G4VBL5_SCHMA Loading...

PRORP domain-containing protein

AlphaFold DB , UniProt , Accession G4VBL5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 530 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.2	Very low	45.9	Very low	161 Å²	161	128.6 Å²	128.6	79%	0.793	59%	0.594	S	S	*	*				0	125.1	0	-141.8	176.1	-173.1	0	0	106.9	R5 M6 L9	M1-R5 HydrophobicContact CG-CB 4.39Å; M1-M6 HydrophobicContact CB-CE 4.49Å; M1-L9 HydrophobicContact CE-CD1 3.68Å
2	S	49.8	Very low	45.9	Very low	69 Å²	69	119.2 Å²	119.2	48%	0.483	55%	0.55	S	S	.	.			trans	-66.7	147.6	-176.4	68.4	0	0	0	0	111.4	Y4 R5 M6	S2-Y4 PolarHBondContact O-N 3.36Å; S2-Y4 VanDerWaalsContact O-N 3.16Å; S2-R5 WeakPolarHBondContact O-CB 3.41Å; S2-R5 PolarHBondContact O-N 3.39Å; S2-R5 PolarHBondContact OG-N 2.89Å; S2-M6 PolarHBondContact O-N 3.35Å
3	A	49.1	Very low	45.9	Very low	83 Å²	83	117.4 Å²	117.4	69%	0.686	54%	0.54	S	S	*	.	H	α-helix	trans	-53.5	-35.1	176.9	0	0	0	0	0	112.3	M6 Y7	A3-M6 PolarHBondContact O-N 3.21Å; A3-Y7 WeakPolarHBondContact O-CB 3.27Å; A3-Y7 PolarHBondContact O-N 3.12Å
4	Y	43.5	Very low	46	Very low	165 Å²	165	112.4 Å²	112.4	65%	0.647	53%	0.525	S	S	*	.	H	α-helix	trans	-61.7	-42	174.5	-176.7	-99.4	0	0	0	113.3	S2 M6 R8	S2-Y4 PolarHBondContact O-N 3.36Å; S2-Y4 VanDerWaalsContact O-N 3.16Å; Y4-M6 VanDerWaalsContact C-N 3.32Å; Y4-M6 PolarHBondContact O-N 3.08Å; Y4-R8 VanDerWaalsContact O-CB 3.32Å; Y4-R8 WeakPolarHBondContact O-CB 3.37Å; Y4-R8 PolarHBondContact O-N 3.46Å
5	R	43.3	Very low	46	Very low	161 Å²	161	109.1 Å²	109.1	61%	0.608	51%	0.51	S	S	*	.	H	α-helix	trans	-63.4	-40.3	174.7	-110	-178.6	176.3	174.9	-0.4	111.4	M1 S2 L9	M1-R5 HydrophobicContact CG-CB 4.39Å; S2-R5 WeakPolarHBondContact O-CB 3.41Å; S2-R5 PolarHBondContact O-N 3.39Å; S2-R5 PolarHBondContact OG-N 2.89Å; R5-L9 WeakPolarHBondContact O-CB 3.45Å; R5-L9 VanDerWaalsContact O-CG 3.29Å; R5-L9 WeakPolarHBondContact O-CG 3.42Å; R5-L9 PolarHBondContact O-N 3.34Å
6	M	43.5	Very low	46.3	Very low	113 Å²	113	102.4 Å²	102.4	56%	0.557	48%	0.478	S	S	*	.	H	α-helix	trans	-67.7	-44.9	-179.6	-137.1	178.9	-68.3	0	0	111.6	M1 S2 A3 Y4 L9 F10	M1-M6 HydrophobicContact CB-CE 4.49Å; S2-M6 PolarHBondContact O-N 3.35Å; A3-M6 PolarHBondContact O-N 3.21Å; Y4-M6 VanDerWaalsContact C-N 3.32Å; Y4-M6 PolarHBondContact O-N 3.08Å; M6-L9 PolarHBondContact O-N 3.44Å; M6-F10 WeakPolarHBondContact O-CB 3.28Å; M6-F10 PolarHBondContact O-N 3.36Å
7	Y	44.9	Very low	46.2	Very low	160 Å²	160	100.6 Å²	100.6	63%	0.627	47%	0.467	S	S	*	.	H	α-helix	trans	-61.5	-45.5	174.4	-179.7	-96.9	0	0	0	111.9	A3 L9 F10 Y11	A3-Y7 WeakPolarHBondContact O-CB 3.27Å; A3-Y7 PolarHBondContact O-N 3.12Å; Y7-L9 PolarHBondContact O-N 3.07Å; Y7-F10 PolarHBondContact O-N 3.03Å; Y7-Y11 VanDerWaalsContact O-CB 3.27Å; Y7-Y11 WeakPolarHBondContact O-CB 2.83Å; Y7-Y11 PolarHBondContact O-N 3.34Å
8	R	44.3	Very low	46.2	Very low	136 Å²	136	98.9 Å²	98.9	51%	0.513	46%	0.461	S	S	.	.	H	α-helix	trans	-60.6	-45	177.3	-174.6	178.4	174	-179	0.7	111.9	Y4 Y11 Q12	Y4-R8 VanDerWaalsContact O-CB 3.32Å; Y4-R8 WeakPolarHBondContact O-CB 3.37Å; Y4-R8 PolarHBondContact O-N 3.46Å; R8-Y11 PolarHBondContact O-N 3.44Å; R8-Q12 HydrophobicContact CG-CG 4.45Å; R8-Q12 WeakPolarHBondContact O-CB 3.3Å; R8-Q12 WeakPolarHBondContact O-CG 3.49Å; R8-Q12 PolarHBondContact O-N 3.19Å; R8-Q12 PolarHBondContact O-OE1 3.03Å
9	L	45.1	Very low	46.4	Very low	79 Å²	79	94.3 Å²	94.3	41%	0.414	44%	0.44	S	S	.	.	H	α-helix	trans	-64	-43	176.9	-75.4	168	0	0	0	112.2	M1 R5 M6 Y7 Q12 K13	M1-L9 HydrophobicContact CE-CD1 3.68Å; R5-L9 WeakPolarHBondContact O-CB 3.45Å; R5-L9 VanDerWaalsContact O-CG 3.29Å; R5-L9 WeakPolarHBondContact O-CG 3.42Å; R5-L9 PolarHBondContact O-N 3.34Å; M6-L9 PolarHBondContact O-N 3.44Å; Y7-L9 PolarHBondContact O-N 3.07Å; L9-Q12 PolarHBondContact O-N 2.94Å; L9-K13 VanDerWaalsContact O-CB 3.29Å; L9-K13 WeakPolarHBondContact O-CB 3.49Å; L9-K13 PolarHBondContact O-N 3.29Å
10	F	48.9	Very low	46.7	Very low	156 Å²	156	89.8 Å²	89.8	68%	0.684	42%	0.419	S	S	*	.	H	α-helix	trans	-64.9	-43.2	177.2	-171.9	-93.6	0	0	0	111.7	M6 Y7 K13 S14	M6-F10 WeakPolarHBondContact O-CB 3.28Å; M6-F10 PolarHBondContact O-N 3.36Å; Y7-F10 PolarHBondContact O-N 3.03Å; F10-K13 PolarHBondContact O-N 3.39Å; F10-S14 VanDerWaalsContact O-CB 3.22Å; F10-S14 WeakPolarHBondContact O-CB 3.5Å; F10-S14 PolarHBondContact O-N 3.5Å
11	Y	47.9	Very low	46.5	Very low	132 Å²	132	86.2 Å²	86.2	52%	0.518	40%	0.403	S	S	.	.	H	α-helix	trans	-61.6	-46.4	174.8	-176.9	-93.1	0	0	0	111.7	Y7 R8 S14 H15	Y7-Y11 VanDerWaalsContact O-CB 3.27Å; Y7-Y11 WeakPolarHBondContact O-CB 2.83Å; Y7-Y11 PolarHBondContact O-N 3.34Å; R8-Y11 PolarHBondContact O-N 3.44Å; Y11-S14 PolarHBondContact O-N 2.96Å; Y11-H15 VanDerWaalsContact O-CB 3.22Å; Y11-H15 WeakPolarHBondContact O-CB 3.19Å; Y11-H15 PolarHBondContact O-N 3.15Å
12	Q	45.8	Very low	46.4	Very low	15 Å²	15	85.8 Å²	85.8	7%	0.07	39%	0.393	C	S	.	.	H	α-helix	trans	-61.6	-46.5	176.7	-75.5	168	-35.2	0	0	111.8	R8 L9 H15 F16 L60	R8-Q12 HydrophobicContact CG-CG 4.45Å; R8-Q12 WeakPolarHBondContact O-CB 3.3Å; R8-Q12 WeakPolarHBondContact O-CG 3.49Å; R8-Q12 PolarHBondContact O-N 3.19Å; R8-Q12 PolarHBondContact O-OE1 3.03Å; L9-Q12 PolarHBondContact O-N 2.94Å; Q12-H15 PolarHBondContact O-N 3.23Å; Q12-F16 WeakPolarHBondContact O-CB 3.29Å; Q12-F16 PolarHBondContact O-N 3.26Å; Q12-L60 HydrophobicContact CB-CD2 4.49Å; Q12-L60 PolarHBondContact NE2-O 2.91Å
13	K	45.9	Very low	46.2	Very low	96 Å²	96	84.6 Å²	84.6	42%	0.417	38%	0.381	S	S	.	.	H	α-helix	trans	-63.7	-46.9	178.4	-174	176	-175.4	175.5	0	111.8	L9 F10 F16 Y17 S66 D69	L9-K13 VanDerWaalsContact O-CB 3.29Å; L9-K13 WeakPolarHBondContact O-CB 3.49Å; L9-K13 PolarHBondContact O-N 3.29Å; F10-K13 PolarHBondContact O-N 3.39Å; K13-F16 PolarHBondContact O-N 2.94Å; K13-Y17 VanDerWaalsContact O-CB 3.27Å; K13-Y17 WeakPolarHBondContact O-CB 3.32Å; K13-Y17 PolarHBondContact O-N 3.22Å; K13-S66 PolarHBondContact NZ-OG 2.83Å; K13-D69 WeakPolarHBondContact CE-OD2 3.49Å; K13-D69 IonicContact NZ-OD1 3.68Å; K13-D69 IonicContact NZ-OD2 3.32Å
14	S	47.6	Very low	45.9	Very low	48 Å²	48	82 Å²	82	34%	0.336	36%	0.356	S	S	.	.	H	α-helix	trans	-62.8	-43.5	177.8	-177.4	0	0	0	0	111.3	F10 Y11 Y17 N18	F10-S14 VanDerWaalsContact O-CB 3.22Å; F10-S14 WeakPolarHBondContact O-CB 3.5Å; F10-S14 PolarHBondContact O-N 3.5Å; Y11-S14 PolarHBondContact O-N 2.96Å; S14-Y17 PolarHBondContact O-N 3.32Å; S14-N18 WeakPolarHBondContact O-CB 3.31Å; S14-N18 PolarHBondContact O-N 3.1Å; S14-N18 PolarHBondContact O-ND2 3.23Å; S14-N18 VanDerWaalsContact O-ND2 3.11Å; S14-N18 PolarHBondContact OG-ND2 3.07Å
15	H	46.5	Very low	45.6	Very low	63 Å²	63	78.6 Å²	78.6	29%	0.292	35%	0.346	S	S	.	.	H	α-helix	trans	-73	-30.8	178.8	-172.1	-71.9	0	0	0	112.7	Y11 Q12 Y19 L60	Y11-H15 VanDerWaalsContact O-CB 3.22Å; Y11-H15 WeakPolarHBondContact O-CB 3.19Å; Y11-H15 PolarHBondContact O-N 3.15Å; Q12-H15 PolarHBondContact O-N 3.23Å; H15-Y19 WeakPolarHBondContact O-CA 3.47Å; H15-Y19 WeakPolarHBondContact O-CB 3.36Å; H15-Y19 PolarHBondContact O-N 3.08Å; H15-L60 HydrophobicContact CB-CD2 3.68Å; H15-L60 WeakPolarHBondContact ND1-CD2 3.29Å
16	F	49.9	Very low	45.3	Very low	2 Å²	2	71.7 Å²	71.7	1%	0.009	33%	0.325	C	S	.	.	H	α-helix	trans	-67.3	-48.5	169.6	-179.7	-108.6	0	0	0	112.2	Q12 K13 Y19 C20 L57 L60 F63 V65 M73 L88	Q12-F16 WeakPolarHBondContact O-CB 3.29Å; Q12-F16 PolarHBondContact O-N 3.26Å; K13-F16 PolarHBondContact O-N 2.94Å; F16-Y19 WeakPolarHBondContact O-CA 3.5Å; F16-Y19 WeakPolarHBondContact O-CB 3.37Å; F16-Y19 PolarHBondContact O-N 3.01Å; F16-Y19 VanDerWaalsContact O-N 3.09Å; F16-C20 PolarHBondContact O-N 3.49Å; F16-C20 PolarHBondContact O-SG 3.37Å; F16-L57 HydrophobicContact CD2-CD2 3.59Å; F16-L57 HydrophobicContact CE2-CD2 3.72Å; F16-L60 HydrophobicContact CB-CD1 3.78Å; F16-L60 HydrophobicContact CD2-CD1 4.01Å; F16-L60 HydrophobicContact CG-CD1 4.4Å; F16-F63 HydrophobicContact CB-CE2 3.78Å; F16-F63 HydrophobicContact CB-CZ 3.89Å; F16-F63 AromaticContact CD1-CE2 3.78Å; F16-F63 HydrophobicContact CD1-CE2 3.78Å; F16-F63 HydrophobicContact CD1-CZ 4.26Å; F16-F63 HydrophobicContact CD2-CE1 4.4Å; F16-F63 AromaticContact CD2-CE2 3.68Å; F16-F63 HydrophobicContact CD2-CE2 3.68Å; F16-F63 AromaticContact CD2-CZ 3.26Å; F16-F63 HydrophobicContact CD2-CZ 3.26Å; F16-F63 HydrophobicContact CE1-CE2 4.26Å; F16-F63 HydrophobicContact CE2-CE2 4.13Å; F16-F63 AromaticContact CE2-CZ 3.74Å; F16-F63 HydrophobicContact CE2-CZ 3.74Å; F16-F63 AromaticContact CG-CE2 3.44Å; F16-F63 HydrophobicContact CG-CE2 3.44Å; F16-F63 VanDerWaalsContact CG-CE2 3.44Å; F16-F63 AromaticContact CG-CZ 3.53Å; F16-F63 HydrophobicContact CG-CZ 3.53Å; F16-F63 HydrophobicContact CZ-CE2 4.4Å; F16-F63 HydrophobicContact CZ-CZ 4.42Å; F16-V65 HydrophobicContact CD1-CG1 4.42Å; F16-V65 HydrophobicContact CD1-CG2 3.97Å; F16-V65 HydrophobicContact CE1-CB 4.24Å; F16-V65 HydrophobicContact CE1-CG1 3.7Å; F16-V65 HydrophobicContact CE1-CG2 3.38Å; F16-V65 HydrophobicContact CZ-CG2 3.72Å; F16-M73 HydrophobicContact CE1-CE 3.79Å; F16-M73 HydrophobicContact CE1-SD 3.77Å; F16-M73 HydrophobicContact CZ-CE 3.96Å; F16-M73 HydrophobicContact CZ-SD 3.79Å; F16-L88 HydrophobicContact CE2-CD1 4.49Å
17	Y	45.9	Very low	44.9	Very low	72 Å²	72	74 Å²	74	28%	0.282	33%	0.328	S	S	.	.	H	α-helix	trans	-64.4	-47.4	179.6	-170.9	-93.1	0	0	0	110.7	K13 S14 Y19 C20 I21 D69 D72	K13-Y17 VanDerWaalsContact O-CB 3.27Å; K13-Y17 WeakPolarHBondContact O-CB 3.32Å; K13-Y17 PolarHBondContact O-N 3.22Å; S14-Y17 PolarHBondContact O-N 3.32Å; Y17-Y19 VanDerWaalsContact C-N 3.27Å; Y17-Y19 PolarHBondContact O-N 3.46Å; Y17-C20 PolarHBondContact O-N 2.94Å; Y17-I21 HydrophobicContact CD1-CB 4.49Å; Y17-I21 HydrophobicContact CD1-CG1 3.95Å; Y17-I21 HydrophobicContact CD2-CG1 4.28Å; Y17-I21 HydrophobicContact CE1-CB 4.39Å; Y17-I21 HydrophobicContact CE1-CD1 3.96Å; Y17-I21 HydrophobicContact CE1-CG1 3.7Å; Y17-I21 HydrophobicContact CE2-CD1 4.09Å; Y17-I21 HydrophobicContact CE2-CG1 4.07Å; Y17-I21 HydrophobicContact CG-CG1 4.24Å; Y17-I21 WeakPolarHBondContact O-CB 3.45Å; Y17-I21 VanDerWaalsContact O-CG1 3.31Å; Y17-I21 WeakPolarHBondContact O-CG1 3.23Å; Y17-I21 PolarHBondContact O-N 3.36Å; Y17-D69 HydrophobicContact CD2-CB 4.12Å; Y17-D69 HydrophobicContact CE2-CB 4.42Å; Y17-D72 HydrophobicContact CE2-CB 3.99Å; Y17-D72 WeakPolarHBondContact CE2-OD2 3.41Å; Y17-D72 PolarHBondContact OH-OD2 2.82Å
18	N	45.8	Very low	44.3	Very low	69 Å²	69	70.2 Å²	70.2	37%	0.369	31%	0.314	S	S	.	.	H	α-helix	trans	-63.8	-30.9	170.9	-68.4	-28.6	0	0	0	111	S14 Y22	S14-N18 WeakPolarHBondContact O-CB 3.31Å; S14-N18 PolarHBondContact O-N 3.1Å; S14-N18 PolarHBondContact O-ND2 3.23Å; S14-N18 VanDerWaalsContact O-ND2 3.11Å; S14-N18 PolarHBondContact OG-ND2 3.07Å; N18-Y22 CarbonylContact O-C 3.56Å; N18-Y22 WeakPolarHBondContact O-CA 3.45Å; N18-Y22 WeakPolarHBondContact O-CB 3.34Å; N18-Y22 PolarHBondContact O-N 2.75Å
19	Y	50.2	Low	43.7	Very low	12 Å²	12	68.9 Å²	68.9	5%	0.047	32%	0.324	C	S	.	.	H	α-helix	trans	-65.1	-54.4	172.3	169.6	-115.5	0	0	0	111.3	H15 F16 Y17 N23 Y52 I53 V56 L57	H15-Y19 WeakPolarHBondContact O-CA 3.47Å; H15-Y19 WeakPolarHBondContact O-CB 3.36Å; H15-Y19 PolarHBondContact O-N 3.08Å; F16-Y19 WeakPolarHBondContact O-CA 3.5Å; F16-Y19 WeakPolarHBondContact O-CB 3.37Å; F16-Y19 PolarHBondContact O-N 3.01Å; F16-Y19 VanDerWaalsContact O-N 3.09Å; Y17-Y19 VanDerWaalsContact C-N 3.27Å; Y17-Y19 PolarHBondContact O-N 3.46Å; Y19-N23 WeakPolarHBondContact CA-ND2 3.45Å; Y19-N23 HydrophobicContact CD2-CB 4.13Å; Y19-N23 WeakPolarHBondContact CD2-ND2 3.37Å; Y19-N23 HydrophobicContact CE2-CB 4.12Å; Y19-N23 WeakPolarHBondContact O-CA 3.17Å; Y19-N23 WeakPolarHBondContact O-CB 3.47Å; Y19-N23 PolarHBondContact O-N 2.84Å; Y19-N23 PolarHBondContact O-ND2 3.15Å; Y19-Y52 HydrophobicContact CE2-CD1 4.19Å; Y19-Y52 AromaticContact CE2-CE1 3.83Å; Y19-Y52 HydrophobicContact CE2-CE1 3.83Å; Y19-I53 VanDerWaalsContact OH-CA 3.26Å; Y19-I53 WeakPolarHBondContact OH-CA 3.35Å; Y19-I53 WeakPolarHBondContact OH-CG1 3.36Å; Y19-V56 HydrophobicContact CD1-CB 4.3Å; Y19-V56 HydrophobicContact CD1-CG1 4.19Å; Y19-V56 HydrophobicContact CD2-CB 3.25Å; Y19-V56 HydrophobicContact CD2-CG1 3.03Å; Y19-V56 HydrophobicContact CD2-CG2 3.53Å; Y19-V56 HydrophobicContact CE1-CB 4.31Å; Y19-V56 HydrophobicContact CE2-CB 3.26Å; Y19-V56 HydrophobicContact CE2-CG1 3.67Å; Y19-V56 HydrophobicContact CE2-CG2 3.26Å; Y19-V56 HydrophobicContact CG-CB 3.78Å; Y19-V56 HydrophobicContact CG-CG1 3.32Å; Y19-L57 HydrophobicContact CD1-CD2 3.64Å; Y19-L57 HydrophobicContact CD1-CG 4.32Å; Y19-L57 HydrophobicContact CE1-CD2 3.84Å; Y19-L57 HydrophobicContact CE1-CG 4.03Å
20	C	51	Low	43.1	Very low	3 Å²	3	69.7 Å²	69.7	2%	0.02	34%	0.337	C	S	.	.	H	α-helix	trans	-66.4	-49.8	-176.4	-63.9	0	0	0	0	111.1	F16 Y17 I24 M73	F16-C20 PolarHBondContact O-N 3.49Å; F16-C20 PolarHBondContact O-SG 3.37Å; Y17-C20 PolarHBondContact O-N 2.94Å; C20-I24 WeakPolarHBondContact O-CB 3.43Å; C20-I24 WeakPolarHBondContact O-CD1 3.45Å; C20-I24 WeakPolarHBondContact O-CG1 3.45Å; C20-I24 PolarHBondContact O-N 3.11Å; C20-I24 VanDerWaalsContact O-N 3.12Å; C20-M73 HydrophobicContact CB-CG 3.65Å; C20-M73 HydrophobicContact CB-SD 3.49Å; C20-M73 WeakPolarHBondContact CB-SD 3.04Å; C20-M73 PolarHBondContact SG-SD 2.78Å
21	I	42.7	Very low	42.2	Very low	16 Å²	16	71.2 Å²	71.2	8%	0.082	34%	0.343	C	S	.	.	H	α-helix	trans	-72.1	-51.6	-179.5	-60.2	-104.8	0	0	0	110.6	Y17 N23 Q25 D72	Y17-I21 HydrophobicContact CD1-CB 4.49Å; Y17-I21 HydrophobicContact CD1-CG1 3.95Å; Y17-I21 HydrophobicContact CD2-CG1 4.28Å; Y17-I21 HydrophobicContact CE1-CB 4.39Å; Y17-I21 HydrophobicContact CE1-CD1 3.96Å; Y17-I21 HydrophobicContact CE1-CG1 3.7Å; Y17-I21 HydrophobicContact CE2-CD1 4.09Å; Y17-I21 HydrophobicContact CE2-CG1 4.07Å; Y17-I21 HydrophobicContact CG-CG1 4.24Å; Y17-I21 WeakPolarHBondContact O-CB 3.45Å; Y17-I21 VanDerWaalsContact O-CG1 3.31Å; Y17-I21 WeakPolarHBondContact O-CG1 3.23Å; Y17-I21 PolarHBondContact O-N 3.36Å; I21-N23 VanDerWaalsContact C-N 3.33Å; I21-N23 PolarHBondContact O-N 3.38Å; I21-Q25 WeakPolarHBondContact O-CA 3.21Å; I21-Q25 WeakPolarHBondContact O-CB 3.28Å; I21-Q25 VanDerWaalsContact O-CG 3.31Å; I21-Q25 WeakPolarHBondContact O-CG 3.24Å; I21-Q25 PolarHBondContact O-N 3.13Å; I21-D72 HydrophobicContact CD1-CB 4.22Å
22	Y	42.6	Very low	41.6	Very low	151 Å²	151	70.6 Å²	70.6	59%	0.592	36%	0.355	S	S	*	.	H	α-helix	trans	-81.2	-1.8	-174.8	-124	-82	0	0	0	113.5	N18 G26	N18-Y22 CarbonylContact O-C 3.56Å; N18-Y22 WeakPolarHBondContact O-CA 3.45Å; N18-Y22 WeakPolarHBondContact O-CB 3.34Å; N18-Y22 PolarHBondContact O-N 2.75Å; Y22-G26 VanDerWaalsContact C-N 3.26Å; Y22-G26 CarbonylContact O-C 3.41Å; Y22-G26 VanDerWaalsContact O-C 3.32Å; Y22-G26 WeakPolarHBondContact O-CA 3.37Å; Y22-G26 PolarHBondContact O-N 2.85Å
23	N	46.7	Very low	41.1	Very low	45 Å²	45	77.6 Å²	77.6	24%	0.241	39%	0.393	C	S	.	.	H	α-helix	trans	-109	-24.6	165.9	-68.3	-87.3	0	0	0	113.8	Y19 I21 Q25 Y52	Y19-N23 WeakPolarHBondContact CA-ND2 3.45Å; Y19-N23 HydrophobicContact CD2-CB 4.13Å; Y19-N23 WeakPolarHBondContact CD2-ND2 3.37Å; Y19-N23 HydrophobicContact CE2-CB 4.12Å; Y19-N23 WeakPolarHBondContact O-CA 3.17Å; Y19-N23 WeakPolarHBondContact O-CB 3.47Å; Y19-N23 PolarHBondContact O-N 2.84Å; Y19-N23 PolarHBondContact O-ND2 3.15Å; I21-N23 VanDerWaalsContact C-N 3.33Å; I21-N23 PolarHBondContact O-N 3.38Å; N23-Q25 VanDerWaalsContact C-N 3.31Å; N23-Y52 HydrophobicContact CB-CE1 3.98Å; N23-Y52 PolarHBondContact OD1-OH 3.12Å
24	I	41.9	Very low	40.2	Very low	28 Å²	28	81.5 Å²	81.5	14%	0.144	41%	0.407	C	S	.	.	H	α-helix	trans	-69.3	-37	163.4	-65.3	168.1	0	0	0	109.3	C20 N76 L77 F84	C20-I24 WeakPolarHBondContact O-CB 3.43Å; C20-I24 WeakPolarHBondContact O-CD1 3.45Å; C20-I24 WeakPolarHBondContact O-CG1 3.45Å; C20-I24 PolarHBondContact O-N 3.11Å; C20-I24 VanDerWaalsContact O-N 3.12Å; I24-N76 VanDerWaalsContact CG2-O 3.27Å; I24-N76 WeakPolarHBondContact CG2-O 3.27Å; I24-L77 HydrophobicContact CD1-CD2 3.49Å; I24-L77 VanDerWaalsContact CD1-CD2 3.49Å; I24-L77 HydrophobicContact CD1-CG 4.05Å; I24-L77 HydrophobicContact CG1-CD2 4.31Å; I24-F84 HydrophobicContact CD1-CE2 4.17Å; I24-F84 HydrophobicContact CD1-CZ 4.42Å
