolarHBondContact O-N 2.85Å; L432-L435 VanDerWaalsContact O-N 3.11Å; L435-A562 HydrophobicContact CB-CB 4.05Å; L435-A562 HydrophobicContact CD1-CB 3.65Å; L435-A562 HydrophobicContact CG-CB 4.49Å; L435-W563 HydrophobicContact CD1-CD2 3.71Å; L435-W563 HydrophobicContact CD1-CE3 4.09Å; L435-W563 HydrophobicContact CD1-CG 4.2Å; L435-W563 HydrophobicContact CD1-CH2 4.16Å; L435-W563 HydrophobicContact CD1-CZ2 3.77Å; L435-W563 HydrophobicContact CD1-CZ3 4.3Å; L435-W563 HydrophobicContact CG-CZ2 4.37Å; L435-L566 HydrophobicContact CD1-CD1 3.72Å; L435-L566 HydrophobicContact CD2-CD1 4.02Å
436	R	81.3	Confident	87.7	Confident	169 Å²	169	79.1 Å²	79.1	64%	0.638	43%	0.425	S	S	*	.			trans	-119.1	116.8	174.2	-66.3	-175.2	179.4	-175	0.5	110.4	F434 N440 N559	F434-R436 PolarHBondContact O-N 3.22Å; R436-N440 PolarHBondContact O-ND2 3.06Å; R436-N559 PolarHBondContact N-OD1 2.89Å; R436-N559 PolarHBondContact O-ND2 3.02Å; R436-N559 PolarHBondContact O-OD1 3.06Å
437	T	75.8	Confident	87.7	Confident	97 Å²	97	79.9 Å²	79.9	60%	0.595	43%	0.429	S	S	*	.			trans	-86.5	-29.7	179.6	54.7	0	0	0	0	112.9	W563	T437-W563 HydrophobicContact CG2-CH2 3.99Å; T437-W563 HydrophobicContact CG2-CZ2 3.77Å
438	R	73.3	Confident	87.7	Confident	237 Å²	237	79.9 Å²	79.9	89%	0.894	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	134.4	179.9	-69.8	-173.8	177.8	178	0	111.6
439	G	74.4	Confident	87.8	Confident	85 Å²	85	81.6 Å²	81.6	88%	0.876	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.6	-8.6	173.1	0	0	0	0	0	116.2
440	N	78.7	Confident	87.9	Confident	45 Å²	45	81.4 Å²	81.4	24%	0.241	44%	0.435	C	S	.	.	S	Bend	trans	-110	135.3	-179	-61.2	-59.2	0	0	0	111.4	R436 V445 M555 N559	R436-N440 PolarHBondContact O-ND2 3.06Å; N440-V445 HydrophobicContact CB-CG2 3.86Å; N440-M555 HydrophobicContact CB-CE 3.97Å; N440-M555 VanDerWaalsContact CG-CE 3.45Å; N440-M555 WeakPolarHBondContact OD1-CE 3.39Å; N440-N559 PolarHBondContact ND2-ND2 2.95Å; N440-N559 VanDerWaalsContact ND2-ND2 3.19Å
441	S	85.9	Confident	88	Confident	63 Å²	63	80 Å²	80	44%	0.441	43%	0.426	S	S	.	.			trans	-66.1	142.6	175.5	87.8	0	0	0	0	111	K443 T444 V445	S441-K443 PolarHBondContact O-N 2.99Å; S441-K443 VanDerWaalsContact O-N 3.15Å; S441-T444 WeakPolarHBondContact O-CA 3.45Å; S441-T444 WeakPolarHBondContact O-CB 3.46Å; S441-T444 PolarHBondContact O-N 3.33Å; S441-T444 PolarHBondContact OG-N 2.7Å; S441-T444 VanDerWaalsContact OG-N 3.09Å; S441-T444 PolarHBondContact OG-OG1 3.28Å; S441-V445 PolarHBondContact O-N 3.39Å
442	L	89.3	Confident	88.2	Confident	161 Å²	161	79.4 Å²	79.4	84%	0.843	42%	0.423	S	S	*	.	H	α-helix	trans	-56	-34	178.5	-158.1	106.6	0	0	0	111.9	V445 G446	L442-V445 PolarHBondContact O-N 3.38Å; L442-G446 PolarHBondContact O-N 3.38Å
443	K	91.8	Very high	88.5	Confident	165 Å²	165	75.7 Å²	75.7	72%	0.717	41%	0.406	S	S	*	.	H	α-helix	trans	-65.1	-40.5	174.2	-67.5	-176	179.9	179	0	112.2	S441 L447	S441-K443 PolarHBondContact O-N 2.99Å; S441-K443 VanDerWaalsContact O-N 3.15Å; K443-L447 VanDerWaalsContact O-CG 3.3Å; K443-L447 WeakPolarHBondContact O-CG 3.32Å; K443-L447 PolarHBondContact O-N 3.14Å; K443-L447 VanDerWaalsContact O-N 3.15Å
444	T	90.9	Very high	88.7	Confident	17 Å²	17	72.9 Å²	72.9	10%	0.104	38%	0.384	C	S	.	.	H	α-helix	trans	-66.8	-45.9	177.1	-56.2	0	0	0	0	110.6	S441 L447 Y448 R553 M555	S441-T444 WeakPolarHBondContact O-CA 3.45Å; S441-T444 WeakPolarHBondContact O-CB 3.46Å; S441-T444 PolarHBondContact O-N 3.33Å; S441-T444 PolarHBondContact OG-N 2.7Å; S441-T444 VanDerWaalsContact OG-N 3.09Å; S441-T444 PolarHBondContact OG-OG1 3.28Å; T444-L447 PolarHBondContact O-N 2.99Å; T444-Y448 HydrophobicContact CG2-CD2 3.86Å; T444-Y448 HydrophobicContact CG2-CE2 3.65Å; T444-Y448 VanDerWaalsContact O-CD2 3.32Å; T444-Y448 WeakPolarHBondContact O-CD2 3.48Å; T444-Y448 PolarHBondContact O-N 3.44Å; T444-Y448 VanDerWaalsContact O-N 3.1Å; T444-R553 HydrophobicContact CG2-CB 3.9Å; T444-R553 WeakPolarHBondContact OG1-CD 3.22Å; T444-M555 HydrophobicContact CG2-CE 4.18Å
445	V	92.8	Very high	89.1	Confident	17 Å²	17	68.2 Å²	68.2	10%	0.103	36%	0.363	C	S	.	.	H	α-helix	trans	-58.7	-49.6	176.6	172.8	0	0	0	0	111.2	N440 S441 L442 L447 Y448 M449 W563	N440-V445 HydrophobicContact CB-CG2 3.86Å; S441-V445 PolarHBondContact O-N 3.39Å; L442-V445 PolarHBondContact O-N 3.38Å; V445-L447 VanDerWaalsContact C-N 3.27Å; V445-L447 PolarHBondContact O-N 3.14Å; V445-Y448 PolarHBondContact O-N 2.78Å; V445-Y448 VanDerWaalsContact O-N 3.16Å; V445-M449 HydrophobicContact CG1-CG 4.4Å; V445-M449 HydrophobicContact CG1-SD 4.07Å; V445-M449 WeakPolarHBondContact O-CG 3.38Å; V445-M449 PolarHBondContact O-N 2.92Å; V445-W563 HydrophobicContact CB-CD2 4.44Å; V445-W563 HydrophobicContact CG1-CD2 3.36Å; V445-W563 HydrophobicContact CG1-CE3 3.32Å; V445-W563 HydrophobicContact CG1-CG 3.93Å; V445-W563 HydrophobicContact CG1-CH2 4Å; V445-W563 HydrophobicContact CG1-CZ2 4.04Å; V445-W563 HydrophobicContact CG1-CZ3 3.65Å; V445-W563 HydrophobicContact CG2-CD2 4.4Å; V445-W563 HydrophobicContact CG2-CZ2 4.38Å
446	G	94.4	Very high	89.4	Confident	37 Å²	37	65.7 Å²	65.7	38%	0.381	35%	0.35	S	S	.	.	H	α-helix	trans	-59.1	-35.1	178.1	0	0	0	0	0	113.6	L442 L450	L442-G446 PolarHBondContact O-N 3.38Å; G446-L450 WeakPolarHBondContact O-CB 3.36Å; G446-L450 PolarHBondContact O-N 3.49Å
447	L	94.3	Very high	90	Very high	60 Å²	60	57.6 Å²	57.6	31%	0.314	32%	0.319	S	S	.	.	H	α-helix	trans	-68.7	-44.4	174.9	-73.3	173.3	0	0	0	112.4	K443 T444 V445 M449 L450 V451 L549	K443-L447 VanDerWaalsContact O-CG 3.3Å; K443-L447 WeakPolarHBondContact O-CG 3.32Å; K443-L447 PolarHBondContact O-N 3.14Å; K443-L447 VanDerWaalsContact O-N 3.15Å; T444-L447 PolarHBondContact O-N 2.99Å; V445-L447 VanDerWaalsContact C-N 3.27Å; V445-L447 PolarHBondContact O-N 3.14Å; L447-M449 VanDerWaalsContact C-N 3.31Å; L447-M449 PolarHBondContact O-N 3.38Å; L447-L450 PolarHBondContact O-N 3.19Å; L447-V451 VanDerWaalsContact O-CG2 3.31Å; L447-V451 WeakPolarHBondContact O-CG2 3.41Å; L447-V451 PolarHBondContact O-N 3.4Å; L447-L549 HydrophobicContact CB-CD1 3.9Å; L447-L549 HydrophobicContact CB-CD2 3.8Å; L447-L549 HydrophobicContact CD1-CD2 3.78Å; L447-L549 HydrophobicContact CG-CD2 4.36Å
448	Y	94	Very high	91	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-62	-40.6	175.5	-81.7	-70.3	0	0	0	111.8	T444 V445 V451 G452 Y546 L549 M550 R553 M555 A560	T444-Y448 HydrophobicContact CG2-CD2 3.86Å; T444-Y448 HydrophobicContact CG2-CE2 3.65Å; T444-Y448 VanDerWaalsContact O-CD2 3.32Å; T444-Y448 WeakPolarHBondContact O-CD2 3.48Å; T444-Y448 PolarHBondContact O-N 3.44Å; T444-Y448 VanDerWaalsContact O-N 3.1Å; V445-Y448 PolarHBondContact O-N 2.78Å; V445-Y448 VanDerWaalsContact O-N 3.16Å; Y448-V451 PolarHBondContact O-N 2.99Å; Y448-G452 PolarHBondContact O-N 3.06Å; Y448-Y546 HydrophobicContact CD1-CD2 4.15Å; Y448-Y546 HydrophobicContact CD1-CE2 4.11Å; Y448-Y546 HydrophobicContact CE1-CD2 4.08Å; Y448-Y546 AromaticContact CE1-CE2 3.94Å; Y448-Y546 HydrophobicContact CE1-CE2 3.94Å; Y448-L549 HydrophobicContact CD1-CB 4.43Å; Y448-L549 HydrophobicContact CD1-CD1 3.91Å; Y448-L549 HydrophobicContact CE1-CB 3.72Å; Y448-L549 HydrophobicContact CE1-CD1 4.05Å; Y448-L549 HydrophobicContact CE2-CB 4.41Å; Y448-L549 HydrophobicContact CG-CD1 4.14Å; Y448-L549 PolarHBondContact OH-O 3.06Å; Y448-M550 HydrophobicContact CE1-CE 3.51Å; Y448-M550 WeakPolarHBondContact OH-CE 3.24Å; Y448-R553 PolarHBondContact OH-O 3.46Å; Y448-M555 HydrophobicContact CD2-CE 3.89Å; Y448-M555 HydrophobicContact CE2-CB 4.2Å; Y448-M555 HydrophobicContact CE2-CE 3.97Å; Y448-A560 HydrophobicContact CD1-CB 4.19Å; Y448-A560 HydrophobicContact CE1-CB 4.05Å
449	M	95.9	Very high	92	Very high	47 Å²	47	44.1 Å²	44.1	23%	0.232	26%	0.263	C	S	.	.	H	α-helix	trans	-60.7	-45	173.2	-69.4	-178.9	74.3	0	0	111.8	V445 L447 V451 G452 A453 W563 L566 G567	V445-M449 HydrophobicContact CG1-CG 4.4Å; V445-M449 HydrophobicContact CG1-SD 4.07Å; V445-M449 WeakPolarHBondContact O-CG 3.38Å; V445-M449 PolarHBondContact O-N 2.92Å; L447-M449 VanDerWaalsContact C-N 3.31Å; L447-M449 PolarHBondContact O-N 3.38Å; M449-V451 PolarHBondContact O-N 2.96Å; M449-G452 PolarHBondContact O-N 3.04Å; M449-A453 VanDerWaalsContact O-CB 3.3Å; M449-A453 WeakPolarHBondContact O-CB 3.36Å; M449-A453 PolarHBondContact O-N 3.42Å; M449-W563 HydrophobicContact CG-CB 4.31Å; M449-W563 HydrophobicContact CG-CE3 4.24Å; M449-W563 VanDerWaalsContact CG-O 3.27Å; M449-W563 WeakPolarHBondContact CG-O 3.39Å; M449-W563 HydrophobicContact SD-CE3 3.98Å; M449-W563 HydrophobicContact SD-CZ3 4.35Å; M449-L566 HydrophobicContact CE-CB 4.37Å; M449-G567 WeakPolarHBondContact O-CA 3.39Å
450	L	96.1	Very high	93	Very high	103 Å²	103	40.6 Å²	40.6	54%	0.539	22%	0.223	S	C	.	.	H	α-helix	trans	-62.8	-42.5	178.7	-179.3	65.9	0	0	0	112	G446 L447 A453 M454	G446-L450 WeakPolarHBondContact O-CB 3.36Å; G446-L450 PolarHBondContact O-N 3.49Å; L447-L450 PolarHBondContact O-N 3.19Å; L450-A453 WeakPolarHBondContact O-CB 3.31Å; L450-A453 PolarHBondContact O-N 3.33Å; L450-M454 WeakPolarHBondContact O-CG 3.41Å; L450-M454 PolarHBondContact O-N 2.95Å
451	V	94.6	Very high	93.7	Very high	18 Å²	18	39.6 Å²	39.6	11%	0.109	22%	0.217	C	C	.	.	H	α-helix	trans	-64.9	-42.1	177.9	176.7	0	0	0	0	110.7	L447 Y448 M449 M454 Q455 G542 L549 F564	L447-V451 VanDerWaalsContact O-CG2 3.31Å; L447-V451 WeakPolarHBondContact O-CG2 3.41Å; L447-V451 PolarHBondContact O-N 3.4Å; Y448-V451 PolarHBondContact O-N 2.99Å; M449-V451 PolarHBondContact O-N 2.96Å; V451-M454 PolarHBondContact O-N 2.72Å; V451-Q455 WeakPolarHBondContact O-CB 3.42Å; V451-Q455 PolarHBondContact O-N 3.26Å; V451-G542 WeakPolarHBondContact CG1-O 3.3Å; V451-L549 HydrophobicContact CB-CD1 4.28Å; V451-L549 HydrophobicContact CG2-CD1 3.53Å; V451-L549 HydrophobicContact CG2-CG 4.48Å; V451-F564 HydrophobicContact CB-CE2 4.33Å; V451-F564 HydrophobicContact CG1-CD2 4.34Å; V451-F564 HydrophobicContact CG1-CE2 3.73Å
452	G	94.9	Very high	94.2	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-66.7	-38.4	174.7	0	0	0	0	0	113.7	Y448 M449 M454 Q455 L456 G457 F564	Y448-G452 PolarHBondContact O-N 3.06Å; M449-G452 PolarHBondContact O-N 3.04Å; G452-M454 VanDerWaalsContact C-N 3.29Å; G452-M454 PolarHBondContact O-N 3.06Å; G452-Q455 PolarHBondContact O-N 3.35Å; G452-L456 PolarHBondContact O-N 3.49Å; G452-G457 PolarHBondContact O-N 3.13Å; G452-F564 VanDerWaalsContact CA-CD2 3.4Å; G452-F564 VanDerWaalsContact CA-CE2 3.44Å; G452-F564 WeakPolarHBondContact CA-O 3.41Å
453	A	96.4	Very high	94.3	Very high	9 Å²	9	31 Å²	31	7%	0.074	17%	0.168	C	C	.	.	I	π-helix	trans	-55.7	-43.5	172	0	0	0	0	0	112	M449 L450 G457 V458 V571	M449-A453 VanDerWaalsContact O-CB 3.3Å; M449-A453 WeakPolarHBondContact O-CB 3.36Å; M449-A453 PolarHBondContact O-N 3.42Å; L450-A453 WeakPolarHBondContact O-CB 3.31Å; L450-A453 PolarHBondContact O-N 3.33Å; A453-G457 CarbonylContact O-C 3.58Å; A453-G457 VanDerWaalsContact O-CA 3.23Å; A453-G457 WeakPolarHBondContact O-CA 3.48Å; A453-G457 PolarHBondContact O-N 2.92Å; A453-G457 VanDerWaalsContact O-N 3.12Å; A453-V458 PolarHBondContact O-N 3.31Å; A453-V571 HydrophobicContact CB-CG2 3.68Å
454	M	95.1	Very high	94.4	Very high	49 Å²	49	23.3 Å²	23.3	24%	0.241	13%	0.134	C	C	.	.	I	π-helix	trans	-73.3	-51.3	176.7	-67.8	-62.2	-68.2	0	0	112.5	L450 V451 G452 L456 V458 M459 T538 I541	L450-M454 WeakPolarHBondContact O-CG 3.41Å; L450-M454 PolarHBondContact O-N 2.95Å; V451-M454 PolarHBondContact O-N 2.72Å; G452-M454 VanDerWaalsContact C-N 3.29Å; G452-M454 PolarHBondContact O-N 3.06Å; M454-L456 PolarHBondContact O-N 2.78Å; M454-V458 HydrophobicContact SD-CG2 4.15Å; M454-M459 WeakPolarHBondContact O-CB 3.33Å; M454-M459 PolarHBondContact O-N 2.9Å; M454-T538 HydrophobicContact CE-CG2 3.79Å; M454-I541 HydrophobicContact CE-CD1 4.29Å; M454-I541 HydrophobicContact CE-CG2 4.46Å
455	Q	93.5	Very high	94.5	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.147	C	C	.	.	I	π-helix	trans	-67.1	-35.9	-171.2	-162.2	167.5	-17.7	0	0	112.8	V451 G452 M459 F539 G542 F564 N611	V451-Q455 WeakPolarHBondContact O-CB 3.42Å; V451-Q455 PolarHBondContact O-N 3.26Å; G452-Q455 PolarHBondContact O-N 3.35Å; Q455-M459 WeakPolarHBondContact O-CB 3.45Å; Q455-M459 WeakPolarHBondContact O-CE 3.34Å; Q455-M459 WeakPolarHBondContact O-CG 3.34Å; Q455-F539 HydrophobicContact CG-CD2 4.22Å; Q455-G542 PolarHBondContact OE1-O 3.14Å; Q455-F564 HydrophobicContact CB-CE1 4.45Å; Q455-F564 HydrophobicContact CB-CE2 4.33Å; Q455-F564 HydrophobicContact CB-CZ 3.64Å; Q455-F564 HydrophobicContact CG-CZ 4.12Å; Q455-N611 PolarHBondContact NE2-OD1 3.37Å
456	L	93.3	Very high	94.4	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.142	C	C	.	.	I	π-helix	trans	-117.6	-45.8	-173.6	-65.4	-174.6	0	0	0	112.4	G452 M454 M459 Y460 F564 Y565 A568 Y607	G452-L456 PolarHBondContact O-N 3.49Å; M454-L456 PolarHBondContact O-N 2.78Å; L456-M459 HydrophobicContact CD2-CE 4.08Å; L456-Y460 HydrophobicContact CB-CD2 4.35Å; L456-Y460 HydrophobicContact CB-CE2 4.39Å; L456-Y460 HydrophobicContact CD2-CD2 4.49Å; L456-Y460 HydrophobicContact CD2-CE2 3.83Å; L456-Y460 WeakPolarHBondContact O-CB 3.34Å; L456-Y460 WeakPolarHBondContact O-CD2 3.4Å; L456-Y460 PolarHBondContact O-N 3.28Å; L456-F564 HydrophobicContact CD1-CD1 4.03Å; L456-F564 HydrophobicContact CD1-CE1 3.49Å; L456-F564 VanDerWaalsContact CD1-CE1 3.49Å; L456-F564 HydrophobicContact CG-CE1 3.76Å; L456-F564 HydrophobicContact CG-CZ 4.44Å; L456-Y565 HydrophobicContact CD1-CD1 3.71Å; L456-Y565 HydrophobicContact CD1-CE1 3.13Å; L456-A568 HydrophobicContact CB-CB 3.83Å; L456-Y607 HydrophobicContact CD2-CD1 3.5Å; L456-Y607 VanDerWaalsContact CD2-CD1 3.5Å; L456-Y607 HydrophobicContact CD2-CD2 4.04Å; L456-Y607 HydrophobicContact CD2-CE1 3.21Å; L456-Y607 HydrophobicContact CD2-CE2 3.86Å; L456-Y607 HydrophobicContact CD2-CG 3.85Å; L456-Y607 HydrophobicContact CG-CD1 4.49Å; L456-Y607 HydrophobicContact CG-CE1 4.47Å
457	G	95.3	Very high	94.3	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.128	C	C	.	.	I	π-helix	trans	-64.8	-72.2	-178	0	0	0	0	0	112.2	G452 A453 M459 Y460 M461	G452-G457 PolarHBondContact O-N 3.13Å; A453-G457 CarbonylContact O-C 3.58Å; A453-G457 VanDerWaalsContact O-CA 3.23Å; A453-G457 WeakPolarHBondContact O-CA 3.48Å; A453-G457 PolarHBondContact O-N 2.92Å; A453-G457 VanDerWaalsContact O-N 3.12Å; G457-M459 PolarHBondContact O-N 3.46Å; G457-Y460 PolarHBondContact O-N 2.89Å; G457-M461 VanDerWaalsContact C-CE 3.43Å; G457-M461 VanDerWaalsContact O-CE 3.24Å; G457-M461 WeakPolarHBondContact O-CE 3.47Å; G457-M461 WeakPolarHBondContact O-CG 3.33Å; G457-M461 PolarHBondContact O-N 3.5Å; G457-M461 VanDerWaalsContact O-N 3.12Å
458	V	96	Very high	94	Very high	42 Å²	42	27.2 Å²	27.2	26%	0.255	14%	0.136	S	C	.	.	I	π-helix	trans	-57.9	-47.4	-178.7	-178	0	0	0	0	111.2	A453 M454 Y460 M461 L462 T538 V571	A453-V458 PolarHBondContact O-N 3.31Å; M454-V458 HydrophobicContact SD-CG2 4.15Å; V458-Y460 PolarHBondContact O-N 3.18Å; V458-M461 HydrophobicContact CG2-CE 4.38Å; V458-M461 PolarHBondContact O-N 3.28Å; V458-L462 HydrophobicContact CG1-CD1 3.84Å; V458-L462 HydrophobicContact CG1-CG 4.4Å; V458-L462 WeakPolarHBondContact O-CG 3.24Å; V458-L462 PolarHBondContact O-N 3.5Å; V458-T538 HydrophobicContact CB-CG2 4.5Å; V458-T538 HydrophobicContact CG1-CG2 3.79Å; V458-V571 HydrophobicContact CG2-CG1 4.36Å
459	M	95.3	Very high	93.7	Very high	9 Å²	9	30.6 Å²	30.6	4%	0.044	15%	0.149	C	C	.	.	H	α-helix	trans	-53.9	-53.6	177	179.7	-74.5	-56.5	0	0	112.3	M454 Q455 L456 G457 M461 L462 S463 S535 T538 F539 Y607	M454-M459 WeakPolarHBondContact O-CB 3.33Å; M454-M459 PolarHBondContact O-N 2.9Å; Q455-M459 WeakPolarHBondContact O-CB 3.45Å; Q455-M459 WeakPolarHBondContact O-CE 3.34Å; Q455-M459 WeakPolarHBondContact O-CG 3.34Å; L456-M459 HydrophobicContact CD2-CE 4.08Å; G457-M459 PolarHBondContact O-N 3.46Å; M459-M461 VanDerWaalsContact C-N 3.34Å; M459-M461 PolarHBondContact O-N 3.39Å; M459-L462 PolarHBondContact O-N 3.32Å; M459-S463 WeakPolarHBondContact O-CB 3.37Å; M459-S463 PolarHBondContact O-N 3.06Å; M459-S535 WeakPolarHBondContact CG-OG 3.33Å; M459-S535 PolarHBondContact O-OG 3.32Å; M459-S535 VanDerWaalsContact O-OG 3.1Å; M459-T538 WeakPolarHBondContact CA-OG1 3.33Å; M459-F539 HydrophobicContact CE-CD2 4.49Å; M459-F539 HydrophobicContact CG-CB 3.71Å; M459-F539 HydrophobicContact CG-CD2 4.11Å; M459-F539 HydrophobicContact CG-CG 4.42Å; M459-F539 HydrophobicContact SD-CD2 4.46Å; M459-Y607 WeakPolarHBondContact CE-OH 3.29Å