25	Q	36.9	Very low	39.3	Very low	93 Å²	93	87.2 Å²	87.2	44%	0.435	43%	0.425	S	S	.	.	S	Bend	trans	-97.3	-43	176	-61.6	-179.5	-20.8	0	0	113.6	I21 N23 F28 N76	I21-Q25 WeakPolarHBondContact O-CA 3.21Å; I21-Q25 WeakPolarHBondContact O-CB 3.28Å; I21-Q25 VanDerWaalsContact O-CG 3.31Å; I21-Q25 WeakPolarHBondContact O-CG 3.24Å; I21-Q25 PolarHBondContact O-N 3.13Å; N23-Q25 VanDerWaalsContact C-N 3.31Å; Q25-F28 WeakPolarHBondContact O-CB 3.4Å; Q25-F28 PolarHBondContact O-N 3.36Å; Q25-F28 VanDerWaalsContact O-N 3.17Å; Q25-N76 PolarHBondContact NE2-OD1 2.87Å
26	G	37.8	Very low	38.6	Very low	17 Å²	17	90 Å²	90	18%	0.175	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	4.1	-158.2	0	0	0	0	0	117.7	Y22 F28	Y22-G26 VanDerWaalsContact C-N 3.26Å; Y22-G26 CarbonylContact O-C 3.41Å; Y22-G26 VanDerWaalsContact O-C 3.32Å; Y22-G26 WeakPolarHBondContact O-CA 3.37Å; Y22-G26 PolarHBondContact O-N 2.85Å; G26-F28 PolarHBondContact O-N 3.22Å
27	R	35.2	Very low	37.5	Very low	162 Å²	162	94.9 Å²	94.9	61%	0.611	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-2.7	154.2	-87.7	-168.9	176.3	-164.5	-5.2	112.8	Y52	R27-Y52 VanDerWaalsContact CZ-CE2 3.45Å; R27-Y52 PolarHBondContact NE-OH 3.12Å
28	F	31.9	Very low	36.6	Very low	79 Å²	79	94 Å²	94	35%	0.346	47%	0.474	S	S	.	.	S	Bend	trans	-103.7	-2.7	176.8	-69.9	-79.8	0	0	0	115.2	Q25 G26 L39 L43	Q25-F28 WeakPolarHBondContact O-CB 3.4Å; Q25-F28 PolarHBondContact O-N 3.36Å; Q25-F28 VanDerWaalsContact O-N 3.17Å; G26-F28 PolarHBondContact O-N 3.22Å; F28-L39 HydrophobicContact CD1-CD2 3.59Å; F28-L39 HydrophobicContact CD1-CG 4.11Å; F28-L39 HydrophobicContact CE1-CD2 4.25Å; F28-L39 HydrophobicContact CE1-CG 4.32Å; F28-L43 HydrophobicContact CD1-CD1 4.01Å; F28-L43 HydrophobicContact CD1-CD2 4.5Å; F28-L43 HydrophobicContact CD1-CG 4.25Å; F28-L43 HydrophobicContact CD2-CD2 4.1Å; F28-L43 HydrophobicContact CE1-CD1 3.61Å; F28-L43 HydrophobicContact CE1-CD2 3.74Å; F28-L43 HydrophobicContact CE1-CG 3.38Å; F28-L43 HydrophobicContact CE2-CD1 4.46Å; F28-L43 HydrophobicContact CE2-CD2 3.27Å; F28-L43 HydrophobicContact CE2-CG 3.95Å; F28-L43 HydrophobicContact CZ-CD1 3.9Å; F28-L43 HydrophobicContact CZ-CD2 3.06Å; F28-L43 HydrophobicContact CZ-CG 3.23Å
29	C	31.3	Very low	35.7	Very low	108 Å²	108	93.8 Å²	93.8	73%	0.73	47%	0.472	S	S	*	.	S	Bend	trans	-109.2	4.7	-174.3	-66.5	0	0	0	0	115.5
30	S	33.7	Very low	34.6	Very low	97 Å²	97	99.5 Å²	99.5	68%	0.678	50%	0.497	S	S	*	.	S	Bend	trans	-115.4	42	178.7	73.9	0	0	0	0	113.8
31	K	29.9	Very low	33.4	Very low	188 Å²	188	105.9 Å²	105.9	82%	0.817	53%	0.527	S	S	*	.			trans	-147.5	107.7	156.6	-71.6	-159.1	177.5	-176.5	0	110.9
32	P	35.2	Very low	32.7	Very low	118 Å²	118	109.6 Å²	109.6	77%	0.766	55%	0.547	S	S	*	.			trans	-71.2	137.9	173.9	29.5	-29.6	0	0	0	109.3
33	N	35	Very low	32.1	Very low	163 Å²	163	104.2 Å²	104.2	87%	0.872	53%	0.528	S	S	*	.			trans	80.1	41.2	165.2	-59.4	-23.9	0	0	0	120
34	Y	26.7	Very low	31.3	Very low	178 Å²	178	105.3 Å²	105.3	70%	0.698	54%	0.543	S	S	*	.	S	Bend	trans	-109.7	132	152.9	-128.6	-98.2	0	0	0	111	I36 T38	Y34-I36 PolarHBondContact O-N 2.9Å; Y34-T38 HydrophobicContact CE1-CG2 4.42Å
35	K	29.7	Very low	30.9	Very low	167 Å²	167	112.3 Å²	112.3	73%	0.726	57%	0.573	S	S	*	*			trans	-49.7	122.7	-177.5	-73.9	176.2	175.3	177.3	0	110	T37 T38	K35-T37 PolarHBondContact O-N 3.47Å; K35-T38 PolarHBondContact O-N 3.45Å
36	I	30	Very low	31.2	Very low	123 Å²	123	114 Å²	114	63%	0.631	58%	0.581	S	S	*	*	H	α-helix	trans	-46.9	-32.7	-175.2	-73.8	170.2	0	0	0	113.1	Y34 T38 L39 F40	Y34-I36 PolarHBondContact O-N 2.9Å; I36-T38 PolarHBondContact O-N 2.99Å; I36-L39 VanDerWaalsContact O-CB 3.29Å; I36-L39 WeakPolarHBondContact O-CB 3.33Å; I36-L39 PolarHBondContact O-N 2.94Å; I36-L39 VanDerWaalsContact O-N 3.16Å; I36-F40 HydrophobicContact CG2-CD2 3.77Å; I36-F40 HydrophobicContact CG2-CE2 3.41Å; I36-F40 VanDerWaalsContact CG2-CE2 3.41Å; I36-F40 VanDerWaalsContact O-CD2 3.29Å; I36-F40 WeakPolarHBondContact O-CD2 3.47Å; I36-F40 PolarHBondContact O-N 2.85Å
37	T	28.1	Very low	31.9	Very low	104 Å²	104	119.6 Å²	119.6	64%	0.638	61%	0.607	S	S	*	*	H	α-helix	trans	-63.1	-36.1	178.6	19.3	0	0	0	0	113.9	K35 L39	K35-T37 PolarHBondContact O-N 3.47Å; T37-L39 VanDerWaalsContact C-N 3.29Å; T37-L39 PolarHBondContact O-N 3.32Å
38	T	27.1	Very low	32.8	Very low	53 Å²	53	113.4 Å²	113.4	33%	0.325	59%	0.585	S	S	.	*	H	α-helix	trans	-78.4	-16.5	177	-31	0	0	0	0	112.3	Y34 K35 I36 N42	Y34-T38 HydrophobicContact CE1-CG2 4.42Å; K35-T38 PolarHBondContact O-N 3.45Å; I36-T38 PolarHBondContact O-N 2.99Å; T38-N42 PolarHBondContact O-ND2 3.12Å
39	L	25.8	Very low	34.1	Very low	65 Å²	65	112.3 Å²	112.3	34%	0.34	59%	0.588	S	S	.	*	H	α-helix	trans	-76.3	-41.2	177.2	-133.5	89.4	0	0	0	111.2	F28 I36 T37 E41 N42 L43	F28-L39 HydrophobicContact CD1-CD2 3.59Å; F28-L39 HydrophobicContact CD1-CG 4.11Å; F28-L39 HydrophobicContact CE1-CD2 4.25Å; F28-L39 HydrophobicContact CE1-CG 4.32Å; I36-L39 VanDerWaalsContact O-CB 3.29Å; I36-L39 WeakPolarHBondContact O-CB 3.33Å; I36-L39 PolarHBondContact O-N 2.94Å; I36-L39 VanDerWaalsContact O-N 3.16Å; T37-L39 VanDerWaalsContact C-N 3.29Å; T37-L39 PolarHBondContact O-N 3.32Å; L39-E41 VanDerWaalsContact C-N 3.34Å; L39-E41 PolarHBondContact O-N 3.29Å; L39-N42 PolarHBondContact O-N 3.47Å; L39-L43 PolarHBondContact O-N 3.48Å; L39-L43 VanDerWaalsContact O-N 3.12Å
40	F	26.7	Very low	35.7	Very low	131 Å²	131	113.5 Å²	113.5	58%	0.575	58%	0.576	S	S	*	*	H	α-helix	trans	-67	-33.9	177.8	-78.8	-68.8	0	0	0	112.7	I36 N42 L43	I36-F40 HydrophobicContact CG2-CD2 3.77Å; I36-F40 HydrophobicContact CG2-CE2 3.41Å; I36-F40 VanDerWaalsContact CG2-CE2 3.41Å; I36-F40 VanDerWaalsContact O-CD2 3.29Å; I36-F40 WeakPolarHBondContact O-CD2 3.47Å; I36-F40 PolarHBondContact O-N 2.85Å; F40-N42 VanDerWaalsContact C-N 3.26Å; F40-N42 PolarHBondContact O-N 2.97Å; F40-L43 HydrophobicContact CD1-CD1 4.4Å; F40-L43 PolarHBondContact O-N 2.92Å
41	E	26.6	Very low	37.3	Very low	137 Å²	137	112.9 Å²	112.9	64%	0.64	57%	0.572	S	S	*	*	H	α-helix	trans	-66.7	-25.5	175.7	-70.3	178.4	162.7	0	0	113.3	L39	L39-E41 VanDerWaalsContact C-N 3.34Å; L39-E41 PolarHBondContact O-N 3.29Å
42	N	27.2	Very low	38.8	Very low	94 Å²	94	106.1 Å²	106.1	50%	0.503	54%	0.542	S	S	.	.	H	α-helix	trans	-90.6	-31	178.6	-77	-55.6	0	0	0	113.4	T38 L39 F40 A44 K45	T38-N42 PolarHBondContact O-ND2 3.12Å; L39-N42 PolarHBondContact O-N 3.47Å; F40-N42 VanDerWaalsContact C-N 3.26Å; F40-N42 PolarHBondContact O-N 2.97Å; N42-A44 PolarHBondContact O-N 3.36Å; N42-K45 PolarHBondContact O-N 3.49Å
43	L	30.1	Very low	40.3	Very low	39 Å²	39	100.6 Å²	100.6	20%	0.204	51%	0.506	C	S	.	.	H	α-helix	trans	-62.8	-37.9	179.5	-99	157.1	0	0	0	113.7	F28 L39 F40 K45	F28-L43 HydrophobicContact CD1-CD1 4.01Å; F28-L43 HydrophobicContact CD1-CD2 4.5Å; F28-L43 HydrophobicContact CD1-CG 4.25Å; F28-L43 HydrophobicContact CD2-CD2 4.1Å; F28-L43 HydrophobicContact CE1-CD1 3.61Å; F28-L43 HydrophobicContact CE1-CD2 3.74Å; F28-L43 HydrophobicContact CE1-CG 3.38Å; F28-L43 HydrophobicContact CE2-CD1 4.46Å; F28-L43 HydrophobicContact CE2-CD2 3.27Å; F28-L43 HydrophobicContact CE2-CG 3.95Å; F28-L43 HydrophobicContact CZ-CD1 3.9Å; F28-L43 HydrophobicContact CZ-CD2 3.06Å; F28-L43 HydrophobicContact CZ-CG 3.23Å; L39-L43 PolarHBondContact O-N 3.48Å; L39-L43 VanDerWaalsContact O-N 3.12Å; F40-L43 HydrophobicContact CD1-CD1 4.4Å; F40-L43 PolarHBondContact O-N 2.92Å; L43-K45 PolarHBondContact O-N 3.48Å
44	A	30.7	Very low	41.8	Very low	67 Å²	67	95.3 Å²	95.3	55%	0.554	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-9.9	179.2	0	0	0	0	0	113.9	N42	N42-A44 PolarHBondContact O-N 3.36Å
45	K	34.4	Very low	43.7	Very low	175 Å²	175	90 Å²	90	76%	0.761	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.8	-6.5	-169.7	-68.9	-176.8	178.6	174.8	0	116.2	N42 L43 N47	N42-K45 PolarHBondContact O-N 3.49Å; L43-K45 PolarHBondContact O-N 3.48Å; K45-N47 PolarHBondContact O-N 2.94Å
46	Q	43.3	Very low	45.3	Very low	130 Å²	130	83.1 Å²	83.1	61%	0.607	44%	0.438	S	S	*	.			trans	-100.3	91.7	-175.3	-64	-165.6	12.4	0	0	112.4	I48	Q46-I48 PolarHBondContact O-N 2.99Å
47	N	50.8	Low	47.1	Very low	134 Å²	134	77.2 Å²	77.2	72%	0.717	41%	0.408	S	S	*	.			trans	-49.6	124.3	163.1	-82.7	-37.8	0	0	0	109.9	K45 S49	K45-N47 PolarHBondContact O-N 2.94Å; N47-S49 PolarHBondContact O-N 3.06Å
48	I	55.4	Low	49.2	Very low	32 Å²	32	75.5 Å²	75.5	16%	0.164	40%	0.401	C	S	.	.			trans	-60.2	108.4	169.6	-61.8	172.8	0	0	0	107.1	Q46 I53 F84	Q46-I48 PolarHBondContact O-N 2.99Å; I48-I53 HydrophobicContact CG2-CD1 3.73Å; I48-I53 HydrophobicContact CG2-CG1 3.74Å; I48-F84 HydrophobicContact CD1-CB 4.43Å; I48-F84 HydrophobicContact CD1-CD2 3.81Å
49	S	59.8	Low	51.3	Low	56 Å²	56	77.5 Å²	77.5	39%	0.392	42%	0.415	S	S	.	.			trans	-72.4	147.5	-174.9	82.2	0	0	0	0	111.5	N47 S51 Y52 I53	N47-S49 PolarHBondContact O-N 3.06Å; S49-S51 PolarHBondContact O-N 2.86Å; S49-S51 PolarHBondContact OG-OG 3.09Å; S49-Y52 WeakPolarHBondContact O-CB 3.35Å; S49-Y52 PolarHBondContact O-N 3.31Å; S49-Y52 PolarHBondContact OG-N 2.93Å; S49-I53 PolarHBondContact O-N 2.92Å
50	R	64.4	Low	53.1	Low	132 Å²	132	74.6 Å²	74.6	50%	0.498	40%	0.399	S	S	.	.	H	α-helix	trans	-54.9	-37.8	173.2	-177.4	177.6	175.7	-178.5	-4.7	112.7	Y52 I53 N54 Y94	R50-Y52 PolarHBondContact O-N 3.42Å; R50-I53 PolarHBondContact O-N 3.41Å; R50-N54 PolarHBondContact O-N 2.84Å; R50-N54 VanDerWaalsContact O-N 3.08Å; R50-Y94 VanDerWaalsContact NH2-CZ 3.31Å
51	S	66.4	Low	55.3	Low	85 Å²	85	69.8 Å²	69.8	59%	0.594	39%	0.386	S	S	*	.	H	α-helix	trans	-61.5	-36	178.2	80.8	0	0	0	0	111.9	S49 N54 S55	S49-S51 PolarHBondContact O-N 2.86Å; S49-S51 PolarHBondContact OG-OG 3.09Å; S51-N54 PolarHBondContact O-N 3.28Å; S51-S55 PolarHBondContact O-N 3.44Å
52	Y	62.1	Low	58.1	Low	45 Å²	45	66 Å²	66	18%	0.176	37%	0.37	C	S	.	.	H	α-helix	trans	-69.6	-48.5	-178.7	-165.8	-114	0	0	0	111.4	Y19 N23 R27 S49 R50 N54 S55 V56	Y19-Y52 HydrophobicContact CE2-CD1 4.19Å; Y19-Y52 AromaticContact CE2-CE1 3.83Å; Y19-Y52 HydrophobicContact CE2-CE1 3.83Å; N23-Y52 HydrophobicContact CB-CE1 3.98Å; N23-Y52 PolarHBondContact OD1-OH 3.12Å; R27-Y52 VanDerWaalsContact CZ-CE2 3.45Å; R27-Y52 PolarHBondContact NE-OH 3.12Å; S49-Y52 WeakPolarHBondContact O-CB 3.35Å; S49-Y52 PolarHBondContact O-N 3.31Å; S49-Y52 PolarHBondContact OG-N 2.93Å; R50-Y52 PolarHBondContact O-N 3.42Å; Y52-N54 VanDerWaalsContact C-N 3.29Å; Y52-N54 PolarHBondContact O-N 3.41Å; Y52-S55 PolarHBondContact O-N 3.16Å; Y52-S55 VanDerWaalsContact O-N 3.11Å; Y52-S55 PolarHBondContact O-OG 3.41Å; Y52-V56 PolarHBondContact O-N 2.8Å
53	I	65.2	Low	60.7	Low	3 Å²	3	62.1 Å²	62.1	2%	0.015	35%	0.349	C	S	.	.	H	α-helix	trans	-55.6	-45.5	174.8	-68.4	167.4	0	0	0	111.1	Y19 I48 S49 R50 S55 V56 L57 C87 Y91	Y19-I53 VanDerWaalsContact OH-CA 3.26Å; Y19-I53 WeakPolarHBondContact OH-CA 3.35Å; Y19-I53 WeakPolarHBondContact OH-CG1 3.36Å; I48-I53 HydrophobicContact CG2-CD1 3.73Å; I48-I53 HydrophobicContact CG2-CG1 3.74Å; S49-I53 PolarHBondContact O-N 2.92Å; R50-I53 PolarHBondContact O-N 3.41Å; I53-S55 PolarHBondContact O-N 3.13Å; I53-V56 PolarHBondContact O-N 3.22Å; I53-L57 HydrophobicContact CG2-CD1 3.51Å; I53-L57 HydrophobicContact CG2-CG 4.14Å; I53-L57 WeakPolarHBondContact O-CB 3.18Å; I53-L57 WeakPolarHBondContact O-CG 3.4Å; I53-L57 PolarHBondContact O-N 3.35Å; I53-C87 HydrophobicContact CD1-CB 3.29Å; I53-Y91 HydrophobicContact CG2-CD2 4.01Å; I53-Y91 HydrophobicContact CG2-CG 4.11Å
54	N	67.9	Low	63.2	Low	52 Å²	52	64.4 Å²	64.4	28%	0.278	37%	0.365	S	S	.	.	H	α-helix	trans	-59.3	-46.7	175.9	-80.2	-18	0	0	0	112.6	R50 S51 Y52 V56 S58 Y91	R50-N54 PolarHBondContact O-N 2.84Å; R50-N54 VanDerWaalsContact O-N 3.08Å; S51-N54 PolarHBondContact O-N 3.28Å; Y52-N54 VanDerWaalsContact C-N 3.29Å; Y52-N54 PolarHBondContact O-N 3.41Å; N54-V56 PolarHBondContact O-N 2.74Å; N54-S58 WeakPolarHBondContact O-CB 3.39Å; N54-S58 PolarHBondContact O-N 3.37Å; N54-S58 PolarHBondContact O-OG 3.27Å; N54-Y91 WeakPolarHBondContact OD1-CD2 3.46Å
55	S	66	Low	65.6	Low	65 Å²	65	61.7 Å²	61.7	46%	0.455	34%	0.342	S	S	.	.	H	α-helix	trans	-60.6	-29	-176	70.4	0	0	0	0	113.5	S51 Y52 I53	S51-S55 PolarHBondContact O-N 3.44Å; Y52-S55 PolarHBondContact O-N 3.16Å; Y52-S55 VanDerWaalsContact O-N 3.11Å; Y52-S55 PolarHBondContact O-OG 3.41Å; I53-S55 PolarHBondContact O-N 3.13Å
56	V	62.3	Low	67.9	Low	23 Å²	23	55.1 Å²	55.1	14%	0.139	32%	0.317	C	S	.	.	H	α-helix	trans	-103.1	-30.6	-176	-165.7	0	0	0	0	114.1	Y19 Y52 I53 N54 P59	Y19-V56 HydrophobicContact CD1-CB 4.3Å; Y19-V56 HydrophobicContact CD1-CG1 4.19Å; Y19-V56 HydrophobicContact CD2-CB 3.25Å; Y19-V56 HydrophobicContact CD2-CG1 3.03Å; Y19-V56 HydrophobicContact CD2-CG2 3.53Å; Y19-V56 HydrophobicContact CE1-CB 4.31Å; Y19-V56 HydrophobicContact CE2-CB 3.26Å; Y19-V56 HydrophobicContact CE2-CG1 3.67Å; Y19-V56 HydrophobicContact CE2-CG2 3.26Å; Y19-V56 HydrophobicContact CG-CB 3.78Å; Y19-V56 HydrophobicContact CG-CG1 3.32Å; Y52-V56 PolarHBondContact O-N 2.8Å; I53-V56 PolarHBondContact O-N 3.22Å; N54-V56 PolarHBondContact O-N 2.74Å; V56-P59 VanDerWaalsContact O-CD 3.31Å; V56-P59 WeakPolarHBondContact O-CD 3.26Å
57	L	69.3	Low	69.8	Low	0 Å²	0	52.5 Å²	52.5	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-81.1	-29.6	176	-62.7	-175.3	0	0	0	112.2	F16 Y19 I53 P59 L60 L88 Y91	F16-L57 HydrophobicContact CD2-CD2 3.59Å; F16-L57 HydrophobicContact CE2-CD2 3.72Å; Y19-L57 HydrophobicContact CD1-CD2 3.64Å; Y19-L57 HydrophobicContact CD1-CG 4.32Å; Y19-L57 HydrophobicContact CE1-CD2 3.84Å; Y19-L57 HydrophobicContact CE1-CG 4.03Å; I53-L57 HydrophobicContact CG2-CD1 3.51Å; I53-L57 HydrophobicContact CG2-CG 4.14Å; I53-L57 WeakPolarHBondContact O-CB 3.18Å; I53-L57 WeakPolarHBondContact O-CG 3.4Å; I53-L57 PolarHBondContact O-N 3.35Å; L57-P59 VanDerWaalsContact C-CD 3.46Å; L57-L60 HydrophobicContact CD2-CD1 3.83Å; L57-L60 VanDerWaalsContact O-CB 3.31Å; L57-L60 WeakPolarHBondContact O-CB 3.48Å; L57-L60 PolarHBondContact O-N 3.02Å; L57-L88 HydrophobicContact CD1-CD1 3.49Å; L57-L88 VanDerWaalsContact CD1-CD1 3.49Å; L57-Y91 HydrophobicContact CB-CD1 4.16Å; L57-Y91 HydrophobicContact CB-CD2 4.16Å; L57-Y91 HydrophobicContact CB-CE1 3.57Å; L57-Y91 HydrophobicContact CB-CE2 3.59Å; L57-Y91 HydrophobicContact CB-CG 4.45Å; L57-Y91 WeakPolarHBondContact CB-OH 3.17Å; L57-Y91 HydrophobicContact CD1-CD1 3.51Å; L57-Y91 HydrophobicContact CD1-CD2 4.08Å; L57-Y91 HydrophobicContact CD1-CE1 3.77Å; L57-Y91 HydrophobicContact CD1-CE2 4.33Å; L57-Y91 HydrophobicContact CD1-CG 3.71Å; L57-Y91 HydrophobicContact CG-CE1 4.33Å; L57-Y91 PolarHBondContact O-OH 2.93Å
58	S	71.9	Confident	71.1	Confident	68 Å²	68	49.2 Å²	49.2	48%	0.476	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-55.6	-38.7	-178.7	55.8	0	0	0	0	115.1	N54 L60 Y91	N54-S58 WeakPolarHBondContact O-CB 3.39Å; N54-S58 PolarHBondContact O-N 3.37Å; N54-S58 PolarHBondContact O-OG 3.27Å; S58-L60 PolarHBondContact O-N 3.46Å; S58-Y91 WeakPolarHBondContact CA-OH 3.4Å; S58-Y91 PolarHBondContact N-OH 2.86Å
59	P	70	Confident	72.1	Confident	95 Å²	95	48.2 Å²	48.2	62%	0.617	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-70.3	-18.9	176.5	-18.3	34.5	0	0	0	113.8	V56 L57	V56-P59 VanDerWaalsContact O-CD 3.31Å; V56-P59 WeakPolarHBondContact O-CD 3.26Å; L57-P59 VanDerWaalsContact C-CD 3.46Å