460	Y	94.2	Very high	93.3	Very high	10 Å²	10	28.8 Å²	28.8	4%	0.039	14%	0.14	C	C	.	.	H	α-helix	trans	-66.2	-37.1	-178.6	-80.9	-50.2	0	0	0	112.3	R423 V424 L456 G457 V458 L462 S463 F464 S603 Y607	R423-Y460 VanDerWaalsContact CZ-CZ 3.48Å; R423-Y460 VanDerWaalsContact CZ-OH 3.27Å; R423-Y460 VanDerWaalsContact NE-CZ 3.33Å; R423-Y460 PolarHBondContact NE-OH 3.46Å; R423-Y460 PolarHBondContact NH2-OH 2.88Å; R423-Y460 VanDerWaalsContact NH2-OH 3.12Å; V424-Y460 HydrophobicContact CG1-CD2 4.02Å; V424-Y460 HydrophobicContact CG1-CE2 4.43Å; L456-Y460 HydrophobicContact CB-CD2 4.35Å; L456-Y460 HydrophobicContact CB-CE2 4.39Å; L456-Y460 HydrophobicContact CD2-CD2 4.49Å; L456-Y460 HydrophobicContact CD2-CE2 3.83Å; L456-Y460 WeakPolarHBondContact O-CB 3.34Å; L456-Y460 WeakPolarHBondContact O-CD2 3.4Å; L456-Y460 PolarHBondContact O-N 3.28Å; G457-Y460 PolarHBondContact O-N 2.89Å; V458-Y460 PolarHBondContact O-N 3.18Å; Y460-L462 VanDerWaalsContact C-N 3.3Å; Y460-L462 PolarHBondContact O-N 3.33Å; Y460-S463 PolarHBondContact O-N 3.34Å; Y460-F464 HydrophobicContact CD1-CD1 4.31Å; Y460-F464 AromaticContact CD1-CE1 3.93Å; Y460-F464 HydrophobicContact CD1-CE1 3.93Å; Y460-F464 HydrophobicContact CD1-CZ 4.43Å; Y460-F464 HydrophobicContact CE1-CE1 4.43Å; Y460-F464 WeakPolarHBondContact O-CB 3.43Å; Y460-F464 WeakPolarHBondContact O-CG 3.47Å; Y460-F464 PolarHBondContact O-N 2.94Å; Y460-S603 PolarHBondContact OH-OG 3.43Å; Y460-Y607 WeakPolarHBondContact OH-CE2 3.16Å; Y460-Y607 PolarHBondContact OH-OH 3.48Å
461	M	94.5	Very high	92.8	Very high	25 Å²	25	27.5 Å²	27.5	12%	0.123	14%	0.137	C	C	.	.	H	α-helix	trans	-61.5	-41.4	177.6	-71.4	-177.4	-80.7	0	0	111.9	Y417 V420 G457 V458 M459 R465 V571 A575	Y417-M461 HydrophobicContact CD1-CG 4.1Å; Y417-M461 HydrophobicContact CD1-SD 4.03Å; Y417-M461 HydrophobicContact CE1-CB 4.41Å; Y417-M461 HydrophobicContact CE1-CG 4.38Å; Y417-M461 HydrophobicContact CE1-SD 4.24Å; V420-M461 HydrophobicContact CB-CG 4.38Å; V420-M461 HydrophobicContact CG1-CG 4.11Å; V420-M461 HydrophobicContact CG2-CG 4.23Å; G457-M461 VanDerWaalsContact C-CE 3.43Å; G457-M461 VanDerWaalsContact O-CE 3.24Å; G457-M461 WeakPolarHBondContact O-CE 3.47Å; G457-M461 WeakPolarHBondContact O-CG 3.33Å; G457-M461 PolarHBondContact O-N 3.5Å; G457-M461 VanDerWaalsContact O-N 3.12Å; V458-M461 HydrophobicContact CG2-CE 4.38Å; V458-M461 PolarHBondContact O-N 3.28Å; M459-M461 VanDerWaalsContact C-N 3.34Å; M459-M461 PolarHBondContact O-N 3.39Å; M461-R465 WeakPolarHBondContact O-CB 3.4Å; M461-R465 PolarHBondContact O-N 3.05Å; M461-R465 VanDerWaalsContact O-N 3.16Å; M461-V571 HydrophobicContact CE-CB 4.48Å; M461-V571 HydrophobicContact CE-CG1 3.44Å; M461-V571 VanDerWaalsContact CE-CG1 3.44Å; M461-A575 HydrophobicContact CE-CB 4.28Å; M461-A575 HydrophobicContact SD-CB 3.15Å; M461-A575 WeakPolarHBondContact SD-CB 3.26Å
462	L	95.3	Very high	92.3	Very high	34 Å²	34	27.7 Å²	27.7	18%	0.178	14%	0.138	C	C	.	.	H	α-helix	trans	-68.1	-48.3	175.9	-67.2	169.3	0	0	0	111.3	V458 M459 Y460 R465 A466 L531 L534 T538	V458-L462 HydrophobicContact CG1-CD1 3.84Å; V458-L462 HydrophobicContact CG1-CG 4.4Å; V458-L462 WeakPolarHBondContact O-CG 3.24Å; V458-L462 PolarHBondContact O-N 3.5Å; M459-L462 PolarHBondContact O-N 3.32Å; Y460-L462 VanDerWaalsContact C-N 3.3Å; Y460-L462 PolarHBondContact O-N 3.33Å; L462-R465 PolarHBondContact O-N 3.39Å; L462-A466 WeakPolarHBondContact O-CB 3.03Å; L462-A466 PolarHBondContact O-N 3.34Å; L462-L531 HydrophobicContact CD2-CD2 3.73Å; L462-L534 HydrophobicContact CD1-CB 3.73Å; L462-L534 HydrophobicContact CD2-CB 4.49Å; L462-T538 HydrophobicContact CD1-CG2 4.15Å
463	S	92.6	Very high	91.7	Very high	9 Å²	9	32 Å²	32	6%	0.063	17%	0.168	C	C	.	.	H	α-helix	trans	-60.2	-49.6	179.2	-177.2	0	0	0	0	112.1	M459 Y460 R465 A466 Y467 S535	M459-S463 WeakPolarHBondContact O-CB 3.37Å; M459-S463 PolarHBondContact O-N 3.06Å; Y460-S463 PolarHBondContact O-N 3.34Å; S463-R465 VanDerWaalsContact C-N 3.29Å; S463-R465 PolarHBondContact O-N 3.34Å; S463-A466 VanDerWaalsContact O-CB 3.29Å; S463-A466 WeakPolarHBondContact O-CB 3.19Å; S463-A466 PolarHBondContact O-N 3.16Å; S463-Y467 VanDerWaalsContact O-CD2 3.26Å; S463-Y467 WeakPolarHBondContact O-CD2 3.35Å; S463-Y467 PolarHBondContact O-N 3.46Å; S463-S535 WeakPolarHBondContact CB-OG 3.44Å
464	F	93.1	Very high	91.2	Very high	4 Å²	4	32.2 Å²	32.2	2%	0.018	17%	0.168	C	C	.	.	H	α-helix	trans	-67.2	-31.5	-177.9	-81.6	19.2	0	0	0	112.4	Y406 A419 V420 R423 Y460 Y467	Y406-F464 HydrophobicContact CD1-CD1 4.11Å; Y406-F464 HydrophobicContact CD1-CE1 4.15Å; Y406-F464 HydrophobicContact CD1-CG 4.4Å; Y406-F464 HydrophobicContact CD1-CZ 4.48Å; Y406-F464 HydrophobicContact CD2-CD1 4.34Å; Y406-F464 AromaticContact CD2-CD2 3.92Å; Y406-F464 HydrophobicContact CD2-CD2 3.92Å; Y406-F464 AromaticContact CD2-CE1 3.91Å; Y406-F464 HydrophobicContact CD2-CE1 3.91Å; Y406-F464 AromaticContact CD2-CE2 3.46Å; Y406-F464 HydrophobicContact CD2-CE2 3.46Å; Y406-F464 VanDerWaalsContact CD2-CE2 3.46Å; Y406-F464 HydrophobicContact CD2-CG 4.33Å; Y406-F464 AromaticContact CD2-CZ 3.42Å; Y406-F464 HydrophobicContact CD2-CZ 3.42Å; Y406-F464 VanDerWaalsContact CD2-CZ 3.42Å; Y406-F464 HydrophobicContact CE1-CB 4.02Å; Y406-F464 AromaticContact CE1-CD1 3.94Å; Y406-F464 HydrophobicContact CE1-CD1 3.94Å; Y406-F464 HydrophobicContact CE1-CD2 4.18Å; Y406-F464 HydrophobicContact CE1-CE1 4.37Å; Y406-F464 AromaticContact CE1-CG 3.81Å; Y406-F464 HydrophobicContact CE1-CG 3.81Å; Y406-F464 HydrophobicContact CE2-CB 4.45Å; Y406-F464 HydrophobicContact CE2-CD1 4.2Å; Y406-F464 AromaticContact CE2-CD2 3.23Å; Y406-F464 HydrophobicContact CE2-CD2 3.23Å; Y406-F464 HydrophobicContact CE2-CE1 4.17Å; Y406-F464 AromaticContact CE2-CE2 3.21Å; Y406-F464 HydrophobicContact CE2-CE2 3.21Å; Y406-F464 AromaticContact CE2-CG 3.75Å; Y406-F464 HydrophobicContact CE2-CG 3.75Å; Y406-F464 AromaticContact CE2-CZ 3.68Å; Y406-F464 HydrophobicContact CE2-CZ 3.68Å; Y406-F464 HydrophobicContact CG-CD1 4.3Å; Y406-F464 AromaticContact CG-CE1 3.9Å; Y406-F464 HydrophobicContact CG-CE1 3.9Å; Y406-F464 HydrophobicContact CG-CE2 4.28Å; Y406-F464 AromaticContact CG-CZ 3.87Å; Y406-F464 HydrophobicContact CG-CZ 3.87Å; Y406-F464 AromaticContact CZ-CD1 3.99Å; Y406-F464 AromaticContact CZ-CD2 3.38Å; Y406-F464 AromaticContact CZ-CE2 3.86Å; Y406-F464 AromaticContact CZ-CG 3.44Å; Y406-F464 VanDerWaalsContact CZ-CG 3.44Å; Y406-F464 WeakPolarHBondContact OH-CB 3.43Å; Y406-F464 PolarHBondContact OH-O 2.99Å; A419-F464 HydrophobicContact CB-CD2 4Å; A419-F464 HydrophobicContact CB-CE2 3.86Å; V420-F464 HydrophobicContact CG2-CB 4.15Å; V420-F464 HydrophobicContact CG2-CD2 3.38Å; V420-F464 HydrophobicContact CG2-CE2 3.98Å; V420-F464 HydrophobicContact CG2-CG 3.87Å; R423-F464 VanDerWaalsContact NH1-CZ 3.34Å; Y460-F464 HydrophobicContact CD1-CD1 4.31Å; Y460-F464 AromaticContact CD1-CE1 3.93Å; Y460-F464 HydrophobicContact CD1-CE1 3.93Å; Y460-F464 HydrophobicContact CD1-CZ 4.43Å; Y460-F464 HydrophobicContact CE1-CE1 4.43Å; Y460-F464 WeakPolarHBondContact O-CB 3.43Å; Y460-F464 WeakPolarHBondContact O-CG 3.47Å; Y460-F464 PolarHBondContact O-N 2.94Å; F464-Y467 HydrophobicContact CD1-CE2 4.46Å
465	R	92.3	Very high	90.7	Very high	100 Å²	100	29.9 Å²	29.9	38%	0.377	16%	0.156	S	C	.	.	H	α-helix	trans	-73.6	-31.3	172.2	-167.4	170.1	-177.1	174.6	-1.8	111.9	Y417 M461 L462 S463 Y467 L468 Y469 L531	Y417-R465 PolarHBondContact OH-NH1 2.87Å; M461-R465 WeakPolarHBondContact O-CB 3.4Å; M461-R465 PolarHBondContact O-N 3.05Å; M461-R465 VanDerWaalsContact O-N 3.16Å; L462-R465 PolarHBondContact O-N 3.39Å; S463-R465 VanDerWaalsContact C-N 3.29Å; S463-R465 PolarHBondContact O-N 3.34Å; R465-Y467 VanDerWaalsContact C-N 3.26Å; R465-Y467 PolarHBondContact O-N 3.09Å; R465-L468 HydrophobicContact CG-CD1 4.49Å; R465-L468 WeakPolarHBondContact O-CB 3.31Å; R465-L468 PolarHBondContact O-N 2.98Å; R465-L468 VanDerWaalsContact O-N 3.14Å; R465-Y469 HydrophobicContact CG-CE2 4.37Å; R465-Y469 VanDerWaalsContact O-CD2 3.32Å; R465-Y469 WeakPolarHBondContact O-CD2 3.23Å; R465-L531 HydrophobicContact CB-CD1 4.34Å; R465-L531 HydrophobicContact CG-CD1 4.08Å
466	A	92.4	Very high	90.2	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-63.7	-29.6	176.6	0	0	0	0	0	113.2	L462 S463 L468 Y469 L470 L475 L531 V532	L462-A466 WeakPolarHBondContact O-CB 3.03Å; L462-A466 PolarHBondContact O-N 3.34Å; S463-A466 VanDerWaalsContact O-CB 3.29Å; S463-A466 WeakPolarHBondContact O-CB 3.19Å; S463-A466 PolarHBondContact O-N 3.16Å; A466-L468 PolarHBondContact O-N 3.27Å; A466-L468 VanDerWaalsContact O-N 3.14Å; A466-Y469 PolarHBondContact O-N 3.25Å; A466-L470 HydrophobicContact CB-CD1 4.47Å; A466-L470 PolarHBondContact O-N 3.42Å; A466-L475 HydrophobicContact CB-CD1 4.05Å; A466-L531 HydrophobicContact CB-CB 3.81Å; A466-V532 HydrophobicContact CB-CG2 3.49Å; A466-V532 VanDerWaalsContact CB-CG2 3.49Å
467	Y	90.5	Very high	89.7	Confident	20 Å²	20	35.3 Å²	35.3	8%	0.078	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-17.5	173.4	-80.2	-84.2	0	0	0	114.6	F403 Y406 A411 S463 F464 R465 Y469 V472 L475	F403-Y467 WeakPolarHBondContact CA-OH 3.37Å; F403-Y467 VanDerWaalsContact CD1-OH 3.3Å; F403-Y467 WeakPolarHBondContact CD1-OH 3.49Å; F403-Y467 PolarHBondContact O-OH 3.19Å; Y406-Y467 HydrophobicContact CD1-CD1 4.22Å; Y406-Y467 AromaticContact CD1-CD2 3.43Å; Y406-Y467 HydrophobicContact CD1-CD2 3.43Å; Y406-Y467 VanDerWaalsContact CD1-CD2 3.43Å; Y406-Y467 HydrophobicContact CD1-CE1 4.25Å; Y406-Y467 AromaticContact CD1-CE2 3.48Å; Y406-Y467 HydrophobicContact CD1-CE2 3.48Å; Y406-Y467 VanDerWaalsContact CD1-CE2 3.48Å; Y406-Y467 AromaticContact CD1-CG 3.79Å; Y406-Y467 HydrophobicContact CD1-CG 3.79Å; Y406-Y467 AromaticContact CD1-CZ 3.88Å; Y406-Y467 AromaticContact CE1-CD2 3.45Å; Y406-Y467 HydrophobicContact CE1-CD2 3.45Å; Y406-Y467 VanDerWaalsContact CE1-CD2 3.45Å; Y406-Y467 AromaticContact CE1-CE2 3.98Å; Y406-Y467 HydrophobicContact CE1-CE2 3.98Å; Y406-Y467 AromaticContact CE1-CG 3.77Å; Y406-Y467 HydrophobicContact CE1-CG 3.77Å; Y406-Y467 HydrophobicContact CG-CE2 4.47Å; A411-Y467 HydrophobicContact CB-CD1 4.44Å; A411-Y467 HydrophobicContact CB-CG 4.34Å; S463-Y467 VanDerWaalsContact O-CD2 3.26Å; S463-Y467 WeakPolarHBondContact O-CD2 3.35Å; S463-Y467 PolarHBondContact O-N 3.46Å; F464-Y467 HydrophobicContact CD1-CE2 4.46Å; R465-Y467 VanDerWaalsContact C-N 3.26Å; R465-Y467 PolarHBondContact O-N 3.09Å; Y467-Y469 PolarHBondContact O-N 3.46Å; Y467-V472 HydrophobicContact CE1-CG2 4.1Å; Y467-L475 HydrophobicContact CD1-CD1 4.27Å; Y467-L475 HydrophobicContact CD2-CD1 3.61Å; Y467-L475 HydrophobicContact CE1-CD1 4.22Å; Y467-L475 HydrophobicContact CE2-CD1 3.55Å; Y467-L475 HydrophobicContact CE2-CD2 4.25Å; Y467-L475 HydrophobicContact CG-CD1 4.02Å
468	L	88.6	Confident	89.2	Confident	93 Å²	93	36 Å²	36	49%	0.487	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-14	172.5	-60.5	176.9	0	0	0	112.6	R465 A466	R465-L468 HydrophobicContact CG-CD1 4.49Å; R465-L468 WeakPolarHBondContact O-CB 3.31Å; R465-L468 PolarHBondContact O-N 2.98Å; R465-L468 VanDerWaalsContact O-N 3.14Å; A466-L468 PolarHBondContact O-N 3.27Å; A466-L468 VanDerWaalsContact O-N 3.14Å
469	Y	88.3	Confident	88.8	Confident	70 Å²	70	35.5 Å²	35.5	28%	0.275	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122.3	-19.2	-173.5	-56.5	-81.6	0	0	0	113.1	R465 A466 Y467 H524 T527 L531	R465-Y469 HydrophobicContact CG-CE2 4.37Å; R465-Y469 VanDerWaalsContact O-CD2 3.32Å; R465-Y469 WeakPolarHBondContact O-CD2 3.23Å; A466-Y469 PolarHBondContact O-N 3.25Å; Y467-Y469 PolarHBondContact O-N 3.46Å; Y469-H524 HydrophobicContact CD1-CB 4.03Å; Y469-T527 HydrophobicContact CD1-CG2 4.27Å; Y469-T527 HydrophobicContact CD2-CG2 4.38Å; Y469-T527 HydrophobicContact CE1-CG2 3.99Å; Y469-T527 HydrophobicContact CE2-CG2 4.1Å; Y469-T527 HydrophobicContact CG-CG2 4.46Å; Y469-L531 HydrophobicContact CD2-CD1 3.8Å; Y469-L531 HydrophobicContact CE2-CD1 3.74Å
470	L	86.4	Confident	88.1	Confident	9 Å²	9	39 Å²	39	5%	0.047	21%	0.206	C	C	.	.	S	Bend	trans	-130.5	144.7	-175.4	-57.4	177.8	0	0	0	111	A466 E474 F478 F525 G528 V532	A466-L470 HydrophobicContact CB-CD1 4.47Å; A466-L470 PolarHBondContact O-N 3.42Å; L470-E474 HydrophobicContact CB-CB 4.04Å; L470-E474 HydrophobicContact CD2-CB 4.42Å; L470-E474 WeakPolarHBondContact CD2-OE1 3.48Å; L470-F478 HydrophobicContact CD1-CD2 4.02Å; L470-F478 HydrophobicContact CD1-CE2 4.38Å; L470-F478 HydrophobicContact CD2-CE2 4.36Å; L470-F525 HydrophobicContact CD2-CD2 3.47Å; L470-F525 VanDerWaalsContact CD2-CD2 3.47Å; L470-F525 HydrophobicContact CD2-CE2 3.8Å; L470-G528 WeakPolarHBondContact CD1-O 3.39Å; L470-V532 HydrophobicContact CD1-CB 4.45Å; L470-V532 HydrophobicContact CD1-CG2 3.45Å; L470-V532 VanDerWaalsContact CD1-CG2 3.45Å
471	T	85.7	Confident	87.6	Confident	77 Å²	77	39 Å²	39	47%	0.472	21%	0.207	S	C	.	.			trans	-69.8	164.4	167.3	65.2	0	0	0	0	111.9	S473 E474 L475	T471-S473 VanDerWaalsContact C-N 3.27Å; T471-S473 PolarHBondContact O-N 2.97Å; T471-E474 WeakPolarHBondContact CB-OE2 3.41Å; T471-E474 WeakPolarHBondContact CG2-OE2 2.98Å; T471-E474 PolarHBondContact N-OE2 2.88Å; T471-E474 PolarHBondContact O-N 3.39Å; T471-E474 VanDerWaalsContact OG1-CD 3.26Å; T471-E474 WeakPolarHBondContact OG1-CG 3.14Å; T471-E474 PolarHBondContact OG1-N 3.15Å; T471-E474 PolarHBondContact OG1-OE2 2.83Å; T471-L475 PolarHBondContact O-N 3.46Å
472	V	85.2	Confident	87.3	Confident	22 Å²	22	38.7 Å²	38.7	13%	0.133	21%	0.207	C	C	.	.	H	α-helix	trans	-53	-45.9	175.4	-179.3	0	0	0	0	111.1	F403 Y467 E474 L475 L476	F403-V472 HydrophobicContact CB-CG1 4.29Å; Y467-V472 HydrophobicContact CE1-CG2 4.1Å; V472-E474 PolarHBondContact O-N 3.17Å; V472-L475 PolarHBondContact O-N 2.82Å; V472-L476 HydrophobicContact CG1-CD1 3.98Å; V472-L476 HydrophobicContact CG1-CG 4.46Å; V472-L476 WeakPolarHBondContact O-CB 3.47Å; V472-L476 VanDerWaalsContact O-CG 3.32Å; V472-L476 WeakPolarHBondContact O-CG 3.38Å; V472-L476 PolarHBondContact O-N 3.34Å
473	S	82.9	Confident	86.6	Confident	89 Å²	89	40.9 Å²	40.9	62%	0.622	22%	0.223	S	C	*	.	H	α-helix	trans	-63.3	-41.1	-178.6	-54	0	0	0	0	112.5	T471 L477	T471-S473 VanDerWaalsContact C-N 3.27Å; T471-S473 PolarHBondContact O-N 2.97Å; S473-L477 VanDerWaalsContact O-CB 3.31Å; S473-L477 WeakPolarHBondContact O-CB 3.41Å; S473-L477 PolarHBondContact O-N 3.06Å
474	E	84.2	Confident	86.1	Confident	14 Å²	14	42 Å²	42	7%	0.065	23%	0.228	C	C	.	.	H	α-helix	trans	-66.3	-45.2	176.1	-70.5	161	69.1	0	0	112	L470 T471 V472 L476 L477 F478 R517	L470-E474 HydrophobicContact CB-CB 4.04Å; L470-E474 HydrophobicContact CD2-CB 4.42Å; L470-E474 WeakPolarHBondContact CD2-OE1 3.48Å; T471-E474 WeakPolarHBondContact CB-OE2 3.41Å; T471-E474 WeakPolarHBondContact CG2-OE2 2.98Å; T471-E474 PolarHBondContact N-OE2 2.88Å; T471-E474 PolarHBondContact O-N 3.39Å; T471-E474 VanDerWaalsContact OG1-CD 3.26Å; T471-E474 WeakPolarHBondContact OG1-CG 3.14Å; T471-E474 PolarHBondContact OG1-N 3.15Å; T471-E474 PolarHBondContact OG1-OE2 2.83Å; V472-E474 PolarHBondContact O-N 3.17Å; E474-L476 VanDerWaalsContact C-N 3.33Å; E474-L476 PolarHBondContact O-N 3.05Å; E474-L477 WeakPolarHBondContact O-CB 3.43Å; E474-L477 PolarHBondContact O-N 2.92Å; E474-F478 HydrophobicContact CB-CD2 4.4Å; E474-F478 HydrophobicContact CB-CE2 3.96Å; E474-F478 WeakPolarHBondContact O-CD2 3.49Å; E474-F478 WeakPolarHBondContact O-CE2 3.15Å; E474-F478 WeakPolarHBondContact O-CG 3.43Å; E474-F478 PolarHBondContact O-N 3.37Å; E474-R517 IonicContact OE1-CZ 2.93Å; E474-R517 IonicContact OE1-NE 3.98Å; E474-R517 IonicContact OE1-NH1 2.55Å; E474-R517 PolarHBondContact OE1-NH1 3.41Å; E474-R517 IonicContact OE1-NH2 2.84Å; E474-R517 PolarHBondContact OE1-NH2 3.46Å; E474-R517 IonicContact OE2-CZ 3.59Å; E474-R517 IonicContact OE2-NH1 3.95Å; E474-R517 IonicContact OE2-NH2 2.86Å; E474-R517 PolarHBondContact OE2-NH2 2.85Å
475	L	86	Confident	85.9	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-61.7	-45.4	180	-167.7	144.6	0	0	0	110.3	F403 A466 Y467 T471 V472 L477 F478 T479 V532	F403-L475 HydrophobicContact CD1-CD2 3.57Å; F403-L475 HydrophobicContact CE1-CD2 3.54Å; A466-L475 HydrophobicContact CB-CD1 4.05Å; Y467-L475 HydrophobicContact CD1-CD1 4.27Å; Y467-L475 HydrophobicContact CD2-CD1 3.61Å; Y467-L475 HydrophobicContact CE1-CD1 4.22Å; Y467-L475 HydrophobicContact CE2-CD1 3.55Å; Y467-L475 HydrophobicContact CE2-CD2 4.25Å; Y467-L475 HydrophobicContact CG-CD1 4.02Å; T471-L475 PolarHBondContact O-N 3.46Å; V472-L475 PolarHBondContact O-N 2.82Å; L475-L477 PolarHBondContact O-N 3.12Å; L475-F478 PolarHBondContact O-N 3.44Å; L475-T479 HydrophobicContact CD2-CG2 4.05Å; L475-T479 VanDerWaalsContact O-CG2 3.25Å; L475-T479 WeakPolarHBondContact O-CG2 3.45Å; L475-T479 PolarHBondContact O-N 3.24Å; L475-V532 HydrophobicContact CD1-CG2 3.98Å; L475-V532 HydrophobicContact CG-CG2 3.86Å
476	L	83.2	Confident	85.6	Confident	67 Å²	67	39.5 Å²	39.5	35%	0.351	22%	0.219	S	C	.	.	H	α-helix	trans	-56.8	-48.3	173.6	-74.6	171.8	0	0	0	111.9	F403 V472 E474 F478 T479	F403-L476 HydrophobicContact CB-CD2 3.95Å; F403-L476 HydrophobicContact CB-CG 4.36Å; F403-L476 HydrophobicContact CD1-CD2 4.06Å; F403-L476 HydrophobicContact CD2-CD2 3.45Å; F403-L476 VanDerWaalsContact CD2-CD2 3.45Å; F403-L476 HydrophobicContact CE1-CD2 4.46Å; F403-L476 HydrophobicContact CE2-CD2 3.9Å; F403-L476 HydrophobicContact CG-CD2 3.56Å; F403-L476 HydrophobicContact CG-CG 4.35Å; F403-L476 HydrophobicContact CZ-CD2 4.39Å; V472-L476 HydrophobicContact CG1-CD1 3.98Å; V472-L476 HydrophobicContact CG1-CG 4.46Å; V472-L476 WeakPolarHBondContact O-CB 3.47Å; V472-L476 VanDerWaalsContact O-CG 3.32Å; V472-L476 WeakPolarHBondContact O-CG 3.38Å; V472-L476 PolarHBondContact O-N 3.34Å; E474-L476 VanDerWaalsContact C-N 3.33Å; E474-L476 PolarHBondContact O-N 3.05Å; L476-F478 VanDerWaalsContact C-N 3.29Å; L476-F478 PolarHBondContact O-N 3.12Å; L476-T479 PolarHBondContact O-N 2.7Å; L476-T479 PolarHBondContact O-OG1 3.46Å