60	L	64.6	Low	73.2	Confident	4 Å²	4	45.6 Å²	45.6	2%	0.021	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-78	-28.4	-176.8	-61	177.7	0	0	0	112.5	Q12 H15 F16 L57 S58 F63	Q12-L60 HydrophobicContact CB-CD2 4.49Å; Q12-L60 PolarHBondContact NE2-O 2.91Å; H15-L60 HydrophobicContact CB-CD2 3.68Å; H15-L60 WeakPolarHBondContact ND1-CD2 3.29Å; F16-L60 HydrophobicContact CB-CD1 3.78Å; F16-L60 HydrophobicContact CD2-CD1 4.01Å; F16-L60 HydrophobicContact CG-CD1 4.4Å; L57-L60 HydrophobicContact CD2-CD1 3.83Å; L57-L60 VanDerWaalsContact O-CB 3.31Å; L57-L60 WeakPolarHBondContact O-CB 3.48Å; L57-L60 PolarHBondContact O-N 3.02Å; S58-L60 PolarHBondContact O-N 3.46Å; L60-F63 HydrophobicContact CB-CD1 4.12Å; L60-F63 HydrophobicContact CB-CE1 3.74Å; L60-F63 HydrophobicContact CD1-CE1 4.04Å; L60-F63 HydrophobicContact CD1-CZ 4.13Å
61	G	73.8	Confident	74	Confident	29 Å²	29	45.5 Å²	45.5	30%	0.299	27%	0.274	S	S	.	.			trans	65.9	-154	-170.4	0	0	0	0	0	112.2	F63	G61-F63 VanDerWaalsContact O-CD1 3.28Å; G61-F63 WeakPolarHBondContact O-CD1 3.42Å; G61-F63 WeakPolarHBondContact O-CE1 3.44Å
62	D	84.4	Confident	74.4	Confident	57 Å²	57	44 Å²	44	31%	0.305	26%	0.259	S	S	.	.	S	Bend	trans	-92.6	135.3	179.3	-167.6	27.6	0	0	0	112.3	C97 P98 E99 L100	D62-C97 HydrophobicContact CB-CB 4.18Å; D62-C97 WeakPolarHBondContact OD1-CA 3.44Å; D62-C97 VanDerWaalsContact OD1-CB 3.29Å; D62-C97 WeakPolarHBondContact OD1-CB 3.2Å; D62-P98 WeakPolarHBondContact OD2-CD 3.42Å; D62-P98 VanDerWaalsContact OD2-CG 3.29Å; D62-P98 WeakPolarHBondContact OD2-CG 3.36Å; D62-E99 PolarHBondContact OD1-N 3.2Å; D62-E99 WeakPolarHBondContact OD2-CB 3.38Å; D62-E99 WeakPolarHBondContact OD2-CG 3.43Å; D62-E99 PolarHBondContact OD2-N 2.99Å; D62-L100 WeakPolarHBondContact OD1-CB 3.34Å; D62-L100 PolarHBondContact OD1-N 2.88Å
63	F	82.1	Confident	75.1	Confident	13 Å²	13	41.9 Å²	41.9	6%	0.057	25%	0.251	C	S	.	.			trans	-161.7	163.9	-174.8	61.8	-81.4	0	0	0	110.9	F16 L60 G61 V65 E99 L100	F16-F63 HydrophobicContact CB-CE2 3.78Å; F16-F63 HydrophobicContact CB-CZ 3.89Å; F16-F63 AromaticContact CD1-CE2 3.78Å; F16-F63 HydrophobicContact CD1-CE2 3.78Å; F16-F63 HydrophobicContact CD1-CZ 4.26Å; F16-F63 HydrophobicContact CD2-CE1 4.4Å; F16-F63 AromaticContact CD2-CE2 3.68Å; F16-F63 HydrophobicContact CD2-CE2 3.68Å; F16-F63 AromaticContact CD2-CZ 3.26Å; F16-F63 HydrophobicContact CD2-CZ 3.26Å; F16-F63 HydrophobicContact CE1-CE2 4.26Å; F16-F63 HydrophobicContact CE2-CE2 4.13Å; F16-F63 AromaticContact CE2-CZ 3.74Å; F16-F63 HydrophobicContact CE2-CZ 3.74Å; F16-F63 AromaticContact CG-CE2 3.44Å; F16-F63 HydrophobicContact CG-CE2 3.44Å; F16-F63 VanDerWaalsContact CG-CE2 3.44Å; F16-F63 AromaticContact CG-CZ 3.53Å; F16-F63 HydrophobicContact CG-CZ 3.53Å; F16-F63 HydrophobicContact CZ-CE2 4.4Å; F16-F63 HydrophobicContact CZ-CZ 4.42Å; L60-F63 HydrophobicContact CB-CD1 4.12Å; L60-F63 HydrophobicContact CB-CE1 3.74Å; L60-F63 HydrophobicContact CD1-CE1 4.04Å; L60-F63 HydrophobicContact CD1-CZ 4.13Å; G61-F63 VanDerWaalsContact O-CD1 3.28Å; G61-F63 WeakPolarHBondContact O-CD1 3.42Å; G61-F63 WeakPolarHBondContact O-CE1 3.44Å; F63-V65 HydrophobicContact CD2-CG2 4.23Å; F63-V65 HydrophobicContact CE2-CG2 3.67Å; F63-E99 CarbonylContact O-C 3.52Å; F63-L100 HydrophobicContact CE1-CD1 4.48Å; F63-L100 HydrophobicContact CE1-CD2 4.07Å; F63-L100 HydrophobicContact CE2-CD1 3.92Å; F63-L100 HydrophobicContact CZ-CD1 3.86Å; F63-L100 HydrophobicContact CZ-CD2 4.04Å; F63-L100 WeakPolarHBondContact O-CA 3.44Å; F63-L100 VanDerWaalsContact O-CB 3.3Å; F63-L100 WeakPolarHBondContact O-CB 3.39Å; F63-L100 PolarHBondContact O-N 2.9Å
64	T	82.5	Confident	75.6	Confident	87 Å²	87	43.3 Å²	43.3	53%	0.534	26%	0.258	S	S	.	.			trans	-95.3	145.1	174.8	55.4	0	0	0	0	112	E99	T64-E99 HydrophobicContact CG2-CB 3.91Å; T64-E99 WeakPolarHBondContact CG2-OE2 3.45Å
65	V	80.6	Confident	75.9	Confident	11 Å²	11	46.8 Å²	46.8	7%	0.067	28%	0.277	C	S	.	.			trans	-104.9	132.3	174.1	-175.8	0	0	0	0	109.6	F16 F63 D69 C70 M73 L100 S103 L104	F16-V65 HydrophobicContact CD1-CG1 4.42Å; F16-V65 HydrophobicContact CD1-CG2 3.97Å; F16-V65 HydrophobicContact CE1-CB 4.24Å; F16-V65 HydrophobicContact CE1-CG1 3.7Å; F16-V65 HydrophobicContact CE1-CG2 3.38Å; F16-V65 HydrophobicContact CZ-CG2 3.72Å; F63-V65 HydrophobicContact CD2-CG2 4.23Å; F63-V65 HydrophobicContact CE2-CG2 3.67Å; V65-D69 HydrophobicContact CG1-CB 3.74Å; V65-C70 WeakPolarHBondContact CG1-SG 3.32Å; V65-M73 HydrophobicContact CG1-CE 3.93Å; V65-L100 HydrophobicContact CG2-CD1 3.4Å; V65-L100 VanDerWaalsContact CG2-CD1 3.4Å; V65-S103 PolarHBondContact N-OG 3.33Å; V65-S103 VanDerWaalsContact N-OG 3.08Å; V65-L104 HydrophobicContact CG2-CD2 4.39Å
66	S	82	Confident	76.1	Confident	36 Å²	36	46.5 Å²	46.5	25%	0.252	27%	0.27	S	S	.	.			trans	-70.6	152.2	175	22.9	0	0	0	0	112.1	K13 S68 D69 C70	K13-S66 PolarHBondContact NZ-OG 2.83Å; S66-S68 WeakPolarHBondContact CB-OG 3.16Å; S66-S68 PolarHBondContact O-N 2.87Å; S66-S68 PolarHBondContact OG-OG 3.1Å; S66-D69 PolarHBondContact O-N 3.22Å; S66-D69 PolarHBondContact OG-OD1 2.9Å; S66-D69 PolarHBondContact OG-OD2 3.01Å; S66-D69 VanDerWaalsContact OG-OD2 3.05Å; S66-C70 PolarHBondContact O-N 3.15Å
67	V	84.4	Confident	76.4	Confident	76 Å²	76	46.8 Å²	46.8	46%	0.461	27%	0.271	S	S	.	.	H	α-helix	trans	-57	-36.5	173.8	176.1	0	0	0	0	111.5	C70 R71 Y107	V67-C70 PolarHBondContact O-N 3.1Å; V67-R71 WeakPolarHBondContact O-CG 3.43Å; V67-R71 PolarHBondContact O-N 2.85Å; V67-Y107 HydrophobicContact CG1-CD2 4.29Å
68	S	78.3	Confident	76.2	Confident	64 Å²	64	51.4 Å²	51.4	45%	0.448	29%	0.292	S	S	.	.	H	α-helix	trans	-57.1	-50.4	173	53.6	0	0	0	0	111.6	S66 C70 R71 D72	S66-S68 WeakPolarHBondContact CB-OG 3.16Å; S66-S68 PolarHBondContact O-N 2.87Å; S66-S68 PolarHBondContact OG-OG 3.1Å; S68-C70 VanDerWaalsContact C-N 3.3Å; S68-C70 PolarHBondContact O-N 3.29Å; S68-R71 WeakPolarHBondContact O-CB 3.44Å; S68-R71 PolarHBondContact O-N 2.89Å; S68-R71 VanDerWaalsContact O-N 3.13Å; S68-D72 VanDerWaalsContact O-CG 3.3Å; S68-D72 PolarHBondContact O-N 3.13Å
69	D	76.5	Confident	75.7	Confident	11 Å²	11	53 Å²	53	6%	0.059	30%	0.304	C	S	.	.	H	α-helix	trans	-66.5	-37.6	-176.5	-56.3	15.1	0	0	0	110.2	K13 Y17 V65 S66 D72 M73	K13-D69 WeakPolarHBondContact CE-OD2 3.49Å; K13-D69 IonicContact NZ-OD1 3.68Å; K13-D69 IonicContact NZ-OD2 3.32Å; Y17-D69 HydrophobicContact CD2-CB 4.12Å; Y17-D69 HydrophobicContact CE2-CB 4.42Å; V65-D69 HydrophobicContact CG1-CB 3.74Å; S66-D69 PolarHBondContact O-N 3.22Å; S66-D69 PolarHBondContact OG-OD1 2.9Å; S66-D69 PolarHBondContact OG-OD2 3.01Å; S66-D69 VanDerWaalsContact OG-OD2 3.05Å; D69-D72 PolarHBondContact O-N 3.22Å; D69-M73 WeakPolarHBondContact O-CB 3.44Å; D69-M73 VanDerWaalsContact O-CG 3.26Å; D69-M73 WeakPolarHBondContact O-CG 3.01Å; D69-M73 PolarHBondContact O-N 2.8Å
70	C	81.5	Confident	75.1	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.007	29%	0.294	C	S	.	.	H	α-helix	trans	-63.2	-42.7	172.9	-72.5	0	0	0	0	113	V65 S66 V67 S68 M73 N74 W85 Y107	V65-C70 WeakPolarHBondContact CG1-SG 3.32Å; S66-C70 PolarHBondContact O-N 3.15Å; V67-C70 PolarHBondContact O-N 3.1Å; S68-C70 VanDerWaalsContact C-N 3.3Å; S68-C70 PolarHBondContact O-N 3.29Å; C70-M73 HydrophobicContact CB-CE 4.3Å; C70-M73 PolarHBondContact O-N 2.85Å; C70-N74 WeakPolarHBondContact O-CB 3.19Å; C70-N74 PolarHBondContact O-N 2.78Å; C70-W85 HydrophobicContact CB-CH2 4.48Å; C70-Y107 HydrophobicContact CB-CD1 3.5Å; C70-Y107 VanDerWaalsContact CB-CD1 3.5Å; C70-Y107 HydrophobicContact CB-CD2 3.36Å; C70-Y107 HydrophobicContact CB-CE1 3.68Å; C70-Y107 HydrophobicContact CB-CE2 3.58Å; C70-Y107 HydrophobicContact CB-CG 3.32Å
71	R	82.1	Confident	75.2	Confident	130 Å²	130	53 Å²	53	49%	0.491	30%	0.3	S	S	.	.	H	α-helix	trans	-64.6	-43	175.1	-74.8	179.9	178.8	167.2	0.1	111.5	V67 S68 M73 N74 N75 Y107 H111	V67-R71 WeakPolarHBondContact O-CG 3.43Å; V67-R71 PolarHBondContact O-N 2.85Å; S68-R71 WeakPolarHBondContact O-CB 3.44Å; S68-R71 PolarHBondContact O-N 2.89Å; S68-R71 VanDerWaalsContact O-N 3.13Å; R71-M73 VanDerWaalsContact C-N 3.33Å; R71-M73 PolarHBondContact O-N 2.79Å; R71-N74 PolarHBondContact O-N 2.73Å; R71-N74 VanDerWaalsContact O-N 3.16Å; R71-N75 WeakPolarHBondContact O-CB 3.47Å; R71-N75 VanDerWaalsContact O-CG 3.22Å; R71-N75 PolarHBondContact O-N 2.82Å; R71-N75 PolarHBondContact O-ND2 3.01Å; R71-Y107 HydrophobicContact CG-CE2 3.81Å; R71-H111 PolarHBondContact NE-NE2 2.78Å; R71-H111 PolarHBondContact NH2-NE2 2.6Å
72	D	75.5	Confident	74.9	Confident	53 Å²	53	57.6 Å²	57.6	28%	0.283	32%	0.317	S	S	.	.	H	α-helix	trans	-60	-45.8	176	-70.9	-7	0	0	0	110.3	Y17 I21 S68 D69 N74 N75 N76	Y17-D72 HydrophobicContact CE2-CB 3.99Å; Y17-D72 WeakPolarHBondContact CE2-OD2 3.41Å; Y17-D72 PolarHBondContact OH-OD2 2.82Å; I21-D72 HydrophobicContact CD1-CB 4.22Å; S68-D72 VanDerWaalsContact O-CG 3.3Å; S68-D72 PolarHBondContact O-N 3.13Å; D69-D72 PolarHBondContact O-N 3.22Å; D72-N74 PolarHBondContact O-N 2.92Å; D72-N75 PolarHBondContact O-N 3.21Å; D72-N76 WeakPolarHBondContact O-CB 3.39Å; D72-N76 PolarHBondContact O-N 2.95Å; D72-N76 PolarHBondContact O-ND2 3.42Å
73	M	75.6	Confident	74.3	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.01	31%	0.314	C	S	.	.	H	α-helix	trans	-57.1	-49.2	172.7	-72.9	-172.3	-66.2	0	0	111.3	F16 C20 V65 D69 C70 R71 N75 N76 L77 F84 W85	F16-M73 HydrophobicContact CE1-CE 3.79Å; F16-M73 HydrophobicContact CE1-SD 3.77Å; F16-M73 HydrophobicContact CZ-CE 3.96Å; F16-M73 HydrophobicContact CZ-SD 3.79Å; C20-M73 HydrophobicContact CB-CG 3.65Å; C20-M73 HydrophobicContact CB-SD 3.49Å; C20-M73 WeakPolarHBondContact CB-SD 3.04Å; C20-M73 PolarHBondContact SG-SD 2.78Å; V65-M73 HydrophobicContact CG1-CE 3.93Å; D69-M73 WeakPolarHBondContact O-CB 3.44Å; D69-M73 VanDerWaalsContact O-CG 3.26Å; D69-M73 WeakPolarHBondContact O-CG 3.01Å; D69-M73 PolarHBondContact O-N 2.8Å; C70-M73 HydrophobicContact CB-CE 4.3Å; C70-M73 PolarHBondContact O-N 2.85Å; R71-M73 VanDerWaalsContact C-N 3.33Å; R71-M73 PolarHBondContact O-N 2.79Å; M73-N75 PolarHBondContact O-N 2.84Å; M73-N76 PolarHBondContact O-N 3.39Å; M73-L77 VanDerWaalsContact O-CG 3.26Å; M73-L77 WeakPolarHBondContact O-CG 3.3Å; M73-L77 PolarHBondContact O-N 2.75Å; M73-L77 VanDerWaalsContact O-N 3.07Å; M73-F84 HydrophobicContact SD-CE1 4.5Å; M73-F84 HydrophobicContact SD-CZ 4.19Å; M73-W85 HydrophobicContact CE-CH2 4.3Å
74	N	76.5	Confident	74.2	Confident	32 Å²	32	56.1 Å²	56.1	17%	0.171	31%	0.312	C	S	.	.	H	α-helix	trans	-61.1	-43.9	-178	-157.8	53.1	0	0	0	112.5	C70 R71 D72 N76 L77 W85 Y107 E114	C70-N74 WeakPolarHBondContact O-CB 3.19Å; C70-N74 PolarHBondContact O-N 2.78Å; R71-N74 PolarHBondContact O-N 2.73Å; R71-N74 VanDerWaalsContact O-N 3.16Å; D72-N74 PolarHBondContact O-N 2.92Å; N74-N76 VanDerWaalsContact C-N 3.31Å; N74-N76 PolarHBondContact O-N 2.87Å; N74-L77 PolarHBondContact O-N 3.19Å; N74-W85 HydrophobicContact CB-CZ2 4.04Å; N74-W85 PolarHBondContact OD1-NE1 2.85Å; N74-Y107 WeakPolarHBondContact CB-OH 3.31Å; N74-E114 PolarHBondContact ND2-OE2 3.31Å
75	N	74.8	Confident	74.3	Confident	125 Å²	125	52.6 Å²	52.6	67%	0.668	29%	0.289	S	S	*	.	H	α-helix	trans	-68.5	-28.4	179.5	-69.7	-20.6	0	0	0	113	R71 D72 M73	R71-N75 WeakPolarHBondContact O-CB 3.47Å; R71-N75 VanDerWaalsContact O-CG 3.22Å; R71-N75 PolarHBondContact O-N 2.82Å; R71-N75 PolarHBondContact O-ND2 3.01Å; D72-N75 PolarHBondContact O-N 3.21Å; M73-N75 PolarHBondContact O-N 2.84Å
76	N	69.4	Low	74.6	Confident	59 Å²	59	52.5 Å²	52.5	32%	0.316	29%	0.289	S	S	.	.	H	α-helix	trans	-90.9	-10	179.7	-76.1	-80.3	0	0	0	113.5	I24 Q25 D72 M73 N74 H78	I24-N76 VanDerWaalsContact CG2-O 3.27Å; I24-N76 WeakPolarHBondContact CG2-O 3.27Å; Q25-N76 PolarHBondContact NE2-OD1 2.87Å; D72-N76 WeakPolarHBondContact O-CB 3.39Å; D72-N76 PolarHBondContact O-N 2.95Å; D72-N76 PolarHBondContact O-ND2 3.42Å; M73-N76 PolarHBondContact O-N 3.39Å; N74-N76 VanDerWaalsContact C-N 3.31Å; N74-N76 PolarHBondContact O-N 2.87Å; N76-H78 PolarHBondContact O-N 2.87Å
77	L	68.6	Low	74.5	Confident	29 Å²	29	52.3 Å²	52.3	15%	0.152	29%	0.287	C	S	.	.	S	Bend	trans	-71.7	123.3	176.4	-78.4	164.2	0	0	0	110.4	I24 M73 N74 H81 F84 W85	I24-L77 HydrophobicContact CD1-CD2 3.49Å; I24-L77 VanDerWaalsContact CD1-CD2 3.49Å; I24-L77 HydrophobicContact CD1-CG 4.05Å; I24-L77 HydrophobicContact CG1-CD2 4.31Å; M73-L77 VanDerWaalsContact O-CG 3.26Å; M73-L77 WeakPolarHBondContact O-CG 3.3Å; M73-L77 PolarHBondContact O-N 2.75Å; M73-L77 VanDerWaalsContact O-N 3.07Å; N74-L77 PolarHBondContact O-N 3.19Å; L77-H81 HydrophobicContact CD2-CB 4.13Å; L77-F84 HydrophobicContact CD1-CB 4.39Å; L77-F84 HydrophobicContact CD1-CD1 3.43Å; L77-F84 VanDerWaalsContact CD1-CD1 3.43Å; L77-F84 HydrophobicContact CD1-CE1 3.92Å; L77-F84 HydrophobicContact CD1-CG 4.07Å; L77-F84 HydrophobicContact CD2-CB 3.73Å; L77-F84 HydrophobicContact CD2-CD1 3.75Å; L77-F84 HydrophobicContact CD2-CD2 3.99Å; L77-F84 HydrophobicContact CD2-CE1 4.33Å; L77-F84 HydrophobicContact CD2-CG 3.53Å; L77-F84 HydrophobicContact CG-CD1 4.18Å; L77-F84 HydrophobicContact CG-CG 4.45Å; L77-W85 HydrophobicContact CD1-CZ2 4.3Å
78	H	65.1	Low	74.5	Confident	97 Å²	97	48.9 Å²	48.9	45%	0.449	27%	0.266	S	S	.	.			trans	-66.5	144.7	172	-173.9	-81.8	0	0	0	110.3	N76 T80 H81	N76-H78 PolarHBondContact O-N 2.87Å; H78-T80 PolarHBondContact ND1-N 3.22Å; H78-T80 PolarHBondContact ND1-OG1 2.72Å; H78-T80 PolarHBondContact O-N 2.96Å; H78-H81 PolarHBondContact O-N 3.13Å
79	S	61.3	Low	75	Confident	102 Å²	102	45.9 Å²	45.9	71%	0.713	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-20.7	-171.4	57.4	0	0	0	0	114.9
80	T	58.1	Low	75.5	Confident	67 Å²	67	47.6 Å²	47.6	41%	0.411	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-12.8	177.5	54.1	0	0	0	0	114.2	H78 L82	H78-T80 PolarHBondContact ND1-N 3.22Å; H78-T80 PolarHBondContact ND1-OG1 2.72Å; H78-T80 PolarHBondContact O-N 2.96Å; T80-L82 PolarHBondContact O-N 2.78Å
81	H	66.6	Low	75.6	Confident	32 Å²	32	48 Å²	48	15%	0.148	26%	0.256	C	S	.	.			trans	-86.4	47.6	-174.2	-68.6	-104.6	0	0	0	113.2	L77 H78 S83 F84	L77-H81 HydrophobicContact CD2-CB 4.13Å; H78-H81 PolarHBondContact O-N 3.13Å; H81-S83 PolarHBondContact O-N 3Å; H81-F84 PolarHBondContact O-N 3Å; H81-F84 VanDerWaalsContact O-N 3.11Å
82	L	67	Low	75.9	Confident	126 Å²	126	41.8 Å²	41.8	66%	0.66	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-22	-178	-61.7	175.1	0	0	0	113.5	T80	T80-L82 PolarHBondContact O-N 2.78Å
83	S	72	Confident	76.4	Confident	34 Å²	34	41 Å²	41	24%	0.238	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87	-9.6	-178.7	63.8	0	0	0	0	114.9	H81 P86 C87	H81-S83 PolarHBondContact O-N 3Å; S83-P86 WeakPolarHBondContact O-CD 3.48Å; S83-C87 WeakPolarHBondContact O-CB 3.43Å; S83-C87 PolarHBondContact O-N 3.35Å; S83-C87 PolarHBondContact O-SG 3.36Å
84	F	79.2	Confident	76.9	Confident	4 Å²	4	46.8 Å²	46.8	2%	0.018	25%	0.25	C	S	.	.	H	α-helix	trans	-58.6	-57.8	-174.8	173.9	-98.8	0	0	0	112.4	I24 I48 M73 L77 H81 C87 L88	I24-F84 HydrophobicContact CD1-CE2 4.17Å; I24-F84 HydrophobicContact CD1-CZ 4.42Å; I48-F84 HydrophobicContact CD1-CB 4.43Å; I48-F84 HydrophobicContact CD1-CD2 3.81Å; M73-F84 HydrophobicContact SD-CE1 4.5Å; M73-F84 HydrophobicContact SD-CZ 4.19Å; L77-F84 HydrophobicContact CD1-CB 4.39Å; L77-F84 HydrophobicContact CD1-CD1 3.43Å; L77-F84 VanDerWaalsContact CD1-CD1 3.43Å; L77-F84 HydrophobicContact CD1-CE1 3.92Å; L77-F84 HydrophobicContact CD1-CG 4.07Å; L77-F84 HydrophobicContact CD2-CB 3.73Å; L77-F84 HydrophobicContact CD2-CD1 3.75Å; L77-F84 HydrophobicContact CD2-CD2 3.99Å; L77-F84 HydrophobicContact CD2-CE1 4.33Å; L77-F84 HydrophobicContact CD2-CG 3.53Å; L77-F84 HydrophobicContact CG-CD1 4.18Å; L77-F84 HydrophobicContact CG-CG 4.45Å; H81-F84 PolarHBondContact O-N 3Å; H81-F84 VanDerWaalsContact O-N 3.11Å; F84-C87 PolarHBondContact O-N 2.68Å; F84-L88 HydrophobicContact CE1-CD2 4.16Å; F84-L88 HydrophobicContact CZ-CD2 4.21Å; F84-L88 WeakPolarHBondContact O-CB 3.46Å; F84-L88 PolarHBondContact O-N 2.9Å