477	L	82.1	Confident	85.1	Confident	48 Å²	48	41 Å²	41	25%	0.251	23%	0.229	S	C	.	.	H	α-helix	trans	-56.9	-42.2	178.4	179.6	64.1	0	0	0	111.9	S473 E474 L475 V480 A513 I516	S473-L477 VanDerWaalsContact O-CB 3.31Å; S473-L477 WeakPolarHBondContact O-CB 3.41Å; S473-L477 PolarHBondContact O-N 3.06Å; E474-L477 WeakPolarHBondContact O-CB 3.43Å; E474-L477 PolarHBondContact O-N 2.92Å; L475-L477 PolarHBondContact O-N 3.12Å; L477-V480 WeakPolarHBondContact O-CB 3.34Å; L477-V480 WeakPolarHBondContact O-CG1 3.5Å; L477-V480 PolarHBondContact O-N 3.48Å; L477-A513 HydrophobicContact CD1-CB 3.88Å; L477-A513 HydrophobicContact CD2-CB 3.66Å; L477-A513 HydrophobicContact CG-CB 3.57Å; L477-I516 HydrophobicContact CD1-CD1 4.22Å; L477-I516 HydrophobicContact CD2-CG2 4.49Å
478	F	85.5	Confident	84.8	Confident	14 Å²	14	42.8 Å²	42.8	6%	0.061	24%	0.239	C	C	.	.	H	α-helix	trans	-79.5	-20.6	-179.5	-63.6	-45.8	0	0	0	114.3	L470 E474 L475 L476 V480 A513 F525 L529 V532 Q533 N536	L470-F478 HydrophobicContact CD1-CD2 4.02Å; L470-F478 HydrophobicContact CD1-CE2 4.38Å; L470-F478 HydrophobicContact CD2-CE2 4.36Å; E474-F478 HydrophobicContact CB-CD2 4.4Å; E474-F478 HydrophobicContact CB-CE2 3.96Å; E474-F478 WeakPolarHBondContact O-CD2 3.49Å; E474-F478 WeakPolarHBondContact O-CE2 3.15Å; E474-F478 WeakPolarHBondContact O-CG 3.43Å; E474-F478 PolarHBondContact O-N 3.37Å; L475-F478 PolarHBondContact O-N 3.44Å; L476-F478 VanDerWaalsContact C-N 3.29Å; L476-F478 PolarHBondContact O-N 3.12Å; F478-V480 PolarHBondContact O-N 3.37Å; F478-A513 HydrophobicContact CD1-CB 4.28Å; F478-A513 HydrophobicContact CE1-CB 3.88Å; F478-F525 HydrophobicContact CE1-CZ 4.36Å; F478-F525 AromaticContact CE2-CE2 3.53Å; F478-F525 HydrophobicContact CE2-CE2 3.53Å; F478-F525 AromaticContact CE2-CZ 3.88Å; F478-F525 HydrophobicContact CE2-CZ 3.88Å; F478-F525 AromaticContact CZ-CE2 3.56Å; F478-F525 HydrophobicContact CZ-CE2 3.56Å; F478-F525 AromaticContact CZ-CZ 3.45Å; F478-F525 HydrophobicContact CZ-CZ 3.45Å; F478-F525 VanDerWaalsContact CZ-CZ 3.45Å; F478-L529 HydrophobicContact CB-CD1 4.35Å; F478-L529 HydrophobicContact CD1-CD1 3.53Å; F478-L529 HydrophobicContact CD2-CD1 3.81Å; F478-L529 HydrophobicContact CE1-CD1 3.75Å; F478-L529 HydrophobicContact CE2-CD1 4.03Å; F478-L529 HydrophobicContact CG-CD1 3.6Å; F478-L529 HydrophobicContact CZ-CD1 4.03Å; F478-V532 HydrophobicContact CB-CB 4.36Å; F478-V532 HydrophobicContact CB-CG1 3.69Å; F478-Q533 PolarHBondContact O-NE2 3.32Å; F478-N536 PolarHBondContact O-ND2 3.27Å
479	T	86.7	Confident	84.8	Confident	31 Å²	31	39.4 Å²	39.4	19%	0.19	22%	0.221	C	C	.	.	H	α-helix	trans	-71.8	-14.4	172.7	61.2	0	0	0	0	113.5	F403 L475 L476 L481 T482 V532	F403-T479 HydrophobicContact CE1-CG2 4.42Å; L475-T479 HydrophobicContact CD2-CG2 4.05Å; L475-T479 VanDerWaalsContact O-CG2 3.25Å; L475-T479 WeakPolarHBondContact O-CG2 3.45Å; L475-T479 PolarHBondContact O-N 3.24Å; L476-T479 PolarHBondContact O-N 2.7Å; L476-T479 PolarHBondContact O-OG1 3.46Å; T479-L481 PolarHBondContact O-N 2.97Å; T479-T482 VanDerWaalsContact O-CB 3.31Å; T479-T482 WeakPolarHBondContact O-CB 3.45Å; T479-T482 PolarHBondContact O-N 2.89Å; T479-T482 PolarHBondContact O-OG1 3.34Å; T479-V532 HydrophobicContact CG2-CG1 4.17Å
480	V	81.1	Confident	84.6	Confident	83 Å²	83	38 Å²	38	50%	0.503	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-19.4	175.9	83.5	0	0	0	0	113.2	L477 F478 T482 P483 A509	L477-V480 WeakPolarHBondContact O-CB 3.34Å; L477-V480 WeakPolarHBondContact O-CG1 3.5Å; L477-V480 PolarHBondContact O-N 3.48Å; F478-V480 PolarHBondContact O-N 3.37Å; V480-T482 VanDerWaalsContact C-N 3.32Å; V480-P483 VanDerWaalsContact O-CD 3.28Å; V480-P483 WeakPolarHBondContact O-CD 3.25Å; V480-A509 HydrophobicContact CG1-CB 4.03Å
481	L	83.5	Confident	84.4	Confident	11 Å²	11	38 Å²	38	6%	0.058	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-8.8	178.1	-59.6	174.5	0	0	0	113.4	T479 L484 Y485 A506 A509 V510	T479-L481 PolarHBondContact O-N 2.97Å; L481-L484 VanDerWaalsContact O-CB 3.27Å; L481-L484 WeakPolarHBondContact O-CB 3.46Å; L481-L484 PolarHBondContact O-N 3.33Å; L481-Y485 HydrophobicContact CB-CD2 4.4Å; L481-Y485 HydrophobicContact CB-CE2 3.9Å; L481-Y485 VanDerWaalsContact O-CD2 3.29Å; L481-Y485 WeakPolarHBondContact O-CD2 3.38Å; L481-Y485 PolarHBondContact O-N 2.88Å; L481-A506 HydrophobicContact CD2-CB 4.18Å; L481-A509 HydrophobicContact CD2-CB 3.81Å; L481-V510 HydrophobicContact CD1-CG2 3.52Å; L481-V510 HydrophobicContact CD2-CG2 3.81Å; L481-V510 HydrophobicContact CG-CG2 4.31Å
482	T	86.9	Confident	84.4	Confident	18 Å²	18	39.6 Å²	39.6	11%	0.11	22%	0.22	C	C	.	.	H	α-helix	trans	-56.4	-45	-178.7	-53	0	0	0	0	113.5	T479 V480 L484 Y485 I486 N536 F539	T479-T482 VanDerWaalsContact O-CB 3.31Å; T479-T482 WeakPolarHBondContact O-CB 3.45Å; T479-T482 PolarHBondContact O-N 2.89Å; T479-T482 PolarHBondContact O-OG1 3.34Å; V480-T482 VanDerWaalsContact C-N 3.32Å; T482-L484 PolarHBondContact O-N 2.96Å; T482-Y485 PolarHBondContact O-N 3.5Å; T482-Y485 VanDerWaalsContact O-N 3.11Å; T482-I486 HydrophobicContact CG2-CD1 3.99Å; T482-I486 HydrophobicContact CG2-CG1 4.42Å; T482-I486 WeakPolarHBondContact O-CG1 3.34Å; T482-I486 PolarHBondContact O-N 2.91Å; T482-N536 PolarHBondContact OG1-OD1 3.06Å; T482-F539 HydrophobicContact CG2-CD1 3.45Å; T482-F539 VanDerWaalsContact CG2-CD1 3.45Å; T482-F539 HydrophobicContact CG2-CE1 3.85Å; T482-F539 HydrophobicContact CG2-CG 4.29Å
483	P	82.2	Confident	84.2	Confident	79 Å²	79	42.8 Å²	42.8	51%	0.513	24%	0.235	S	C	.	.	H	α-helix	trans	-59.3	-32.2	175.6	-24.2	36.1	0	0	0	113.7	V480 T487	V480-P483 VanDerWaalsContact O-CD 3.28Å; V480-P483 WeakPolarHBondContact O-CD 3.25Å; P483-T487 WeakPolarHBondContact O-CG2 3.38Å; P483-T487 PolarHBondContact O-N 3.35Å; P483-T487 PolarHBondContact O-OG1 2.88Å
484	L	82	Confident	84	Confident	34 Å²	34	40.2 Å²	40.2	18%	0.178	22%	0.217	C	C	.	.	H	α-helix	trans	-63.8	-51	172.9	178.3	77.1	0	0	0	110.6	L481 T482 I486 T487 L488 Y502 A506	L481-L484 VanDerWaalsContact O-CB 3.27Å; L481-L484 WeakPolarHBondContact O-CB 3.46Å; L481-L484 PolarHBondContact O-N 3.33Å; T482-L484 PolarHBondContact O-N 2.96Å; L484-I486 VanDerWaalsContact C-N 3.27Å; L484-I486 PolarHBondContact O-N 2.93Å; L484-T487 PolarHBondContact O-N 3.42Å; L484-T487 PolarHBondContact O-OG1 3.42Å; L484-L488 WeakPolarHBondContact O-CB 3.18Å; L484-L488 PolarHBondContact O-N 3.2Å; L484-Y502 VanDerWaalsContact CD1-C 3.49Å; L484-Y502 WeakPolarHBondContact CD1-O 3.32Å; L484-A506 HydrophobicContact CB-CB 3.96Å; L484-A506 HydrophobicContact CD1-CB 3.56Å; L484-A506 HydrophobicContact CD2-CB 3.01Å; L484-A506 HydrophobicContact CG-CB 3.61Å
485	Y	87.9	Confident	83.8	Confident	42 Å²	42	49.1 Å²	49.1	17%	0.165	26%	0.255	C	S	.	.	H	α-helix	trans	-61.5	-39.6	-178.7	-65.2	-61.7	0	0	0	111.3	L481 T482 T487 L488 I489 Q533 N536 I537	L481-Y485 HydrophobicContact CB-CD2 4.4Å; L481-Y485 HydrophobicContact CB-CE2 3.9Å; L481-Y485 VanDerWaalsContact O-CD2 3.29Å; L481-Y485 WeakPolarHBondContact O-CD2 3.38Å; L481-Y485 PolarHBondContact O-N 2.88Å; T482-Y485 PolarHBondContact O-N 3.5Å; T482-Y485 VanDerWaalsContact O-N 3.11Å; Y485-T487 PolarHBondContact O-N 3.27Å; Y485-L488 PolarHBondContact O-N 2.7Å; Y485-I489 VanDerWaalsContact O-CB 3.27Å; Y485-I489 WeakPolarHBondContact O-CB 3.39Å; Y485-I489 WeakPolarHBondContact O-CD1 3.29Å; Y485-I489 VanDerWaalsContact O-CG1 3.23Å; Y485-I489 WeakPolarHBondContact O-CG1 3.28Å; Y485-I489 PolarHBondContact O-N 3.44Å; Y485-Q533 VanDerWaalsContact CE2-OE1 3.25Å; Y485-Q533 PolarHBondContact OH-OE1 2.91Å; Y485-N536 HydrophobicContact CD2-CB 3.63Å; Y485-N536 HydrophobicContact CE2-CB 3.73Å; Y485-I537 HydrophobicContact CD1-CD1 4.43Å; Y485-I537 HydrophobicContact CD1-CG1 3.64Å; Y485-I537 HydrophobicContact CD2-CG1 4.24Å; Y485-I537 HydrophobicContact CE1-CD1 3.99Å; Y485-I537 HydrophobicContact CE1-CG1 3.64Å; Y485-I537 HydrophobicContact CE2-CG1 4.23Å; Y485-I537 HydrophobicContact CG-CG1 3.95Å
486	I	87.1	Confident	83.2	Confident	8 Å²	8	55.6 Å²	55.6	4%	0.041	28%	0.28	C	S	.	.	H	α-helix	trans	-57.7	-50.8	175.3	-67.2	164.3	0	0	0	110.5	T482 L484 Y490 F539 A540 M543 V544 W619	T482-I486 HydrophobicContact CG2-CD1 3.99Å; T482-I486 HydrophobicContact CG2-CG1 4.42Å; T482-I486 WeakPolarHBondContact O-CG1 3.34Å; T482-I486 PolarHBondContact O-N 2.91Å; L484-I486 VanDerWaalsContact C-N 3.27Å; L484-I486 PolarHBondContact O-N 2.93Å; I486-Y490 WeakPolarHBondContact O-CB 3.31Å; I486-Y490 PolarHBondContact O-N 2.91Å; I486-F539 HydrophobicContact CD1-CE1 4.21Å; I486-A540 HydrophobicContact CB-CB 4.42Å; I486-A540 HydrophobicContact CG1-CB 3.68Å; I486-M543 HydrophobicContact CD1-SD 3.55Å; I486-M543 VanDerWaalsContact CD1-SD 3.55Å; I486-M543 HydrophobicContact CG1-SD 4.28Å; I486-V544 HydrophobicContact CG2-CG2 3.96Å; I486-V544 WeakPolarHBondContact O-CG2 3.45Å; I486-W619 HydrophobicContact CD1-CH2 4.49Å; I486-W619 HydrophobicContact CG2-CE3 3.96Å; I486-W619 HydrophobicContact CG2-CH2 3.96Å; I486-W619 HydrophobicContact CG2-CZ3 3.56Å
487	T	81.2	Confident	82.7	Confident	33 Å²	33	63.7 Å²	63.7	20%	0.202	31%	0.306	C	S	.	.	H	α-helix	trans	-65.1	-42.9	-179.6	50.4	0	0	0	0	112.3	P483 L484 Y485 Y490 D491	P483-T487 WeakPolarHBondContact O-CG2 3.38Å; P483-T487 PolarHBondContact O-N 3.35Å; P483-T487 PolarHBondContact O-OG1 2.88Å; L484-T487 PolarHBondContact O-N 3.42Å; L484-T487 PolarHBondContact O-OG1 3.42Å; Y485-T487 PolarHBondContact O-N 3.27Å; T487-Y490 PolarHBondContact O-N 2.85Å; T487-D491 WeakPolarHBondContact O-CB 3.28Å; T487-D491 PolarHBondContact O-N 3.48Å
488	L	84.7	Confident	82	Confident	56 Å²	56	64.7 Å²	64.7	29%	0.293	31%	0.311	S	S	.	.	H	α-helix	trans	-60.7	-50.8	177.7	-167	92.6	0	0	0	111.6	L484 Y485 Y490 D491 I492 L498	L484-L488 WeakPolarHBondContact O-CB 3.18Å; L484-L488 PolarHBondContact O-N 3.2Å; Y485-L488 PolarHBondContact O-N 2.7Å; L488-Y490 VanDerWaalsContact C-N 3.34Å; L488-Y490 PolarHBondContact O-N 3.24Å; L488-D491 PolarHBondContact O-N 2.71Å; L488-I492 HydrophobicContact CD2-CD1 4.2Å; L488-I492 HydrophobicContact CG-CD1 4.04Å; L488-I492 WeakPolarHBondContact O-CB 3.28Å; L488-I492 VanDerWaalsContact O-CG1 3.25Å; L488-I492 WeakPolarHBondContact O-CG1 3.35Å; L488-I492 PolarHBondContact O-N 2.98Å; L488-L498 HydrophobicContact CD1-CD1 3.35Å; L488-L498 HydrophobicContact CD1-CD2 4.06Å; L488-L498 HydrophobicContact CD1-CG 4.06Å; L488-L498 HydrophobicContact CG-CD1 4.15Å
489	I	87.1	Confident	81.2	Confident	23 Å²	23	68.1 Å²	68.1	12%	0.118	32%	0.323	C	S	.	.	H	α-helix	trans	-65.2	-40.7	-179.5	-69.8	160.9	0	0	0	110.2	Y485 I492 M493 A540 I541 V544	Y485-I489 VanDerWaalsContact O-CB 3.27Å; Y485-I489 WeakPolarHBondContact O-CB 3.39Å; Y485-I489 WeakPolarHBondContact O-CD1 3.29Å; Y485-I489 VanDerWaalsContact O-CG1 3.23Å; Y485-I489 WeakPolarHBondContact O-CG1 3.28Å; Y485-I489 PolarHBondContact O-N 3.44Å; I489-I492 PolarHBondContact O-N 3.41Å; I489-M493 HydrophobicContact CG2-CG 4.31Å; I489-M493 HydrophobicContact CG2-SD 3.84Å; I489-M493 WeakPolarHBondContact O-CB 3.48Å; I489-M493 VanDerWaalsContact O-CG 3.31Å; I489-M493 WeakPolarHBondContact O-CG 3.4Å; I489-M493 PolarHBondContact O-N 3.4Å; I489-A540 HydrophobicContact CD1-CB 3.55Å; I489-I541 HydrophobicContact CD1-CG1 3.68Å; I489-I541 HydrophobicContact CG1-CG1 4.49Å; I489-I541 HydrophobicContact CG2-CG1 4.5Å; I489-V544 HydrophobicContact CB-CG2 4.35Å; I489-V544 HydrophobicContact CG2-CB 4.04Å; I489-V544 HydrophobicContact CG2-CG1 4.12Å; I489-V544 HydrophobicContact CG2-CG2 4.13Å
490	Y	84.8	Confident	80.6	Confident	41 Å²	41	76.3 Å²	76.3	16%	0.161	35%	0.351	C	S	.	.	H	α-helix	trans	-61.6	-45.1	175.5	-174.4	-92.7	0	0	0	112.3	I486 T487 L488 M493 S494 V544 K547	I486-Y490 WeakPolarHBondContact O-CB 3.31Å; I486-Y490 PolarHBondContact O-N 2.91Å; T487-Y490 PolarHBondContact O-N 2.85Å; L488-Y490 VanDerWaalsContact C-N 3.34Å; L488-Y490 PolarHBondContact O-N 3.24Å; Y490-M493 PolarHBondContact O-N 3.28Å; Y490-S494 WeakPolarHBondContact O-CB 3.37Å; Y490-S494 PolarHBondContact O-N 2.84Å; Y490-S494 PolarHBondContact O-OG 3.41Å; Y490-V544 HydrophobicContact CD2-CG1 3.99Å; Y490-K547 HydrophobicContact CE2-CD 4.12Å; Y490-K547 PolarHBondContact OH-NZ 2.92Å
491	D	82.1	Confident	80.2	Confident	9 Å²	9	75 Å²	75	5%	0.048	35%	0.354	C	S	.	.	H	α-helix	trans	-65.2	-41.9	177.9	-84.7	-16.9	0	0	0	111.6	T487 L488 S494 K495 R496	T487-D491 WeakPolarHBondContact O-CB 3.28Å; T487-D491 PolarHBondContact O-N 3.48Å; L488-D491 PolarHBondContact O-N 2.71Å; D491-S494 CarbonylContact O-C 3.58Å; D491-S494 PolarHBondContact O-N 2.96Å; D491-K495 PolarHBondContact O-N 2.94Å; D491-R496 HydrophobicContact CB-CB 4.27Å; D491-R496 PolarHBondContact O-N 2.96Å
492	I	85.2	Confident	79.5	Confident	109 Å²	109	78.6 Å²	78.6	56%	0.559	37%	0.368	S	S	*	.	H	α-helix	trans	-60.8	-50.8	174.8	-69.9	166.9	0	0	0	110.5	L488 I489 S494 K495	L488-I492 HydrophobicContact CD2-CD1 4.2Å; L488-I492 HydrophobicContact CG-CD1 4.04Å; L488-I492 WeakPolarHBondContact O-CB 3.28Å; L488-I492 VanDerWaalsContact O-CG1 3.25Å; L488-I492 WeakPolarHBondContact O-CG1 3.35Å; L488-I492 PolarHBondContact O-N 2.98Å; I489-I492 PolarHBondContact O-N 3.41Å; I492-S494 VanDerWaalsContact C-N 3.26Å; I492-S494 PolarHBondContact O-N 3.29Å; I492-K495 PolarHBondContact O-N 2.87Å
493	M	82.5	Confident	78.6	Confident	89 Å²	89	79.3 Å²	79.3	44%	0.438	38%	0.375	S	S	.	.	H	α-helix	trans	-64.9	-30.8	179.2	-73	-177.9	64.4	0	0	112.6	I489 Y490 K495 V544 R548	I489-M493 HydrophobicContact CG2-CG 4.31Å; I489-M493 HydrophobicContact CG2-SD 3.84Å; I489-M493 WeakPolarHBondContact O-CB 3.48Å; I489-M493 VanDerWaalsContact O-CG 3.31Å; I489-M493 WeakPolarHBondContact O-CG 3.4Å; I489-M493 PolarHBondContact O-N 3.4Å; Y490-M493 PolarHBondContact O-N 3.28Å; M493-K495 VanDerWaalsContact C-N 3.34Å; M493-V544 HydrophobicContact CE-CG1 4.24Å; M493-V544 HydrophobicContact SD-CB 4.36Å; M493-V544 HydrophobicContact SD-CG1 3.47Å; M493-V544 WeakPolarHBondContact SD-CG1 3.47Å; M493-R548 HydrophobicContact CE-CB 4.35Å; M493-R548 HydrophobicContact CE-CG 4.3Å
494	S	78	Confident	78.2	Confident	35 Å²	35	82 Å²	82	25%	0.245	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	3	178.5	-57.2	0	0	0	0	113.8	Y490 D491 I492 R496	Y490-S494 WeakPolarHBondContact O-CB 3.37Å; Y490-S494 PolarHBondContact O-N 2.84Å; Y490-S494 PolarHBondContact O-OG 3.41Å; D491-S494 CarbonylContact O-C 3.58Å; D491-S494 PolarHBondContact O-N 2.96Å; I492-S494 VanDerWaalsContact C-N 3.26Å; I492-S494 PolarHBondContact O-N 3.29Å; S494-R496 PolarHBondContact O-N 2.73Å
495	K	79.6	Confident	77.6	Confident	201 Å²	201	83.4 Å²	83.4	87%	0.874	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	35.2	-175.6	-55.8	-174.8	179.1	-178.3	0	113.7	D491 I492 M493	D491-K495 PolarHBondContact O-N 2.94Å; I492-K495 PolarHBondContact O-N 2.87Å; M493-K495 VanDerWaalsContact C-N 3.34Å
496	R	74.3	Confident	76.5	Confident	136 Å²	136	81.8 Å²	81.8	51%	0.513	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-90.6	153.4	176.4	-69.6	-176.6	173.8	-172.5	-1	110.6	D491 S494	D491-R496 HydrophobicContact CB-CB 4.27Å; D491-R496 PolarHBondContact O-N 2.96Å; S494-R496 PolarHBondContact O-N 2.73Å
497	R	71.8	Confident	75.7	Confident	237 Å²	237	86.1 Å²	86.1	89%	0.894	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-66.8	134.8	173	-69.6	-170.2	-175.1	-173	1.9	109.6	R499	R497-R499 PolarHBondContact O-N 3.2Å
498	L	68.8	Low	75.5	Confident	69 Å²	69	89.1 Å²	89.1	36%	0.361	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-56.1	124.5	176.8	-148	78.8	0	0	0	110.6	L488 W500	L488-L498 HydrophobicContact CD1-CD1 3.35Å; L488-L498 HydrophobicContact CD1-CD2 4.06Å; L488-L498 HydrophobicContact CD1-CG 4.06Å; L488-L498 HydrophobicContact CG-CD1 4.15Å; L498-W500 PolarHBondContact O-N 3.26Å
499	R	68.8	Low	74.8	Confident	86 Å²	86	88 Å²	88	33%	0.325	42%	0.423	S	S	.	.			trans	-84.5	97	174.2	-58.1	-165.4	-166.1	160.9	1.3	109.4	R497 G501 Y502	R497-R499 PolarHBondContact O-N 3.2Å; R499-G501 PolarHBondContact O-N 3.11Å; R499-Y502 HydrophobicContact CB-CD2 3.66Å; R499-Y502 HydrophobicContact CB-CE2 3.82Å; R499-Y502 HydrophobicContact CG-CD2 4.41Å; R499-Y502 HydrophobicContact CG-CE2 4.15Å; R499-Y502 PolarHBondContact NH1-OH 3.27Å; R499-Y502 PolarHBondContact O-N 2.77Å
500	W	72.1	Confident	73.8	Confident	203 Å²	203	90.5 Å²	90.5	77%	0.769	44%	0.439	S	S	*	.	H	α-helix	trans	-51.3	-25.4	179.4	-71.1	101.2	0	0	0	114.8	L498 Y502 A503 F504	L498-W500 PolarHBondContact O-N 3.26Å; W500-Y502 VanDerWaalsContact C-N 3.3Å; W500-Y502 PolarHBondContact O-N 2.86Å; W500-A503 HydrophobicContact CE3-CB 4.46Å; W500-A503 PolarHBondContact O-N 2.97Å; W500-F504 PolarHBondContact O-N 3.3Å