85	W	85.7	Confident	77.4	Confident	13 Å²	13	48.4 Å²	48.4	5%	0.049	26%	0.259	C	S	.	.	H	α-helix	trans	-61.3	-48.2	-177.8	-67.5	107.4	0	0	0	112.7	C70 M73 N74 L77 C87 L88 L89 L104 Y107 I108 H115 T119	C70-W85 HydrophobicContact CB-CH2 4.48Å; M73-W85 HydrophobicContact CE-CH2 4.3Å; N74-W85 HydrophobicContact CB-CZ2 4.04Å; N74-W85 PolarHBondContact OD1-NE1 2.85Å; L77-W85 HydrophobicContact CD1-CZ2 4.3Å; W85-C87 VanDerWaalsContact C-N 3.3Å; W85-C87 PolarHBondContact O-N 3.5Å; W85-L88 HydrophobicContact CE3-CD2 4.4Å; W85-L88 HydrophobicContact CZ3-CD2 4.41Å; W85-L88 PolarHBondContact O-N 3.24Å; W85-L89 WeakPolarHBondContact O-CB 3.08Å; W85-L89 VanDerWaalsContact O-CG 3.31Å; W85-L89 WeakPolarHBondContact O-CG 3.46Å; W85-L89 PolarHBondContact O-N 3.02Å; W85-L104 HydrophobicContact CZ3-CD2 4.18Å; W85-Y107 AromaticContact CH2-CD1 3.81Å; W85-Y107 HydrophobicContact CH2-CD1 3.81Å; W85-Y107 AromaticContact CH2-CE1 3.5Å; W85-Y107 HydrophobicContact CH2-CE1 3.5Å; W85-Y107 VanDerWaalsContact CH2-CE1 3.5Å; W85-Y107 AromaticContact CZ2-CE1 3.83Å; W85-Y107 HydrophobicContact CZ2-CE1 3.83Å; W85-Y107 HydrophobicContact CZ3-CD1 4.16Å; W85-Y107 HydrophobicContact CZ3-CE1 4.27Å; W85-I108 HydrophobicContact CE3-CD1 4.24Å; W85-H115 AromaticContact CD1-ND1 3.7Å; W85-H115 AromaticContact CD2-CE1 3.93Å; W85-H115 AromaticContact CE2-CE1 3.5Å; W85-H115 AromaticContact CE2-ND1 3.92Å; W85-H115 AromaticContact CZ2-CE1 3.79Å; W85-H115 AromaticContact NE1-CE1 3.58Å; W85-H115 AromaticContact NE1-ND1 3.59Å; W85-T119 HydrophobicContact CB-CG2 3.56Å; W85-T119 HydrophobicContact CG-CG2 4.24Å
86	P	85.2	Confident	78.1	Confident	10 Å²	10	47.8 Å²	47.8	7%	0.065	26%	0.255	C	S	.	.	H	α-helix	trans	-56.7	-40.9	173.8	-27.4	35.9	0	0	0	113.5	S83 N90 V118 T119	S83-P86 WeakPolarHBondContact O-CD 3.48Å; P86-N90 VanDerWaalsContact O-CB 3.25Å; P86-N90 WeakPolarHBondContact O-CB 3.37Å; P86-N90 VanDerWaalsContact O-CG 3.31Å; P86-N90 PolarHBondContact O-N 3.17Å; P86-N90 PolarHBondContact O-ND2 3.3Å; P86-V118 HydrophobicContact CB-CG1 3.96Å; P86-V118 HydrophobicContact CG-CB 4.13Å; P86-V118 HydrophobicContact CG-CG1 3.65Å; P86-T119 WeakPolarHBondContact CD-OG1 3.23Å
87	C	81.6	Confident	79	Confident	32 Å²	32	45.2 Å²	45.2	22%	0.216	24%	0.242	C	C	.	.	H	α-helix	trans	-67.8	-40.9	179.2	-67.5	0	0	0	0	111.9	I53 S83 F84 W85 N90 Y91	I53-C87 HydrophobicContact CD1-CB 3.29Å; S83-C87 WeakPolarHBondContact O-CB 3.43Å; S83-C87 PolarHBondContact O-N 3.35Å; S83-C87 PolarHBondContact O-SG 3.36Å; F84-C87 PolarHBondContact O-N 2.68Å; W85-C87 VanDerWaalsContact C-N 3.3Å; W85-C87 PolarHBondContact O-N 3.5Å; C87-N90 PolarHBondContact O-N 3.38Å; C87-Y91 PolarHBondContact O-N 3Å
88	L	83	Confident	80.2	Confident	3 Å²	3	46.6 Å²	46.6	2%	0.016	25%	0.253	C	S	.	.	H	α-helix	trans	-64.3	-45.3	175.9	-179.2	61.7	0	0	0	111.6	F16 L57 F84 W85 Y91 T92 L104	F16-L88 HydrophobicContact CE2-CD1 4.49Å; L57-L88 HydrophobicContact CD1-CD1 3.49Å; L57-L88 VanDerWaalsContact CD1-CD1 3.49Å; F84-L88 HydrophobicContact CE1-CD2 4.16Å; F84-L88 HydrophobicContact CZ-CD2 4.21Å; F84-L88 WeakPolarHBondContact O-CB 3.46Å; F84-L88 PolarHBondContact O-N 2.9Å; W85-L88 HydrophobicContact CE3-CD2 4.4Å; W85-L88 HydrophobicContact CZ3-CD2 4.41Å; W85-L88 PolarHBondContact O-N 3.24Å; L88-Y91 VanDerWaalsContact O-CB 3.32Å; L88-Y91 WeakPolarHBondContact O-CB 3.26Å; L88-Y91 PolarHBondContact O-N 3.39Å; L88-T92 WeakPolarHBondContact O-CG2 3.45Å; L88-T92 PolarHBondContact O-N 2.81Å; L88-L104 HydrophobicContact CD1-CD1 4.31Å; L88-L104 HydrophobicContact CD2-CD1 3.75Å; L88-L104 HydrophobicContact CD2-CD2 3.89Å; L88-L104 HydrophobicContact CG-CD1 3.67Å
89	L	89.3	Confident	81.4	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-61.5	-46	176.1	-71.2	177.2	0	0	0	111.7	W85 Y91 T92 M93 L104 I108 T119 C122 T123 L126	W85-L89 WeakPolarHBondContact O-CB 3.08Å; W85-L89 VanDerWaalsContact O-CG 3.31Å; W85-L89 WeakPolarHBondContact O-CG 3.46Å; W85-L89 PolarHBondContact O-N 3.02Å; L89-Y91 VanDerWaalsContact C-N 3.29Å; L89-Y91 PolarHBondContact O-N 3.25Å; L89-T92 PolarHBondContact O-N 3.35Å; L89-T92 VanDerWaalsContact O-N 3.13Å; L89-T92 PolarHBondContact O-OG1 3.46Å; L89-M93 PolarHBondContact O-N 2.81Å; L89-L104 HydrophobicContact CD2-CB 4.03Å; L89-L104 HydrophobicContact CD2-CD1 4.42Å; L89-I108 HydrophobicContact CD1-CD1 3.75Å; L89-I108 HydrophobicContact CD2-CD1 3.83Å; L89-I108 HydrophobicContact CG-CD1 4.13Å; L89-T119 HydrophobicContact CD1-CG2 4.1Å; L89-C122 HydrophobicContact CB-CB 4.12Å; L89-C122 HydrophobicContact CD1-CB 3.66Å; L89-T123 WeakPolarHBondContact CD1-OG1 3.32Å; L89-L126 HydrophobicContact CB-CD1 3.72Å; L89-L126 HydrophobicContact CD1-CD1 4.46Å; L89-L126 HydrophobicContact CD2-CD1 3.64Å; L89-L126 HydrophobicContact CG-CD1 4.11Å
90	N	86.3	Confident	82.6	Confident	48 Å²	48	41.9 Å²	41.9	26%	0.257	22%	0.219	S	C	.	.	H	α-helix	trans	-60.2	-38.6	175.3	-83	-48.8	0	0	0	112.2	P86 C87 T92 M93 Y94	P86-N90 VanDerWaalsContact O-CB 3.25Å; P86-N90 WeakPolarHBondContact O-CB 3.37Å; P86-N90 VanDerWaalsContact O-CG 3.31Å; P86-N90 PolarHBondContact O-N 3.17Å; P86-N90 PolarHBondContact O-ND2 3.3Å; C87-N90 PolarHBondContact O-N 3.38Å; N90-T92 VanDerWaalsContact C-N 3.3Å; N90-T92 PolarHBondContact O-N 3.15Å; N90-M93 WeakPolarHBondContact O-CB 3.12Å; N90-M93 PolarHBondContact O-N 2.66Å; N90-M93 VanDerWaalsContact O-N 3.11Å; N90-Y94 HydrophobicContact CB-CD2 4.14Å; N90-Y94 HydrophobicContact CB-CE2 3.86Å; N90-Y94 WeakPolarHBondContact O-CD2 3.43Å; N90-Y94 PolarHBondContact O-N 3.14Å
91	Y	83.9	Confident	84.3	Confident	8 Å²	8	39.4 Å²	39.4	3%	0.031	20%	0.203	C	C	.	.	H	α-helix	trans	-54.8	-46.4	173.7	171.4	-86.6	0	0	0	111.6	I53 N54 L57 S58 C87 L88 L89 M93 Y94 N95 L100	I53-Y91 HydrophobicContact CG2-CD2 4.01Å; I53-Y91 HydrophobicContact CG2-CG 4.11Å; N54-Y91 WeakPolarHBondContact OD1-CD2 3.46Å; L57-Y91 HydrophobicContact CB-CD1 4.16Å; L57-Y91 HydrophobicContact CB-CD2 4.16Å; L57-Y91 HydrophobicContact CB-CE1 3.57Å; L57-Y91 HydrophobicContact CB-CE2 3.59Å; L57-Y91 HydrophobicContact CB-CG 4.45Å; L57-Y91 WeakPolarHBondContact CB-OH 3.17Å; L57-Y91 HydrophobicContact CD1-CD1 3.51Å; L57-Y91 HydrophobicContact CD1-CD2 4.08Å; L57-Y91 HydrophobicContact CD1-CE1 3.77Å; L57-Y91 HydrophobicContact CD1-CE2 4.33Å; L57-Y91 HydrophobicContact CD1-CG 3.71Å; L57-Y91 HydrophobicContact CG-CE1 4.33Å; L57-Y91 PolarHBondContact O-OH 2.93Å; S58-Y91 WeakPolarHBondContact CA-OH 3.4Å; S58-Y91 PolarHBondContact N-OH 2.86Å; C87-Y91 PolarHBondContact O-N 3Å; L88-Y91 VanDerWaalsContact O-CB 3.32Å; L88-Y91 WeakPolarHBondContact O-CB 3.26Å; L88-Y91 PolarHBondContact O-N 3.39Å; L89-Y91 VanDerWaalsContact C-N 3.29Å; L89-Y91 PolarHBondContact O-N 3.25Å; Y91-M93 PolarHBondContact O-N 3.01Å; Y91-Y94 PolarHBondContact O-N 2.93Å; Y91-N95 WeakPolarHBondContact CD2-ND2 3.48Å; Y91-N95 HydrophobicContact CE1-CB 4.28Å; Y91-N95 HydrophobicContact CE2-CB 4.23Å; Y91-N95 WeakPolarHBondContact CE2-ND2 3.36Å; Y91-N95 PolarHBondContact O-N 3.29Å; Y91-N95 PolarHBondContact O-ND2 3.46Å; Y91-L100 HydrophobicContact CD1-CD2 4.35Å; Y91-L100 HydrophobicContact CE1-CD2 4.31Å
92	T	89.2	Confident	85.7	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-63.5	-25.4	179.8	75	0	0	0	0	113.6	L88 L89 N90 C97 L100 R101 L104	L88-T92 WeakPolarHBondContact O-CG2 3.45Å; L88-T92 PolarHBondContact O-N 2.81Å; L89-T92 PolarHBondContact O-N 3.35Å; L89-T92 VanDerWaalsContact O-N 3.13Å; L89-T92 PolarHBondContact O-OG1 3.46Å; N90-T92 VanDerWaalsContact C-N 3.3Å; N90-T92 PolarHBondContact O-N 3.15Å; T92-C97 PolarHBondContact O-N 2.83Å; T92-L100 HydrophobicContact CG2-CB 4.24Å; T92-L100 HydrophobicContact CG2-CD2 3.84Å; T92-L100 HydrophobicContact CG2-CG 3.7Å; T92-R101 HydrophobicContact CG2-CB 4.47Å; T92-R101 PolarHBondContact O-NE 2.99Å; T92-R101 PolarHBondContact O-NH2 3.17Å; T92-L104 HydrophobicContact CG2-CD1 3.85Å
93	M	86.3	Confident	86.9	Confident	38 Å²	38	38.1 Å²	38.1	19%	0.187	19%	0.19	C	C	.	.	H	α-helix	trans	-78.5	-49.4	175.3	-171.3	-179.2	61.4	0	0	110.7	L89 N90 Y91 N95 D96 K125 L126 I129	L89-M93 PolarHBondContact O-N 2.81Å; N90-M93 WeakPolarHBondContact O-CB 3.12Å; N90-M93 PolarHBondContact O-N 2.66Å; N90-M93 VanDerWaalsContact O-N 3.11Å; Y91-M93 PolarHBondContact O-N 3.01Å; M93-N95 VanDerWaalsContact C-N 3.35Å; M93-N95 PolarHBondContact O-N 3.2Å; M93-D96 PolarHBondContact O-N 3.03Å; M93-K125 HydrophobicContact SD-CD 4.17Å; M93-K125 VanDerWaalsContact SD-CE 3.57Å; M93-L126 HydrophobicContact CB-CD2 3.93Å; M93-L126 HydrophobicContact CG-CD2 4.32Å; M93-I129 HydrophobicContact CG-CD1 4.05Å; M93-I129 HydrophobicContact SD-CD1 3.99Å
94	Y	86.5	Confident	87.8	Confident	123 Å²	123	36.5 Å²	36.5	48%	0.482	18%	0.179	S	C	.	.	H	α-helix	trans	-71.5	-25.8	-175.5	-69.3	-61	0	0	0	114.2	R50 N90 Y91	R50-Y94 VanDerWaalsContact NH2-CZ 3.31Å; N90-Y94 HydrophobicContact CB-CD2 4.14Å; N90-Y94 HydrophobicContact CB-CE2 3.86Å; N90-Y94 WeakPolarHBondContact O-CD2 3.43Å; N90-Y94 PolarHBondContact O-N 3.14Å; Y91-Y94 PolarHBondContact O-N 2.93Å
95	N	85.7	Confident	88.7	Confident	66 Å²	66	36.3 Å²	36.3	35%	0.353	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.6	12.5	-178.9	-60.8	-91.6	0	0	0	112.6	Y91 M93 C97	Y91-N95 WeakPolarHBondContact CD2-ND2 3.48Å; Y91-N95 HydrophobicContact CE1-CB 4.28Å; Y91-N95 HydrophobicContact CE2-CB 4.23Å; Y91-N95 WeakPolarHBondContact CE2-ND2 3.36Å; Y91-N95 PolarHBondContact O-N 3.29Å; Y91-N95 PolarHBondContact O-ND2 3.46Å; M93-N95 VanDerWaalsContact C-N 3.35Å; M93-N95 PolarHBondContact O-N 3.2Å; N95-C97 PolarHBondContact O-N 2.9Å; N95-C97 PolarHBondContact O-SG 3.49Å; N95-C97 VanDerWaalsContact O-SG 3.37Å
96	D	89.1	Confident	89.2	Confident	112 Å²	112	38.5 Å²	38.5	60%	0.599	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	41.9	63.1	-177.7	-162.8	32.8	0	0	0	114.8	M93 P98 R101	M93-D96 PolarHBondContact O-N 3.03Å; D96-P98 VanDerWaalsContact C-CD 3.43Å; D96-P98 WeakPolarHBondContact O-CD 3.28Å; D96-R101 IonicContact OD1-CZ 3.65Å; D96-R101 IonicContact OD1-NH2 2.93Å; D96-R101 PolarHBondContact OD1-NH2 2.96Å
97	C	89.3	Confident	89.7	Confident	4 Å²	4	38.2 Å²	38.2	3%	0.027	19%	0.188	C	C	.	.			trans	-104.7	80.9	179.2	-51.9	0	0	0	0	110.6	D62 T92 N95 L100 R101	D62-C97 HydrophobicContact CB-CB 4.18Å; D62-C97 WeakPolarHBondContact OD1-CA 3.44Å; D62-C97 VanDerWaalsContact OD1-CB 3.29Å; D62-C97 WeakPolarHBondContact OD1-CB 3.2Å; T92-C97 PolarHBondContact O-N 2.83Å; N95-C97 PolarHBondContact O-N 2.9Å; N95-C97 PolarHBondContact O-SG 3.49Å; N95-C97 VanDerWaalsContact O-SG 3.37Å; C97-L100 HydrophobicContact CB-CB 3.92Å; C97-L100 HydrophobicContact CB-CD2 4.42Å; C97-R101 WeakPolarHBondContact O-CB 3.46Å; C97-R101 PolarHBondContact O-N 3.5Å
98	P	93.3	Very high	90.4	Very high	59 Å²	59	36.7 Å²	36.7	38%	0.383	18%	0.178	S	C	.	.	H	α-helix	trans	-63.9	-38.2	-173.6	23.6	-34.9	0	0	0	114.7	D62 D96 R102	D62-P98 WeakPolarHBondContact OD2-CD 3.42Å; D62-P98 VanDerWaalsContact OD2-CG 3.29Å; D62-P98 WeakPolarHBondContact OD2-CG 3.36Å; D96-P98 VanDerWaalsContact C-CD 3.43Å; D96-P98 WeakPolarHBondContact O-CD 3.28Å; P98-R102 WeakPolarHBondContact O-CB 3.27Å; P98-R102 PolarHBondContact O-N 3.44Å
99	E	89.9	Confident	91	Very high	99 Å²	99	37.8 Å²	37.8	46%	0.463	18%	0.184	S	C	.	.	H	α-helix	trans	-69	-43.4	179.4	-66.2	-59.5	140.2	0	0	111.3	D62 F63 T64 R102 S103	D62-E99 PolarHBondContact OD1-N 3.2Å; D62-E99 WeakPolarHBondContact OD2-CB 3.38Å; D62-E99 WeakPolarHBondContact OD2-CG 3.43Å; D62-E99 PolarHBondContact OD2-N 2.99Å; F63-E99 CarbonylContact O-C 3.52Å; T64-E99 HydrophobicContact CG2-CB 3.91Å; T64-E99 WeakPolarHBondContact CG2-OE2 3.45Å; E99-R102 PolarHBondContact O-N 3.42Å; E99-S103 PolarHBondContact O-N 2.67Å; E99-S103 PolarHBondContact O-OG 2.78Å
100	L	87.3	Confident	91.4	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-63.7	-46.8	175.6	-177.3	56.9	0	0	0	110.3	D62 F63 V65 Y91 T92 C97 R102 S103 L104	D62-L100 WeakPolarHBondContact OD1-CB 3.34Å; D62-L100 PolarHBondContact OD1-N 2.88Å; F63-L100 HydrophobicContact CE1-CD1 4.48Å; F63-L100 HydrophobicContact CE1-CD2 4.07Å; F63-L100 HydrophobicContact CE2-CD1 3.92Å; F63-L100 HydrophobicContact CZ-CD1 3.86Å; F63-L100 HydrophobicContact CZ-CD2 4.04Å; F63-L100 WeakPolarHBondContact O-CA 3.44Å; F63-L100 VanDerWaalsContact O-CB 3.3Å; F63-L100 WeakPolarHBondContact O-CB 3.39Å; F63-L100 PolarHBondContact O-N 2.9Å; V65-L100 HydrophobicContact CG2-CD1 3.4Å; V65-L100 VanDerWaalsContact CG2-CD1 3.4Å; Y91-L100 HydrophobicContact CD1-CD2 4.35Å; Y91-L100 HydrophobicContact CE1-CD2 4.31Å; T92-L100 HydrophobicContact CG2-CB 4.24Å; T92-L100 HydrophobicContact CG2-CD2 3.84Å; T92-L100 HydrophobicContact CG2-CG 3.7Å; C97-L100 HydrophobicContact CB-CB 3.92Å; C97-L100 HydrophobicContact CB-CD2 4.42Å; L100-R102 VanDerWaalsContact C-N 3.3Å; L100-R102 PolarHBondContact O-N 3.05Å; L100-S103 PolarHBondContact O-N 3.13Å; L100-S103 PolarHBondContact O-OG 3.11Å; L100-S103 VanDerWaalsContact O-OG 3.06Å; L100-L104 HydrophobicContact CD1-CD1 3.83Å; L100-L104 HydrophobicContact CD1-CD2 4.48Å; L100-L104 HydrophobicContact CD1-CG 3.97Å; L100-L104 HydrophobicContact CG-CD1 3.87Å; L100-L104 HydrophobicContact CG-CG 4.4Å; L100-L104 WeakPolarHBondContact O-CB 3.47Å; L100-L104 VanDerWaalsContact O-CG 3.22Å; L100-L104 WeakPolarHBondContact O-CG 3.32Å; L100-L104 PolarHBondContact O-N 2.85Å
101	R	93.6	Very high	91.8	Very high	15 Å²	15	40.8 Å²	40.8	6%	0.057	21%	0.206	C	C	.	.	H	α-helix	trans	-55.5	-45.3	175.3	-169.2	-173.8	-53.2	162.7	14.8	111.4	T92 D96 C97 T105 L126 I129 Q130	T92-R101 HydrophobicContact CG2-CB 4.47Å; T92-R101 PolarHBondContact O-NE 2.99Å; T92-R101 PolarHBondContact O-NH2 3.17Å; D96-R101 IonicContact OD1-CZ 3.65Å; D96-R101 IonicContact OD1-NH2 2.93Å; D96-R101 PolarHBondContact OD1-NH2 2.96Å; C97-R101 WeakPolarHBondContact O-CB 3.46Å; C97-R101 PolarHBondContact O-N 3.5Å; R101-T105 WeakPolarHBondContact O-CB 3.35Å; R101-T105 WeakPolarHBondContact O-CG2 3.41Å; R101-T105 PolarHBondContact O-N 3.47Å; R101-T105 PolarHBondContact O-OG1 3.37Å; R101-L126 HydrophobicContact CG-CB 4.18Å; R101-L126 HydrophobicContact CG-CD1 4.05Å; R101-L126 HydrophobicContact CG-CD2 3.96Å; R101-L126 HydrophobicContact CG-CG 4.28Å; R101-I129 VanDerWaalsContact NH1-CG2 3.28Å; R101-Q130 HydrophobicContact CG-CG 4.42Å
102	R	95.8	Very high	92.2	Very high	116 Å²	116	42.8 Å²	42.8	44%	0.438	22%	0.215	S	C	.	.	H	α-helix	trans	-68.2	-45.8	-178.5	-173.1	163.9	179.4	80	2.3	112.7	P98 E99 L100 T105 N106 Q130	P98-R102 WeakPolarHBondContact O-CB 3.27Å; P98-R102 PolarHBondContact O-N 3.44Å; E99-R102 PolarHBondContact O-N 3.42Å; L100-R102 VanDerWaalsContact C-N 3.3Å; L100-R102 PolarHBondContact O-N 3.05Å; R102-T105 WeakPolarHBondContact CA-OG1 3.33Å; R102-T105 PolarHBondContact O-OG1 2.94Å; R102-T105 VanDerWaalsContact O-OG1 3.06Å; R102-N106 WeakPolarHBondContact O-CB 3.36Å; R102-N106 PolarHBondContact O-N 3.21Å; R102-N106 PolarHBondContact O-ND2 3.4Å; R102-Q130 VanDerWaalsContact CA-NE2 3.3Å
103	S	92.1	Very high	92.4	Very high	16 Å²	16	47.9 Å²	47.9	11%	0.112	24%	0.242	C	C	.	.	H	α-helix	trans	-63.9	-42.8	178.1	54.1	0	0	0	0	112.5	V65 E99 L100 N106 Y107	V65-S103 PolarHBondContact N-OG 3.33Å; V65-S103 VanDerWaalsContact N-OG 3.08Å; E99-S103 PolarHBondContact O-N 2.67Å; E99-S103 PolarHBondContact O-OG 2.78Å; L100-S103 PolarHBondContact O-N 3.13Å; L100-S103 PolarHBondContact O-OG 3.11Å; L100-S103 VanDerWaalsContact O-OG 3.06Å; S103-N106 PolarHBondContact O-N 3.27Å; S103-Y107 PolarHBondContact O-N 3.16Å; S103-Y107 VanDerWaalsContact O-N 3.09Å
104	L	92	Very high	92.6	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-66.5	-47	177.1	-65.6	175.6	0	0	0	112.8	V65 W85 L88 L89 T92 L100 N106 Y107 I108	V65-L104 HydrophobicContact CG2-CD2 4.39Å; W85-L104 HydrophobicContact CZ3-CD2 4.18Å; L88-L104 HydrophobicContact CD1-CD1 4.31Å; L88-L104 HydrophobicContact CD2-CD1 3.75Å; L88-L104 HydrophobicContact CD2-CD2 3.89Å; L88-L104 HydrophobicContact CG-CD1 3.67Å; L89-L104 HydrophobicContact CD2-CB 4.03Å; L89-L104 HydrophobicContact CD2-CD1 4.42Å; T92-L104 HydrophobicContact CG2-CD1 3.85Å; L100-L104 HydrophobicContact CD1-CD1 3.83Å; L100-L104 HydrophobicContact CD1-CD2 4.48Å; L100-L104 HydrophobicContact CD1-CG 3.97Å; L100-L104 HydrophobicContact CG-CD1 3.87Å; L100-L104 HydrophobicContact CG-CG 4.4Å; L100-L104 WeakPolarHBondContact O-CB 3.47Å; L100-L104 VanDerWaalsContact O-CG 3.22Å; L100-L104 WeakPolarHBondContact O-CG 3.32Å; L100-L104 PolarHBondContact O-N 2.85Å; L104-N106 VanDerWaalsContact C-N 3.29Å; L104-N106 PolarHBondContact O-N 2.96Å; L104-Y107 PolarHBondContact O-N 2.75Å; L104-I108 WeakPolarHBondContact O-CG1 3.23Å; L104-I108 PolarHBondContact O-N 2.97Å
105	T	96.9	Very high	92.8	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62	-37.8	178	50.4	0	0	0	0	111.6	R101 R102 L109 T123 L126 Q130 R132	R101-T105 WeakPolarHBondContact O-CB 3.35Å; R101-T105 WeakPolarHBondContact O-CG2 3.41Å; R101-T105 PolarHBondContact O-N 3.47Å; R101-T105 PolarHBondContact O-OG1 3.37Å; R102-T105 WeakPolarHBondContact CA-OG1 3.33Å; R102-T105 PolarHBondContact O-OG1 2.94Å; R102-T105 VanDerWaalsContact O-OG1 3.06Å; T105-L109 VanDerWaalsContact O-CB 3.31Å; T105-L109 WeakPolarHBondContact O-CB 3.49Å; T105-L109 WeakPolarHBondContact O-CG 3.39Å; T105-L109 PolarHBondContact O-N 2.87Å; T105-T123 HydrophobicContact CG2-CG2 4.16Å; T105-L126 HydrophobicContact CG2-CB 3.95Å; T105-L126 HydrophobicContact CG2-CD1 4.1Å; T105-Q130 PolarHBondContact OG1-OE1 3.17Å; T105-R132 PolarHBondContact OG1-NH1 3.24Å
106	N	97.2	Very high	92.9	Very high	59 Å²	59	43.4 Å²	43.4	32%	0.316	23%	0.227	S	C	.	.	H	α-helix	trans	-61.6	-47.2	173.6	-75	-14.7	0	0	0	112.3	R102 S103 L104 I108 L109 S110 R132	R102-N106 WeakPolarHBondContact O-CB 3.36Å; R102-N106 PolarHBondContact O-N 3.21Å; R102-N106 PolarHBondContact O-ND2 3.4Å; S103-N106 PolarHBondContact O-N 3.27Å; L104-N106 VanDerWaalsContact C-N 3.29Å; L104-N106 PolarHBondContact O-N 2.96Å; N106-I108 PolarHBondContact O-N 3.4Å; N106-L109 PolarHBondContact O-N 3.27Å; N106-S110 PolarHBondContact O-N 2.8Å; N106-S110 VanDerWaalsContact O-N 3.09Å; N106-S110 PolarHBondContact O-OG 3.43Å; N106-R132 PolarHBondContact OD1-NH1 2.92Å; N106-R132 PolarHBondContact OD1-NH2 3.32Å
107	Y	94.9	Very high	93	Very high	4 Å²	4	39.1 Å²	39.1	2%	0.016	20%	0.204	C	C	.	.	H	α-helix	trans	-59	-48.6	178	170.6	-104.4	0	0	0	111.9	V67 C70 R71 N74 W85 S103 L104 L109 S110 H111 H115	V67-Y107 HydrophobicContact CG1-CD2 4.29Å; C70-Y107 HydrophobicContact CB-CD1 3.5Å; C70-Y107 VanDerWaalsContact CB-CD1 3.5Å; C70-Y107 HydrophobicContact CB-CD2 3.36Å; C70-Y107 HydrophobicContact CB-CE1 3.68Å; C70-Y107 HydrophobicContact CB-CE2 3.58Å; C70-Y107 HydrophobicContact CB-CG 3.32Å; R71-Y107 HydrophobicContact CG-CE2 3.81Å; N74-Y107 WeakPolarHBondContact CB-OH 3.31Å; W85-Y107 AromaticContact CH2-CD1 3.81Å; W85-Y107 HydrophobicContact CH2-CD1 3.81Å; W85-Y107 AromaticContact CH2-CE1 3.5Å; W85-Y107 HydrophobicContact CH2-CE1 3.5Å; W85-Y107 VanDerWaalsContact CH2-CE1 3.5Å; W85-Y107 AromaticContact CZ2-CE1 3.83Å; W85-Y107 HydrophobicContact CZ2-CE1 3.83Å; W85-Y107 HydrophobicContact CZ3-CD1 4.16Å; W85-Y107 HydrophobicContact CZ3-CE1 4.27Å; S103-Y107 PolarHBondContact O-N 3.16Å; S103-Y107 VanDerWaalsContact O-N 3.09Å; L104-Y107 PolarHBondContact O-N 2.75Å; Y107-L109 VanDerWaalsContact C-N 3.32Å; Y107-L109 PolarHBondContact O-N 3.29Å; Y107-S110 PolarHBondContact O-N 3.03Å; Y107-S110 VanDerWaalsContact O-N 3.11Å; Y107-H111 AromaticContact CD2-CE1 3.69Å; Y107-H111 AromaticContact CD2-ND1 3.54Å; Y107-H111 AromaticContact CE2-CE1 3.48Å; Y107-H111 VanDerWaalsContact CE2-CE1 3.48Å; Y107-H111 WeakPolarHBondContact CE2-CE1 3.13Å; Y107-H111 AromaticContact CE2-CG 3.98Å; Y107-H111 AromaticContact CE2-ND1 3.38Å; Y107-H111 WeakPolarHBondContact CE2-ND1 3.41Å; Y107-H111 PolarHBondContact O-N 3.01Å; Y107-H111 PolarHBondContact O-ND1 3.44Å; Y107-H115 AromaticContact CE1-CE1 3.87Å; Y107-H115 AromaticContact CE1-NE2 3.63Å
108	I	95.8	Very high	93	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62.9	-40.4	179.9	-66.7	168.1	0	0	0	110.8	W85 L89 L104 N106 S110 H111 K112 T119 L120 T123	W85-I108 HydrophobicContact CE3-CD1 4.24Å; L89-I108 HydrophobicContact CD1-CD1 3.75Å; L89-I108 HydrophobicContact CD2-CD1 3.83Å; L89-I108 HydrophobicContact CG-CD1 4.13Å; L104-I108 WeakPolarHBondContact O-CG1 3.23Å; L104-I108 PolarHBondContact O-N 2.97Å; N106-I108 PolarHBondContact O-N 3.4Å; I108-S110 VanDerWaalsContact C-N 3.26Å; I108-S110 PolarHBondContact O-N 3.09Å; I108-H111 CarbonylContact O-C 3.57Å; I108-H111 VanDerWaalsContact O-C 3.3Å; I108-H111 PolarHBondContact O-N 3.49Å; I108-H111 VanDerWaalsContact O-N 3.13Å; I108-K112 WeakPolarHBondContact O-CA 3.29Å; I108-K112 WeakPolarHBondContact O-CG 3.47Å; I108-K112 PolarHBondContact O-N 2.89Å; I108-T119 HydrophobicContact CD1-CG2 3.89Å; I108-T119 HydrophobicContact CG2-CG2 4.35Å; I108-L120 HydrophobicContact CG2-CD2 4.08Å; I108-T123 HydrophobicContact CG2-CG2 4.11Å
109	L	97.4	Very high	92.9	Very high	26 Å²	26	39.4 Å²	39.4	14%	0.136	20%	0.204	C	C	.	.	H	α-helix	trans	-63.5	-29.6	176	-78.6	175	0	0	0	113.1	T105 N106 Y107 K112 L127 E135 L139	T105-L109 VanDerWaalsContact O-CB 3.31Å; T105-L109 WeakPolarHBondContact O-CB 3.49Å; T105-L109 WeakPolarHBondContact O-CG 3.39Å; T105-L109 PolarHBondContact O-N 2.87Å; N106-L109 PolarHBondContact O-N 3.27Å; Y107-L109 VanDerWaalsContact C-N 3.32Å; Y107-L109 PolarHBondContact O-N 3.29Å; L109-K112 WeakPolarHBondContact O-CE 3.42Å; L109-K112 VanDerWaalsContact O-CG 3.27Å; L109-K112 WeakPolarHBondContact O-CG 3.44Å; L109-L127 HydrophobicContact CD1-CD1 4.21Å; L109-L127 HydrophobicContact CD1-CD2 3.91Å; L109-L127 HydrophobicContact CD2-CD1 4.09Å; L109-E135 HydrophobicContact CD1-CB 3.88Å; L109-E135 HydrophobicContact CD1-CG 4.17Å; L109-L139 HydrophobicContact CD2-CB 4.18Å; L109-L139 HydrophobicContact CD2-CD1 4.5Å; L109-L139 HydrophobicContact CD2-CD2 4.16Å
110	S	96.6	Very high	93.1	Very high	91 Å²	91	34.7 Å²	34.7	64%	0.636	18%	0.182	S	C	*	.	H	α-helix	trans	-80.4	-17.7	174.7	-61.5	0	0	0	0	113.6	N106 Y107 I108	N106-S110 PolarHBondContact O-N 2.8Å; N106-S110 VanDerWaalsContact O-N 3.09Å; N106-S110 PolarHBondContact O-OG 3.43Å; Y107-S110 PolarHBondContact O-N 3.03Å; Y107-S110 VanDerWaalsContact O-N 3.11Å; I108-S110 VanDerWaalsContact C-N 3.26Å; I108-S110 PolarHBondContact O-N 3.09Å
111	H	94.2	Very high	93.4	Very high	21 Å²	21	35.2 Å²	35.2	10%	0.097	19%	0.185	C	C	.	.	S	Bend	trans	-131.5	38.1	-175.1	-52.9	80.5	0	0	0	111.5	R71 Y107 I108 N113 E114 H115	R71-H111 PolarHBondContact NE-NE2 2.78Å; R71-H111 PolarHBondContact NH2-NE2 2.6Å; Y107-H111 AromaticContact CD2-CE1 3.69Å; Y107-H111 AromaticContact CD2-ND1 3.54Å; Y107-H111 AromaticContact CE2-CE1 3.48Å; Y107-H111 VanDerWaalsContact CE2-CE1 3.48Å; Y107-H111 WeakPolarHBondContact CE2-CE1 3.13Å; Y107-H111 AromaticContact CE2-CG 3.98Å; Y107-H111 AromaticContact CE2-ND1 3.38Å; Y107-H111 WeakPolarHBondContact CE2-ND1 3.41Å; Y107-H111 PolarHBondContact O-N 3.01Å; Y107-H111 PolarHBondContact O-ND1 3.44Å; I108-H111 CarbonylContact O-C 3.57Å; I108-H111 VanDerWaalsContact O-C 3.3Å; I108-H111 PolarHBondContact O-N 3.49Å; I108-H111 VanDerWaalsContact O-N 3.13Å; H111-N113 PolarHBondContact O-N 2.86Å; H111-N113 VanDerWaalsContact O-N 3.09Å; H111-E114 HydrophobicContact CB-CB 4.45Å; H111-E114 HydrophobicContact CB-CG 4.34Å; H111-E114 IonicContact CD2-OE1 3.51Å; H111-E114 WeakPolarHBondContact O-CB 3.06Å; H111-E114 PolarHBondContact O-N 3.41Å; H111-H115 PolarHBondContact O-CD2 2.8Å
112	K	94	Very high	93.4	Very high	50 Å²	50	35.5 Å²	35.5	22%	0.217	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-55.5	-34.2	-170.9	-53.7	175.5	-163	178	0	113.4	I108 L109 E114 H115 L120 L139 Y142	I108-K112 WeakPolarHBondContact O-CA 3.29Å; I108-K112 WeakPolarHBondContact O-CG 3.47Å; I108-K112 PolarHBondContact O-N 2.89Å; L109-K112 WeakPolarHBondContact O-CE 3.42Å; L109-K112 VanDerWaalsContact O-CG 3.27Å; L109-K112 WeakPolarHBondContact O-CG 3.44Å; K112-E114 VanDerWaalsContact C-N 3.27Å; K112-E114 PolarHBondContact O-N 2.58Å; K112-H115 PolarHBondContact O-N 2.67Å; K112-L120 HydrophobicContact CB-CD2 4.18Å; K112-L139 HydrophobicContact CD-CD1 4.07Å; K112-Y142 HydrophobicContact CB-CD1 4.44Å; K112-Y142 HydrophobicContact CB-CE1 3.93Å; K112-Y142 HydrophobicContact CD-CD1 4.31Å; K112-Y142 HydrophobicContact CD-CG 4.44Å
113	N	92.6	Very high	93.5	Very high	107 Å²	107	30 Å²	30	57%	0.572	17%	0.168	S	C	*	.	G	3₁₀ helix	trans	-66.6	-27.1	-179.4	59.8	-44.8	0	0	0	113.1	H111 H115	H111-N113 PolarHBondContact O-N 2.86Å; H111-N113 VanDerWaalsContact O-N 3.09Å; N113-H115 VanDerWaalsContact C-N 3.32Å
114	E	90	Very high	93.7	Very high	96 Å²	96	29.2 Å²	29.2	45%	0.449	16%	0.163	S	C	.	.	G	3₁₀ helix	trans	-81.9	-9.5	-178.4	-60.8	176.8	-161.6	0	0	113	N74 H111 K112	N74-E114 PolarHBondContact ND2-OE2 3.31Å; H111-E114 HydrophobicContact CB-CB 4.45Å; H111-E114 HydrophobicContact CB-CG 4.34Å; H111-E114 IonicContact CD2-OE1 3.51Å; H111-E114 WeakPolarHBondContact O-CB 3.06Å; H111-E114 PolarHBondContact O-N 3.41Å; K112-E114 VanDerWaalsContact C-N 3.27Å; K112-E114 PolarHBondContact O-N 2.58Å
115	H	90	Very high	93.8	Very high	4 Å²	4	33.2 Å²	33.2	2%	0.019	18%	0.18	C	C	.	.	S	Bend	trans	-109.5	152.5	-173.1	-65.8	-60.9	0	0	0	113.5	W85 Y107 H111 K112 N113 T119 L120 R146	W85-H115 AromaticContact CD1-ND1 3.7Å; W85-H115 AromaticContact CD2-CE1 3.93Å; W85-H115 AromaticContact CE2-CE1 3.5Å; W85-H115 AromaticContact CE2-ND1 3.92Å; W85-H115 AromaticContact CZ2-CE1 3.79Å; W85-H115 AromaticContact NE1-CE1 3.58Å; W85-H115 AromaticContact NE1-ND1 3.59Å; Y107-H115 AromaticContact CE1-CE1 3.87Å; Y107-H115 AromaticContact CE1-NE2 3.63Å; H111-H115 PolarHBondContact O-CD2 2.8Å; K112-H115 PolarHBondContact O-N 2.67Å; N113-H115 VanDerWaalsContact C-N 3.32Å; H115-T119 HydrophobicContact CB-CG2 3.94Å; H115-L120 HydrophobicContact CB-CD2 4.23Å; H115-R146 PolarHBondContact O-NH2 2.93Å
116	S	88.8	Confident	93.8	Very high	33 Å²	33	33.4 Å²	33.4	23%	0.231	18%	0.181	C	C	.	.			trans	-68.7	156.4	177.9	80.2	0	0	0	0	112.4	V118 T119 L120	S116-V118 PolarHBondContact O-N 3.38Å; S116-T119 WeakPolarHBondContact O-CA 3.24Å; S116-T119 VanDerWaalsContact O-CB 3.31Å; S116-T119 WeakPolarHBondContact O-CB 3.31Å; S116-T119 PolarHBondContact O-N 3.24Å; S116-T119 PolarHBondContact OG-N 2.93Å; S116-T119 VanDerWaalsContact OG-N 3.14Å; S116-T119 PolarHBondContact OG-OG1 2.92Å; S116-L120 WeakPolarHBondContact O-CG 3.44Å; S116-L120 PolarHBondContact O-N 2.88Å
117	N	90.5	Very high	93.8	Very high	21 Å²	21	30.6 Å²	30.6	11%	0.112	17%	0.166	C	C	.	.	H	α-helix	trans	-57.6	-36.3	175.7	-68	-21.3	0	0	0	112	T119 L120 M121 R146 L147 E151 F155	N117-T119 PolarHBondContact O-N 3.41Å; N117-L120 PolarHBondContact O-N 3.46Å; N117-M121 WeakPolarHBondContact O-CB 3.27Å; N117-M121 VanDerWaalsContact O-CG 3.31Å; N117-M121 WeakPolarHBondContact O-CG 3.07Å; N117-M121 PolarHBondContact O-N 2.98Å; N117-R146 WeakPolarHBondContact OD1-CD 3.3Å; N117-R146 PolarHBondContact OD1-NE 3.42Å; N117-L147 HydrophobicContact CB-CD2 3.84Å; N117-L147 VanDerWaalsContact CG-CD2 3.47Å; N117-L147 WeakPolarHBondContact ND2-CD2 3.29Å; N117-E151 PolarHBondContact ND2-OE1 3.45Å; N117-F155 HydrophobicContact CB-CE2 3.89Å; N117-F155 HydrophobicContact CB-CZ 4.14Å
118	V	89.7	Confident	93.8	Very high	69 Å²	69	30.8 Å²	30.8	42%	0.418	17%	0.17	S	C	.	.	H	α-helix	trans	-63.4	-41	175.1	-176.2	0	0	0	0	111.6	P86 S116 M121 C122 F155	P86-V118 HydrophobicContact CB-CG1 3.96Å; P86-V118 HydrophobicContact CG-CB 4.13Å; P86-V118 HydrophobicContact CG-CG1 3.65Å; S116-V118 PolarHBondContact O-N 3.38Å; V118-M121 PolarHBondContact O-N 3.13Å; V118-C122 PolarHBondContact O-N 3.33Å; V118-C122 PolarHBondContact O-SG 3.3Å; V118-F155 HydrophobicContact CG2-CE1 4.11Å; V118-F155 HydrophobicContact CG2-CZ 3.86Å
119	T	91.2	Very high	93.6	Very high	1 Å²	1	34 Å²	34	1%	0.006	19%	0.186	C	C	.	.	H	α-helix	trans	-62.7	-45.1	175.3	-55.6	0	0	0	0	111.1	W85 P86 L89 I108 H115 S116 N117 M121 C122 T123	W85-T119 HydrophobicContact CB-CG2 3.56Å; W85-T119 HydrophobicContact CG-CG2 4.24Å; P86-T119 WeakPolarHBondContact CD-OG1 3.23Å; L89-T119 HydrophobicContact CD1-CG2 4.1Å; I108-T119 HydrophobicContact CD1-CG2 3.89Å; I108-T119 HydrophobicContact CG2-CG2 4.35Å; H115-T119 HydrophobicContact CB-CG2 3.94Å; S116-T119 WeakPolarHBondContact O-CA 3.24Å; S116-T119 VanDerWaalsContact O-CB 3.31Å; S116-T119 WeakPolarHBondContact O-CB 3.31Å; S116-T119 PolarHBondContact O-N 3.24Å; S116-T119 PolarHBondContact OG-N 2.93Å; S116-T119 VanDerWaalsContact OG-N 3.14Å; S116-T119 PolarHBondContact OG-OG1 2.92Å; N117-T119 PolarHBondContact O-N 3.41Å; T119-M121 VanDerWaalsContact C-N 3.33Å; T119-M121 PolarHBondContact O-N 2.97Å; T119-C122 PolarHBondContact O-N 2.77Å; T119-T123 WeakPolarHBondContact O-CB 3.33Å; T119-T123 PolarHBondContact O-N 3.46Å; T119-T123 PolarHBondContact O-OG1 3.42Å
120	L	95.1	Very high	93.4	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-64.1	-39.2	178.4	-61.1	-179.6	0	0	0	111.3	I108 K112 H115 S116 N117 T123 L124 L139 Y142 I143	I108-L120 HydrophobicContact CG2-CD2 4.08Å; K112-L120 HydrophobicContact CB-CD2 4.18Å; H115-L120 HydrophobicContact CB-CD2 4.23Å; S116-L120 WeakPolarHBondContact O-CG 3.44Å; S116-L120 PolarHBondContact O-N 2.88Å; N117-L120 PolarHBondContact O-N 3.46Å; L120-T123 WeakPolarHBondContact O-CB 3.47Å; L120-T123 PolarHBondContact O-N 2.85Å; L120-L124 WeakPolarHBondContact O-CB 3.35Å; L120-L124 PolarHBondContact O-N 3.06Å; L120-L139 HydrophobicContact CB-CD1 4.44Å; L120-L139 HydrophobicContact CD2-CD1 4.14Å; L120-Y142 HydrophobicContact CD1-CD1 4.29Å; L120-Y142 HydrophobicContact CD1-CE1 3.87Å; L120-I143 HydrophobicContact CB-CD1 3.87Å; L120-I143 HydrophobicContact CB-CG1 3.97Å; L120-I143 HydrophobicContact CD1-CG1 4.38Å
121	M	93.6	Very high	93.4	Very high	11 Å²	11	35.8 Å²	35.8	5%	0.054	18%	0.184	C	C	.	.	H	α-helix	trans	-63.2	-44.8	174	-75.1	-53.8	-57.8	0	0	113	N117 V118 T119 T123 L124 K125 I143 F155 D158 M159	N117-M121 WeakPolarHBondContact O-CB 3.27Å; N117-M121 VanDerWaalsContact O-CG 3.31Å; N117-M121 WeakPolarHBondContact O-CG 3.07Å; N117-M121 PolarHBondContact O-N 2.98Å; V118-M121 PolarHBondContact O-N 3.13Å; T119-M121 VanDerWaalsContact C-N 3.33Å; T119-M121 PolarHBondContact O-N 2.97Å; M121-T123 VanDerWaalsContact C-N 3.28Å; M121-T123 PolarHBondContact O-N 3.21Å; M121-L124 HydrophobicContact CE-CD2 4.4Å; M121-L124 WeakPolarHBondContact O-CB 3.48Å; M121-L124 PolarHBondContact O-N 3.01Å; M121-L124 HydrophobicContact SD-CD2 4.42Å; M121-K125 PolarHBondContact O-N 3.39Å; M121-K125 VanDerWaalsContact O-N 3.11Å; M121-I143 HydrophobicContact SD-CD1 4.09Å; M121-I143 HydrophobicContact SD-CG2 4.07Å; M121-F155 HydrophobicContact CG-CB 4.44Å; M121-F155 HydrophobicContact CG-CD1 3.65Å; M121-F155 HydrophobicContact CG-CE1 4.02Å; M121-F155 HydrophobicContact CG-CG 4.04Å; M121-F155 HydrophobicContact SD-CB 4.37Å; M121-D158 HydrophobicContact CE-CB 3.8Å; M121-M159 HydrophobicContact CE-CB 4.15Å; M121-M159 HydrophobicContact CE-CG 3.32Å; M121-M159 HydrophobicContact SD-CG 3.6Å; M121-M159 VanDerWaalsContact SD-CG 3.6Å; M121-M159 HydrophobicContact SD-SD 4.35Å
122	C	93.3	Very high	93.5	Very high	21 Å²	21	35.8 Å²	35.8	14%	0.142	18%	0.183	C	C	.	.	H	α-helix	trans	-61.1	-40.8	173.4	-68	0	0	0	0	111.2	L89 V118 T119 K125 L126	L89-C122 HydrophobicContact CB-CB 4.12Å; L89-C122 HydrophobicContact CD1-CB 3.66Å; V118-C122 PolarHBondContact O-N 3.33Å; V118-C122 PolarHBondContact O-SG 3.3Å; T119-C122 PolarHBondContact O-N 2.77Å; C122-K125 PolarHBondContact O-N 3.47Å; C122-L126 VanDerWaalsContact O-CG 3.3Å; C122-L126 WeakPolarHBondContact O-CG 3.31Å; C122-L126 PolarHBondContact O-N 3.43Å; C122-L126 VanDerWaalsContact O-N 3.08Å