501	G	72.9	Confident	73.2	Confident	55 Å²	55	92.7 Å²	92.7	57%	0.567	45%	0.453	S	S	*	.	H	α-helix	trans	-57.8	-38.1	173.4	0	0	0	0	0	113.7	R499 F504 S505	R499-G501 PolarHBondContact O-N 3.11Å; G501-F504 PolarHBondContact O-N 3.38Å; G501-S505 PolarHBondContact O-N 3.14Å; G501-S505 VanDerWaalsContact O-N 3.14Å
502	Y	68.7	Low	72.7	Confident	88 Å²	88	93.7 Å²	93.7	35%	0.345	47%	0.465	S	S	.	.	H	α-helix	trans	-72.2	-40.5	177.3	-59.5	-48.5	0	0	0	111.7	L484 R499 W500 F504 S505 A506	L484-Y502 VanDerWaalsContact CD1-C 3.49Å; L484-Y502 WeakPolarHBondContact CD1-O 3.32Å; R499-Y502 HydrophobicContact CB-CD2 3.66Å; R499-Y502 HydrophobicContact CB-CE2 3.82Å; R499-Y502 HydrophobicContact CG-CD2 4.41Å; R499-Y502 HydrophobicContact CG-CE2 4.15Å; R499-Y502 PolarHBondContact NH1-OH 3.27Å; R499-Y502 PolarHBondContact O-N 2.77Å; W500-Y502 VanDerWaalsContact C-N 3.3Å; W500-Y502 PolarHBondContact O-N 2.86Å; Y502-F504 PolarHBondContact O-N 3.42Å; Y502-S505 WeakPolarHBondContact CA-OG 3.28Å; Y502-S505 PolarHBondContact O-N 3.37Å; Y502-S505 VanDerWaalsContact O-N 3.14Å; Y502-S505 PolarHBondContact O-OG 2.99Å; Y502-A506 PolarHBondContact O-N 3.47Å
503	A	68.5	Low	71.6	Confident	33 Å²	33	88.7 Å²	88.7	27%	0.273	44%	0.44	S	S	.	.	H	α-helix	trans	-58.1	-39.7	174.3	0	0	0	0	0	111.4	W500 A506 L507	W500-A503 HydrophobicContact CE3-CB 4.46Å; W500-A503 PolarHBondContact O-N 2.97Å; A503-A506 PolarHBondContact O-N 3.15Å; A503-L507 WeakPolarHBondContact O-CB 3.29Å; A503-L507 PolarHBondContact O-N 3.08Å
504	F	74.4	Confident	70.8	Confident	134 Å²	134	86.6 Å²	86.6	59%	0.588	44%	0.441	S	S	*	.	H	α-helix	trans	-64	-44.8	174.4	-174.9	-105.6	0	0	0	112.6	W500 G501 Y502 A506 L507 L508	W500-F504 PolarHBondContact O-N 3.3Å; G501-F504 PolarHBondContact O-N 3.38Å; Y502-F504 PolarHBondContact O-N 3.42Å; F504-A506 VanDerWaalsContact C-N 3.29Å; F504-A506 PolarHBondContact O-N 2.89Å; F504-L507 PolarHBondContact O-N 3.49Å; F504-L508 HydrophobicContact CD1-CD1 3.81Å; F504-L508 HydrophobicContact CE1-CD1 3.27Å; F504-L508 HydrophobicContact CE2-CD1 4.48Å; F504-L508 HydrophobicContact CZ-CD1 3.66Å; F504-L508 PolarHBondContact O-N 3.28Å
505	S	69.1	Low	70.4	Confident	64 Å²	64	90.7 Å²	90.7	45%	0.448	46%	0.459	S	S	.	.	H	α-helix	trans	-62.3	-35.6	176.4	53.3	0	0	0	0	113	G501 Y502 L508 A509	G501-S505 PolarHBondContact O-N 3.14Å; G501-S505 VanDerWaalsContact O-N 3.14Å; Y502-S505 WeakPolarHBondContact CA-OG 3.28Å; Y502-S505 PolarHBondContact O-N 3.37Å; Y502-S505 VanDerWaalsContact O-N 3.14Å; Y502-S505 PolarHBondContact O-OG 2.99Å; S505-L508 WeakPolarHBondContact O-CB 3.3Å; S505-L508 PolarHBondContact O-N 2.93Å; S505-A509 PolarHBondContact O-N 3.46Å
506	A	65.4	Low	69.7	Low	8 Å²	8	87.1 Å²	87.1	7%	0.066	45%	0.448	C	S	.	.	H	α-helix	trans	-71.1	-40.6	175.1	0	0	0	0	0	113.2	L481 L484 Y502 A503 F504 L508 A509 V510	L481-A506 HydrophobicContact CD2-CB 4.18Å; L484-A506 HydrophobicContact CB-CB 3.96Å; L484-A506 HydrophobicContact CD1-CB 3.56Å; L484-A506 HydrophobicContact CD2-CB 3.01Å; L484-A506 HydrophobicContact CG-CB 3.61Å; Y502-A506 PolarHBondContact O-N 3.47Å; A503-A506 PolarHBondContact O-N 3.15Å; F504-A506 VanDerWaalsContact C-N 3.29Å; F504-A506 PolarHBondContact O-N 2.89Å; A506-L508 VanDerWaalsContact C-N 3.26Å; A506-L508 PolarHBondContact O-N 3.48Å; A506-A509 PolarHBondContact O-N 3.33Å; A506-A509 VanDerWaalsContact O-N 3.14Å; A506-V510 WeakPolarHBondContact O-CG2 3.41Å; A506-V510 PolarHBondContact O-N 3.06Å
507	L	70.9	Confident	69.2	Low	99 Å²	99	83.7 Å²	83.7	52%	0.518	44%	0.435	S	S	.	.	H	α-helix	trans	-58	-44.3	173.3	-176.9	68.5	0	0	0	110.3	A503 F504 A509 V510 I511	A503-L507 WeakPolarHBondContact O-CB 3.29Å; A503-L507 PolarHBondContact O-N 3.08Å; F504-L507 PolarHBondContact O-N 3.49Å; L507-A509 PolarHBondContact O-N 3.41Å; L507-V510 PolarHBondContact O-N 3.35Å; L507-I511 HydrophobicContact CD1-CD1 4.25Å; L507-I511 HydrophobicContact CD2-CD1 4.43Å; L507-I511 HydrophobicContact CG-CD1 3.83Å; L507-I511 HydrophobicContact CG-CG1 4.49Å; L507-I511 WeakPolarHBondContact O-CB 3.28Å; L507-I511 WeakPolarHBondContact O-CG1 3.48Å; L507-I511 PolarHBondContact O-N 3.32Å
508	L	77	Confident	68.4	Low	97 Å²	97	82.2 Å²	82.2	51%	0.508	43%	0.431	S	S	.	.	H	α-helix	trans	-59.2	-42.1	173.6	-105.6	151.3	0	0	0	112.8	F504 S505 A506 I511 G512	F504-L508 HydrophobicContact CD1-CD1 3.81Å; F504-L508 HydrophobicContact CE1-CD1 3.27Å; F504-L508 HydrophobicContact CE2-CD1 4.48Å; F504-L508 HydrophobicContact CZ-CD1 3.66Å; F504-L508 PolarHBondContact O-N 3.28Å; S505-L508 WeakPolarHBondContact O-CB 3.3Å; S505-L508 PolarHBondContact O-N 2.93Å; A506-L508 VanDerWaalsContact C-N 3.26Å; A506-L508 PolarHBondContact O-N 3.48Å; L508-I511 PolarHBondContact O-N 2.98Å; L508-G512 PolarHBondContact O-N 3.24Å
509	A	68.3	Low	67.7	Low	31 Å²	31	86 Å²	86	26%	0.256	45%	0.452	S	S	.	.	H	α-helix	trans	-67.4	-40.7	177.2	0	0	0	0	0	112.5	V480 L481 S505 A506 L507 G512 A513	V480-A509 HydrophobicContact CG1-CB 4.03Å; L481-A509 HydrophobicContact CD2-CB 3.81Å; S505-A509 PolarHBondContact O-N 3.46Å; A506-A509 PolarHBondContact O-N 3.33Å; A506-A509 VanDerWaalsContact O-N 3.14Å; L507-A509 PolarHBondContact O-N 3.41Å; A509-G512 PolarHBondContact O-N 2.94Å; A509-A513 WeakPolarHBondContact O-CB 3.49Å; A509-A513 PolarHBondContact O-N 3.32Å
510	V	67.3	Low	67.1	Low	77 Å²	77	89.5 Å²	89.5	47%	0.467	47%	0.472	S	S	.	.	H	α-helix	trans	-63.1	-45.4	173.3	174.5	0	0	0	0	110.9	L481 A506 L507 A513 G514	L481-V510 HydrophobicContact CD1-CG2 3.52Å; L481-V510 HydrophobicContact CD2-CG2 3.81Å; L481-V510 HydrophobicContact CG-CG2 4.31Å; A506-V510 WeakPolarHBondContact O-CG2 3.41Å; A506-V510 PolarHBondContact O-N 3.06Å; L507-V510 PolarHBondContact O-N 3.35Å; V510-A513 PolarHBondContact O-N 2.78Å; V510-G514 PolarHBondContact O-N 2.96Å
511	I	72.1	Confident	66.7	Low	86 Å²	86	83.5 Å²	83.5	44%	0.441	46%	0.457	S	S	.	.	H	α-helix	trans	-62.9	-47	177.5	-71	168.6	0	0	0	110	L507 L508 A513 G514 I515	L507-I511 HydrophobicContact CD1-CD1 4.25Å; L507-I511 HydrophobicContact CD2-CD1 4.43Å; L507-I511 HydrophobicContact CG-CD1 3.83Å; L507-I511 HydrophobicContact CG-CG1 4.49Å; L507-I511 WeakPolarHBondContact O-CB 3.28Å; L507-I511 WeakPolarHBondContact O-CG1 3.48Å; L507-I511 PolarHBondContact O-N 3.32Å; L508-I511 PolarHBondContact O-N 2.98Å; I511-A513 VanDerWaalsContact C-N 3.28Å; I511-A513 PolarHBondContact O-N 3.33Å; I511-G514 PolarHBondContact O-N 2.6Å; I511-G514 VanDerWaalsContact O-N 3.1Å; I511-I515 HydrophobicContact CG2-CD1 3.63Å; I511-I515 HydrophobicContact CG2-CG1 4.22Å; I511-I515 VanDerWaalsContact O-CG1 3.31Å; I511-I515 WeakPolarHBondContact O-CG1 3.46Å; I511-I515 PolarHBondContact O-N 3.03Å
512	G	71.3	Confident	66.5	Low	30 Å²	30	84.2 Å²	84.2	31%	0.309	45%	0.451	S	S	.	.	H	α-helix	trans	-57.1	-42.9	175.9	0	0	0	0	0	111.9	L508 A509 I515 I516	L508-G512 PolarHBondContact O-N 3.24Å; A509-G512 PolarHBondContact O-N 2.94Å; G512-I515 PolarHBondContact O-N 3.29Å; G512-I516 WeakPolarHBondContact O-CD1 3.15Å; G512-I516 VanDerWaalsContact O-CG1 3.27Å; G512-I516 WeakPolarHBondContact O-CG1 3.42Å; G512-I516 PolarHBondContact O-N 2.88Å; G512-I516 VanDerWaalsContact O-N 3.08Å
513	A	62.6	Low	66.6	Low	4 Å²	4	86.8 Å²	86.8	3%	0.033	47%	0.471	C	S	.	.	H	α-helix	trans	-65	-38.8	175.1	0	0	0	0	0	113	L477 F478 A509 V510 I511	L477-A513 HydrophobicContact CD1-CB 3.88Å; L477-A513 HydrophobicContact CD2-CB 3.66Å; L477-A513 HydrophobicContact CG-CB 3.57Å; F478-A513 HydrophobicContact CD1-CB 4.28Å; F478-A513 HydrophobicContact CE1-CB 3.88Å; A509-A513 WeakPolarHBondContact O-CB 3.49Å; A509-A513 PolarHBondContact O-N 3.32Å; V510-A513 PolarHBondContact O-N 2.78Å; I511-A513 VanDerWaalsContact C-N 3.28Å; I511-A513 PolarHBondContact O-N 3.33Å
514	G	64.5	Low	67.2	Low	45 Å²	45	91 Å²	91	46%	0.464	49%	0.485	S	S	.	.	H	α-helix	trans	-66.2	-40.9	175.1	0	0	0	0	0	113	V510 I511 R517	V510-G514 PolarHBondContact O-N 2.96Å; I511-G514 PolarHBondContact O-N 2.6Å; I511-G514 VanDerWaalsContact O-N 3.1Å; G514-R517 PolarHBondContact O-N 3.45Å
515	I	70.5	Confident	67.6	Low	121 Å²	121	85.3 Å²	85.3	62%	0.621	46%	0.46	S	S	*	.	H	α-helix	trans	-65.9	-42.3	178.5	-68.7	168	0	0	0	111	I511 G512 R517	I511-I515 HydrophobicContact CG2-CD1 3.63Å; I511-I515 HydrophobicContact CG2-CG1 4.22Å; I511-I515 VanDerWaalsContact O-CG1 3.31Å; I511-I515 WeakPolarHBondContact O-CG1 3.46Å; I511-I515 PolarHBondContact O-N 3.03Å; G512-I515 PolarHBondContact O-N 3.29Å; I515-R517 PolarHBondContact O-N 3.31Å
516	I	65.1	Low	68.3	Low	127 Å²	127	89.8 Å²	89.8	65%	0.651	47%	0.467	S	S	*	.	H	α-helix	trans	-58.1	-21.2	178.1	-72.6	166.6	0	0	0	111.7	L477 G512	L477-I516 HydrophobicContact CD1-CD1 4.22Å; L477-I516 HydrophobicContact CD2-CG2 4.49Å; G512-I516 WeakPolarHBondContact O-CD1 3.15Å; G512-I516 VanDerWaalsContact O-CG1 3.27Å; G512-I516 WeakPolarHBondContact O-CG1 3.42Å; G512-I516 PolarHBondContact O-N 2.88Å; G512-I516 VanDerWaalsContact O-N 3.08Å
517	R	62.5	Low	69.4	Low	63 Å²	63	92.4 Å²	92.4	24%	0.238	48%	0.482	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.4	24.8	-166.5	-136.6	-149.1	168.5	167.4	9.6	116	E474 G514 I515 D519	E474-R517 IonicContact OE1-CZ 2.93Å; E474-R517 IonicContact OE1-NE 3.98Å; E474-R517 IonicContact OE1-NH1 2.55Å; E474-R517 PolarHBondContact OE1-NH1 3.41Å; E474-R517 IonicContact OE1-NH2 2.84Å; E474-R517 PolarHBondContact OE1-NH2 3.46Å; E474-R517 IonicContact OE2-CZ 3.59Å; E474-R517 IonicContact OE2-NH1 3.95Å; E474-R517 IonicContact OE2-NH2 2.86Å; E474-R517 PolarHBondContact OE2-NH2 2.85Å; G514-R517 PolarHBondContact O-N 3.45Å; I515-R517 PolarHBondContact O-N 3.31Å; R517-D519 PolarHBondContact O-N 3.34Å
518	Y	55.4	Low	70.3	Confident	206 Å²	206	87.7 Å²	87.7	81%	0.808	46%	0.457	S	S	*	.			trans	-61.3	-9.3	-176	-149.8	-96.6	0	0	0	114.8
519	D	54.4	Low	70.8	Confident	148 Å²	148	84.7 Å²	84.7	79%	0.791	44%	0.441	S	S	*	.	S	Bend	trans	-103.8	84.4	-177.4	-71	-30.4	0	0	0	114	R517	R517-D519 PolarHBondContact O-N 3.34Å
520	Q	57.2	Low	71.9	Confident	161 Å²	161	88.1 Å²	88.1	75%	0.752	46%	0.455	S	S	*	.			trans	92	78.7	171	-49	-176.1	7.4	0	0	116.3	T522	Q520-T522 PolarHBondContact O-N 3.22Å
521	V	63.6	Low	73.2	Confident	76 Å²	76	85.3 Å²	85.3	46%	0.461	44%	0.437	S	S	.	.			trans	-74	100.6	161.5	-177	0	0	0	0	108.6	F525 W526	V521-F525 HydrophobicContact CG1-CB 4.06Å; V521-F525 HydrophobicContact CG1-CD1 3.54Å; V521-F525 HydrophobicContact CG1-CE1 4.34Å; V521-F525 HydrophobicContact CG1-CG 4.12Å; V521-W526 HydrophobicContact CG1-CZ2 4.24Å
522	T	67	Low	74.1	Confident	70 Å²	70	81.3 Å²	81.3	43%	0.429	42%	0.417	S	S	.	.			trans	-74.1	152.8	171.1	55.7	0	0	0	0	110.4	Q520 H524 F525	Q520-T522 PolarHBondContact O-N 3.22Å; T522-H524 PolarHBondContact O-N 3.3Å; T522-F525 WeakPolarHBondContact O-CB 3.35Å; T522-F525 PolarHBondContact O-N 3.09Å
523	D	70.7	Confident	75.1	Confident	143 Å²	143	81.2 Å²	81.2	77%	0.765	41%	0.408	S	S	*	.	H	α-helix	trans	-55.9	-29.9	179.3	-70.7	-28.8	0	0	0	113	F525	D523-F525 VanDerWaalsContact C-N 3.29Å; D523-F525 PolarHBondContact O-N 3.46Å
524	H	81.2	Confident	76.7	Confident	122 Å²	122	84.6 Å²	84.6	57%	0.565	43%	0.426	S	S	*	.	H	α-helix	trans	-68.9	-24.2	176.5	-66.9	-43.2	0	0	0	113.8	Y469 T522 W526 T527 G528	Y469-H524 HydrophobicContact CD1-CB 4.03Å; T522-H524 PolarHBondContact O-N 3.3Å; H524-W526 PolarHBondContact O-N 2.93Å; H524-T527 PolarHBondContact O-N 2.83Å; H524-G528 PolarHBondContact O-N 2.87Å
525	F	82.7	Confident	78.2	Confident	14 Å²	14	82.7 Å²	82.7	6%	0.061	41%	0.405	C	S	.	.	H	α-helix	trans	-58.4	-46.3	179.7	172.4	-110.2	0	0	0	112.7	L470 F478 V521 T522 D523 T527 G528 L529	L470-F525 HydrophobicContact CD2-CD2 3.47Å; L470-F525 VanDerWaalsContact CD2-CD2 3.47Å; L470-F525 HydrophobicContact CD2-CE2 3.8Å; F478-F525 HydrophobicContact CE1-CZ 4.36Å; F478-F525 AromaticContact CE2-CE2 3.53Å; F478-F525 HydrophobicContact CE2-CE2 3.53Å; F478-F525 AromaticContact CE2-CZ 3.88Å; F478-F525 HydrophobicContact CE2-CZ 3.88Å; F478-F525 AromaticContact CZ-CE2 3.56Å; F478-F525 HydrophobicContact CZ-CE2 3.56Å; F478-F525 AromaticContact CZ-CZ 3.45Å; F478-F525 HydrophobicContact CZ-CZ 3.45Å; F478-F525 VanDerWaalsContact CZ-CZ 3.45Å; V521-F525 HydrophobicContact CG1-CB 4.06Å; V521-F525 HydrophobicContact CG1-CD1 3.54Å; V521-F525 HydrophobicContact CG1-CE1 4.34Å; V521-F525 HydrophobicContact CG1-CG 4.12Å; T522-F525 WeakPolarHBondContact O-CB 3.35Å; T522-F525 PolarHBondContact O-N 3.09Å; D523-F525 VanDerWaalsContact C-N 3.29Å; D523-F525 PolarHBondContact O-N 3.46Å; F525-T527 PolarHBondContact O-N 3.43Å; F525-G528 WeakPolarHBondContact O-CA 3.43Å; F525-G528 PolarHBondContact O-N 3.17Å; F525-G528 VanDerWaalsContact O-N 3.08Å; F525-L529 HydrophobicContact CE1-CB 4.48Å; F525-L529 HydrophobicContact CE1-CD2 4.04Å; F525-L529 HydrophobicContact CZ-CB 4.43Å; F525-L529 HydrophobicContact CZ-CD2 4.26Å; F525-L529 WeakPolarHBondContact O-CB 3.45Å; F525-L529 PolarHBondContact O-N 3.39Å
526	W	84	Confident	79.2	Confident	158 Å²	158	77.1 Å²	77.1	60%	0.598	38%	0.376	S	S	*	.	H	α-helix	trans	-62.3	-34.9	-176.9	-68	110.2	0	0	0	112.1	V521 H524 L529 L530	V521-W526 HydrophobicContact CG1-CZ2 4.24Å; H524-W526 PolarHBondContact O-N 2.93Å; W526-L529 HydrophobicContact CE3-CD2 3.96Å; W526-L529 HydrophobicContact CZ3-CD2 3.92Å; W526-L530 VanDerWaalsContact O-CB 3.3Å; W526-L530 WeakPolarHBondContact O-CB 3.49Å; W526-L530 PolarHBondContact O-N 2.88Å
527	T	89.6	Confident	80.6	Confident	62 Å²	62	73.7 Å²	73.7	38%	0.38	36%	0.359	S	S	.	.	H	α-helix	trans	-65.6	-47.4	174.2	-57.8	0	0	0	0	110.4	Y469 H524 F525 L530 L531	Y469-T527 HydrophobicContact CD1-CG2 4.27Å; Y469-T527 HydrophobicContact CD2-CG2 4.38Å; Y469-T527 HydrophobicContact CE1-CG2 3.99Å; Y469-T527 HydrophobicContact CE2-CG2 4.1Å; Y469-T527 HydrophobicContact CG-CG2 4.46Å; H524-T527 PolarHBondContact O-N 2.83Å; F525-T527 PolarHBondContact O-N 3.43Å; T527-L530 PolarHBondContact O-N 3.42Å; T527-L531 HydrophobicContact CG2-CD1 4.23Å; T527-L531 VanDerWaalsContact O-CG 3.29Å; T527-L531 WeakPolarHBondContact O-CG 3.24Å; T527-L531 PolarHBondContact O-N 2.89Å
528	G	89.1	Confident	82.2	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-59	-47.2	175.7	0	0	0	0	0	113	L470 H524 F525 L530 L531 V532	L470-G528 WeakPolarHBondContact CD1-O 3.39Å; H524-G528 PolarHBondContact O-N 2.87Å; F525-G528 WeakPolarHBondContact O-CA 3.43Å; F525-G528 PolarHBondContact O-N 3.17Å; F525-G528 VanDerWaalsContact O-N 3.08Å; G528-L530 PolarHBondContact O-N 3.16Å; G528-L531 PolarHBondContact O-N 3.39Å; G528-V532 WeakPolarHBondContact O-CG2 3.28Å; G528-V532 PolarHBondContact O-N 2.88Å
529	L	88.2	Confident	84	Confident	34 Å²	34	62.3 Å²	62.3	18%	0.178	32%	0.316	C	S	.	.	H	α-helix	trans	-59.1	-48.4	178.4	178.8	61.9	0	0	0	111.2	F478 F525 W526 L531 V532 Q533	F478-L529 HydrophobicContact CB-CD1 4.35Å; F478-L529 HydrophobicContact CD1-CD1 3.53Å; F478-L529 HydrophobicContact CD2-CD1 3.81Å; F478-L529 HydrophobicContact CE1-CD1 3.75Å; F478-L529 HydrophobicContact CE2-CD1 4.03Å; F478-L529 HydrophobicContact CG-CD1 3.6Å; F478-L529 HydrophobicContact CZ-CD1 4.03Å; F525-L529 HydrophobicContact CE1-CB 4.48Å; F525-L529 HydrophobicContact CE1-CD2 4.04Å; F525-L529 HydrophobicContact CZ-CB 4.43Å; F525-L529 HydrophobicContact CZ-CD2 4.26Å; F525-L529 WeakPolarHBondContact O-CB 3.45Å; F525-L529 PolarHBondContact O-N 3.39Å; W526-L529 HydrophobicContact CE3-CD2 3.96Å; W526-L529 HydrophobicContact CZ3-CD2 3.92Å; L529-L531 VanDerWaalsContact C-N 3.32Å; L529-L531 PolarHBondContact O-N 3.21Å; L529-V532 PolarHBondContact O-N 2.8Å; L529-Q533 HydrophobicContact CD1-CG 4.27Å; L529-Q533 WeakPolarHBondContact O-CG 3.37Å; L529-Q533 PolarHBondContact O-N 3.28Å
530	L	91.2	Very high	85.8	Confident	103 Å²	103	55.2 Å²	55.2	54%	0.539	28%	0.279	S	S	.	.	H	α-helix	trans	-59.6	-43.3	178	-178.5	143.6	0	0	0	111.4	W526 T527 G528 Q533 L534	W526-L530 VanDerWaalsContact O-CB 3.3Å; W526-L530 WeakPolarHBondContact O-CB 3.49Å; W526-L530 PolarHBondContact O-N 2.88Å; T527-L530 PolarHBondContact O-N 3.42Å; G528-L530 PolarHBondContact O-N 3.16Å; L530-Q533 PolarHBondContact O-N 2.88Å; L530-L534 HydrophobicContact CD2-CD1 3.55Å; L530-L534 HydrophobicContact CD2-CG 4.3Å; L530-L534 HydrophobicContact CG-CD1 4.33Å; L530-L534 WeakPolarHBondContact O-CB 3.43Å; L530-L534 WeakPolarHBondContact O-CG 3.49Å; L530-L534 PolarHBondContact O-N 3.45Å
531	L	93.8	Very high	87.5	Confident	19 Å²	19	50.8 Å²	50.8	10%	0.099	26%	0.259	C	S	.	.	H	α-helix	trans	-61.5	-43.8	176.5	-71.7	170.7	0	0	0	112.2	L462 R465 A466 Y469 T527 G528 L529 L534 S535	L462-L531 HydrophobicContact CD2-CD2 3.73Å; R465-L531 HydrophobicContact CB-CD1 4.34Å; R465-L531 HydrophobicContact CG-CD1 4.08Å; A466-L531 HydrophobicContact CB-CB 3.81Å; Y469-L531 HydrophobicContact CD2-CD1 3.8Å; Y469-L531 HydrophobicContact CE2-CD1 3.74Å; T527-L531 HydrophobicContact CG2-CD1 4.23Å; T527-L531 VanDerWaalsContact O-CG 3.29Å; T527-L531 WeakPolarHBondContact O-CG 3.24Å; T527-L531 PolarHBondContact O-N 2.89Å; G528-L531 PolarHBondContact O-N 3.39Å; L529-L531 VanDerWaalsContact C-N 3.32Å; L529-L531 PolarHBondContact O-N 3.21Å; L531-L534 PolarHBondContact O-N 2.87Å; L531-S535 WeakPolarHBondContact O-CB 3.48Å; L531-S535 PolarHBondContact O-N 3.07Å