123	T	96.8	Very high	93.6	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-63	-45.4	177.4	-56.8	0	0	0	0	110.9	L89 T105 I108 T119 L120 M121 K125 L126 L127 L139	L89-T123 WeakPolarHBondContact CD1-OG1 3.32Å; T105-T123 HydrophobicContact CG2-CG2 4.16Å; I108-T123 HydrophobicContact CG2-CG2 4.11Å; T119-T123 WeakPolarHBondContact O-CB 3.33Å; T119-T123 PolarHBondContact O-N 3.46Å; T119-T123 PolarHBondContact O-OG1 3.42Å; L120-T123 WeakPolarHBondContact O-CB 3.47Å; L120-T123 PolarHBondContact O-N 2.85Å; M121-T123 VanDerWaalsContact C-N 3.28Å; M121-T123 PolarHBondContact O-N 3.21Å; T123-K125 PolarHBondContact O-N 2.93Å; T123-L126 PolarHBondContact O-N 2.89Å; T123-L126 VanDerWaalsContact O-N 3.14Å; T123-L127 HydrophobicContact CG2-CD1 4.31Å; T123-L127 HydrophobicContact CG2-CG 4.44Å; T123-L127 WeakPolarHBondContact O-CG 3.37Å; T123-L127 PolarHBondContact O-N 3.38Å; T123-L139 HydrophobicContact CG2-CD2 3.72Å
124	L	96.8	Very high	93.9	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-55.7	-49.6	177.1	-174.2	69.9	0	0	0	111.3	L120 M121 L126 L127 G128 F136 L139 Y140 I143	L120-L124 WeakPolarHBondContact O-CB 3.35Å; L120-L124 PolarHBondContact O-N 3.06Å; M121-L124 HydrophobicContact CE-CD2 4.4Å; M121-L124 WeakPolarHBondContact O-CB 3.48Å; M121-L124 PolarHBondContact O-N 3.01Å; M121-L124 HydrophobicContact SD-CD2 4.42Å; L124-L126 VanDerWaalsContact C-N 3.34Å; L124-L126 PolarHBondContact O-N 2.9Å; L124-L127 PolarHBondContact O-N 3.25Å; L124-G128 PolarHBondContact O-N 3.44Å; L124-G128 VanDerWaalsContact O-N 3.15Å; L124-F136 HydrophobicContact CD1-CD1 4.06Å; L124-F136 HydrophobicContact CD1-CD2 3.59Å; L124-F136 HydrophobicContact CD1-CE1 4.01Å; L124-F136 HydrophobicContact CD1-CE2 3.55Å; L124-F136 HydrophobicContact CD1-CG 3.84Å; L124-F136 HydrophobicContact CD1-CZ 3.75Å; L124-F136 WeakPolarHBondContact CD1-O 3.35Å; L124-F136 HydrophobicContact CD2-CE2 4.42Å; L124-F136 HydrophobicContact CD2-CZ 4.24Å; L124-F136 HydrophobicContact CG-CD2 4.03Å; L124-F136 HydrophobicContact CG-CE2 3.55Å; L124-F136 HydrophobicContact CG-CZ 3.82Å; L124-F136 WeakPolarHBondContact O-CD2 3.36Å; L124-F136 VanDerWaalsContact O-CE2 3.26Å; L124-F136 WeakPolarHBondContact O-CE2 3.19Å; L124-L139 HydrophobicContact CB-CD2 4.11Å; L124-L139 HydrophobicContact CD1-CB 4.28Å; L124-L139 HydrophobicContact CD1-CD2 4.35Å; L124-L139 HydrophobicContact CD1-CG 4.29Å; L124-Y140 HydrophobicContact CD2-CD2 4.18Å; L124-I143 HydrophobicContact CB-CD1 4.21Å; L124-I143 HydrophobicContact CD2-CD1 4.21Å
125	K	95.2	Very high	94.3	Very high	83 Å²	83	33.7 Å²	33.7	36%	0.361	18%	0.178	S	C	.	.	H	α-helix	trans	-56.7	-45.5	175.6	-177.4	179.1	-179.3	-179.7	0	112.3	M93 M121 C122 T123 L127 G128 I129	M93-K125 HydrophobicContact SD-CD 4.17Å; M93-K125 VanDerWaalsContact SD-CE 3.57Å; M121-K125 PolarHBondContact O-N 3.39Å; M121-K125 VanDerWaalsContact O-N 3.11Å; C122-K125 PolarHBondContact O-N 3.47Å; T123-K125 PolarHBondContact O-N 2.93Å; K125-L127 PolarHBondContact O-N 3.06Å; K125-G128 PolarHBondContact O-N 3.28Å; K125-I129 HydrophobicContact CG-CD1 4.45Å; K125-I129 PolarHBondContact O-N 2.85Å; K125-I129 VanDerWaalsContact O-N 3.14Å
126	L	95.8	Very high	94.6	Very high	4 Å²	4	33.5 Å²	33.5	2%	0.021	18%	0.177	C	C	.	.	H	α-helix	trans	-66.3	-36	179.5	-66.7	172.8	0	0	0	112.6	L89 M93 R101 T105 C122 T123 L124 G128 I129 Q130	L89-L126 HydrophobicContact CB-CD1 3.72Å; L89-L126 HydrophobicContact CD1-CD1 4.46Å; L89-L126 HydrophobicContact CD2-CD1 3.64Å; L89-L126 HydrophobicContact CG-CD1 4.11Å; M93-L126 HydrophobicContact CB-CD2 3.93Å; M93-L126 HydrophobicContact CG-CD2 4.32Å; R101-L126 HydrophobicContact CG-CB 4.18Å; R101-L126 HydrophobicContact CG-CD1 4.05Å; R101-L126 HydrophobicContact CG-CD2 3.96Å; R101-L126 HydrophobicContact CG-CG 4.28Å; T105-L126 HydrophobicContact CG2-CB 3.95Å; T105-L126 HydrophobicContact CG2-CD1 4.1Å; C122-L126 VanDerWaalsContact O-CG 3.3Å; C122-L126 WeakPolarHBondContact O-CG 3.31Å; C122-L126 PolarHBondContact O-N 3.43Å; C122-L126 VanDerWaalsContact O-N 3.08Å; T123-L126 PolarHBondContact O-N 2.89Å; T123-L126 VanDerWaalsContact O-N 3.14Å; L124-L126 VanDerWaalsContact C-N 3.34Å; L124-L126 PolarHBondContact O-N 2.9Å; L126-G128 VanDerWaalsContact C-N 3.27Å; L126-G128 PolarHBondContact O-N 2.8Å; L126-I129 HydrophobicContact CD2-CD1 4.37Å; L126-I129 PolarHBondContact O-N 3.44Å; L126-Q130 WeakPolarHBondContact O-CB 3.3Å; L126-Q130 VanDerWaalsContact O-CG 3.23Å; L126-Q130 WeakPolarHBondContact O-CG 3.44Å; L126-Q130 PolarHBondContact O-N 3.14Å
127	L	97.5	Very high	95	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-62.1	-37.4	174	-67.7	172.4	0	0	0	111.6	L109 T123 L124 K125 Q130 Q131 R132 E135 F136 L139	L109-L127 HydrophobicContact CD1-CD1 4.21Å; L109-L127 HydrophobicContact CD1-CD2 3.91Å; L109-L127 HydrophobicContact CD2-CD1 4.09Å; T123-L127 HydrophobicContact CG2-CD1 4.31Å; T123-L127 HydrophobicContact CG2-CG 4.44Å; T123-L127 WeakPolarHBondContact O-CG 3.37Å; T123-L127 PolarHBondContact O-N 3.38Å; L124-L127 PolarHBondContact O-N 3.25Å; K125-L127 PolarHBondContact O-N 3.06Å; L127-Q130 CarbonylContact O-C 3.3Å; L127-Q130 PolarHBondContact O-N 2.63Å; L127-Q131 PolarHBondContact O-N 2.91Å; L127-Q131 VanDerWaalsContact O-N 3.08Å; L127-R132 HydrophobicContact CB-CB 4.45Å; L127-R132 HydrophobicContact CD2-CB 3.98Å; L127-R132 PolarHBondContact O-N 3.46Å; L127-E135 HydrophobicContact CD1-CB 4.28Å; L127-E135 HydrophobicContact CD2-CB 4.35Å; L127-F136 HydrophobicContact CB-CB 4.12Å; L127-F136 HydrophobicContact CB-CD2 4.1Å; L127-L139 HydrophobicContact CD1-CB 4.26Å; L127-L139 HydrophobicContact CD1-CD2 3.74Å
128	G	94.5	Very high	95.4	Very high	9 Å²	9	36.7 Å²	36.7	9%	0.093	19%	0.194	C	C	.	.	H	α-helix	trans	-60.1	-50.7	172.4	0	0	0	0	0	112	L124 K125 L126 Q130 Q131	L124-G128 PolarHBondContact O-N 3.44Å; L124-G128 VanDerWaalsContact O-N 3.15Å; K125-G128 PolarHBondContact O-N 3.28Å; L126-G128 VanDerWaalsContact C-N 3.27Å; L126-G128 PolarHBondContact O-N 2.8Å; G128-Q130 VanDerWaalsContact C-N 3.27Å; G128-Q130 PolarHBondContact O-N 3.41Å; G128-Q131 PolarHBondContact O-N 2.96Å
129	I	91.7	Very high	95.8	Very high	66 Å²	66	33.4 Å²	33.4	34%	0.338	17%	0.174	S	C	.	.	H	α-helix	trans	-59.6	-38.8	176.6	-64.5	168.9	0	0	0	111.5	M93 R101 K125 L126 Q131	M93-I129 HydrophobicContact CG-CD1 4.05Å; M93-I129 HydrophobicContact SD-CD1 3.99Å; R101-I129 VanDerWaalsContact NH1-CG2 3.28Å; K125-I129 HydrophobicContact CG-CD1 4.45Å; K125-I129 PolarHBondContact O-N 2.85Å; K125-I129 VanDerWaalsContact O-N 3.14Å; L126-I129 HydrophobicContact CD2-CD1 4.37Å; L126-I129 PolarHBondContact O-N 3.44Å; I129-Q131 PolarHBondContact O-N 3.13Å
130	Q	94.5	Very high	96	Very high	41 Å²	41	33.7 Å²	33.7	19%	0.192	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-1.1	177.8	-68.2	177.5	-54.7	0	0	113.7	R101 R102 T105 L126 L127 G128 R132	R101-Q130 HydrophobicContact CG-CG 4.42Å; R102-Q130 VanDerWaalsContact CA-NE2 3.3Å; T105-Q130 PolarHBondContact OG1-OE1 3.17Å; L126-Q130 WeakPolarHBondContact O-CB 3.3Å; L126-Q130 VanDerWaalsContact O-CG 3.23Å; L126-Q130 WeakPolarHBondContact O-CG 3.44Å; L126-Q130 PolarHBondContact O-N 3.14Å; L127-Q130 CarbonylContact O-C 3.3Å; L127-Q130 PolarHBondContact O-N 2.63Å; G128-Q130 VanDerWaalsContact C-N 3.27Å; G128-Q130 PolarHBondContact O-N 3.41Å; Q130-R132 HydrophobicContact CB-CG 3.92Å; Q130-R132 PolarHBondContact O-N 2.86Å
131	Q	95	Very high	96.1	Very high	114 Å²	114	36.6 Å²	36.6	53%	0.533	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	31.2	-177.6	-54.7	-175.2	66.6	0	0	113.5	L127 G128 I129 H133	L127-Q131 PolarHBondContact O-N 2.91Å; L127-Q131 VanDerWaalsContact O-N 3.08Å; G128-Q131 PolarHBondContact O-N 2.96Å; I129-Q131 PolarHBondContact O-N 3.13Å; Q131-H133 VanDerWaalsContact C-N 3.35Å; Q131-H133 PolarHBondContact O-N 3.37Å
132	R	97.2	Very high	96.2	Very high	21 Å²	21	39.6 Å²	39.6	8%	0.079	20%	0.202	C	C	.	.			trans	-91.1	67.4	178.8	-68.1	176.5	68.5	-179.7	3.6	110.4	T105 N106 L127 Q130 T134 E135 F136	T105-R132 PolarHBondContact OG1-NH1 3.24Å; N106-R132 PolarHBondContact OD1-NH1 2.92Å; N106-R132 PolarHBondContact OD1-NH2 3.32Å; L127-R132 HydrophobicContact CB-CB 4.45Å; L127-R132 HydrophobicContact CD2-CB 3.98Å; L127-R132 PolarHBondContact O-N 3.46Å; Q130-R132 HydrophobicContact CB-CG 3.92Å; Q130-R132 PolarHBondContact O-N 2.86Å; R132-T134 PolarHBondContact O-N 3.31Å; R132-E135 IonicContact CZ-OE1 3.77Å; R132-E135 VanDerWaalsContact CZ-OE1 3.24Å; R132-E135 IonicContact NE-OE1 2.86Å; R132-E135 PolarHBondContact NE-OE1 3.39Å; R132-E135 IonicContact NH2-OE1 3.17Å; R132-E135 PolarHBondContact NH2-OE1 2.73Å; R132-E135 PolarHBondContact O-N 3.28Å; R132-F136 VanDerWaalsContact O-CB 3.28Å; R132-F136 WeakPolarHBondContact O-CB 3.37Å; R132-F136 PolarHBondContact O-N 2.96Å
133	H	96.7	Very high	96.3	Very high	38 Å²	38	38.6 Å²	38.6	18%	0.176	20%	0.195	C	C	.	.	H	α-helix	trans	-68.8	-32.2	-165.7	-59.4	-49.4	0	0	0	114.2	Q131 F136 K137 P167 F168 F200	Q131-H133 VanDerWaalsContact C-N 3.35Å; Q131-H133 PolarHBondContact O-N 3.37Å; H133-F136 WeakPolarHBondContact O-CB 3.49Å; H133-F136 PolarHBondContact O-N 2.98Å; H133-K137 PolarHBondContact O-N 3.11Å; H133-P167 HydrophobicContact CB-CG 4.45Å; H133-P167 WeakPolarHBondContact ND1-CD 3.47Å; H133-F168 HydrophobicContact CB-CE2 4.08Å; H133-F168 HydrophobicContact CB-CZ 4.24Å; H133-F168 WeakPolarHBondContact O-CE2 3.17Å; H133-F200 AromaticContact NE2-CZ 3.95Å
134	T	97.5	Very high	96.2	Very high	110 Å²	110	40.6 Å²	40.6	68%	0.675	21%	0.205	S	C	*	.	H	α-helix	trans	-64.7	-50.8	175.9	-51.9	0	0	0	0	110.9	R132 F136 K137 S138	R132-T134 PolarHBondContact O-N 3.31Å; T134-F136 VanDerWaalsContact C-N 3.31Å; T134-F136 PolarHBondContact O-N 2.83Å; T134-K137 PolarHBondContact O-N 3.11Å; T134-S138 PolarHBondContact O-N 3Å; T134-S138 VanDerWaalsContact O-N 3.09Å; T134-S138 PolarHBondContact O-OG 2.89Å
135	E	98.1	Very high	96.1	Very high	62 Å²	62	48 Å²	48	29%	0.29	25%	0.245	S	C	.	.	H	α-helix	trans	-67.7	-33.9	177.2	-57.9	100.3	123.6	0	0	112.1	L109 L127 R132 L139	L109-E135 HydrophobicContact CD1-CB 3.88Å; L109-E135 HydrophobicContact CD1-CG 4.17Å; L127-E135 HydrophobicContact CD1-CB 4.28Å; L127-E135 HydrophobicContact CD2-CB 4.35Å; R132-E135 IonicContact CZ-OE1 3.77Å; R132-E135 VanDerWaalsContact CZ-OE1 3.24Å; R132-E135 IonicContact NE-OE1 2.86Å; R132-E135 PolarHBondContact NE-OE1 3.39Å; R132-E135 IonicContact NH2-OE1 3.17Å; R132-E135 PolarHBondContact NH2-OE1 2.73Å; R132-E135 PolarHBondContact O-N 3.28Å; E135-L139 WeakPolarHBondContact O-CB 3.32Å; E135-L139 PolarHBondContact O-N 2.88Å
136	F	98.1	Very high	96.1	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-56.4	-53.1	172.4	-178.7	-79.9	0	0	0	110.5	L124 L127 R132 H133 T134 S138 L139 Y140 V163 T166 F168	L124-F136 HydrophobicContact CD1-CD1 4.06Å; L124-F136 HydrophobicContact CD1-CD2 3.59Å; L124-F136 HydrophobicContact CD1-CE1 4.01Å; L124-F136 HydrophobicContact CD1-CE2 3.55Å; L124-F136 HydrophobicContact CD1-CG 3.84Å; L124-F136 HydrophobicContact CD1-CZ 3.75Å; L124-F136 WeakPolarHBondContact CD1-O 3.35Å; L124-F136 HydrophobicContact CD2-CE2 4.42Å; L124-F136 HydrophobicContact CD2-CZ 4.24Å; L124-F136 HydrophobicContact CG-CD2 4.03Å; L124-F136 HydrophobicContact CG-CE2 3.55Å; L124-F136 HydrophobicContact CG-CZ 3.82Å; L124-F136 WeakPolarHBondContact O-CD2 3.36Å; L124-F136 VanDerWaalsContact O-CE2 3.26Å; L124-F136 WeakPolarHBondContact O-CE2 3.19Å; L127-F136 HydrophobicContact CB-CB 4.12Å; L127-F136 HydrophobicContact CB-CD2 4.1Å; R132-F136 VanDerWaalsContact O-CB 3.28Å; R132-F136 WeakPolarHBondContact O-CB 3.37Å; R132-F136 PolarHBondContact O-N 2.96Å; H133-F136 WeakPolarHBondContact O-CB 3.49Å; H133-F136 PolarHBondContact O-N 2.98Å; T134-F136 VanDerWaalsContact C-N 3.31Å; T134-F136 PolarHBondContact O-N 2.83Å; F136-S138 PolarHBondContact O-N 3.22Å; F136-L139 PolarHBondContact O-N 3.11Å; F136-Y140 VanDerWaalsContact O-CB 3.31Å; F136-Y140 WeakPolarHBondContact O-CB 3.33Å; F136-Y140 PolarHBondContact O-N 2.94Å; F136-V163 HydrophobicContact CE1-CG2 4.13Å; F136-V163 HydrophobicContact CZ-CG2 4.09Å; F136-T166 HydrophobicContact CD1-CG2 4.21Å; F136-T166 HydrophobicContact CD2-CG2 4.12Å; F136-T166 HydrophobicContact CE1-CG2 3.91Å; F136-T166 HydrophobicContact CE2-CG2 3.79Å; F136-T166 HydrophobicContact CG-CG2 4.33Å; F136-T166 HydrophobicContact CZ-CG2 3.7Å; F136-F168 AromaticContact CD1-CD2 3.85Å; F136-F168 HydrophobicContact CD1-CD2 3.85Å; F136-F168 AromaticContact CD1-CE2 3.99Å; F136-F168 HydrophobicContact CD1-CE2 3.99Å; F136-F168 HydrophobicContact CE1-CD2 4.16Å
137	K	97.2	Very high	96	Very high	56 Å²	56	48.8 Å²	48.8	24%	0.243	25%	0.245	C	C	.	.	H	α-helix	trans	-61.7	-46.5	-178.9	-175.6	54.5	174.9	166.3	0	111.5	H133 T134 L139 Y140 D141 F168 D171	H133-K137 PolarHBondContact O-N 3.11Å; T134-K137 PolarHBondContact O-N 3.11Å; K137-L139 VanDerWaalsContact C-N 3.3Å; K137-L139 PolarHBondContact O-N 3.17Å; K137-Y140 HydrophobicContact CD-CD1 4.23Å; K137-Y140 PolarHBondContact O-N 3.43Å; K137-D141 VanDerWaalsContact CE-OD1 3.3Å; K137-D141 WeakPolarHBondContact CE-OD1 3.43Å; K137-D141 VanDerWaalsContact CE-OD2 3.29Å; K137-D141 WeakPolarHBondContact CE-OD2 3.39Å; K137-D141 IonicContact NZ-OD1 3.48Å; K137-D141 PolarHBondContact NZ-OD1 2.96Å; K137-D141 IonicContact NZ-OD2 3.61Å; K137-D141 VanDerWaalsContact O-CG 3.31Å; K137-D141 PolarHBondContact O-N 2.98Å; K137-F168 HydrophobicContact CB-CD2 4.48Å; K137-F168 HydrophobicContact CB-CE1 4.23Å; K137-F168 HydrophobicContact CB-CE2 3.79Å; K137-F168 HydrophobicContact CB-CZ 3.64Å; K137-F168 HydrophobicContact CD-CD1 4.32Å; K137-F168 HydrophobicContact CD-CE1 4.35Å; K137-F168 HydrophobicContact CD-CG 4.44Å; K137-F168 HydrophobicContact CG-CE1 4.24Å; K137-F168 HydrophobicContact CG-CZ 4.17Å; K137-D171 IonicContact NZ-OD2 3.33Å; K137-D171 PolarHBondContact NZ-OD2 2.77Å
138	S	97.8	Very high	95.7	Very high	64 Å²	64	52.3 Å²	52.3	45%	0.448	26%	0.264	S	S	.	.	H	α-helix	trans	-60.8	-36.1	176.8	-60.4	0	0	0	0	113.4	T134 F136 Y142	T134-S138 PolarHBondContact O-N 3Å; T134-S138 VanDerWaalsContact O-N 3.09Å; T134-S138 PolarHBondContact O-OG 2.89Å; F136-S138 PolarHBondContact O-N 3.22Å; S138-Y142 WeakPolarHBondContact O-CB 3.41Å; S138-Y142 PolarHBondContact O-N 2.84Å
139	L	98	Very high	95.3	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-75.2	-39.9	175.8	179.6	60.7	0	0	0	111.7	L109 K112 L120 T123 L124 L127 E135 F136 K137 Y142 I143	L109-L139 HydrophobicContact CD2-CB 4.18Å; L109-L139 HydrophobicContact CD2-CD1 4.5Å; L109-L139 HydrophobicContact CD2-CD2 4.16Å; K112-L139 HydrophobicContact CD-CD1 4.07Å; L120-L139 HydrophobicContact CB-CD1 4.44Å; L120-L139 HydrophobicContact CD2-CD1 4.14Å; T123-L139 HydrophobicContact CG2-CD2 3.72Å; L124-L139 HydrophobicContact CB-CD2 4.11Å; L124-L139 HydrophobicContact CD1-CB 4.28Å; L124-L139 HydrophobicContact CD1-CD2 4.35Å; L124-L139 HydrophobicContact CD1-CG 4.29Å; L127-L139 HydrophobicContact CD1-CB 4.26Å; L127-L139 HydrophobicContact CD1-CD2 3.74Å; E135-L139 WeakPolarHBondContact O-CB 3.32Å; E135-L139 PolarHBondContact O-N 2.88Å; F136-L139 PolarHBondContact O-N 3.11Å; K137-L139 VanDerWaalsContact C-N 3.3Å; K137-L139 PolarHBondContact O-N 3.17Å; L139-Y142 HydrophobicContact CD1-CD1 4.32Å; L139-Y142 WeakPolarHBondContact O-CB 3.31Å; L139-Y142 PolarHBondContact O-N 2.94Å; L139-I143 HydrophobicContact CD1-CD1 4.1Å; L139-I143 HydrophobicContact CD1-CG1 4.16Å; L139-I143 HydrophobicContact CD2-CD1 4.44Å; L139-I143 HydrophobicContact CG-CD1 3.83Å; L139-I143 HydrophobicContact CG-CG1 4.35Å; L139-I143 VanDerWaalsContact O-CG1 3.26Å; L139-I143 WeakPolarHBondContact O-CG1 3.19Å; L139-I143 PolarHBondContact O-N 2.73Å
140	Y	96.3	Very high	95.1	Very high	7 Å²	7	60.4 Å²	60.4	3%	0.027	31%	0.311	C	S	.	.	H	α-helix	trans	-58.3	-52	176.9	173.6	-116.4	0	0	0	111.4	L124 F136 K137 Y142 I143 L144 V163 L175	L124-Y140 HydrophobicContact CD2-CD2 4.18Å; F136-Y140 VanDerWaalsContact O-CB 3.31Å; F136-Y140 WeakPolarHBondContact O-CB 3.33Å; F136-Y140 PolarHBondContact O-N 2.94Å; K137-Y140 HydrophobicContact CD-CD1 4.23Å; K137-Y140 PolarHBondContact O-N 3.43Å; Y140-Y142 VanDerWaalsContact C-N 3.29Å; Y140-Y142 PolarHBondContact O-N 2.59Å; Y140-I143 PolarHBondContact O-N 3.47Å; Y140-I143 VanDerWaalsContact O-N 3.13Å; Y140-L144 HydrophobicContact CD1-CD1 4.24Å; Y140-L144 HydrophobicContact CD2-CG 4.37Å; Y140-L144 HydrophobicContact CE1-CD1 3.66Å; Y140-L144 HydrophobicContact CE1-CG 4.46Å; Y140-L144 HydrophobicContact CE2-CD1 3.98Å; Y140-L144 HydrophobicContact CE2-CD2 4.18Å; Y140-L144 HydrophobicContact CE2-CG 3.99Å; Y140-L144 PolarHBondContact O-N 3.34Å; Y140-V163 HydrophobicContact CD2-CG2 3.93Å; Y140-V163 HydrophobicContact CE2-CG2 3.62Å; Y140-V163 HydrophobicContact CG-CG2 4.49Å; Y140-L175 WeakPolarHBondContact OH-CD1 3.48Å