532	V	92	Very high	88.9	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.012	24%	0.237	C	C	.	.	H	α-helix	trans	-65.9	-40.6	176.9	176.4	0	0	0	0	111.6	A466 L470 L475 F478 T479 G528 L529 S535 N536	A466-V532 HydrophobicContact CB-CG2 3.49Å; A466-V532 VanDerWaalsContact CB-CG2 3.49Å; L470-V532 HydrophobicContact CD1-CB 4.45Å; L470-V532 HydrophobicContact CD1-CG2 3.45Å; L470-V532 VanDerWaalsContact CD1-CG2 3.45Å; L475-V532 HydrophobicContact CD1-CG2 3.98Å; L475-V532 HydrophobicContact CG-CG2 3.86Å; F478-V532 HydrophobicContact CB-CB 4.36Å; F478-V532 HydrophobicContact CB-CG1 3.69Å; T479-V532 HydrophobicContact CG2-CG1 4.17Å; G528-V532 WeakPolarHBondContact O-CG2 3.28Å; G528-V532 PolarHBondContact O-N 2.88Å; L529-V532 PolarHBondContact O-N 2.8Å; V532-S535 VanDerWaalsContact O-CB 3.3Å; V532-S535 WeakPolarHBondContact O-CB 3.34Å; V532-S535 PolarHBondContact O-N 3.02Å; V532-N536 PolarHBondContact O-N 3.06Å; V532-N536 PolarHBondContact O-ND2 2.93Å; V532-N536 PolarHBondContact O-OD1 3.23Å
533	Q	92.7	Very high	90	Very high	28 Å²	28	44.1 Å²	44.1	13%	0.131	22%	0.218	C	C	.	.	H	α-helix	trans	-66.4	-41.3	178	-63.8	-45.2	-47.6	0	0	112	F478 Y485 L529 L530 S535 N536 I537	F478-Q533 PolarHBondContact O-NE2 3.32Å; Y485-Q533 VanDerWaalsContact CE2-OE1 3.25Å; Y485-Q533 PolarHBondContact OH-OE1 2.91Å; L529-Q533 HydrophobicContact CD1-CG 4.27Å; L529-Q533 WeakPolarHBondContact O-CG 3.37Å; L529-Q533 PolarHBondContact O-N 3.28Å; L530-Q533 PolarHBondContact O-N 2.88Å; Q533-S535 VanDerWaalsContact C-N 3.29Å; Q533-S535 PolarHBondContact O-N 3.36Å; Q533-N536 PolarHBondContact O-N 3.41Å; Q533-I537 VanDerWaalsContact O-CG1 3.28Å; Q533-I537 WeakPolarHBondContact O-CG1 3.15Å; Q533-I537 PolarHBondContact O-N 3.16Å
534	L	95.4	Very high	90.9	Very high	75 Å²	75	37.5 Å²	37.5	39%	0.393	18%	0.183	S	C	.	.	H	α-helix	trans	-62.6	-38.2	172.2	-69.4	176.7	0	0	0	111.6	L462 L530 L531 I537 T538	L462-L534 HydrophobicContact CD1-CB 3.73Å; L462-L534 HydrophobicContact CD2-CB 4.49Å; L530-L534 HydrophobicContact CD2-CD1 3.55Å; L530-L534 HydrophobicContact CD2-CG 4.3Å; L530-L534 HydrophobicContact CG-CD1 4.33Å; L530-L534 WeakPolarHBondContact O-CB 3.43Å; L530-L534 WeakPolarHBondContact O-CG 3.49Å; L530-L534 PolarHBondContact O-N 3.45Å; L531-L534 PolarHBondContact O-N 2.87Å; L534-I537 PolarHBondContact O-N 2.96Å; L534-T538 WeakPolarHBondContact O-CB 3.36Å; L534-T538 VanDerWaalsContact O-CG2 3.25Å; L534-T538 WeakPolarHBondContact O-CG2 3.48Å; L534-T538 PolarHBondContact O-N 3.4Å; L534-T538 PolarHBondContact O-OG1 2.78Å
535	S	95.1	Very high	91.4	Very high	4 Å²	4	32.2 Å²	32.2	3%	0.028	16%	0.161	C	C	.	.	H	α-helix	trans	-59.7	-47.9	172.7	-179.3	0	0	0	0	111.6	M459 S463 L531 V532 Q533 I537 T538 F539	M459-S535 WeakPolarHBondContact CG-OG 3.33Å; M459-S535 PolarHBondContact O-OG 3.32Å; M459-S535 VanDerWaalsContact O-OG 3.1Å; S463-S535 WeakPolarHBondContact CB-OG 3.44Å; L531-S535 WeakPolarHBondContact O-CB 3.48Å; L531-S535 PolarHBondContact O-N 3.07Å; V532-S535 VanDerWaalsContact O-CB 3.3Å; V532-S535 WeakPolarHBondContact O-CB 3.34Å; V532-S535 PolarHBondContact O-N 3.02Å; Q533-S535 VanDerWaalsContact C-N 3.29Å; Q533-S535 PolarHBondContact O-N 3.36Å; S535-I537 VanDerWaalsContact C-N 3.34Å; S535-I537 PolarHBondContact O-N 2.88Å; S535-T538 WeakPolarHBondContact CA-OG1 3.33Å; S535-T538 PolarHBondContact O-N 3.48Å; S535-T538 PolarHBondContact O-OG1 3.1Å; S535-F539 WeakPolarHBondContact O-CB 3.19Å; S535-F539 PolarHBondContact O-N 3.12Å
536	N	92.8	Very high	91.8	Very high	4 Å²	4	31.6 Å²	31.6	2%	0.021	16%	0.159	C	C	.	.	H	α-helix	trans	-63	-39.6	178.9	-64.5	-19.1	0	0	0	112.1	F478 T482 Y485 V532 Q533 A540	F478-N536 PolarHBondContact O-ND2 3.27Å; T482-N536 PolarHBondContact OG1-OD1 3.06Å; Y485-N536 HydrophobicContact CD2-CB 3.63Å; Y485-N536 HydrophobicContact CE2-CB 3.73Å; V532-N536 PolarHBondContact O-N 3.06Å; V532-N536 PolarHBondContact O-ND2 2.93Å; V532-N536 PolarHBondContact O-OD1 3.23Å; Q533-N536 PolarHBondContact O-N 3.41Å; N536-A540 VanDerWaalsContact O-CB 3.28Å; N536-A540 WeakPolarHBondContact O-CB 3.15Å; N536-A540 PolarHBondContact O-N 3.46Å
537	I	94.1	Very high	92	Very high	55 Å²	55	25.1 Å²	25.1	28%	0.282	13%	0.134	S	C	.	.	H	α-helix	trans	-65.5	-47.7	177	-68.9	164.7	0	0	0	110.6	Y485 Q533 L534 S535 F539 A540 I541	Y485-I537 HydrophobicContact CD1-CD1 4.43Å; Y485-I537 HydrophobicContact CD1-CG1 3.64Å; Y485-I537 HydrophobicContact CD2-CG1 4.24Å; Y485-I537 HydrophobicContact CE1-CD1 3.99Å; Y485-I537 HydrophobicContact CE1-CG1 3.64Å; Y485-I537 HydrophobicContact CE2-CG1 4.23Å; Y485-I537 HydrophobicContact CG-CG1 3.95Å; Q533-I537 VanDerWaalsContact O-CG1 3.28Å; Q533-I537 WeakPolarHBondContact O-CG1 3.15Å; Q533-I537 PolarHBondContact O-N 3.16Å; L534-I537 PolarHBondContact O-N 2.96Å; S535-I537 VanDerWaalsContact C-N 3.34Å; S535-I537 PolarHBondContact O-N 2.88Å; I537-F539 PolarHBondContact O-N 3.3Å; I537-A540 PolarHBondContact O-N 3.44Å; I537-I541 HydrophobicContact CG2-CD1 3.88Å; I537-I541 HydrophobicContact CG2-CG1 4.39Å; I537-I541 VanDerWaalsContact O-CG1 3.31Å; I537-I541 WeakPolarHBondContact O-CG1 3.08Å; I537-I541 PolarHBondContact O-N 2.95Å
538	T	95.3	Very high	91.8	Very high	13 Å²	13	27.4 Å²	27.4	8%	0.08	14%	0.136	C	C	.	.	H	α-helix	trans	-65.3	-38.9	-179.9	52.5	0	0	0	0	111.9	M454 V458 M459 L462 L534 S535 G542	M454-T538 HydrophobicContact CE-CG2 3.79Å; V458-T538 HydrophobicContact CB-CG2 4.5Å; V458-T538 HydrophobicContact CG1-CG2 3.79Å; M459-T538 WeakPolarHBondContact CA-OG1 3.33Å; L462-T538 HydrophobicContact CD1-CG2 4.15Å; L534-T538 WeakPolarHBondContact O-CB 3.36Å; L534-T538 VanDerWaalsContact O-CG2 3.25Å; L534-T538 WeakPolarHBondContact O-CG2 3.48Å; L534-T538 PolarHBondContact O-N 3.4Å; L534-T538 PolarHBondContact O-OG1 2.78Å; S535-T538 WeakPolarHBondContact CA-OG1 3.33Å; S535-T538 PolarHBondContact O-N 3.48Å; S535-T538 PolarHBondContact O-OG1 3.1Å; T538-G542 PolarHBondContact O-N 2.95Å
539	F	93.9	Very high	91.8	Very high	17 Å²	17	28 Å²	28	8%	0.075	14%	0.14	C	C	.	.	H	α-helix	trans	-55.9	-51	168.6	-176.5	-88.8	0	0	0	111.5	W399 Q455 M459 T482 I486 S535 I537 G542 M543 Y607 W610	W399-F539 HydrophobicContact CH2-CE2 4.48Å; W399-F539 HydrophobicContact CH2-CZ 4.32Å; W399-F539 HydrophobicContact CZ3-CZ 4.5Å; Q455-F539 HydrophobicContact CG-CD2 4.22Å; M459-F539 HydrophobicContact CE-CD2 4.49Å; M459-F539 HydrophobicContact CG-CB 3.71Å; M459-F539 HydrophobicContact CG-CD2 4.11Å; M459-F539 HydrophobicContact CG-CG 4.42Å; M459-F539 HydrophobicContact SD-CD2 4.46Å; T482-F539 HydrophobicContact CG2-CD1 3.45Å; T482-F539 VanDerWaalsContact CG2-CD1 3.45Å; T482-F539 HydrophobicContact CG2-CE1 3.85Å; T482-F539 HydrophobicContact CG2-CG 4.29Å; I486-F539 HydrophobicContact CD1-CE1 4.21Å; S535-F539 WeakPolarHBondContact O-CB 3.19Å; S535-F539 PolarHBondContact O-N 3.12Å; I537-F539 PolarHBondContact O-N 3.3Å; F539-G542 PolarHBondContact O-N 3.38Å; F539-M543 HydrophobicContact CE1-CB 4.37Å; F539-M543 HydrophobicContact CE1-SD 3.72Å; F539-M543 HydrophobicContact CZ-SD 4.29Å; F539-M543 WeakPolarHBondContact O-CB 3.43Å; F539-M543 PolarHBondContact O-N 3.05Å; F539-Y607 HydrophobicContact CD2-CE1 4.21Å; F539-Y607 AromaticContact CE2-CE1 3.43Å; F539-Y607 HydrophobicContact CE2-CE1 3.43Å; F539-Y607 VanDerWaalsContact CE2-CE1 3.43Å; F539-Y607 AromaticContact CE2-CZ 3.87Å; F539-Y607 HydrophobicContact CZ-CE1 4.27Å; F539-W610 AromaticContact CZ-NE1 3.91Å
540	A	91.9	Very high	91.7	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-65.6	-40.6	-176.4	0	0	0	0	0	112.6	I486 I489 N536 I537 G542 M543 V544	I486-A540 HydrophobicContact CB-CB 4.42Å; I486-A540 HydrophobicContact CG1-CB 3.68Å; I489-A540 HydrophobicContact CD1-CB 3.55Å; N536-A540 VanDerWaalsContact O-CB 3.28Å; N536-A540 WeakPolarHBondContact O-CB 3.15Å; N536-A540 PolarHBondContact O-N 3.46Å; I537-A540 PolarHBondContact O-N 3.44Å; A540-G542 VanDerWaalsContact C-N 3.31Å; A540-G542 PolarHBondContact O-N 3.44Å; A540-M543 PolarHBondContact O-N 3.28Å; A540-V544 WeakPolarHBondContact O-CB 3.35Å; A540-V544 VanDerWaalsContact O-CG2 3.32Å; A540-V544 WeakPolarHBondContact O-CG2 3.38Å; A540-V544 PolarHBondContact O-N 2.93Å
541	I	93.8	Very high	91.4	Very high	68 Å²	68	27.3 Å²	27.3	35%	0.349	13%	0.133	S	C	.	.	H	α-helix	trans	-57.6	-47.6	172.5	-69.6	170.2	0	0	0	109.9	M454 I489 I537 G545	M454-I541 HydrophobicContact CE-CD1 4.29Å; M454-I541 HydrophobicContact CE-CG2 4.46Å; I489-I541 HydrophobicContact CD1-CG1 3.68Å; I489-I541 HydrophobicContact CG1-CG1 4.49Å; I489-I541 HydrophobicContact CG2-CG1 4.5Å; I537-I541 HydrophobicContact CG2-CD1 3.88Å; I537-I541 HydrophobicContact CG2-CG1 4.39Å; I537-I541 VanDerWaalsContact O-CG1 3.31Å; I537-I541 WeakPolarHBondContact O-CG1 3.08Å; I537-I541 PolarHBondContact O-N 2.95Å; I541-G545 WeakPolarHBondContact O-CA 3.37Å; I541-G545 PolarHBondContact O-N 3.02Å
542	G	92.5	Very high	91	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-60.3	-49.5	177.3	0	0	0	0	0	112.6	V451 Q455 T538 F539 A540 V544 G545 Y546	V451-G542 WeakPolarHBondContact CG1-O 3.3Å; Q455-G542 PolarHBondContact OE1-O 3.14Å; T538-G542 PolarHBondContact O-N 2.95Å; F539-G542 PolarHBondContact O-N 3.38Å; A540-G542 VanDerWaalsContact C-N 3.31Å; A540-G542 PolarHBondContact O-N 3.44Å; G542-V544 PolarHBondContact O-N 3.27Å; G542-G545 PolarHBondContact O-N 2.9Å; G542-Y546 WeakPolarHBondContact O-CB 3.3Å; G542-Y546 PolarHBondContact O-N 3.42Å
543	M	90.4	Very high	90.7	Very high	5 Å²	5	34.5 Å²	34.5	3%	0.025	17%	0.167	C	C	.	.	H	α-helix	trans	-64.2	-46.1	-176.9	-168.7	173.8	-169.5	0	0	112.7	I486 F539 A540 Y546 K547 W610 A614 W619	I486-M543 HydrophobicContact CD1-SD 3.55Å; I486-M543 VanDerWaalsContact CD1-SD 3.55Å; I486-M543 HydrophobicContact CG1-SD 4.28Å; F539-M543 HydrophobicContact CE1-CB 4.37Å; F539-M543 HydrophobicContact CE1-SD 3.72Å; F539-M543 HydrophobicContact CZ-SD 4.29Å; F539-M543 WeakPolarHBondContact O-CB 3.43Å; F539-M543 PolarHBondContact O-N 3.05Å; A540-M543 PolarHBondContact O-N 3.28Å; M543-Y546 PolarHBondContact O-N 3.34Å; M543-K547 PolarHBondContact O-N 3.47Å; M543-K547 VanDerWaalsContact O-N 3.15Å; M543-W610 HydrophobicContact CE-CZ2 4.19Å; M543-W610 PolarHBondContact SD-NE1 3.37Å; M543-A614 HydrophobicContact CE-CB 3.41Å; M543-A614 VanDerWaalsContact CE-CB 3.41Å; M543-W619 HydrophobicContact CE-CH2 3.55Å; M543-W619 HydrophobicContact CE-CZ2 3.54Å; M543-W619 HydrophobicContact SD-CH2 4.02Å; M543-W619 HydrophobicContact SD-CZ2 4.36Å
544	V	90.4	Very high	90.2	Very high	5 Å²	5	38 Å²	38	3%	0.03	19%	0.192	C	C	.	.	H	α-helix	trans	-65.4	-41.8	175.8	173.8	0	0	0	0	110.7	I486 I489 Y490 M493 A540 G542 Y546 K547 R548	I486-V544 HydrophobicContact CG2-CG2 3.96Å; I486-V544 WeakPolarHBondContact O-CG2 3.45Å; I489-V544 HydrophobicContact CB-CG2 4.35Å; I489-V544 HydrophobicContact CG2-CB 4.04Å; I489-V544 HydrophobicContact CG2-CG1 4.12Å; I489-V544 HydrophobicContact CG2-CG2 4.13Å; Y490-V544 HydrophobicContact CD2-CG1 3.99Å; M493-V544 HydrophobicContact CE-CG1 4.24Å; M493-V544 HydrophobicContact SD-CB 4.36Å; M493-V544 HydrophobicContact SD-CG1 3.47Å; M493-V544 WeakPolarHBondContact SD-CG1 3.47Å; A540-V544 WeakPolarHBondContact O-CB 3.35Å; A540-V544 VanDerWaalsContact O-CG2 3.32Å; A540-V544 WeakPolarHBondContact O-CG2 3.38Å; A540-V544 PolarHBondContact O-N 2.93Å; G542-V544 PolarHBondContact O-N 3.27Å; V544-Y546 PolarHBondContact O-N 3.41Å; V544-K547 PolarHBondContact O-N 2.94Å; V544-R548 WeakPolarHBondContact O-CB 3.38Å; V544-R548 PolarHBondContact O-N 3.4Å
545	G	91.7	Very high	89.7	Confident	10 Å²	10	34.9 Å²	34.9	10%	0.103	18%	0.176	C	C	.	.	H	α-helix	trans	-59	-45	176	0	0	0	0	0	112.3	I541 G542 R548 L549	I541-G545 WeakPolarHBondContact O-CA 3.37Å; I541-G545 PolarHBondContact O-N 3.02Å; G542-G545 PolarHBondContact O-N 2.9Å; G545-R548 PolarHBondContact O-N 3.26Å; G545-L549 WeakPolarHBondContact O-CB 3.48Å; G545-L549 WeakPolarHBondContact O-CG 3.3Å; G545-L549 PolarHBondContact O-N 3.25Å
546	Y	90.3	Very high	89.1	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.008	20%	0.197	C	C	.	.	H	α-helix	trans	-62.1	-48.6	178.8	-176	-96.9	0	0	0	111.2	Y448 G542 M543 V544 R548 L549 M550 A560 F561 F564 N611 T615	Y448-Y546 HydrophobicContact CD1-CD2 4.15Å; Y448-Y546 HydrophobicContact CD1-CE2 4.11Å; Y448-Y546 HydrophobicContact CE1-CD2 4.08Å; Y448-Y546 AromaticContact CE1-CE2 3.94Å; Y448-Y546 HydrophobicContact CE1-CE2 3.94Å; G542-Y546 WeakPolarHBondContact O-CB 3.3Å; G542-Y546 PolarHBondContact O-N 3.42Å; M543-Y546 PolarHBondContact O-N 3.34Å; V544-Y546 PolarHBondContact O-N 3.41Å; Y546-R548 VanDerWaalsContact C-N 3.32Å; Y546-R548 PolarHBondContact O-N 2.99Å; Y546-L549 PolarHBondContact O-N 2.99Å; Y546-M550 HydrophobicContact CD1-CG 4.33Å; Y546-M550 HydrophobicContact CE1-CG 3.88Å; Y546-M550 HydrophobicContact CE2-CE 4.17Å; Y546-M550 PolarHBondContact O-N 3.18Å; Y546-A560 HydrophobicContact CE2-CB 4.22Å; Y546-F561 HydrophobicContact CE1-CE2 4.37Å; Y546-F561 HydrophobicContact CE2-CD2 4.48Å; Y546-F561 HydrophobicContact CE2-CE2 4.34Å; Y546-F561 AromaticContact CZ-CE2 3.81Å; Y546-F561 WeakPolarHBondContact OH-CD2 3.46Å; Y546-F561 WeakPolarHBondContact OH-CE2 3.46Å; Y546-F564 AromaticContact CD2-CD2 3.82Å; Y546-F564 HydrophobicContact CD2-CD2 3.82Å; Y546-F564 AromaticContact CD2-CE2 3.82Å; Y546-F564 HydrophobicContact CD2-CE2 3.82Å; Y546-F564 HydrophobicContact CE2-CD2 4.29Å; Y546-F564 HydrophobicContact CG-CE2 4.4Å; Y546-N611 HydrophobicContact CD1-CB 3.91Å; Y546-N611 HydrophobicContact CE1-CB 3.81Å; Y546-T615 HydrophobicContact CD1-CG2 4.1Å; Y546-T615 HydrophobicContact CE1-CG2 3.79Å
547	K	87	Confident	88.7	Confident	21 Å²	21	39.5 Å²	39.5	9%	0.091	20%	0.203	C	C	.	.	H	α-helix	trans	-57	-47.1	176	-172.1	-169.4	179.1	-160.9	0	111.2	Y490 M543 V544 L549 M550 E551 W619	Y490-K547 HydrophobicContact CE2-CD 4.12Å; Y490-K547 PolarHBondContact OH-NZ 2.92Å; M543-K547 PolarHBondContact O-N 3.47Å; M543-K547 VanDerWaalsContact O-N 3.15Å; V544-K547 PolarHBondContact O-N 2.94Å; K547-L549 VanDerWaalsContact C-N 3.34Å; K547-L549 PolarHBondContact O-N 2.9Å; K547-M550 PolarHBondContact O-N 2.72Å; K547-E551 WeakPolarHBondContact CE-OE1 3.25Å; K547-E551 IonicContact NZ-OE1 2.78Å; K547-E551 WeakPolarHBondContact O-CG 3.36Å; K547-E551 PolarHBondContact O-N 3.02Å; K547-W619 HydrophobicContact CD-CG 4.48Å
548	R	86.9	Confident	88.3	Confident	110 Å²	110	40.1 Å²	40.1	42%	0.415	21%	0.205	S	C	.	.	H	α-helix	trans	-64.9	-36.9	-179.9	-171.2	58.9	170.3	177.7	-0.9	112.7	M493 V544 G545 Y546 E551 T552	M493-R548 HydrophobicContact CE-CB 4.35Å; M493-R548 HydrophobicContact CE-CG 4.3Å; V544-R548 WeakPolarHBondContact O-CB 3.38Å; V544-R548 PolarHBondContact O-N 3.4Å; G545-R548 PolarHBondContact O-N 3.26Å; Y546-R548 VanDerWaalsContact C-N 3.32Å; Y546-R548 PolarHBondContact O-N 2.99Å; R548-E551 IonicContact NH1-OE2 3.69Å; R548-E551 PolarHBondContact NH1-OE2 3.38Å; R548-E551 VanDerWaalsContact NH1-OE2 3.11Å; R548-E551 PolarHBondContact O-N 3.45Å; R548-T552 WeakPolarHBondContact O-CB 3.04Å; R548-T552 WeakPolarHBondContact O-CG2 3.39Å; R548-T552 PolarHBondContact O-N 3.41Å; R548-T552 PolarHBondContact O-OG1 3.33Å
549	L	88.8	Confident	87.9	Confident	14 Å²	14	39.8 Å²	39.8	7%	0.073	20%	0.202	C	C	.	.	H	α-helix	trans	-66.6	-39.9	173.8	-74.2	177.3	0	0	0	111.5	L447 Y448 V451 G545 Y546 K547 E551 T552 R553	L447-L549 HydrophobicContact CB-CD1 3.9Å; L447-L549 HydrophobicContact CB-CD2 3.8Å; L447-L549 HydrophobicContact CD1-CD2 3.78Å; L447-L549 HydrophobicContact CG-CD2 4.36Å; Y448-L549 HydrophobicContact CD1-CB 4.43Å; Y448-L549 HydrophobicContact CD1-CD1 3.91Å; Y448-L549 HydrophobicContact CE1-CB 3.72Å; Y448-L549 HydrophobicContact CE1-CD1 4.05Å; Y448-L549 HydrophobicContact CE2-CB 4.41Å; Y448-L549 HydrophobicContact CG-CD1 4.14Å; Y448-L549 PolarHBondContact OH-O 3.06Å; V451-L549 HydrophobicContact CB-CD1 4.28Å; V451-L549 HydrophobicContact CG2-CD1 3.53Å; V451-L549 HydrophobicContact CG2-CG 4.48Å; G545-L549 WeakPolarHBondContact O-CB 3.48Å; G545-L549 WeakPolarHBondContact O-CG 3.3Å; G545-L549 PolarHBondContact O-N 3.25Å; Y546-L549 PolarHBondContact O-N 2.99Å; K547-L549 VanDerWaalsContact C-N 3.34Å; K547-L549 PolarHBondContact O-N 2.9Å; L549-E551 VanDerWaalsContact C-N 3.3Å; L549-E551 PolarHBondContact O-N 2.99Å; L549-T552 PolarHBondContact O-N 3.48Å; L549-R553 CarbonylContact O-C 3.52Å; L549-R553 VanDerWaalsContact O-CA 3.31Å; L549-R553 WeakPolarHBondContact O-CA 3.34Å; L549-R553 PolarHBondContact O-N 2.91Å; L549-R553 VanDerWaalsContact O-O 3.14Å
550	M	86	Confident	87.7	Confident	27 Å²	27	39 Å²	39	13%	0.133	20%	0.199	C	C	.	.	H	α-helix	trans	-63.1	-36.6	175	-80.1	-66.3	147.9	0	0	112.7	Y448 Y546 K547 M555 A560 T615	Y448-M550 HydrophobicContact CE1-CE 3.51Å; Y448-M550 WeakPolarHBondContact OH-CE 3.24Å; Y546-M550 HydrophobicContact CD1-CG 4.33Å; Y546-M550 HydrophobicContact CE1-CG 3.88Å; Y546-M550 HydrophobicContact CE2-CE 4.17Å; Y546-M550 PolarHBondContact O-N 3.18Å; K547-M550 PolarHBondContact O-N 2.72Å; M550-M555 HydrophobicContact CE-CB 4.24Å; M550-M555 WeakPolarHBondContact CE-O 3.21Å; M550-A560 HydrophobicContact CE-CB 3.25Å; M550-T615 HydrophobicContact CB-CG2 4.36Å; M550-T615 HydrophobicContact CG-CG2 4.19Å
551	E	84.1	Confident	87.6	Confident	95 Å²	95	39 Å²	39	44%	0.444	20%	0.199	S	C	.	.	H	α-helix	trans	-69.8	-37.9	175	-70.2	171.1	-176.9	0	0	113.1	K547 R548 L549	K547-E551 WeakPolarHBondContact CE-OE1 3.25Å; K547-E551 IonicContact NZ-OE1 2.78Å; K547-E551 WeakPolarHBondContact O-CG 3.36Å; K547-E551 PolarHBondContact O-N 3.02Å; R548-E551 IonicContact NH1-OE2 3.69Å; R548-E551 PolarHBondContact NH1-OE2 3.38Å; R548-E551 VanDerWaalsContact NH1-OE2 3.11Å; R548-E551 PolarHBondContact O-N 3.45Å; L549-E551 VanDerWaalsContact C-N 3.3Å; L549-E551 PolarHBondContact O-N 2.99Å
552	T	85.2	Confident	87.5	Confident	76 Å²	76	35.9 Å²	35.9	47%	0.466	18%	0.183	S	C	.	.	H	α-helix	trans	-99.9	-26.5	-170	56	0	0	0	0	114.1	R548 L549	R548-T552 WeakPolarHBondContact O-CB 3.04Å; R548-T552 WeakPolarHBondContact O-CG2 3.39Å; R548-T552 PolarHBondContact O-N 3.41Å; R548-T552 PolarHBondContact O-OG1 3.33Å; L549-T552 PolarHBondContact O-N 3.48Å
553	R	86	Confident	87.6	Confident	95 Å²	95	37.6 Å²	37.6	36%	0.358	19%	0.19	S	C	.	.	S	Bend	trans	-146	68.3	-175.8	-58.5	-169.8	-173.8	176.4	8.4	109.4	T444 Y448 L549 M555	T444-R553 HydrophobicContact CG2-CB 3.9Å; T444-R553 WeakPolarHBondContact OG1-CD 3.22Å; Y448-R553 PolarHBondContact OH-O 3.46Å; L549-R553 CarbonylContact O-C 3.52Å; L549-R553 VanDerWaalsContact O-CA 3.31Å; L549-R553 WeakPolarHBondContact O-CA 3.34Å; L549-R553 PolarHBondContact O-N 2.91Å; L549-R553 VanDerWaalsContact O-O 3.14Å; R553-M555 PolarHBondContact O-N 3.46Å
554	P	83.7	Confident	87.6	Confident	102 Å²	102	37.4 Å²	37.4	66%	0.662	19%	0.189	S	C	*	.			trans	-61	138.5	-174	25.5	-34.4	0	0	0	111
555	M	83.4	Confident	87.8	Confident	10 Å²	10	37.1 Å²	37.1	5%	0.049	19%	0.187	C	C	.	.			trans	-137.8	145.3	174	-177.5	-176.3	-58.2	0	0	107.7	N440 T444 Y448 M550 R553 Q557 N559 A560	N440-M555 HydrophobicContact CB-CE 3.97Å; N440-M555 VanDerWaalsContact CG-CE 3.45Å; N440-M555 WeakPolarHBondContact OD1-CE 3.39Å; T444-M555 HydrophobicContact CG2-CE 4.18Å; Y448-M555 HydrophobicContact CD2-CE 3.89Å; Y448-M555 HydrophobicContact CE2-CB 4.2Å; Y448-M555 HydrophobicContact CE2-CE 3.97Å; M550-M555 HydrophobicContact CE-CB 4.24Å; M550-M555 WeakPolarHBondContact CE-O 3.21Å; R553-M555 PolarHBondContact O-N 3.46Å; M555-Q557 PolarHBondContact O-N 3.46Å; M555-N559 HydrophobicContact CG-CB 4.15Å; M555-N559 HydrophobicContact SD-CB 4.03Å; M555-N559 PolarHBondContact SD-ND2 3.29Å; M555-A560 HydrophobicContact CB-CB 4.25Å; M555-A560 HydrophobicContact CG-CB 4.33Å; M555-A560 HydrophobicContact SD-CB 4.12Å; M555-A560 PolarHBondContact SD-N 2.85Å
556	P	83.9	Confident	88	Confident	73 Å²	73	38.9 Å²	38.9	47%	0.474	19%	0.194	S	C	.	.			trans	-49.8	127.5	171.9	-27.8	35	0	0	0	110.9	H558 N559 A560	P556-H558 VanDerWaalsContact C-N 3.3Å; P556-H558 PolarHBondContact O-N 2.81Å; P556-N559 HydrophobicContact CB-CB 4.46Å; P556-N559 WeakPolarHBondContact O-CA 3.47Å; P556-N559 WeakPolarHBondContact O-CB 3.43Å; P556-N559 PolarHBondContact O-N 2.83Å; P556-A560 PolarHBondContact O-N 3.32Å
557	Q	83.5	Confident	88.3	Confident	32 Å²	32	38.9 Å²	38.9	15%	0.15	20%	0.195	C	C	.	.	H	α-helix	trans	-59.7	-37.3	-165.3	-63.7	-153.8	23.6	0	0	113.5	M555 N559 A560 F561 F608 Y612 T615	M555-Q557 PolarHBondContact O-N 3.46Å; Q557-N559 VanDerWaalsContact C-N 3.28Å; Q557-N559 PolarHBondContact O-N 3.31Å; Q557-A560 PolarHBondContact O-N 3.4Å; Q557-F561 WeakPolarHBondContact O-CB 3.45Å; Q557-F561 WeakPolarHBondContact O-CD2 3.21Å; Q557-F561 PolarHBondContact O-N 3.23Å; Q557-F608 HydrophobicContact CB-CE2 4.05Å; Q557-Y612 HydrophobicContact CG-CD2 4.37Å; Q557-T615 PolarHBondContact NE2-OG1 3.41Å
558	H	85.4	Confident	88.7	Confident	68 Å²	68	37.9 Å²	37.9	32%	0.315	19%	0.191	S	C	.	.	H	α-helix	trans	-60.3	-37.6	175.1	53.6	-100.4	0	0	0	112.6	F434 P556 A562	F434-H558 HydrophobicContact CB-CB 3.94Å; F434-H558 HydrophobicContact CD1-CB 4.13Å; F434-H558 HydrophobicContact CG-CB 3.97Å; P556-H558 VanDerWaalsContact C-N 3.3Å; P556-H558 PolarHBondContact O-N 2.81Å; H558-A562 PolarHBondContact O-N 2.86Å
559	N	88.4	Confident	89.2	Confident	5 Å²	5	36.3 Å²	36.3	3%	0.027	19%	0.187	C	C	.	.	H	α-helix	trans	-76.4	-38.7	177.7	-173.6	33.5	0	0	0	111.2	F434 R436 N440 M555 P556 Q557 F561 A562 W563	F434-N559 PolarHBondContact O-OD1 2.93Å; R436-N559 PolarHBondContact N-OD1 2.89Å; R436-N559 PolarHBondContact O-ND2 3.02Å; R436-N559 PolarHBondContact O-OD1 3.06Å; N440-N559 PolarHBondContact ND2-ND2 2.95Å; N440-N559 VanDerWaalsContact ND2-ND2 3.19Å; M555-N559 HydrophobicContact CG-CB 4.15Å; M555-N559 HydrophobicContact SD-CB 4.03Å; M555-N559 PolarHBondContact SD-ND2 3.29Å; P556-N559 HydrophobicContact CB-CB 4.46Å; P556-N559 WeakPolarHBondContact O-CA 3.47Å; P556-N559 WeakPolarHBondContact O-CB 3.43Å; P556-N559 PolarHBondContact O-N 2.83Å; Q557-N559 VanDerWaalsContact C-N 3.28Å; Q557-N559 PolarHBondContact O-N 3.31Å; N559-F561 VanDerWaalsContact C-N 3.28Å; N559-F561 PolarHBondContact O-N 3.32Å; N559-A562 WeakPolarHBondContact O-CB 3.48Å; N559-A562 PolarHBondContact O-N 3.34Å; N559-W563 VanDerWaalsContact O-CD1 3.31Å; N559-W563 PolarHBondContact O-N 3.33Å
560	A	89	Confident	89.5	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-59.4	-43.4	174	0	0	0	0	0	111	Y448 Y546 M550 M555 P556 Q557 A562 W563 F564	Y448-A560 HydrophobicContact CD1-CB 4.19Å; Y448-A560 HydrophobicContact CE1-CB 4.05Å; Y546-A560 HydrophobicContact CE2-CB 4.22Å; M550-A560 HydrophobicContact CE-CB 3.25Å; M555-A560 HydrophobicContact CB-CB 4.25Å; M555-A560 HydrophobicContact CG-CB 4.33Å; M555-A560 HydrophobicContact SD-CB 4.12Å; M555-A560 PolarHBondContact SD-N 2.85Å; P556-A560 PolarHBondContact O-N 3.32Å; Q557-A560 PolarHBondContact O-N 3.4Å; A560-A562 PolarHBondContact O-N 2.99Å; A560-W563 PolarHBondContact O-N 2.96Å; A560-F564 WeakPolarHBondContact O-CB 3.39Å; A560-F564 PolarHBondContact O-N 2.96Å
561	F	89.7	Confident	90	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-65.7	-33.7	177.2	-98.2	-88.6	0	0	0	113.9	F431 Y546 Q557 N559 F564 Y565 Y607 F608 N611	F431-F561 HydrophobicContact CD1-CB 3.73Å; F431-F561 HydrophobicContact CE1-CB 3.93Å; F431-F561 HydrophobicContact CE1-CG 4.47Å; F431-F561 HydrophobicContact CG-CB 4.07Å; F431-F561 HydrophobicContact CZ-CB 4.44Å; Y546-F561 HydrophobicContact CE1-CE2 4.37Å; Y546-F561 HydrophobicContact CE2-CD2 4.48Å; Y546-F561 HydrophobicContact CE2-CE2 4.34Å; Y546-F561 AromaticContact CZ-CE2 3.81Å; Y546-F561 WeakPolarHBondContact OH-CD2 3.46Å; Y546-F561 WeakPolarHBondContact OH-CE2 3.46Å; Q557-F561 WeakPolarHBondContact O-CB 3.45Å; Q557-F561 WeakPolarHBondContact O-CD2 3.21Å; Q557-F561 PolarHBondContact O-N 3.23Å; N559-F561 VanDerWaalsContact C-N 3.28Å; N559-F561 PolarHBondContact O-N 3.32Å; F561-F564 HydrophobicContact CD1-CD1 4.33Å; F561-F564 HydrophobicContact CE1-CD1 4.37Å; F561-F564 HydrophobicContact CE1-CE1 4.48Å; F561-F564 PolarHBondContact O-N 3.37Å; F561-Y565 AromaticContact CD1-CD2 3.96Å; F561-Y565 HydrophobicContact CD1-CD2 3.96Å; F561-Y565 AromaticContact CD1-CE2 3.53Å; F561-Y565 HydrophobicContact CD1-CE2 3.53Å; F561-Y565 HydrophobicContact CE1-CE2 4.06Å; F561-Y565 WeakPolarHBondContact O-CB 3.47Å; F561-Y565 VanDerWaalsContact O-CD2 3.3Å; F561-Y565 WeakPolarHBondContact O-CD2 3.47Å; F561-Y565 PolarHBondContact O-N 2.93Å; F561-Y607 VanDerWaalsContact CZ-O 3.31Å; F561-Y607 WeakPolarHBondContact CZ-O 3.25Å; F561-F608 HydrophobicContact CB-CD2 4.32Å; F561-F608 HydrophobicContact CD1-CB 4.45Å; F561-F608 HydrophobicContact CD1-CD2 4.33Å; F561-F608 AromaticContact CD2-CD2 3.52Å; F561-F608 HydrophobicContact CD2-CD2 3.52Å; F561-F608 HydrophobicContact CD2-CE2 4.06Å; F561-F608 HydrophobicContact CE1-CB 4.2Å; F561-F608 AromaticContact CE2-CD2 3.8Å; F561-F608 HydrophobicContact CE2-CD2 3.8Å; F561-F608 HydrophobicContact CE2-CE2 4.49Å; F561-F608 AromaticContact CG-CD2 3.78Å; F561-F608 HydrophobicContact CG-CD2 3.78Å; F561-F608 HydrophobicContact CZ-CB 4.24Å; F561-F608 HydrophobicContact CZ-CD2 4.3Å; F561-N611 HydrophobicContact CE2-CB 3.91Å; F561-N611 HydrophobicContact CZ-CB 3.64Å; F561-N611 VanDerWaalsContact CZ-ND2 3.34Å; F561-N611 WeakPolarHBondContact CZ-ND2 3.4Å
562	A	91.8	Very high	90.6	Very high	3 Å²	3	36.4 Å²	36.4	3%	0.025	19%	0.192	C	C	.	.	H	α-helix	trans	-60.3	-50.4	173.2	0	0	0	0	0	111.2	F431 L435 H558 N559 A560 L566	F431-A562 HydrophobicContact CB-CB 4.1Å; F431-A562 WeakPolarHBondContact O-CB 3.21Å; L435-A562 HydrophobicContact CB-CB 4.05Å; L435-A562 HydrophobicContact CD1-CB 3.65Å; L435-A562 HydrophobicContact CG-CB 4.49Å; H558-A562 PolarHBondContact O-N 2.86Å; N559-A562 WeakPolarHBondContact O-CB 3.48Å; N559-A562 PolarHBondContact O-N 3.34Å; A560-A562 PolarHBondContact O-N 2.99Å; A562-L566 VanDerWaalsContact O-CG 3.28Å; A562-L566 WeakPolarHBondContact O-CG 3.36Å; A562-L566 PolarHBondContact O-N 2.88Å
563	W	93.4	Very high	91.1	Very high	37 Å²	37	34.6 Å²	34.6	14%	0.14	18%	0.181	C	C	.	.	H	α-helix	trans	-65.6	-39.4	175.7	-69.8	113.2	0	0	0	113.1	L435 T437 V445 M449 N559 A560 L566 G567	L435-W563 HydrophobicContact CD1-CD2 3.71Å; L435-W563 HydrophobicContact CD1-CE3 4.09Å; L435-W563 HydrophobicContact CD1-CG 4.2Å; L435-W563 HydrophobicContact CD1-CH2 4.16Å; L435-W563 HydrophobicContact CD1-CZ2 3.77Å; L435-W563 HydrophobicContact CD1-CZ3 4.3Å; L435-W563 HydrophobicContact CG-CZ2 4.37Å; T437-W563 HydrophobicContact CG2-CH2 3.99Å; T437-W563 HydrophobicContact CG2-CZ2 3.77Å; V445-W563 HydrophobicContact CB-CD2 4.44Å; V445-W563 HydrophobicContact CG1-CD2 3.36Å; V445-W563 HydrophobicContact CG1-CE3 3.32Å; V445-W563 HydrophobicContact CG1-CG 3.93Å; V445-W563 HydrophobicContact CG1-CH2 4Å; V445-W563 HydrophobicContact CG1-CZ2 4.04Å; V445-W563 HydrophobicContact CG1-CZ3 3.65Å; V445-W563 HydrophobicContact CG2-CD2 4.4Å; V445-W563 HydrophobicContact CG2-CZ2 4.38Å; M449-W563 HydrophobicContact CG-CB 4.31Å; M449-W563 HydrophobicContact CG-CE3 4.24Å; M449-W563 VanDerWaalsContact CG-O 3.27Å; M449-W563 WeakPolarHBondContact CG-O 3.39Å; M449-W563 HydrophobicContact SD-CE3 3.98Å; M449-W563 HydrophobicContact SD-CZ3 4.35Å; N559-W563 VanDerWaalsContact O-CD1 3.31Å; N559-W563 PolarHBondContact O-N 3.33Å; A560-W563 PolarHBondContact O-N 2.96Å; W563-L566 HydrophobicContact CE3-CD1 3.8Å; W563-L566 HydrophobicContact CZ3-CD1 3.98Å; W563-L566 PolarHBondContact O-N 3.43Å; W563-G567 PolarHBondContact O-N 2.83Å
564	F	92.2	Very high	91.6	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-58.3	-48.6	177.4	-174	-91.4	0	0	0	111.9	V451 G452 Q455 L456 Y546 A560 F561 G567 A568	V451-F564 HydrophobicContact CB-CE2 4.33Å; V451-F564 HydrophobicContact CG1-CD2 4.34Å; V451-F564 HydrophobicContact CG1-CE2 3.73Å; G452-F564 VanDerWaalsContact CA-CD2 3.4Å; G452-F564 VanDerWaalsContact CA-CE2 3.44Å; G452-F564 WeakPolarHBondContact CA-O 3.41Å; Q455-F564 HydrophobicContact CB-CE1 4.45Å; Q455-F564 HydrophobicContact CB-CE2 4.33Å; Q455-F564 HydrophobicContact CB-CZ 3.64Å; Q455-F564 HydrophobicContact CG-CZ 4.12Å; L456-F564 HydrophobicContact CD1-CD1 4.03Å; L456-F564 HydrophobicContact CD1-CE1 3.49Å; L456-F564 VanDerWaalsContact CD1-CE1 3.49Å; L456-F564 HydrophobicContact CG-CE1 3.76Å; L456-F564 HydrophobicContact CG-CZ 4.44Å; Y546-F564 AromaticContact CD2-CD2 3.82Å; Y546-F564 HydrophobicContact CD2-CD2 3.82Å; Y546-F564 AromaticContact CD2-CE2 3.82Å; Y546-F564 HydrophobicContact CD2-CE2 3.82Å; Y546-F564 HydrophobicContact CE2-CD2 4.29Å; Y546-F564 HydrophobicContact CG-CE2 4.4Å; A560-F564 WeakPolarHBondContact O-CB 3.39Å; A560-F564 PolarHBondContact O-N 2.96Å; F561-F564 HydrophobicContact CD1-CD1 4.33Å; F561-F564 HydrophobicContact CE1-CD1 4.37Å; F561-F564 HydrophobicContact CE1-CE1 4.48Å; F561-F564 PolarHBondContact O-N 3.37Å; F564-G567 PolarHBondContact O-N 3.4Å; F564-A568 PolarHBondContact O-N 3.14Å
565	Y	94.7	Very high	92.1	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-69.4	-34.5	176.4	-84.4	-65.1	0	0	0	113.4	A427 F431 L456 F561 G567 A568 F569 S603 G604	A427-Y565 HydrophobicContact CB-CD1 3.59Å; A427-Y565 HydrophobicContact CB-CE1 3.21Å; A427-Y565 HydrophobicContact CB-CE2 4.2Å; A427-Y565 HydrophobicContact CB-CG 4.25Å; F431-Y565 AromaticContact CD2-CD2 3.63Å; F431-Y565 HydrophobicContact CD2-CD2 3.63Å; F431-Y565 AromaticContact CD2-CE2 3.63Å; F431-Y565 HydrophobicContact CD2-CE2 3.63Å; F431-Y565 HydrophobicContact CE2-CD2 4.19Å; F431-Y565 AromaticContact CE2-CE2 3.69Å; F431-Y565 HydrophobicContact CE2-CE2 3.69Å; F431-Y565 HydrophobicContact CG-CD2 4.32Å; L456-Y565 HydrophobicContact CD1-CD1 3.71Å; L456-Y565 HydrophobicContact CD1-CE1 3.13Å; F561-Y565 AromaticContact CD1-CD2 3.96Å; F561-Y565 HydrophobicContact CD1-CD2 3.96Å; F561-Y565 AromaticContact CD1-CE2 3.53Å; F561-Y565 HydrophobicContact CD1-CE2 3.53Å; F561-Y565 HydrophobicContact CE1-CE2 4.06Å; F561-Y565 WeakPolarHBondContact O-CB 3.47Å; F561-Y565 VanDerWaalsContact O-CD2 3.3Å; F561-Y565 WeakPolarHBondContact O-CD2 3.47Å; F561-Y565 PolarHBondContact O-N 2.93Å; Y565-G567 VanDerWaalsContact C-N 3.28Å; Y565-G567 PolarHBondContact O-N 3.38Å; Y565-A568 PolarHBondContact O-N 2.88Å; Y565-F569 WeakPolarHBondContact O-CB 3.3Å; Y565-F569 PolarHBondContact O-N 3.31Å; Y565-S603 PolarHBondContact OH-O 2.91Å; Y565-G604 PolarHBondContact OH-N 3.47Å
566	L	95	Very high	92.7	Very high	46 Å²	46	32.6 Å²	32.6	24%	0.241	17%	0.168	C	C	.	.	H	α-helix	trans	-61.2	-38.3	173.4	-74.6	172.9	0	0	0	111.9	L435 M449 A562 W563 F569 L570	L435-L566 HydrophobicContact CD1-CD1 3.72Å; L435-L566 HydrophobicContact CD2-CD1 4.02Å; M449-L566 HydrophobicContact CE-CB 4.37Å; A562-L566 VanDerWaalsContact O-CG 3.28Å; A562-L566 WeakPolarHBondContact O-CG 3.36Å; A562-L566 PolarHBondContact O-N 2.88Å; W563-L566 HydrophobicContact CE3-CD1 3.8Å; W563-L566 HydrophobicContact CZ3-CD1 3.98Å; W563-L566 PolarHBondContact O-N 3.43Å; L566-F569 PolarHBondContact O-N 2.96Å; L566-L570 WeakPolarHBondContact O-CB 3.5Å; L566-L570 PolarHBondContact O-N 3.37Å
567	G	95.7	Very high	93.2	Very high	3 Å²	3	36.8 Å²	36.8	3%	0.031	18%	0.179	C	C	.	.	H	α-helix	trans	-62.7	-45	172.8	0	0	0	0	0	113.1	M449 W563 F564 Y565 V571	M449-G567 WeakPolarHBondContact O-CA 3.39Å; W563-G567 PolarHBondContact O-N 2.83Å; F564-G567 PolarHBondContact O-N 3.4Å; Y565-G567 VanDerWaalsContact C-N 3.28Å; Y565-G567 PolarHBondContact O-N 3.38Å; G567-V571 PolarHBondContact O-N 3.45Å
568	A	96.3	Very high	93.7	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62.2	-44.4	175.2	0	0	0	0	0	112.6	V424 L456 F564 Y565 V571 A572	V424-A568 HydrophobicContact CB-CB 4.3Å; V424-A568 HydrophobicContact CG1-CB 4.3Å; L456-A568 HydrophobicContact CB-CB 3.83Å; F564-A568 PolarHBondContact O-N 3.14Å; Y565-A568 PolarHBondContact O-N 2.88Å; A568-V571 PolarHBondContact O-N 2.95Å; A568-A572 PolarHBondContact O-N 3.36Å
569	F	96.7	Very high	94.1	Very high	76 Å²	76	43.2 Å²	43.2	33%	0.333	22%	0.216	S	C	.	.	H	α-helix	trans	-63.4	-43.5	179.3	-178.3	-109.7	0	0	0	112.1	L421 V424 G425 Y565 L566 V571 A572 V573	L421-F569 HydrophobicContact CD1-CD2 3.93Å; L421-F569 HydrophobicContact CD1-CE2 3.48Å; L421-F569 VanDerWaalsContact CD1-CE2 3.48Å; L421-F569 HydrophobicContact CD1-CZ 4.22Å; L421-F569 HydrophobicContact CG-CE2 4.49Å; V424-F569 HydrophobicContact CG2-CB 4.26Å; V424-F569 HydrophobicContact CG2-CD2 4.22Å; G425-F569 VanDerWaalsContact CA-CD2 3.43Å; Y565-F569 WeakPolarHBondContact O-CB 3.3Å; Y565-F569 PolarHBondContact O-N 3.31Å; L566-F569 PolarHBondContact O-N 2.96Å; F569-V571 VanDerWaalsContact C-N 3.33Å; F569-V571 PolarHBondContact O-N 3.06Å; F569-A572 PolarHBondContact O-N 3.39Å; F569-A572 VanDerWaalsContact O-N 3.17Å; F569-V573 HydrophobicContact CD1-CG2 4.12Å; F569-V573 HydrophobicContact CD2-CG2 4.33Å; F569-V573 HydrophobicContact CE1-CG2 3.75Å; F569-V573 HydrophobicContact CE2-CG2 3.97Å; F569-V573 HydrophobicContact CG-CG2 4.41Å; F569-V573 HydrophobicContact CZ-CG2 3.66Å; F569-V573 WeakPolarHBondContact O-CG2 3.29Å; F569-V573 PolarHBondContact O-N 3.47Å
570	L	96.5	Very high	94.2	Very high	95 Å²	95	44.4 Å²	44.4	50%	0.497	23%	0.229	S	C	.	.	H	α-helix	trans	-57.1	-45.7	177.7	-178.3	65.7	0	0	0	112	L566 V573 I574	L566-L570 WeakPolarHBondContact O-CB 3.5Å; L566-L570 PolarHBondContact O-N 3.37Å; L570-V573 PolarHBondContact O-N 2.96Å; L570-I574 HydrophobicContact CD1-CD1 4.42Å; L570-I574 HydrophobicContact CG-CD1 4.24Å; L570-I574 WeakPolarHBondContact O-CG1 3.32Å; L570-I574 PolarHBondContact O-N 3.32Å; L570-I574 VanDerWaalsContact O-N 3.15Å