141	D	95.6	Very high	94.8	Very high	62 Å²	62	61 Å²	61	33%	0.332	31%	0.314	S	S	.	.	H	α-helix	trans	-62.8	-38.4	178.9	-61	-24.8	0	0	0	110.9	K137 L144 L145	K137-D141 VanDerWaalsContact CE-OD1 3.3Å; K137-D141 WeakPolarHBondContact CE-OD1 3.43Å; K137-D141 VanDerWaalsContact CE-OD2 3.29Å; K137-D141 WeakPolarHBondContact CE-OD2 3.39Å; K137-D141 IonicContact NZ-OD1 3.48Å; K137-D141 PolarHBondContact NZ-OD1 2.96Å; K137-D141 IonicContact NZ-OD2 3.61Å; K137-D141 VanDerWaalsContact O-CG 3.31Å; K137-D141 PolarHBondContact O-N 2.98Å; D141-L144 PolarHBondContact O-N 2.57Å; D141-L145 WeakPolarHBondContact O-CG 3.32Å; D141-L145 PolarHBondContact O-N 3.31Å; D141-L145 VanDerWaalsContact O-N 3.12Å
142	Y	97.2	Very high	94.4	Very high	73 Å²	73	59.8 Å²	59.8	29%	0.286	31%	0.307	S	S	.	.	H	α-helix	trans	-61.2	-44.5	173.4	177.7	-94.2	0	0	0	112.5	K112 L120 S138 L139 Y140 L145 R146	K112-Y142 HydrophobicContact CB-CD1 4.44Å; K112-Y142 HydrophobicContact CB-CE1 3.93Å; K112-Y142 HydrophobicContact CD-CD1 4.31Å; K112-Y142 HydrophobicContact CD-CG 4.44Å; L120-Y142 HydrophobicContact CD1-CD1 4.29Å; L120-Y142 HydrophobicContact CD1-CE1 3.87Å; S138-Y142 WeakPolarHBondContact O-CB 3.41Å; S138-Y142 PolarHBondContact O-N 2.84Å; L139-Y142 HydrophobicContact CD1-CD1 4.32Å; L139-Y142 WeakPolarHBondContact O-CB 3.31Å; L139-Y142 PolarHBondContact O-N 2.94Å; Y140-Y142 VanDerWaalsContact C-N 3.29Å; Y140-Y142 PolarHBondContact O-N 2.59Å; Y142-L145 PolarHBondContact O-N 2.91Å; Y142-R146 VanDerWaalsContact O-CB 3.32Å; Y142-R146 WeakPolarHBondContact O-CB 3.36Å; Y142-R146 PolarHBondContact O-N 2.95Å; Y142-R146 PolarHBondContact OH-NH1 3.24Å; Y142-R146 VanDerWaalsContact OH-NH1 3.08Å
143	I	95.5	Very high	93.7	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-62.9	-47.1	176.8	-70.1	165.7	0	0	0	109.7	L120 M121 L124 L139 Y140 L145 R146 L147 M159	L120-I143 HydrophobicContact CB-CD1 3.87Å; L120-I143 HydrophobicContact CB-CG1 3.97Å; L120-I143 HydrophobicContact CD1-CG1 4.38Å; M121-I143 HydrophobicContact SD-CD1 4.09Å; M121-I143 HydrophobicContact SD-CG2 4.07Å; L124-I143 HydrophobicContact CB-CD1 4.21Å; L124-I143 HydrophobicContact CD2-CD1 4.21Å; L139-I143 HydrophobicContact CD1-CD1 4.1Å; L139-I143 HydrophobicContact CD1-CG1 4.16Å; L139-I143 HydrophobicContact CD2-CD1 4.44Å; L139-I143 HydrophobicContact CG-CD1 3.83Å; L139-I143 HydrophobicContact CG-CG1 4.35Å; L139-I143 VanDerWaalsContact O-CG1 3.26Å; L139-I143 WeakPolarHBondContact O-CG1 3.19Å; L139-I143 PolarHBondContact O-N 2.73Å; Y140-I143 PolarHBondContact O-N 3.47Å; Y140-I143 VanDerWaalsContact O-N 3.13Å; I143-L145 VanDerWaalsContact C-N 3.25Å; I143-L145 PolarHBondContact O-N 3.15Å; I143-R146 PolarHBondContact O-N 3.21Å; I143-L147 HydrophobicContact CG2-CD1 3.62Å; I143-L147 HydrophobicContact CG2-CD2 4.36Å; I143-L147 HydrophobicContact CG2-CG 3.77Å; I143-L147 WeakPolarHBondContact O-CG 3.3Å; I143-L147 PolarHBondContact O-N 3.2Å; I143-M159 HydrophobicContact CG2-SD 4.19Å
144	L	93	Very high	93.1	Very high	42 Å²	42	67.3 Å²	67.3	22%	0.22	35%	0.348	C	S	.	.	H	α-helix	trans	-58.6	-34.6	179.7	-73.9	-176.6	0	0	0	113.7	Y140 D141 K152 M159	Y140-L144 HydrophobicContact CD1-CD1 4.24Å; Y140-L144 HydrophobicContact CD2-CG 4.37Å; Y140-L144 HydrophobicContact CE1-CD1 3.66Å; Y140-L144 HydrophobicContact CE1-CG 4.46Å; Y140-L144 HydrophobicContact CE2-CD1 3.98Å; Y140-L144 HydrophobicContact CE2-CD2 4.18Å; Y140-L144 HydrophobicContact CE2-CG 3.99Å; Y140-L144 PolarHBondContact O-N 3.34Å; D141-L144 PolarHBondContact O-N 2.57Å; L144-K152 WeakPolarHBondContact O-CE 3.32Å; L144-K152 PolarHBondContact O-NZ 2.98Å; L144-M159 HydrophobicContact CD2-CE 4.41Å; L144-M159 HydrophobicContact CD2-SD 3.96Å
145	L	95.2	Very high	92.6	Very high	157 Å²	157	63.2 Å²	63.2	82%	0.822	32%	0.32	S	S	*	.	H	α-helix	trans	-76.2	-31.1	174.9	-69	172.4	0	0	0	112.7	D141 Y142 I143	D141-L145 WeakPolarHBondContact O-CG 3.32Å; D141-L145 PolarHBondContact O-N 3.31Å; D141-L145 VanDerWaalsContact O-N 3.12Å; Y142-L145 PolarHBondContact O-N 2.91Å; I143-L145 VanDerWaalsContact C-N 3.25Å; I143-L145 PolarHBondContact O-N 3.15Å
146	R	95.4	Very high	92	Very high	95 Å²	95	61.9 Å²	61.9	36%	0.358	31%	0.314	S	S	.	.	H	α-helix	trans	-79.5	-36.9	-177.7	-178	175.6	174.8	113.6	0.1	113.4	H115 N117 Y142 I143	H115-R146 PolarHBondContact O-NH2 2.93Å; N117-R146 WeakPolarHBondContact OD1-CD 3.3Å; N117-R146 PolarHBondContact OD1-NE 3.42Å; Y142-R146 VanDerWaalsContact O-CB 3.32Å; Y142-R146 WeakPolarHBondContact O-CB 3.36Å; Y142-R146 PolarHBondContact O-N 2.95Å; Y142-R146 PolarHBondContact OH-NH1 3.24Å; Y142-R146 VanDerWaalsContact OH-NH1 3.08Å; I143-R146 PolarHBondContact O-N 3.21Å
147	L	93.1	Very high	91.3	Very high	8 Å²	8	64.9 Å²	64.9	4%	0.042	33%	0.33	C	S	.	.	S	Bend	trans	-72.4	134.7	-175	-64.5	-176.5	0	0	0	112	N117 I143 E151 K152 F155 M159	N117-L147 HydrophobicContact CB-CD2 3.84Å; N117-L147 VanDerWaalsContact CG-CD2 3.47Å; N117-L147 WeakPolarHBondContact ND2-CD2 3.29Å; I143-L147 HydrophobicContact CG2-CD1 3.62Å; I143-L147 HydrophobicContact CG2-CD2 4.36Å; I143-L147 HydrophobicContact CG2-CG 3.77Å; I143-L147 WeakPolarHBondContact O-CG 3.3Å; I143-L147 PolarHBondContact O-N 3.2Å; L147-E151 HydrophobicContact CB-CB 4.17Å; L147-E151 HydrophobicContact CD2-CB 3.96Å; L147-E151 HydrophobicContact CG-CB 4.49Å; L147-K152 HydrophobicContact CB-CG 3.63Å; L147-K152 HydrophobicContact CD1-CG 4.3Å; L147-K152 VanDerWaalsContact O-CE 3.26Å; L147-K152 WeakPolarHBondContact O-CE 3.39Å; L147-F155 HydrophobicContact CD1-CB 4.19Å; L147-F155 HydrophobicContact CD1-CD2 3.96Å; L147-F155 HydrophobicContact CD1-CG 4.48Å; L147-F155 HydrophobicContact CD2-CD2 3.94Å; L147-F155 HydrophobicContact CD2-CE2 4.17Å; L147-M159 HydrophobicContact CD1-CE 4.06Å; L147-M159 HydrophobicContact CD1-SD 4.07Å
148	N	91.7	Very high	90.8	Very high	73 Å²	73	66.2 Å²	66.2	39%	0.39	34%	0.34	S	S	.	.			trans	-75.5	168	168.2	74.3	54.1	0	0	0	111.4	I150 E151 K152	N148-I150 VanDerWaalsContact C-N 3.29Å; N148-I150 PolarHBondContact O-N 3.14Å; N148-I150 WeakPolarHBondContact OD1-CA 3.32Å; N148-I150 WeakPolarHBondContact OD1-CB 3.46Å; N148-I150 PolarHBondContact OD1-N 3.5Å; N148-E151 PolarHBondContact N-OE2 3.38Å; N148-E151 VanDerWaalsContact N-OE2 3.08Å; N148-E151 VanDerWaalsContact ND2-CD 3.32Å; N148-E151 WeakPolarHBondContact ND2-CG 3.44Å; N148-E151 PolarHBondContact ND2-OE2 3.4Å; N148-E151 PolarHBondContact O-N 3.14Å; N148-E151 VanDerWaalsContact O-N 3.17Å; N148-E151 PolarHBondContact OD1-N 3.37Å; N148-K152 WeakPolarHBondContact O-CG 3.29Å; N148-K152 PolarHBondContact O-N 2.83Å
149	P	87.5	Confident	90.4	Very high	114 Å²	114	63.3 Å²	63.3	74%	0.74	32%	0.32	S	S	*	.	H	α-helix	trans	-57.1	-34.8	-176.8	-27.7	36.2	0	0	0	115.3	K153	P149-K153 PolarHBondContact O-N 2.73Å
150	I	87	Confident	90.1	Very high	132 Å²	132	63.3 Å²	63.3	68%	0.677	32%	0.32	S	S	*	.	H	α-helix	trans	-70.9	-46.2	178.3	-59.9	172.6	0	0	0	109.6	N148 K152 K153 V154	N148-I150 VanDerWaalsContact C-N 3.29Å; N148-I150 PolarHBondContact O-N 3.14Å; N148-I150 WeakPolarHBondContact OD1-CA 3.32Å; N148-I150 WeakPolarHBondContact OD1-CB 3.46Å; N148-I150 PolarHBondContact OD1-N 3.5Å; I150-K152 PolarHBondContact O-N 2.7Å; I150-K153 WeakPolarHBondContact O-CB 3.35Å; I150-K153 PolarHBondContact O-N 3.5Å; I150-V154 WeakPolarHBondContact O-CG2 3.45Å; I150-V154 PolarHBondContact O-N 3.03Å
151	E	87.7	Confident	89.8	Confident	54 Å²	54	66.5 Å²	66.5	25%	0.252	33%	0.334	S	S	.	.	H	α-helix	trans	-65.4	-38.3	177.7	-66	176.8	122.2	0	0	112.3	N117 L147 N148 K153 V154 F155	N117-E151 PolarHBondContact ND2-OE1 3.45Å; L147-E151 HydrophobicContact CB-CB 4.17Å; L147-E151 HydrophobicContact CD2-CB 3.96Å; L147-E151 HydrophobicContact CG-CB 4.49Å; N148-E151 PolarHBondContact N-OE2 3.38Å; N148-E151 VanDerWaalsContact N-OE2 3.08Å; N148-E151 VanDerWaalsContact ND2-CD 3.32Å; N148-E151 WeakPolarHBondContact ND2-CG 3.44Å; N148-E151 PolarHBondContact ND2-OE2 3.4Å; N148-E151 PolarHBondContact O-N 3.14Å; N148-E151 VanDerWaalsContact O-N 3.17Å; N148-E151 PolarHBondContact OD1-N 3.37Å; E151-K153 PolarHBondContact O-N 2.95Å; E151-V154 PolarHBondContact O-N 2.88Å; E151-F155 HydrophobicContact CB-CD2 4.26Å; E151-F155 HydrophobicContact CB-CE2 4.37Å; E151-F155 VanDerWaalsContact O-CD2 3.27Å; E151-F155 WeakPolarHBondContact O-CD2 2.8Å; E151-F155 PolarHBondContact O-N 3.11Å
152	K	86.6	Confident	89.7	Confident	88 Å²	88	64 Å²	64	38%	0.383	32%	0.321	S	S	.	.	H	α-helix	trans	-54.2	-43.8	173.1	-77	-176.7	179.4	-176.3	0	110.9	L144 L147 N148 I150 Q156	L144-K152 WeakPolarHBondContact O-CE 3.32Å; L144-K152 PolarHBondContact O-NZ 2.98Å; L147-K152 HydrophobicContact CB-CG 3.63Å; L147-K152 HydrophobicContact CD1-CG 4.3Å; L147-K152 VanDerWaalsContact O-CE 3.26Å; L147-K152 WeakPolarHBondContact O-CE 3.39Å; N148-K152 WeakPolarHBondContact O-CG 3.29Å; N148-K152 PolarHBondContact O-N 2.83Å; I150-K152 PolarHBondContact O-N 2.7Å; K152-Q156 WeakPolarHBondContact O-CA 3.18Å; K152-Q156 VanDerWaalsContact O-CB 3.27Å; K152-Q156 WeakPolarHBondContact O-CB 3.25Å; K152-Q156 PolarHBondContact O-N 2.83Å
153	K	83.4	Confident	89.6	Confident	116 Å²	116	60.6 Å²	60.6	50%	0.504	31%	0.308	S	S	.	.	H	α-helix	trans	-65.6	-39.9	175.9	-176.4	167.7	178.1	159.5	0	112.4	P149 I150 E151 E180	P149-K153 PolarHBondContact O-N 2.73Å; I150-K153 WeakPolarHBondContact O-CB 3.35Å; I150-K153 PolarHBondContact O-N 3.5Å; E151-K153 PolarHBondContact O-N 2.95Å; K153-E180 VanDerWaalsContact CE-OE2 3.27Å; K153-E180 WeakPolarHBondContact CE-OE2 3.33Å; K153-E180 IonicContact NZ-OE1 3.07Å; K153-E180 PolarHBondContact NZ-OE1 2.75Å; K153-E180 IonicContact NZ-OE2 3.89Å; K153-E180 PolarHBondContact NZ-OE2 2.72Å
154	V	83.9	Confident	89.5	Confident	101 Å²	101	60.6 Å²	60.6	61%	0.612	31%	0.308	S	S	*	.	H	α-helix	trans	-65.4	-43.8	177.9	172.9	0	0	0	0	111.9	I150 E151	I150-V154 WeakPolarHBondContact O-CG2 3.45Å; I150-V154 PolarHBondContact O-N 3.03Å; E151-V154 PolarHBondContact O-N 2.88Å
155	F	87	Confident	89.6	Confident	23 Å²	23	62 Å²	62	10%	0.101	31%	0.313	C	S	.	.	H	α-helix	trans	-90.9	-0.8	-176.3	-67.6	-64.9	0	0	0	114.2	N117 V118 M121 L147 E151 D157 D158 M159	N117-F155 HydrophobicContact CB-CE2 3.89Å; N117-F155 HydrophobicContact CB-CZ 4.14Å; V118-F155 HydrophobicContact CG2-CE1 4.11Å; V118-F155 HydrophobicContact CG2-CZ 3.86Å; M121-F155 HydrophobicContact CG-CB 4.44Å; M121-F155 HydrophobicContact CG-CD1 3.65Å; M121-F155 HydrophobicContact CG-CE1 4.02Å; M121-F155 HydrophobicContact CG-CG 4.04Å; M121-F155 HydrophobicContact SD-CB 4.37Å; L147-F155 HydrophobicContact CD1-CB 4.19Å; L147-F155 HydrophobicContact CD1-CD2 3.96Å; L147-F155 HydrophobicContact CD1-CG 4.48Å; L147-F155 HydrophobicContact CD2-CD2 3.94Å; L147-F155 HydrophobicContact CD2-CE2 4.17Å; E151-F155 HydrophobicContact CB-CD2 4.26Å; E151-F155 HydrophobicContact CB-CE2 4.37Å; E151-F155 VanDerWaalsContact O-CD2 3.27Å; E151-F155 WeakPolarHBondContact O-CD2 2.8Å; E151-F155 PolarHBondContact O-N 3.11Å; F155-D157 PolarHBondContact O-N 3.41Å; F155-D158 PolarHBondContact O-N 3.49Å; F155-M159 HydrophobicContact CB-CE 4.09Å; F155-M159 HydrophobicContact CB-CG 4.43Å; F155-M159 WeakPolarHBondContact O-CB 3.44Å; F155-M159 WeakPolarHBondContact O-CG 3.09Å; F155-M159 PolarHBondContact O-N 2.87Å
156	Q	85.3	Confident	89.6	Confident	34 Å²	34	54.5 Å²	54.5	16%	0.159	27%	0.274	C	S	.	.	H	α-helix	trans	-58.3	-44.9	-169.8	-156.3	176.5	3.3	0	0	113.1	K152 M159 A160 L175 W181	K152-Q156 WeakPolarHBondContact O-CA 3.18Å; K152-Q156 VanDerWaalsContact O-CB 3.27Å; K152-Q156 WeakPolarHBondContact O-CB 3.25Å; K152-Q156 PolarHBondContact O-N 2.83Å; Q156-M159 PolarHBondContact O-N 3.06Å; Q156-A160 WeakPolarHBondContact O-CB 3.33Å; Q156-A160 PolarHBondContact O-N 3.38Å; Q156-L175 PolarHBondContact NE2-O 3.38Å; Q156-W181 HydrophobicContact CB-CZ2 4.02Å; Q156-W181 HydrophobicContact CG-CZ2 3.69Å
157	D	84	Confident	89.7	Confident	64 Å²	64	52.3 Å²	52.3	34%	0.342	27%	0.272	S	S	.	.	H	α-helix	trans	-66.8	-44	179.8	176.5	60.5	0	0	0	112.3	F155 M159 A160 K161 W181	F155-D157 PolarHBondContact O-N 3.41Å; D157-M159 VanDerWaalsContact C-N 3.34Å; D157-M159 PolarHBondContact O-N 3.33Å; D157-A160 PolarHBondContact O-N 3.35Å; D157-K161 WeakPolarHBondContact O-CB 3.31Å; D157-K161 WeakPolarHBondContact O-CG 3.3Å; D157-K161 PolarHBondContact O-N 3.37Å; D157-K161 VanDerWaalsContact OD1-CE 3.24Å; D157-K161 WeakPolarHBondContact OD1-CE 3.31Å; D157-K161 IonicContact OD1-NZ 2.72Å; D157-K161 PolarHBondContact OD1-NZ 3.45Å; D157-K161 VanDerWaalsContact OD2-CE 3.32Å; D157-K161 WeakPolarHBondContact OD2-CE 3.46Å; D157-K161 IonicContact OD2-NZ 3.62Å; D157-K161 PolarHBondContact OD2-NZ 2.87Å; D157-W181 HydrophobicContact CB-CH2 4.25Å
158	D	85.9	Confident	89.8	Confident	84 Å²	84	54.3 Å²	54.3	45%	0.449	28%	0.281	S	S	.	.	H	α-helix	trans	-64.4	-38.8	175.8	-77.5	-26.5	0	0	0	112.1	M121 F155 S162	M121-D158 HydrophobicContact CE-CB 3.8Å; F155-D158 PolarHBondContact O-N 3.49Å; D158-S162 WeakPolarHBondContact O-CB 3.49Å; D158-S162 PolarHBondContact O-N 3.45Å; D158-S162 VanDerWaalsContact O-N 3.07Å; D158-S162 PolarHBondContact O-OG 2.86Å
159	M	89.6	Confident	90	Very high	3 Å²	3	51 Å²	51	2%	0.015	26%	0.263	C	S	.	.	H	α-helix	trans	-63.6	-51	173.1	-75.6	-171.9	-65.2	0	0	110.7	M121 I143 L144 L147 F155 Q156 D157 K161 S162 V163	M121-M159 HydrophobicContact CE-CB 4.15Å; M121-M159 HydrophobicContact CE-CG 3.32Å; M121-M159 HydrophobicContact SD-CG 3.6Å; M121-M159 VanDerWaalsContact SD-CG 3.6Å; M121-M159 HydrophobicContact SD-SD 4.35Å; I143-M159 HydrophobicContact CG2-SD 4.19Å; L144-M159 HydrophobicContact CD2-CE 4.41Å; L144-M159 HydrophobicContact CD2-SD 3.96Å; L147-M159 HydrophobicContact CD1-CE 4.06Å; L147-M159 HydrophobicContact CD1-SD 4.07Å; F155-M159 HydrophobicContact CB-CE 4.09Å; F155-M159 HydrophobicContact CB-CG 4.43Å; F155-M159 WeakPolarHBondContact O-CB 3.44Å; F155-M159 WeakPolarHBondContact O-CG 3.09Å; F155-M159 PolarHBondContact O-N 2.87Å; Q156-M159 PolarHBondContact O-N 3.06Å; D157-M159 VanDerWaalsContact C-N 3.34Å; D157-M159 PolarHBondContact O-N 3.33Å; M159-K161 PolarHBondContact O-N 2.88Å; M159-S162 PolarHBondContact O-N 3.04Å; M159-S162 VanDerWaalsContact O-N 3.11Å; M159-V163 VanDerWaalsContact O-CG2 3.31Å; M159-V163 WeakPolarHBondContact O-CG2 3.34Å; M159-V163 PolarHBondContact O-N 3.23Å
160	A	90.9	Very high	90.3	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-58.1	-47.3	-179.7	0	0	0	0	0	111.4	Q156 D157 S162 V163 A164 I172 W181 I189	Q156-A160 WeakPolarHBondContact O-CB 3.33Å; Q156-A160 PolarHBondContact O-N 3.38Å; D157-A160 PolarHBondContact O-N 3.35Å; A160-S162 VanDerWaalsContact C-N 3.31Å; A160-S162 PolarHBondContact O-N 2.82Å; A160-V163 PolarHBondContact O-N 2.99Å; A160-A164 WeakPolarHBondContact O-CB 3.3Å; A160-A164 PolarHBondContact O-N 3.09Å; A160-I172 WeakPolarHBondContact O-CD1 3.32Å; A160-W181 HydrophobicContact CB-CH2 4.25Å; A160-I189 HydrophobicContact CB-CD1 3.87Å; A160-I189 HydrophobicContact CB-CG1 4.46Å
161	K	90.3	Very high	90.5	Very high	74 Å²	74	45.8 Å²	45.8	32%	0.322	22%	0.223	S	C	.	.	H	α-helix	trans	-59.2	-40.5	175.3	-74.4	169.2	179.1	163.7	0	112.8	D157 M159 I189	D157-K161 WeakPolarHBondContact O-CB 3.31Å; D157-K161 WeakPolarHBondContact O-CG 3.3Å; D157-K161 PolarHBondContact O-N 3.37Å; D157-K161 VanDerWaalsContact OD1-CE 3.24Å; D157-K161 WeakPolarHBondContact OD1-CE 3.31Å; D157-K161 IonicContact OD1-NZ 2.72Å; D157-K161 PolarHBondContact OD1-NZ 3.45Å; D157-K161 VanDerWaalsContact OD2-CE 3.32Å; D157-K161 WeakPolarHBondContact OD2-CE 3.46Å; D157-K161 IonicContact OD2-NZ 3.62Å; D157-K161 PolarHBondContact OD2-NZ 2.87Å; M159-K161 PolarHBondContact O-N 2.88Å; K161-I189 HydrophobicContact CG-CG1 3.92Å