571	V	96.2	Very high	94.3	Very high	43 Å²	43	47.1 Å²	47.1	26%	0.261	24%	0.243	S	C	.	.	H	α-helix	trans	-68.2	-39	178.4	-178.8	0	0	0	0	111.3	A453 V458 M461 G567 A568 F569 I574 A575	A453-V571 HydrophobicContact CB-CG2 3.68Å; V458-V571 HydrophobicContact CG2-CG1 4.36Å; M461-V571 HydrophobicContact CE-CB 4.48Å; M461-V571 HydrophobicContact CE-CG1 3.44Å; M461-V571 VanDerWaalsContact CE-CG1 3.44Å; G567-V571 PolarHBondContact O-N 3.45Å; A568-V571 PolarHBondContact O-N 2.95Å; F569-V571 VanDerWaalsContact C-N 3.33Å; F569-V571 PolarHBondContact O-N 3.06Å; V571-I574 PolarHBondContact O-N 3.46Å; V571-A575 WeakPolarHBondContact O-CB 3.29Å; V571-A575 PolarHBondContact O-N 3.14Å
572	A	95.8	Very high	94.3	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.008	27%	0.273	C	S	.	.	H	α-helix	trans	-64.8	-38.5	177.3	0	0	0	0	0	112.6	V420 L421 V424 A568 F569 A575 W576	V420-A572 HydrophobicContact CG1-CB 4.09Å; L421-A572 HydrophobicContact CB-CB 4.38Å; L421-A572 HydrophobicContact CD1-CB 4.23Å; V424-A572 HydrophobicContact CG2-CB 3.69Å; A568-A572 PolarHBondContact O-N 3.36Å; F569-A572 PolarHBondContact O-N 3.39Å; F569-A572 VanDerWaalsContact O-N 3.17Å; A572-A575 PolarHBondContact O-N 3.23Å; A572-W576 WeakPolarHBondContact O-CB 3.5Å; A572-W576 PolarHBondContact O-N 3.08Å
573	V	96.5	Very high	94.3	Very high	38 Å²	38	58.7 Å²	58.7	23%	0.23	31%	0.309	C	S	.	.	H	α-helix	trans	-59.8	-53.6	173.7	169.2	0	0	0	0	110	L421 F569 L570 A575 W576 F577	L421-V573 HydrophobicContact CD1-CB 4.32Å; L421-V573 HydrophobicContact CD1-CG2 3.48Å; L421-V573 VanDerWaalsContact CD1-CG2 3.48Å; F569-V573 HydrophobicContact CD1-CG2 4.12Å; F569-V573 HydrophobicContact CD2-CG2 4.33Å; F569-V573 HydrophobicContact CE1-CG2 3.75Å; F569-V573 HydrophobicContact CE2-CG2 3.97Å; F569-V573 HydrophobicContact CG-CG2 4.41Å; F569-V573 HydrophobicContact CZ-CG2 3.66Å; F569-V573 WeakPolarHBondContact O-CG2 3.29Å; F569-V573 PolarHBondContact O-N 3.47Å; L570-V573 PolarHBondContact O-N 2.96Å; V573-A575 VanDerWaalsContact C-N 3.28Å; V573-A575 PolarHBondContact O-N 2.87Å; V573-W576 PolarHBondContact O-N 3.23Å; V573-F577 HydrophobicContact CG1-CD2 3.72Å; V573-F577 HydrophobicContact CG1-CE2 3.78Å; V573-F577 VanDerWaalsContact O-CD2 3.28Å; V573-F577 WeakPolarHBondContact O-CD2 3.22Å; V573-F577 PolarHBondContact O-N 3.17Å
574	I	96.2	Very high	94.1	Very high	90 Å²	90	61 Å²	61	46%	0.462	32%	0.321	S	S	.	.	H	α-helix	trans	-57.7	-44.6	179.8	-66.6	166.4	0	0	0	110.4	L570 V571 F577 L578	L570-I574 HydrophobicContact CD1-CD1 4.42Å; L570-I574 HydrophobicContact CG-CD1 4.24Å; L570-I574 WeakPolarHBondContact O-CG1 3.32Å; L570-I574 PolarHBondContact O-N 3.32Å; L570-I574 VanDerWaalsContact O-N 3.15Å; V571-I574 PolarHBondContact O-N 3.46Å; I574-F577 PolarHBondContact O-N 3.29Å; I574-L578 HydrophobicContact CG2-CD1 3.77Å; I574-L578 HydrophobicContact CG2-CG 4.47Å; I574-L578 WeakPolarHBondContact O-CB 3.11Å; I574-L578 VanDerWaalsContact O-CG 3.28Å; I574-L578 WeakPolarHBondContact O-CG 3.46Å; I574-L578 PolarHBondContact O-N 3.29Å; I574-L578 VanDerWaalsContact O-N 3.09Å
575	A	94.8	Very high	94.1	Very high	12 Å²	12	64 Å²	64	10%	0.099	34%	0.335	C	S	.	.	H	α-helix	trans	-66.7	-41.5	-178.8	0	0	0	0	0	113.3	Y417 M461 V571 A572 V573 L578 L579	Y417-A575 HydrophobicContact CD1-CB 3.98Å; Y417-A575 HydrophobicContact CE1-CB 4.43Å; M461-A575 HydrophobicContact CE-CB 4.28Å; M461-A575 HydrophobicContact SD-CB 3.15Å; M461-A575 WeakPolarHBondContact SD-CB 3.26Å; V571-A575 WeakPolarHBondContact O-CB 3.29Å; V571-A575 PolarHBondContact O-N 3.14Å; A572-A575 PolarHBondContact O-N 3.23Å; V573-A575 VanDerWaalsContact C-N 3.28Å; V573-A575 PolarHBondContact O-N 2.87Å; A575-L578 PolarHBondContact O-N 3.42Å; A575-L579 WeakPolarHBondContact O-CB 3.3Å; A575-L579 PolarHBondContact O-N 3.33Å
576	W	94.7	Very high	93.9	Very high	62 Å²	62	64.5 Å²	64.5	24%	0.235	34%	0.339	C	S	.	.	H	α-helix	trans	-66.8	-39.2	177.3	-176.5	64.9	0	0	0	111.8	F418 L421 A572 V573 L578 G580 M585	F418-W576 HydrophobicContact CD2-CD2 4.29Å; F418-W576 AromaticContact CD2-CE2 3.63Å; F418-W576 HydrophobicContact CD2-CH2 4.46Å; F418-W576 AromaticContact CD2-CZ2 3.74Å; F418-W576 HydrophobicContact CD2-CZ2 3.74Å; F418-W576 AromaticContact CD2-NE1 3.7Å; F418-W576 HydrophobicContact CE2-CZ2 4.23Å; L421-W576 HydrophobicContact CD2-CB 4.14Å; L421-W576 HydrophobicContact CD2-CD2 3.86Å; L421-W576 HydrophobicContact CD2-CE3 3.65Å; L421-W576 HydrophobicContact CD2-CG 4.08Å; L421-W576 HydrophobicContact CD2-CZ3 4.33Å; A572-W576 WeakPolarHBondContact O-CB 3.5Å; A572-W576 PolarHBondContact O-N 3.08Å; V573-W576 PolarHBondContact O-N 3.23Å; W576-L578 VanDerWaalsContact C-N 3.3Å; W576-L578 PolarHBondContact O-N 2.81Å; W576-G580 WeakPolarHBondContact O-CA 3.49Å; W576-G580 PolarHBondContact O-N 3.25Å; W576-M585 HydrophobicContact CZ2-SD 4.45Å
577	F	94.8	Very high	93.7	Very high	161 Å²	161	70.6 Å²	70.6	71%	0.706	37%	0.366	S	S	*	.	H	α-helix	trans	-62.7	-35.3	174	-88.4	-70.5	0	0	0	113.1	V573 I574	V573-F577 HydrophobicContact CG1-CD2 3.72Å; V573-F577 HydrophobicContact CG1-CE2 3.78Å; V573-F577 VanDerWaalsContact O-CD2 3.28Å; V573-F577 WeakPolarHBondContact O-CD2 3.22Å; V573-F577 PolarHBondContact O-N 3.17Å; I574-F577 PolarHBondContact O-N 3.29Å
578	L	94.6	Very high	93.6	Very high	132 Å²	132	73.6 Å²	73.6	69%	0.691	38%	0.384	S	S	*	.	H	α-helix	trans	-86.5	-34.8	-177.5	-68.7	175.5	0	0	0	113.9	I574 A575 W576	I574-L578 HydrophobicContact CG2-CD1 3.77Å; I574-L578 HydrophobicContact CG2-CG 4.47Å; I574-L578 WeakPolarHBondContact O-CB 3.11Å; I574-L578 VanDerWaalsContact O-CG 3.28Å; I574-L578 WeakPolarHBondContact O-CG 3.46Å; I574-L578 PolarHBondContact O-N 3.29Å; I574-L578 VanDerWaalsContact O-N 3.09Å; A575-L578 PolarHBondContact O-N 3.42Å; W576-L578 VanDerWaalsContact C-N 3.3Å; W576-L578 PolarHBondContact O-N 2.81Å
579	L	93.6	Very high	93.5	Very high	104 Å²	104	79.8 Å²	79.8	55%	0.545	42%	0.422	S	S	.	.	H	α-helix	trans	-131.8	-5.8	-165.7	-58.5	173.4	0	0	0	113.8	Y417 A575	Y417-L579 HydrophobicContact CD2-CB 4.04Å; Y417-L579 WeakPolarHBondContact CD2-O 3.18Å; Y417-L579 HydrophobicContact CE1-CB 4.18Å; Y417-L579 HydrophobicContact CE1-CD1 4.02Å; Y417-L579 HydrophobicContact CE2-CB 3.61Å; Y417-L579 HydrophobicContact CG-CB 4.49Å; A575-L579 WeakPolarHBondContact O-CB 3.3Å; A575-L579 PolarHBondContact O-N 3.33Å
580	G	90.7	Very high	93.3	Very high	29 Å²	29	80.9 Å²	80.9	30%	0.299	43%	0.431	S	S	.	.			trans	-73.6	150.6	-176.6	0	0	0	0	0	113.2	W576	W576-G580 WeakPolarHBondContact O-CA 3.49Å; W576-G580 PolarHBondContact O-N 3.25Å
581	N	91.4	Very high	93.2	Very high	58 Å²	58	77.4 Å²	77.4	31%	0.31	41%	0.412	S	S	.	.			trans	-109.6	101.9	174.9	-172.9	-15	0	0	0	111.7	D415 Q583 K584	D415-N581 HydrophobicContact CB-CB 4.45Å; D415-N581 VanDerWaalsContact CG-N 3.27Å; D415-N581 PolarHBondContact OD1-N 3.46Å; N581-Q583 PolarHBondContact O-N 3.34Å; N581-Q583 VanDerWaalsContact O-N 3.09Å; N581-Q583 VanDerWaalsContact OD1-CB 3.27Å; N581-Q583 WeakPolarHBondContact OD1-CB 3.46Å; N581-Q583 PolarHBondContact OD1-N 2.97Å; N581-K584 PolarHBondContact O-N 3Å; N581-K584 VanDerWaalsContact O-N 3.09Å
582	A	89.6	Confident	93.2	Very high	74 Å²	74	80.7 Å²	80.7	61%	0.612	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-10.5	178.7	0	0	0	0	0	114.6	M585	A582-M585 VanDerWaalsContact O-CG 3.28Å; A582-M585 WeakPolarHBondContact O-CG 3.4Å
583	Q	90.1	Very high	93.1	Very high	171 Å²	171	82.7 Å²	82.7	80%	0.799	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-18.8	174.9	-57.9	177.6	-3.9	0	0	112.6	N581	N581-Q583 PolarHBondContact O-N 3.34Å; N581-Q583 VanDerWaalsContact O-N 3.09Å; N581-Q583 VanDerWaalsContact OD1-CB 3.27Å; N581-Q583 WeakPolarHBondContact OD1-CB 3.46Å; N581-Q583 PolarHBondContact OD1-N 2.97Å
584	K	90.8	Very high	93	Very high	87 Å²	87	81.4 Å²	81.4	38%	0.378	43%	0.432	S	S	.	.	S	Bend	trans	-102.8	56.8	-179.9	-69.4	-166.4	173.1	-161.3	0	111.9	G412 V414 D415 N581	G412-K584 PolarHBondContact O-NZ 3.45Å; V414-K584 CarbonylContact C-O 3.59Å; V414-K584 WeakPolarHBondContact CA-O 3.5Å; D415-K584 HydrophobicContact CB-CB 4.04Å; D415-K584 PolarHBondContact N-O 3.23Å; N581-K584 PolarHBondContact O-N 3Å; N581-K584 VanDerWaalsContact O-N 3.09Å
585	M	91.2	Very high	92.9	Very high	62 Å²	62	77.1 Å²	77.1	31%	0.305	41%	0.41	S	S	.	.			trans	-86.7	153.4	176.5	-63	-67	-73.5	0	0	110.9	F418 W576 A582 Q587	F418-M585 HydrophobicContact CD1-CE 4.17Å; F418-M585 HydrophobicContact CD1-SD 3.96Å; F418-M585 HydrophobicContact CD2-CE 4Å; F418-M585 HydrophobicContact CD2-SD 3.91Å; F418-M585 HydrophobicContact CE1-CE 3.63Å; F418-M585 HydrophobicContact CE1-SD 4.05Å; F418-M585 HydrophobicContact CE2-CE 3.44Å; F418-M585 VanDerWaalsContact CE2-CE 3.44Å; F418-M585 HydrophobicContact CE2-SD 4Å; F418-M585 HydrophobicContact CG-CE 4.34Å; F418-M585 HydrophobicContact CG-SD 3.9Å; F418-M585 HydrophobicContact CZ-CE 3.23Å; F418-M585 HydrophobicContact CZ-SD 4.06Å; W576-M585 HydrophobicContact CZ2-SD 4.45Å; A582-M585 VanDerWaalsContact O-CG 3.28Å; A582-M585 WeakPolarHBondContact O-CG 3.4Å; M585-Q587 WeakPolarHBondContact O-CG 3.49Å; M585-Q587 PolarHBondContact O-N 2.98Å
586	P	91.1	Very high	92.8	Very high	11 Å²	11	80 Å²	80	7%	0.071	43%	0.426	C	S	.	.			trans	-60.1	126.3	176.2	-18	29.3	0	0	0	111.4	V414 F418 Q591 W592 L595	V414-P586 HydrophobicContact CG1-CG 3.85Å; V414-P586 HydrophobicContact CG2-CB 4.16Å; V414-P586 HydrophobicContact CG2-CG 4.11Å; F418-P586 HydrophobicContact CD1-CG 4.22Å; F418-P586 HydrophobicContact CE1-CG 3.85Å; P586-Q591 HydrophobicContact CB-CB 3.92Å; P586-W592 HydrophobicContact CB-CD2 4.18Å; P586-W592 HydrophobicContact CB-CG 4.33Å; P586-W592 HydrophobicContact CB-CZ2 4.24Å; P586-W592 HydrophobicContact CG-CD2 4.45Å; P586-W592 HydrophobicContact CG-CH2 4.42Å; P586-W592 HydrophobicContact CG-CZ2 4.09Å; P586-W592 PolarHBondContact O-NE1 3.32Å; P586-L595 HydrophobicContact CB-CD1 4.26Å; P586-L595 HydrophobicContact CG-CD1 3.46Å; P586-L595 VanDerWaalsContact CG-CD1 3.46Å
587	Q	91.1	Very high	92.8	Very high	173 Å²	173	79.8 Å²	79.8	81%	0.808	43%	0.427	S	S	*	.			trans	-104.2	-20.5	-174.3	-61.5	-170.5	-14.8	0	0	113.3	M585	M585-Q587 WeakPolarHBondContact O-CG 3.49Å; M585-Q587 PolarHBondContact O-N 2.98Å
588	T	93.7	Very high	92.7	Very high	66 Å²	66	72.1 Å²	72.1	41%	0.405	39%	0.393	S	S	.	.	S	Bend	trans	-113	151.5	-175.9	72.7	0	0	0	0	112.1	L590 Q591 W592	T588-L590 PolarHBondContact O-N 2.99Å; T588-Q591 PolarHBondContact O-N 2.87Å; T588-Q591 VanDerWaalsContact O-N 3.12Å; T588-Q591 VanDerWaalsContact OG1-CG 3.29Å; T588-Q591 WeakPolarHBondContact OG1-CG 3.49Å; T588-Q591 PolarHBondContact OG1-N 3.1Å; T588-Q591 VanDerWaalsContact OG1-N 3.14Å; T588-W592 PolarHBondContact O-N 3.08Å; T588-W592 VanDerWaalsContact O-N 3.17Å
589	T	93.3	Very high	92.7	Very high	130 Å²	130	65.9 Å²	65.9	80%	0.798	36%	0.36	S	S	*	.	H	α-helix	trans	-57.3	-33.8	172.4	-48.9	0	0	0	0	111.6	W592 G593	T589-W592 PolarHBondContact O-N 3.41Å; T589-G593 PolarHBondContact O-N 3Å
590	L	93.3	Very high	92.6	Very high	100 Å²	100	63.1 Å²	63.1	52%	0.524	35%	0.348	S	S	.	.	H	α-helix	trans	-63	-46.5	175.8	-179.2	61.9	0	0	0	111.5	Y409 T588 W592 G593 I594	Y409-L590 HydrophobicContact CD1-CD2 3.69Å; Y409-L590 HydrophobicContact CD1-CG 4.44Å; Y409-L590 HydrophobicContact CE1-CD2 3.84Å; T588-L590 PolarHBondContact O-N 2.99Å; L590-W592 VanDerWaalsContact C-N 3.34Å; L590-W592 PolarHBondContact O-N 2.84Å; L590-G593 PolarHBondContact O-N 2.82Å; L590-I594 HydrophobicContact CD1-CD1 4.13Å; L590-I594 HydrophobicContact CD1-CG1 4.33Å; L590-I594 HydrophobicContact CG-CD1 4.01Å; L590-I594 VanDerWaalsContact O-CG1 3.31Å; L590-I594 WeakPolarHBondContact O-CG1 3.44Å; L590-I594 PolarHBondContact O-N 3.09Å
591	Q	94.4	Very high	92.6	Very high	22 Å²	22	63.8 Å²	63.8	10%	0.103	35%	0.346	C	S	.	.	H	α-helix	trans	-62.6	-41.3	178.3	-71.9	175.1	-25.2	0	0	111.8	Y409 L410 P586 T588 I594 L595	Y409-Q591 PolarHBondContact O-NE2 3.36Å; L410-Q591 HydrophobicContact CD2-CB 3.74Å; L410-Q591 HydrophobicContact CD2-CG 3.81Å; P586-Q591 HydrophobicContact CB-CB 3.92Å; T588-Q591 PolarHBondContact O-N 2.87Å; T588-Q591 VanDerWaalsContact O-N 3.12Å; T588-Q591 VanDerWaalsContact OG1-CG 3.29Å; T588-Q591 WeakPolarHBondContact OG1-CG 3.49Å; T588-Q591 PolarHBondContact OG1-N 3.1Å; T588-Q591 VanDerWaalsContact OG1-N 3.14Å; Q591-I594 PolarHBondContact O-N 3.31Å; Q591-L595 WeakPolarHBondContact O-CG 2.94Å; Q591-L595 PolarHBondContact O-N 3.23Å
592	W	95.1	Very high	92.5	Very high	112 Å²	112	61 Å²	61	42%	0.424	33%	0.331	S	S	.	.	H	α-helix	trans	-63.4	-44.5	173.5	-79	108.3	0	0	0	112.4	F418 P586 T588 T589 L590 I594 L595 V596	F418-W592 HydrophobicContact CE1-CH2 4.16Å; F418-W592 HydrophobicContact CZ-CH2 4.1Å; P586-W592 HydrophobicContact CB-CD2 4.18Å; P586-W592 HydrophobicContact CB-CG 4.33Å; P586-W592 HydrophobicContact CB-CZ2 4.24Å; P586-W592 HydrophobicContact CG-CD2 4.45Å; P586-W592 HydrophobicContact CG-CH2 4.42Å; P586-W592 HydrophobicContact CG-CZ2 4.09Å; P586-W592 PolarHBondContact O-NE1 3.32Å; T588-W592 PolarHBondContact O-N 3.08Å; T588-W592 VanDerWaalsContact O-N 3.17Å; T589-W592 PolarHBondContact O-N 3.41Å; L590-W592 VanDerWaalsContact C-N 3.34Å; L590-W592 PolarHBondContact O-N 2.84Å; W592-I594 VanDerWaalsContact C-N 3.33Å; W592-I594 PolarHBondContact O-N 2.98Å; W592-L595 HydrophobicContact CE3-CD1 4.41Å; W592-L595 PolarHBondContact O-N 3.44Å; W592-V596 WeakPolarHBondContact O-CG2 3.32Å; W592-V596 PolarHBondContact O-N 3.24Å
593	G	94.4	Very high	92.5	Very high	42 Å²	42	57.5 Å²	57.5	43%	0.433	30%	0.302	S	S	.	.	H	α-helix	trans	-60.1	-41.8	176.2	0	0	0	0	0	112.6	T589 L590 V596 F597	T589-G593 PolarHBondContact O-N 3Å; L590-G593 PolarHBondContact O-N 2.82Å; G593-V596 PolarHBondContact O-N 2.87Å; G593-F597 PolarHBondContact O-N 3.25Å
594	I	93.6	Very high	92.5	Very high	12 Å²	12	49.3 Å²	49.3	6%	0.062	26%	0.264	C	S	.	.	H	α-helix	trans	-64	-45.3	175.1	-69	170.8	0	0	0	110.7	F405 Y409 L410 L590 Q591 W592 V596 F597 L598	F405-I594 HydrophobicContact CB-CG2 3.83Å; Y409-I594 VanDerWaalsContact CB-CD1 3.4Å; Y409-I594 HydrophobicContact CD1-CD1 4.07Å; Y409-I594 HydrophobicContact CD2-CD1 3.88Å; Y409-I594 HydrophobicContact CG-CD1 3.51Å; L410-I594 HydrophobicContact CD1-CB 4.45Å; L410-I594 HydrophobicContact CD1-CG2 3.65Å; L410-I594 HydrophobicContact CG-CG2 4.15Å; L590-I594 HydrophobicContact CD1-CD1 4.13Å; L590-I594 HydrophobicContact CD1-CG1 4.33Å; L590-I594 HydrophobicContact CG-CD1 4.01Å; L590-I594 VanDerWaalsContact O-CG1 3.31Å; L590-I594 WeakPolarHBondContact O-CG1 3.44Å; L590-I594 PolarHBondContact O-N 3.09Å; Q591-I594 PolarHBondContact O-N 3.31Å; W592-I594 VanDerWaalsContact C-N 3.33Å; W592-I594 PolarHBondContact O-N 2.98Å; I594-V596 VanDerWaalsContact C-N 3.29Å; I594-V596 PolarHBondContact O-N 3.32Å; I594-F597 PolarHBondContact O-N 3.04Å; I594-L598 HydrophobicContact CG2-CD1 3.82Å; I594-L598 HydrophobicContact CG2-CG 4.06Å; I594-L598 WeakPolarHBondContact O-CB 3.31Å; I594-L598 VanDerWaalsContact O-CG 3.25Å; I594-L598 WeakPolarHBondContact O-CG 3.27Å; I594-L598 PolarHBondContact O-N 3.43Å
595	L	94.2	Very high	92.2	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-60	-39.1	176.5	-75	173.2	0	0	0	112.2	L410 A419 V422 P586 Q591 W592 L598 G599	L410-L595 HydrophobicContact CD1-CD2 3.69Å; L410-L595 HydrophobicContact CD1-CG 4.02Å; L410-L595 HydrophobicContact CD2-CG 4.35Å; A419-L595 HydrophobicContact CB-CD2 3.89Å; V422-L595 HydrophobicContact CG1-CB 4.05Å; V422-L595 HydrophobicContact CG1-CD1 4.41Å; P586-L595 HydrophobicContact CB-CD1 4.26Å; P586-L595 HydrophobicContact CG-CD1 3.46Å; P586-L595 VanDerWaalsContact CG-CD1 3.46Å; Q591-L595 WeakPolarHBondContact O-CG 2.94Å; Q591-L595 PolarHBondContact O-N 3.23Å; W592-L595 HydrophobicContact CE3-CD1 4.41Å; W592-L595 PolarHBondContact O-N 3.44Å; L595-L598 PolarHBondContact O-N 3.44Å; L595-G599 PolarHBondContact O-N 2.88Å
596	V	94.3	Very high	92	Very high	73 Å²	73	45.9 Å²	45.9	44%	0.442	25%	0.25	S	S	.	.	H	α-helix	trans	-63.7	-46.9	175.1	172.3	0	0	0	0	111.4	L426 W592 G593 I594 G599 V600	L426-V596 HydrophobicContact CD1-CB 4.42Å; L426-V596 HydrophobicContact CD1-CG2 4.11Å; W592-V596 WeakPolarHBondContact O-CG2 3.32Å; W592-V596 PolarHBondContact O-N 3.24Å; G593-V596 PolarHBondContact O-N 2.87Å; I594-V596 VanDerWaalsContact C-N 3.29Å; I594-V596 PolarHBondContact O-N 3.32Å; V596-G599 PolarHBondContact O-N 2.81Å; V596-V600 HydrophobicContact CG1-CG2 4.31Å; V596-V600 WeakPolarHBondContact O-CB 3.31Å; V596-V600 PolarHBondContact O-N 2.86Å
597	F	93.3	Very high	91.7	Very high	57 Å²	57	46 Å²	46	25%	0.25	25%	0.249	C	C	.	.	I	π-helix	trans	-60.1	-47.3	175.8	176	-93.6	0	0	0	111.9	L398 F405 G593 I594 G599 V601 A602	L398-F597 HydrophobicContact CD2-CZ 4.31Å; F405-F597 AromaticContact CD2-CD1 3.83Å; F405-F597 HydrophobicContact CD2-CD1 3.83Å; F405-F597 AromaticContact CD2-CE1 3.85Å; F405-F597 HydrophobicContact CD2-CE1 3.85Å; F405-F597 AromaticContact CE2-CD1 3.99Å; F405-F597 HydrophobicContact CE2-CD1 3.99Å; F405-F597 AromaticContact CE2-CE1 3.82Å; F405-F597 HydrophobicContact CE2-CE1 3.82Å; F405-F597 HydrophobicContact CE2-CZ 4.34Å; G593-F597 PolarHBondContact O-N 3.25Å; I594-F597 PolarHBondContact O-N 3.04Å; F597-G599 VanDerWaalsContact C-N 3.28Å; F597-G599 PolarHBondContact O-N 3.36Å; F597-V601 HydrophobicContact CD2-CB 3.96Å; F597-V601 HydrophobicContact CD2-CG1 4.36Å; F597-V601 HydrophobicContact CD2-CG2 3.93Å; F597-V601 HydrophobicContact CE2-CB 3.96Å; F597-V601 HydrophobicContact CE2-CG1 3.86Å; F597-V601 HydrophobicContact CE2-CG2 4.24Å; F597-V601 HydrophobicContact CZ-CG1 4.31Å; F597-V601 WeakPolarHBondContact O-CB 3.47Å; F597-V601 PolarHBondContact O-N 2.9Å; F597-A602 PolarHBondContact O-N 3.38Å; F597-A602 VanDerWaalsContact O-N 3.07Å
598	L	93.2	Very high	91.4	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.222	C	C	.	.	I	π-helix	trans	-61.6	-37.7	179.2	-70.7	179.5	0	0	0	111.8	Y406 L410 R423 I594 L595 S603	Y406-L598 HydrophobicContact CD2-CD1 4.31Å; L410-L598 HydrophobicContact CD1-CD1 3.8Å; R423-L598 HydrophobicContact CG-CB 4.33Å; R423-L598 PolarHBondContact NE-O 2.83Å; I594-L598 HydrophobicContact CG2-CD1 3.82Å; I594-L598 HydrophobicContact CG2-CG 4.06Å; I594-L598 WeakPolarHBondContact O-CB 3.31Å; I594-L598 VanDerWaalsContact O-CG 3.25Å; I594-L598 WeakPolarHBondContact O-CG 3.27Å; I594-L598 PolarHBondContact O-N 3.43Å; L595-L598 PolarHBondContact O-N 3.44Å; L598-S603 WeakPolarHBondContact O-CB 3.27Å; L598-S603 PolarHBondContact O-N 3.45Å; L598-S603 PolarHBondContact O-OG 2.88Å
599	G	93.3	Very high	91	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.209	C	C	.	.	I	π-helix	trans	-76.8	-56.4	179.7	0	0	0	0	0	114	R423 A427 L595 V596 F597 S603 G604	R423-G599 VanDerWaalsContact O-CA 3.24Å; R423-G599 WeakPolarHBondContact O-CA 3.31Å; A427-G599 WeakPolarHBondContact CB-O 3.28Å; L595-G599 PolarHBondContact O-N 2.88Å; V596-G599 PolarHBondContact O-N 2.81Å; F597-G599 VanDerWaalsContact C-N 3.28Å; F597-G599 PolarHBondContact O-N 3.36Å; G599-S603 WeakPolarHBondContact O-CB 3.5Å; G599-G604 PolarHBondContact O-N 3.37Å
600	V	92.6	Very high	90.4	Very high	47 Å²	47	34.8 Å²	34.8	29%	0.285	18%	0.181	S	C	.	.	I	π-helix	trans	-77.1	-48.5	-173.1	177.2	0	0	0	0	111.7	L426 V430 V596 G604 I605	L426-V600 HydrophobicContact CB-CG2 4.25Å; V430-V600 HydrophobicContact CG2-CB 4.4Å; V430-V600 HydrophobicContact CG2-CG1 3.93Å; V430-V600 HydrophobicContact CG2-CG2 4.32Å; V596-V600 HydrophobicContact CG1-CG2 4.31Å; V596-V600 WeakPolarHBondContact O-CB 3.31Å; V596-V600 PolarHBondContact O-N 2.86Å; V600-G604 WeakPolarHBondContact O-CA 3.46Å; V600-G604 PolarHBondContact O-N 2.84Å; V600-I605 PolarHBondContact O-N 2.55Å
601	V	90.9	Very high	89.7	Confident	42 Å²	42	30.1 Å²	30.1	26%	0.255	16%	0.156	S	C	.	.	I	π-helix	trans	-87.3	-61.4	-171.5	-174.9	0	0	0	0	110.5	L398 F597 I605 G606	L398-V601 HydrophobicContact CD1-CG1 4.24Å; L398-V601 HydrophobicContact CD2-CG1 3.81Å; F597-V601 HydrophobicContact CD2-CB 3.96Å; F597-V601 HydrophobicContact CD2-CG1 4.36Å; F597-V601 HydrophobicContact CD2-CG2 3.93Å; F597-V601 HydrophobicContact CE2-CB 3.96Å; F597-V601 HydrophobicContact CE2-CG1 3.86Å; F597-V601 HydrophobicContact CE2-CG2 4.24Å; F597-V601 HydrophobicContact CZ-CG1 4.31Å; F597-V601 WeakPolarHBondContact O-CB 3.47Å; F597-V601 PolarHBondContact O-N 2.9Å; V601-I605 WeakPolarHBondContact O-CB 3.4Å; V601-I605 PolarHBondContact O-N 2.84Å; V601-G606 PolarHBondContact O-N 3.22Å
602	A	89.9	Confident	88.8	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.167	C	C	.	.	I	π-helix	trans	-70.6	-43.7	-171.7	0	0	0	0	0	112.8	W399 S402 F597 G606	W399-A602 PolarHBondContact NE1-O 3.34Å; S402-A602 WeakPolarHBondContact OG-CB 3.28Å; F597-A602 PolarHBondContact O-N 3.38Å; F597-A602 VanDerWaalsContact O-N 3.07Å; A602-G606 WeakPolarHBondContact O-CA 3.42Å
603	S	89.4	Confident	87.7	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.147	C	C	.	.	I	π-helix	trans	-80.3	-69.9	174.2	-69.9	0	0	0	0	110.8	R423 Y460 Y565 L598 G599 I605 Y607	R423-S603 WeakPolarHBondContact CG-OG 3.4Å; R423-S603 PolarHBondContact NE-OG 3.05Å; Y460-S603 PolarHBondContact OH-OG 3.43Å; Y565-S603 PolarHBondContact OH-O 2.91Å; L598-S603 WeakPolarHBondContact O-CB 3.27Å; L598-S603 PolarHBondContact O-N 3.45Å; L598-S603 PolarHBondContact O-OG 2.88Å; G599-S603 WeakPolarHBondContact O-CB 3.5Å; S603-I605 PolarHBondContact O-N 3.14Å; S603-Y607 WeakPolarHBondContact O-CB 3.42Å; S603-Y607 PolarHBondContact O-N 2.94Å
604	G	88.7	Confident	86.5	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.131	C	C	.	.	I	π-helix	trans	-48.3	-67.1	-173.9	0	0	0	0	0	113.4	F431 Y565 G599 V600 F608	F431-G604 VanDerWaalsContact CE2-O 3.29Å; F431-G604 WeakPolarHBondContact CE2-O 3.33Å; Y565-G604 PolarHBondContact OH-N 3.47Å; G599-G604 PolarHBondContact O-N 3.37Å; V600-G604 WeakPolarHBondContact O-CA 3.46Å; V600-G604 PolarHBondContact O-N 2.84Å; G604-F608 WeakPolarHBondContact O-CB 3.1Å
605	I	86.1	Confident	85.3	Confident	77 Å²	77	27.4 Å²	27.4	40%	0.395	14%	0.138	S	C	.	.	I	π-helix	trans	-73.3	-48.6	-177.5	-62.6	170.5	0	0	0	111.3	V600 V601 S603 Y607 F608 M609	V600-I605 PolarHBondContact O-N 2.55Å; V601-I605 WeakPolarHBondContact O-CB 3.4Å; V601-I605 PolarHBondContact O-N 2.84Å; S603-I605 PolarHBondContact O-N 3.14Å; I605-Y607 PolarHBondContact O-N 2.57Å; I605-F608 WeakPolarHBondContact O-CB 3.4Å; I605-F608 PolarHBondContact O-N 3.31Å; I605-M609 HydrophobicContact CG2-CG 4.21Å; I605-M609 HydrophobicContact CG2-SD 3.49Å; I605-M609 WeakPolarHBondContact CG2-SD 3.29Å; I605-M609 VanDerWaalsContact O-CG 3.31Å; I605-M609 WeakPolarHBondContact O-CG 3.38Å; I605-M609 PolarHBondContact O-N 2.86Å
606	G	86.9	Confident	83.9	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-59.3	-51.7	-174.4	0	0	0	0	0	113.5	T395 V601 A602 F608 M609 W610	T395-G606 WeakPolarHBondContact CG2-O 3.12Å; V601-G606 PolarHBondContact O-N 3.22Å; A602-G606 WeakPolarHBondContact O-CA 3.42Å; G606-F608 VanDerWaalsContact C-N 3.29Å; G606-F608 PolarHBondContact O-N 2.95Å; G606-M609 PolarHBondContact O-N 3.02Å; G606-W610 WeakPolarHBondContact O-CB 3.13Å; G606-W610 PolarHBondContact O-N 3.09Å
607	Y	84.7	Confident	81.9	Confident	12 Å²	12	30.2 Å²	30.2	5%	0.047	16%	0.155	C	C	.	.	H	α-helix	trans	-67.3	-32.1	178.9	-85.5	-98	0	0	0	112.9	W399 L456 M459 Y460 F539 F561 S603 I605 W610 N611	W399-Y607 AromaticContact CE2-CD2 3.97Å; W399-Y607 AromaticContact CE2-CE2 3.71Å; W399-Y607 HydrophobicContact CH2-CD1 4.27Å; W399-Y607 HydrophobicContact CH2-CD2 4.5Å; W399-Y607 HydrophobicContact CH2-CE1 4.05Å; W399-Y607 HydrophobicContact CH2-CE2 4.21Å; W399-Y607 AromaticContact CZ2-CD1 3.95Å; W399-Y607 HydrophobicContact CZ2-CD1 3.95Å; W399-Y607 AromaticContact CZ2-CD2 3.48Å; W399-Y607 HydrophobicContact CZ2-CD2 3.48Å; W399-Y607 VanDerWaalsContact CZ2-CD2 3.48Å; W399-Y607 AromaticContact CZ2-CE1 3.92Å; W399-Y607 HydrophobicContact CZ2-CE1 3.92Å; W399-Y607 AromaticContact CZ2-CE2 3.36Å; W399-Y607 HydrophobicContact CZ2-CE2 3.36Å; W399-Y607 AromaticContact CZ2-CG 3.79Å; W399-Y607 HydrophobicContact CZ2-CG 3.79Å; W399-Y607 AromaticContact CZ2-CZ 3.65Å; W399-Y607 AromaticContact NE1-CD2 3.97Å; W399-Y607 AromaticContact NE1-CE2 3.84Å; L456-Y607 HydrophobicContact CD2-CD1 3.5Å; L456-Y607 VanDerWaalsContact CD2-CD1 3.5Å; L456-Y607 HydrophobicContact CD2-CD2 4.04Å; L456-Y607 HydrophobicContact CD2-CE1 3.21Å; L456-Y607 HydrophobicContact CD2-CE2 3.86Å; L456-Y607 HydrophobicContact CD2-CG 3.85Å; L456-Y607 HydrophobicContact CG-CD1 4.49Å; L456-Y607 HydrophobicContact CG-CE1 4.47Å; M459-Y607 WeakPolarHBondContact CE-OH 3.29Å; Y460-Y607 WeakPolarHBondContact OH-CE2 3.16Å; Y460-Y607 PolarHBondContact OH-OH 3.48Å; F539-Y607 HydrophobicContact CD2-CE1 4.21Å; F539-Y607 AromaticContact CE2-CE1 3.43Å; F539-Y607 HydrophobicContact CE2-CE1 3.43Å; F539-Y607 VanDerWaalsContact CE2-CE1 3.43Å; F539-Y607 AromaticContact CE2-CZ 3.87Å; F539-Y607 HydrophobicContact CZ-CE1 4.27Å; F561-Y607 VanDerWaalsContact CZ-O 3.31Å; F561-Y607 WeakPolarHBondContact CZ-O 3.25Å; S603-Y607 WeakPolarHBondContact O-CB 3.42Å; S603-Y607 PolarHBondContact O-N 2.94Å; I605-Y607 PolarHBondContact O-N 2.57Å; Y607-W610 PolarHBondContact O-N 3.43Å; Y607-N611 PolarHBondContact O-N 3.24Å
608	F	85.1	Confident	79.3	Confident	57 Å²	57	33.2 Å²	33.2	25%	0.25	18%	0.182	C	C	.	.	H	α-helix	trans	-59.7	-51.9	172.8	178.8	-98.8	0	0	0	110.9	F431 Q557 F561 G604 I605 G606 W610 Y612	F431-F608 HydrophobicContact CE1-CB 4.36Å; F431-F608 AromaticContact CE1-CD2 3.59Å; F431-F608 HydrophobicContact CE1-CD2 3.59Å; F431-F608 HydrophobicContact CE1-CE2 4.09Å; F431-F608 HydrophobicContact CE1-CG 4.01Å; F431-F608 HydrophobicContact CE2-CB 4.41Å; F431-F608 HydrophobicContact CZ-CB 3.61Å; F431-F608 AromaticContact CZ-CD2 3.73Å; F431-F608 HydrophobicContact CZ-CD2 3.73Å; F431-F608 AromaticContact CZ-CG 3.72Å; F431-F608 HydrophobicContact CZ-CG 3.72Å; Q557-F608 HydrophobicContact CB-CE2 4.05Å; F561-F608 HydrophobicContact CB-CD2 4.32Å; F561-F608 HydrophobicContact CD1-CB 4.45Å; F561-F608 HydrophobicContact CD1-CD2 4.33Å; F561-F608 AromaticContact CD2-CD2 3.52Å; F561-F608 HydrophobicContact CD2-CD2 3.52Å; F561-F608 HydrophobicContact CD2-CE2 4.06Å; F561-F608 HydrophobicContact CE1-CB 4.2Å; F561-F608 AromaticContact CE2-CD2 3.8Å; F561-F608 HydrophobicContact CE2-CD2 3.8Å; F561-F608 HydrophobicContact CE2-CE2 4.49Å; F561-F608 AromaticContact CG-CD2 3.78Å; F561-F608 HydrophobicContact CG-CD2 3.78Å; F561-F608 HydrophobicContact CZ-CB 4.24Å; F561-F608 HydrophobicContact CZ-CD2 4.3Å; G604-F608 WeakPolarHBondContact O-CB 3.1Å; I605-F608 WeakPolarHBondContact O-CB 3.4Å; I605-F608 PolarHBondContact O-N 3.31Å; G606-F608 VanDerWaalsContact C-N 3.29Å; G606-F608 PolarHBondContact O-N 2.95Å; F608-W610 VanDerWaalsContact C-N 3.32Å; F608-W610 PolarHBondContact O-N 3.23Å; F608-Y612 WeakPolarHBondContact O-CB 3.31Å; F608-Y612 PolarHBondContact O-N 3.44Å
609	M	83.7	Confident	76.7	Confident	26 Å²	26	39.7 Å²	39.7	13%	0.128	21%	0.206	C	C	.	.	H	α-helix	trans	-59.6	-42.2	176.2	-65.7	169.3	69.2	0	0	112.1	L391 I394 T395 I605 G606 G613	L391-M609 HydrophobicContact CB-CB 4.42Å; L391-M609 HydrophobicContact CB-CE 4.26Å; L391-M609 HydrophobicContact CD2-CB 4.16Å; L391-M609 HydrophobicContact CD2-CE 3.27Å; L391-M609 HydrophobicContact CD2-CG 3.89Å; L391-M609 HydrophobicContact CD2-SD 4.32Å; L391-M609 HydrophobicContact CG-CE 4.35Å; I394-M609 HydrophobicContact CB-CE 3.96Å; I394-M609 HydrophobicContact CD1-CE 4.31Å; I394-M609 HydrophobicContact CG2-CE 3.78Å; T395-M609 WeakPolarHBondContact OG1-CB 3.29Å; I605-M609 HydrophobicContact CG2-CG 4.21Å; I605-M609 HydrophobicContact CG2-SD 3.49Å; I605-M609 WeakPolarHBondContact CG2-SD 3.29Å; I605-M609 VanDerWaalsContact O-CG 3.31Å; I605-M609 WeakPolarHBondContact O-CG 3.38Å; I605-M609 PolarHBondContact O-N 2.86Å; G606-M609 PolarHBondContact O-N 3.02Å; M609-G613 PolarHBondContact O-N 2.93Å
610	W	81.7	Confident	75.9	Confident	52 Å²	52	41.7 Å²	41.7	20%	0.197	22%	0.216	C	C	.	.	H	α-helix	trans	-65.2	-54.5	179.7	-177	-97.8	0	0	0	113.2	L392 T395 W399 F539 M543 G606 Y607 F608 Y612 G613 A614	L392-W610 HydrophobicContact CD2-CD2 4.05Å; L392-W610 HydrophobicContact CD2-CE3 3.48Å; L392-W610 VanDerWaalsContact CD2-CE3 3.48Å; L392-W610 HydrophobicContact CD2-CH2 4.46Å; L392-W610 HydrophobicContact CD2-CZ3 3.72Å; T395-W610 HydrophobicContact CG2-CB 4.05Å; T395-W610 HydrophobicContact CG2-CE3 4.21Å; W399-W610 HydrophobicContact CH2-CB 3.92Å; W399-W610 AromaticContact CH2-CD1 3.77Å; W399-W610 AromaticContact CH2-CD2 3.66Å; W399-W610 HydrophobicContact CH2-CD2 3.66Å; W399-W610 HydrophobicContact CH2-CE3 4.19Å; W399-W610 AromaticContact CH2-CG 3.52Å; W399-W610 HydrophobicContact CH2-CG 3.52Å; W399-W610 HydrophobicContact CZ2-CB 4.14Å; W399-W610 HydrophobicContact CZ2-CG 4.23Å; W399-W610 AromaticContact CZ3-CD2 3.85Å; W399-W610 HydrophobicContact CZ3-CD2 3.85Å; W399-W610 HydrophobicContact CZ3-CE3 4.05Å; W399-W610 HydrophobicContact CZ3-CG 4.21Å; W399-W610 HydrophobicContact CZ3-CZ2 4.47Å; W399-W610 HydrophobicContact CZ3-CZ3 4.44Å; F539-W610 AromaticContact CZ-NE1 3.91Å; M543-W610 HydrophobicContact CE-CZ2 4.19Å; M543-W610 PolarHBondContact SD-NE1 3.37Å; G606-W610 WeakPolarHBondContact O-CB 3.13Å; G606-W610 PolarHBondContact O-N 3.09Å; Y607-W610 PolarHBondContact O-N 3.43Å; F608-W610 VanDerWaalsContact C-N 3.32Å; F608-W610 PolarHBondContact O-N 3.23Å; W610-Y612 VanDerWaalsContact C-N 3.3Å; W610-Y612 PolarHBondContact O-N 3.12Å; W610-G613 PolarHBondContact O-N 3.04Å; W610-A614 VanDerWaalsContact O-CB 3.26Å; W610-A614 WeakPolarHBondContact O-CB 3.43Å; W610-A614 PolarHBondContact O-N 3.13Å
611	N	78	Confident	75	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-69	-32.5	179.6	-68.3	-38.4	0	0	0	111	Q455 Y546 F561 Y607 A614 T615	Q455-N611 PolarHBondContact NE2-OD1 3.37Å; Y546-N611 HydrophobicContact CD1-CB 3.91Å; Y546-N611 HydrophobicContact CE1-CB 3.81Å; F561-N611 HydrophobicContact CE2-CB 3.91Å; F561-N611 HydrophobicContact CZ-CB 3.64Å; F561-N611 VanDerWaalsContact CZ-ND2 3.34Å; F561-N611 WeakPolarHBondContact CZ-ND2 3.4Å; Y607-N611 PolarHBondContact O-N 3.24Å; N611-A614 PolarHBondContact O-N 3.31Å; N611-T615 WeakPolarHBondContact O-CG2 3.32Å; N611-T615 PolarHBondContact O-N 3.17Å; N611-T615 PolarHBondContact O-OG1 3.45Å
612	Y	76.7	Confident	74.1	Confident	85 Å²	85	41.3 Å²	41.3	33%	0.333	21%	0.21	S	C	.	.	H	α-helix	trans	-58.6	-53.5	171.2	-177.9	-86.7	0	0	0	110.3	L391 Q557 F608 W610 A614 T615 Q616	L391-Y612 HydrophobicContact CD1-CD1 3.9Å; L391-Y612 HydrophobicContact CD1-CE1 4.28Å; Q557-Y612 HydrophobicContact CG-CD2 4.37Å; F608-Y612 WeakPolarHBondContact O-CB 3.31Å; F608-Y612 PolarHBondContact O-N 3.44Å; W610-Y612 VanDerWaalsContact C-N 3.3Å; W610-Y612 PolarHBondContact O-N 3.12Å; Y612-A614 VanDerWaalsContact C-N 3.33Å; Y612-A614 PolarHBondContact O-N 3.14Å; Y612-T615 PolarHBondContact O-N 3.25Å; Y612-T615 PolarHBondContact O-OG1 3.37Å; Y612-Q616 HydrophobicContact CE1-CG 4.23Å; Y612-Q616 WeakPolarHBondContact O-CG 3.47Å; Y612-Q616 PolarHBondContact O-N 2.94Å
613	G	71.5	Confident	73.2	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-57.8	-43	175.8	0	0	0	0	0	112.9	M609 W610 T615 Q616 G617	M609-G613 PolarHBondContact O-N 2.93Å; W610-G613 PolarHBondContact O-N 3.04Å; G613-T615 VanDerWaalsContact C-N 3.3Å; G613-T615 PolarHBondContact O-N 2.86Å; G613-Q616 PolarHBondContact O-N 3.01Å; G613-Q616 VanDerWaalsContact O-N 3.09Å; G613-G617 PolarHBondContact O-N 3.2Å
614	A	69.7	Low	72.2	Confident	11 Å²	11	46.5 Å²	46.5	9%	0.091	24%	0.237	C	C	.	.	H	α-helix	trans	-62.8	-29.6	177.7	0	0	0	0	0	114.6	M543 W610 N611 Y612 Q616 W619	M543-A614 HydrophobicContact CE-CB 3.41Å; M543-A614 VanDerWaalsContact CE-CB 3.41Å; W610-A614 VanDerWaalsContact O-CB 3.26Å; W610-A614 WeakPolarHBondContact O-CB 3.43Å; W610-A614 PolarHBondContact O-N 3.13Å; N611-A614 PolarHBondContact O-N 3.31Å; Y612-A614 VanDerWaalsContact C-N 3.33Å; Y612-A614 PolarHBondContact O-N 3.14Å; A614-Q616 VanDerWaalsContact C-N 3.35Å; A614-W619 HydrophobicContact CB-CZ2 3.8Å; A614-W619 PolarHBondContact O-NE1 3.32Å
615	T	67.9	Low	71.1	Confident	35 Å²	35	49.6 Å²	49.6	22%	0.215	25%	0.253	C	S	.	.	H	α-helix	trans	-76.9	-22.6	174.9	61.9	0	0	0	0	113.2	Y546 M550 Q557 N611 Y612 G613	Y546-T615 HydrophobicContact CD1-CG2 4.1Å; Y546-T615 HydrophobicContact CE1-CG2 3.79Å; M550-T615 HydrophobicContact CB-CG2 4.36Å; M550-T615 HydrophobicContact CG-CG2 4.19Å; Q557-T615 PolarHBondContact NE2-OG1 3.41Å; N611-T615 WeakPolarHBondContact O-CG2 3.32Å; N611-T615 PolarHBondContact O-N 3.17Å; N611-T615 PolarHBondContact O-OG1 3.45Å; Y612-T615 PolarHBondContact O-N 3.25Å; Y612-T615 PolarHBondContact O-OG1 3.37Å; G613-T615 VanDerWaalsContact C-N 3.3Å; G613-T615 PolarHBondContact O-N 2.86Å
616	Q	63.6	Low	70	Confident	100 Å²	100	47.6 Å²	47.6	47%	0.467	24%	0.242	S	C	.	.	H	α-helix	trans	-92.9	-19.2	179.2	-57.6	-67.4	-17.6	0	0	112.5	I388 Y612 G613 A614	I388-Q616 HydrophobicContact CD1-CB 3.48Å; I388-Q616 VanDerWaalsContact CD1-CB 3.48Å; I388-Q616 HydrophobicContact CD1-CG 4.31Å; I388-Q616 HydrophobicContact CG1-CB 4.02Å; Y612-Q616 HydrophobicContact CE1-CG 4.23Å; Y612-Q616 WeakPolarHBondContact O-CG 3.47Å; Y612-Q616 PolarHBondContact O-N 2.94Å; G613-Q616 PolarHBondContact O-N 3.01Å; G613-Q616 VanDerWaalsContact O-N 3.09Å; A614-Q616 VanDerWaalsContact C-N 3.35Å
617	G	52.3	Low	68.7	Low	32 Å²	32	51.3 Å²	51.3	33%	0.33	26%	0.261	S	S	.	.	S	Bend	trans	-81.6	138.8	176.5	0	0	0	0	0	113.8	G613	G613-G617 PolarHBondContact O-N 3.2Å
618	C	40	Very low	67.4	Low	119 Å²	119	54.6 Å²	54.6	80%	0.804	28%	0.279	S	S	*	.			trans	-73.7	122.9	161.2	-81.4	0	0	0	0	109.1
619	W	38.4	Very low	65.8	Low	136 Å²	136	54.4 Å²	54.4	52%	0.515	28%	0.281	S	S	.	.			trans	-83.8	0	174.1	-67	71.4	0	0	0	111.8	I486 M543 K547 A614	I486-W619 HydrophobicContact CD1-CH2 4.49Å; I486-W619 HydrophobicContact CG2-CE3 3.96Å; I486-W619 HydrophobicContact CG2-CH2 3.96Å; I486-W619 HydrophobicContact CG2-CZ3 3.56Å; M543-W619 HydrophobicContact CE-CH2 3.55Å; M543-W619 HydrophobicContact CE-CZ2 3.54Å; M543-W619 HydrophobicContact SD-CH2 4.02Å; M543-W619 HydrophobicContact SD-CZ2 4.36Å; K547-W619 HydrophobicContact CD-CG 4.48Å; A614-W619 HydrophobicContact CB-CZ2 3.8Å; A614-W619 PolarHBondContact O-NE1 3.32Å

Retrieved 619 of 619 residues in 427.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).