162	S	92.9	Very high	90.6	Very high	10 Å²	10	43.2 Å²	43.2	7%	0.07	21%	0.211	C	C	.	.	H	α-helix	trans	-69.5	-45.2	179.9	-58.8	0	0	0	0	111.5	D158 M159 A160 A164 T166	D158-S162 WeakPolarHBondContact O-CB 3.49Å; D158-S162 PolarHBondContact O-N 3.45Å; D158-S162 VanDerWaalsContact O-N 3.07Å; D158-S162 PolarHBondContact O-OG 2.86Å; M159-S162 PolarHBondContact O-N 3.04Å; M159-S162 VanDerWaalsContact O-N 3.11Å; A160-S162 VanDerWaalsContact C-N 3.31Å; A160-S162 PolarHBondContact O-N 2.82Å; S162-A164 VanDerWaalsContact C-N 3.31Å; S162-A164 PolarHBondContact O-N 2.72Å; S162-T166 WeakPolarHBondContact O-CG2 3.15Å
163	V	95.2	Very high	90.6	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-65.7	-35.6	177.8	174.8	0	0	0	0	110.9	F136 Y140 M159 A160 Q165 T166 F168 D171 I172	F136-V163 HydrophobicContact CE1-CG2 4.13Å; F136-V163 HydrophobicContact CZ-CG2 4.09Å; Y140-V163 HydrophobicContact CD2-CG2 3.93Å; Y140-V163 HydrophobicContact CE2-CG2 3.62Å; Y140-V163 HydrophobicContact CG-CG2 4.49Å; M159-V163 VanDerWaalsContact O-CG2 3.31Å; M159-V163 WeakPolarHBondContact O-CG2 3.34Å; M159-V163 PolarHBondContact O-N 3.23Å; A160-V163 PolarHBondContact O-N 2.99Å; V163-Q165 PolarHBondContact O-N 3.36Å; V163-T166 PolarHBondContact O-N 3.04Å; V163-T166 PolarHBondContact O-OG1 3.47Å; V163-F168 HydrophobicContact CG1-CB 4.28Å; V163-F168 WeakPolarHBondContact CG1-O 3.4Å; V163-D171 HydrophobicContact CG1-CB 4.26Å; V163-I172 HydrophobicContact CB-CG1 4.25Å; V163-I172 HydrophobicContact CG1-CD1 4.39Å; V163-I172 HydrophobicContact CG1-CG1 3.92Å
164	A	94.9	Very high	90.5	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-20.6	-176	0	0	0	0	0	113.6	A160 S162 I172 I189 H192 M193 S196	A160-A164 WeakPolarHBondContact O-CB 3.3Å; A160-A164 PolarHBondContact O-N 3.09Å; S162-A164 VanDerWaalsContact C-N 3.31Å; S162-A164 PolarHBondContact O-N 2.72Å; A164-I172 HydrophobicContact CB-CD1 3.31Å; A164-I189 HydrophobicContact CB-CG2 4.35Å; A164-H192 HydrophobicContact CB-CB 3.49Å; A164-H192 VanDerWaalsContact CB-CB 3.49Å; A164-H192 CarbonylContact O-C 3.54Å; A164-H192 VanDerWaalsContact O-O 3.13Å; A164-M193 HydrophobicContact CB-CG 4.21Å; A164-S196 VanDerWaalsContact O-CB 3.23Å; A164-S196 WeakPolarHBondContact O-CB 3.31Å; A164-S196 PolarHBondContact O-OG 3.41Å
165	Q	93.4	Very high	90.2	Very high	71 Å²	71	40.2 Å²	40.2	33%	0.332	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	12.6	-178.5	-62.9	178.2	-7.8	0	0	112.7	V163 H192 S196	V163-Q165 PolarHBondContact O-N 3.36Å; Q165-H192 HydrophobicContact CG-CB 4.04Å; Q165-H192 PolarHBondContact NE2-CD2 3.3Å; Q165-H192 PolarHBondContact NE2-CE1 3.05Å; Q165-H192 PolarHBondContact NE2-NE2 2.76Å; Q165-S196 VanDerWaalsContact CA-OG 3.3Å; Q165-S196 WeakPolarHBondContact CA-OG 3.41Å
166	T	96.5	Very high	89.7	Confident	0 Å²	0	40 Å²	40	0%	0	19%	0.193	C	C	.	.	S	Bend	trans	-126	169.6	-173.9	72.2	0	0	0	0	111.9	F136 S162 V163 F168 W169	F136-T166 HydrophobicContact CD1-CG2 4.21Å; F136-T166 HydrophobicContact CD2-CG2 4.12Å; F136-T166 HydrophobicContact CE1-CG2 3.91Å; F136-T166 HydrophobicContact CE2-CG2 3.79Å; F136-T166 HydrophobicContact CG-CG2 4.33Å; F136-T166 HydrophobicContact CZ-CG2 3.7Å; S162-T166 WeakPolarHBondContact O-CG2 3.15Å; V163-T166 PolarHBondContact O-N 3.04Å; V163-T166 PolarHBondContact O-OG1 3.47Å; T166-F168 PolarHBondContact O-N 3.31Å; T166-F168 VanDerWaalsContact O-N 3.07Å; T166-F168 WeakPolarHBondContact OG1-CD2 3.4Å; T166-F168 PolarHBondContact OG1-N 3.01Å; T166-W169 WeakPolarHBondContact O-CB 3.5Å; T166-W169 PolarHBondContact O-N 3.03Å; T166-W169 VanDerWaalsContact O-N 3.17Å
167	P	96.8	Very high	89	Confident	50 Å²	50	43 Å²	43	33%	0.325	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-18.7	171.6	-24.6	33.6	0	0	0	114.3	H133 W169 F200	H133-P167 HydrophobicContact CB-CG 4.45Å; H133-P167 WeakPolarHBondContact ND1-CD 3.47Å; P167-W169 VanDerWaalsContact C-N 3.26Å; P167-W169 PolarHBondContact O-N 3.13Å; P167-F200 HydrophobicContact CB-CB 4.34Å; P167-F200 HydrophobicContact CB-CD1 4.35Å; P167-F200 HydrophobicContact CB-CG 4.2Å; P167-F200 HydrophobicContact CG-CD1 3.71Å; P167-F200 HydrophobicContact CG-CD2 4.27Å; P167-F200 HydrophobicContact CG-CE1 3.76Å; P167-F200 HydrophobicContact CG-CE2 4.33Å; P167-F200 HydrophobicContact CG-CG 3.95Å; P167-F200 HydrophobicContact CG-CZ 4.06Å
168	F	95.8	Very high	88.3	Confident	50 Å²	50	41.9 Å²	41.9	22%	0.219	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	15.5	-179.5	-42.7	-66.3	0	0	0	113	H133 F136 K137 V163 T166 R170 D171	H133-F168 HydrophobicContact CB-CE2 4.08Å; H133-F168 HydrophobicContact CB-CZ 4.24Å; H133-F168 WeakPolarHBondContact O-CE2 3.17Å; F136-F168 AromaticContact CD1-CD2 3.85Å; F136-F168 HydrophobicContact CD1-CD2 3.85Å; F136-F168 AromaticContact CD1-CE2 3.99Å; F136-F168 HydrophobicContact CD1-CE2 3.99Å; F136-F168 HydrophobicContact CE1-CD2 4.16Å; K137-F168 HydrophobicContact CB-CD2 4.48Å; K137-F168 HydrophobicContact CB-CE1 4.23Å; K137-F168 HydrophobicContact CB-CE2 3.79Å; K137-F168 HydrophobicContact CB-CZ 3.64Å; K137-F168 HydrophobicContact CD-CD1 4.32Å; K137-F168 HydrophobicContact CD-CE1 4.35Å; K137-F168 HydrophobicContact CD-CG 4.44Å; K137-F168 HydrophobicContact CG-CE1 4.24Å; K137-F168 HydrophobicContact CG-CZ 4.17Å; V163-F168 HydrophobicContact CG1-CB 4.28Å; V163-F168 WeakPolarHBondContact CG1-O 3.4Å; T166-F168 PolarHBondContact O-N 3.31Å; T166-F168 VanDerWaalsContact O-N 3.07Å; T166-F168 WeakPolarHBondContact OG1-CD2 3.4Å; T166-F168 PolarHBondContact OG1-N 3.01Å; F168-R170 PolarHBondContact O-N 3.08Å; F168-D171 VanDerWaalsContact O-CB 3.3Å; F168-D171 WeakPolarHBondContact O-CB 3.43Å; F168-D171 PolarHBondContact O-N 3.27Å
169	W	95.5	Very high	86.8	Confident	4 Å²	4	41.9 Å²	41.9	2%	0.015	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-54.6	-26.1	-175.5	67.2	-91.6	0	0	0	113.7	T166 P167 D171 I172 F173 M193 A197 D201 C209	T166-W169 WeakPolarHBondContact O-CB 3.5Å; T166-W169 PolarHBondContact O-N 3.03Å; T166-W169 VanDerWaalsContact O-N 3.17Å; P167-W169 VanDerWaalsContact C-N 3.26Å; P167-W169 PolarHBondContact O-N 3.13Å; W169-D171 VanDerWaalsContact C-N 3.3Å; W169-D171 PolarHBondContact O-N 2.88Å; W169-I172 VanDerWaalsContact O-CB 3.23Å; W169-I172 WeakPolarHBondContact O-CB 3.42Å; W169-I172 WeakPolarHBondContact O-CD1 3.46Å; W169-I172 VanDerWaalsContact O-CG1 3.25Å; W169-I172 WeakPolarHBondContact O-CG1 3.21Å; W169-I172 PolarHBondContact O-N 3.28Å; W169-F173 HydrophobicContact CE3-CE2 4.45Å; W169-F173 HydrophobicContact CH2-CE2 4.48Å; W169-F173 AromaticContact CZ3-CE2 3.72Å; W169-F173 HydrophobicContact CZ3-CE2 3.72Å; W169-F173 AromaticContact CZ3-CZ 3.99Å; W169-F173 HydrophobicContact CZ3-CZ 3.99Å; W169-M193 HydrophobicContact CE3-CB 4.18Å; W169-M193 HydrophobicContact CE3-CE 3.85Å; W169-M193 HydrophobicContact CE3-CG 4.27Å; W169-M193 HydrophobicContact CZ3-CE 3.93Å; W169-A197 HydrophobicContact CH2-CB 4.36Å; W169-A197 HydrophobicContact CZ2-CB 3.96Å; W169-D201 HydrophobicContact CZ2-CB 4.17Å; W169-D201 WeakPolarHBondContact CZ2-OD2 3.5Å; W169-C209 WeakPolarHBondContact CZ3-SG 3.16Å
170	R	93.7	Very high	85.4	Confident	94 Å²	94	46.5 Å²	46.5	36%	0.355	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-67.5	-26	176.8	-70.3	-171.1	171.6	-82.1	3.7	113.6	F168 I172 F173 D201 S205 E208	F168-R170 PolarHBondContact O-N 3.08Å; R170-I172 PolarHBondContact O-N 3.35Å; R170-F173 WeakPolarHBondContact O-CD2 3.19Å; R170-F173 PolarHBondContact O-N 2.89Å; R170-D201 IonicContact CZ-OD2 3.24Å; R170-D201 IonicContact NE-OD2 2.73Å; R170-D201 PolarHBondContact NE-OD2 2.64Å; R170-D201 IonicContact NH2-OD2 2.9Å; R170-D201 PolarHBondContact NH2-OD2 3.08Å; R170-S205 VanDerWaalsContact NH2-CB 3.28Å; R170-S205 PolarHBondContact NH2-OG 3.35Å; R170-E208 IonicContact CZ-OE2 3.56Å; R170-E208 IonicContact NH1-OE2 3.05Å; R170-E208 PolarHBondContact NH1-OE2 2.89Å; R170-E208 VanDerWaalsContact NH1-OE2 3.14Å; R170-E208 IonicContact NH2-OE2 3.21Å
171	D	91.7	Very high	84.1	Confident	42 Å²	42	47.4 Å²	47.4	23%	0.225	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-58.8	-18.9	175.3	-65.6	12.8	0	0	0	111.2	K137 V163 F168 W169 F173 E174 L175	K137-D171 IonicContact NZ-OD2 3.33Å; K137-D171 PolarHBondContact NZ-OD2 2.77Å; V163-D171 HydrophobicContact CG1-CB 4.26Å; F168-D171 VanDerWaalsContact O-CB 3.3Å; F168-D171 WeakPolarHBondContact O-CB 3.43Å; F168-D171 PolarHBondContact O-N 3.27Å; W169-D171 VanDerWaalsContact C-N 3.3Å; W169-D171 PolarHBondContact O-N 2.88Å; D171-F173 VanDerWaalsContact C-N 3.3Å; D171-F173 PolarHBondContact O-N 3.31Å; D171-E174 PolarHBondContact O-N 2.96Å; D171-L175 PolarHBondContact O-N 2.87Å
172	I	90	Very high	82.7	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-63.2	-34.4	176.6	-66.7	174.5	0	0	0	112.3	A160 V163 A164 W169 R170 E174 L175 L176 I189 M193	A160-I172 WeakPolarHBondContact O-CD1 3.32Å; V163-I172 HydrophobicContact CB-CG1 4.25Å; V163-I172 HydrophobicContact CG1-CD1 4.39Å; V163-I172 HydrophobicContact CG1-CG1 3.92Å; A164-I172 HydrophobicContact CB-CD1 3.31Å; W169-I172 VanDerWaalsContact O-CB 3.23Å; W169-I172 WeakPolarHBondContact O-CB 3.42Å; W169-I172 WeakPolarHBondContact O-CD1 3.46Å; W169-I172 VanDerWaalsContact O-CG1 3.25Å; W169-I172 WeakPolarHBondContact O-CG1 3.21Å; W169-I172 PolarHBondContact O-N 3.28Å; R170-I172 PolarHBondContact O-N 3.35Å; I172-E174 PolarHBondContact O-N 2.66Å; I172-L175 CarbonylContact O-C 3.53Å; I172-L175 WeakPolarHBondContact O-CA 3.5Å; I172-L175 WeakPolarHBondContact O-CB 3.31Å; I172-L175 PolarHBondContact O-N 3.45Å; I172-L176 HydrophobicContact CG2-CD1 3.35Å; I172-L176 HydrophobicContact CG2-CD2 4.32Å; I172-L176 HydrophobicContact CG2-CG 3.49Å; I172-L176 VanDerWaalsContact CG2-CG 3.49Å; I172-L176 WeakPolarHBondContact O-CB 3.47Å; I172-L176 VanDerWaalsContact O-CG 3.28Å; I172-L176 WeakPolarHBondContact O-CG 3.46Å; I172-L176 PolarHBondContact O-N 3.29Å; I172-I189 HydrophobicContact CD1-CG2 4.11Å; I172-I189 HydrophobicContact CG2-CG2 4Å; I172-M193 HydrophobicContact CB-SD 4.31Å; I172-M193 HydrophobicContact CD1-CG 3.83Å; I172-M193 HydrophobicContact CD1-SD 4.11Å; I172-M193 HydrophobicContact CG2-SD 3.86Å
173	F	86.6	Confident	81.3	Confident	59 Å²	59	62.4 Å²	62.4	26%	0.259	30%	0.304	S	S	.	.	H	α-helix	trans	-61.3	-34	-179.4	-65.9	-56.2	0	0	0	111.8	W169 R170 D171 S177 M193 K212	W169-F173 HydrophobicContact CE3-CE2 4.45Å; W169-F173 HydrophobicContact CH2-CE2 4.48Å; W169-F173 AromaticContact CZ3-CE2 3.72Å; W169-F173 HydrophobicContact CZ3-CE2 3.72Å; W169-F173 AromaticContact CZ3-CZ 3.99Å; W169-F173 HydrophobicContact CZ3-CZ 3.99Å; R170-F173 WeakPolarHBondContact O-CD2 3.19Å; R170-F173 PolarHBondContact O-N 2.89Å; D171-F173 VanDerWaalsContact C-N 3.3Å; D171-F173 PolarHBondContact O-N 3.31Å; F173-S177 PolarHBondContact O-N 3.42Å; F173-M193 HydrophobicContact CD1-CE 4.14Å; F173-M193 HydrophobicContact CE1-CE 3.39Å; F173-M193 HydrophobicContact CE2-CE 4Å; F173-M193 HydrophobicContact CZ-CE 3.33Å; F173-K212 HydrophobicContact CE1-CD 3.84Å; F173-K212 HydrophobicContact CZ-CD 4.42Å
174	E	81.4	Confident	79.9	Confident	154 Å²	154	65.7 Å²	65.7	72%	0.72	33%	0.327	S	S	*	.	H	α-helix	trans	-69.3	-44.7	172.2	-60.4	-175.2	172.2	0	0	111.1	D171 I172 L176 S177	D171-E174 PolarHBondContact O-N 2.96Å; I172-E174 PolarHBondContact O-N 2.66Å; E174-L176 VanDerWaalsContact C-N 3.3Å; E174-L176 PolarHBondContact O-N 3.01Å; E174-S177 WeakPolarHBondContact O-CB 3.35Å; E174-S177 PolarHBondContact O-N 3.28Å; E174-S177 PolarHBondContact O-OG 2.91Å
175	L	77.5	Confident	78.8	Confident	28 Å²	28	71.8 Å²	71.8	15%	0.147	36%	0.359	C	S	.	.	H	α-helix	trans	-60.8	-35.4	176.6	-68.2	175.3	0	0	0	113	Y140 Q156 D171 I172	Y140-L175 WeakPolarHBondContact OH-CD1 3.48Å; Q156-L175 PolarHBondContact NE2-O 3.38Å; D171-L175 PolarHBondContact O-N 2.87Å; I172-L175 CarbonylContact O-C 3.53Å; I172-L175 WeakPolarHBondContact O-CA 3.5Å; I172-L175 WeakPolarHBondContact O-CB 3.31Å; I172-L175 PolarHBondContact O-N 3.45Å
176	L	76.1	Confident	78.2	Confident	19 Å²	19	69.2 Å²	69.2	10%	0.099	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-3.8	-175.8	-65.4	-175	0	0	0	114.1	I172 E174 S178 W181 Y190	I172-L176 HydrophobicContact CG2-CD1 3.35Å; I172-L176 HydrophobicContact CG2-CD2 4.32Å; I172-L176 HydrophobicContact CG2-CG 3.49Å; I172-L176 VanDerWaalsContact CG2-CG 3.49Å; I172-L176 WeakPolarHBondContact O-CB 3.47Å; I172-L176 VanDerWaalsContact O-CG 3.28Å; I172-L176 WeakPolarHBondContact O-CG 3.46Å; I172-L176 PolarHBondContact O-N 3.29Å; E174-L176 VanDerWaalsContact C-N 3.3Å; E174-L176 PolarHBondContact O-N 3.01Å; L176-S178 PolarHBondContact O-N 2.9Å; L176-W181 HydrophobicContact CD2-CD2 3.41Å; L176-W181 VanDerWaalsContact CD2-CD2 3.41Å; L176-W181 HydrophobicContact CD2-CE3 3.09Å; L176-W181 HydrophobicContact CD2-CG 4.11Å; L176-W181 HydrophobicContact CD2-CH2 3.81Å; L176-W181 HydrophobicContact CD2-CZ2 4.13Å; L176-W181 HydrophobicContact CD2-CZ3 3.31Å; L176-Y190 HydrophobicContact CD1-CE1 4.37Å
177	S	70.2	Confident	77.6	Confident	96 Å²	96	70.4 Å²	70.4	67%	0.671	36%	0.356	S	S	*	.			trans	-64.2	-9.8	-173.6	61.9	0	0	0	0	115.1	F173 E174	F173-S177 PolarHBondContact O-N 3.42Å; E174-S177 WeakPolarHBondContact O-CB 3.35Å; E174-S177 PolarHBondContact O-N 3.28Å; E174-S177 PolarHBondContact O-OG 2.91Å
178	S	68.9	Low	77.2	Confident	41 Å²	41	69.2 Å²	69.2	29%	0.287	35%	0.351	S	S	.	.	S	Bend	trans	-80.8	148.7	-176.8	80.1	0	0	0	0	113.7	L176 E180 W181	L176-S178 PolarHBondContact O-N 2.9Å; S178-E180 PolarHBondContact O-N 3.12Å; S178-W181 PolarHBondContact O-N 3.46Å; S178-W181 VanDerWaalsContact OG-CD1 3.27Å
179	S	55.8	Low	77	Confident	84 Å²	84	67 Å²	67	59%	0.587	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-62.9	-25.8	-177.2	56	0	0	0	0	114.1	W181	S179-W181 VanDerWaalsContact C-N 3.32Å; S179-W181 PolarHBondContact O-N 3.12Å
180	E	59.8	Low	76.8	Confident	100 Å²	100	68.5 Å²	68.5	47%	0.467	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-68	-31.7	179.8	-62.5	-173.7	145.7	0	0	112.1	K153 S178 R182 K183	K153-E180 VanDerWaalsContact CE-OE2 3.27Å; K153-E180 WeakPolarHBondContact CE-OE2 3.33Å; K153-E180 IonicContact NZ-OE1 3.07Å; K153-E180 PolarHBondContact NZ-OE1 2.75Å; K153-E180 IonicContact NZ-OE2 3.89Å; K153-E180 PolarHBondContact NZ-OE2 2.72Å; S178-E180 PolarHBondContact O-N 3.12Å; E180-R182 VanDerWaalsContact C-N 3.31Å; E180-R182 PolarHBondContact O-N 3.36Å; E180-K183 PolarHBondContact O-N 3.48Å
181	W	63	Low	76.9	Confident	19 Å²	19	64.6 Å²	64.6	7%	0.072	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-71.6	-22.6	-176.8	-88.3	77.4	0	0	0	114.5	Q156 D157 A160 L176 S178 S179 K183 C184 N186 I189	Q156-W181 HydrophobicContact CB-CZ2 4.02Å; Q156-W181 HydrophobicContact CG-CZ2 3.69Å; D157-W181 HydrophobicContact CB-CH2 4.25Å; A160-W181 HydrophobicContact CB-CH2 4.25Å; L176-W181 HydrophobicContact CD2-CD2 3.41Å; L176-W181 VanDerWaalsContact CD2-CD2 3.41Å; L176-W181 HydrophobicContact CD2-CE3 3.09Å; L176-W181 HydrophobicContact CD2-CG 4.11Å; L176-W181 HydrophobicContact CD2-CH2 3.81Å; L176-W181 HydrophobicContact CD2-CZ2 4.13Å; L176-W181 HydrophobicContact CD2-CZ3 3.31Å; S178-W181 PolarHBondContact O-N 3.46Å; S178-W181 VanDerWaalsContact OG-CD1 3.27Å; S179-W181 VanDerWaalsContact C-N 3.32Å; S179-W181 PolarHBondContact O-N 3.12Å; W181-K183 PolarHBondContact O-N 3.49Å; W181-K183 VanDerWaalsContact O-N 3.13Å; W181-C184 PolarHBondContact O-N 3.26Å; W181-N186 WeakPolarHBondContact CZ3-OD1 3.08Å; W181-N186 PolarHBondContact O-ND2 3.05Å; W181-I189 HydrophobicContact CH2-CD1 3.71Å; W181-I189 HydrophobicContact CZ3-CD1 3.52Å
182	R	61.5	Low	77	Confident	215 Å²	215	64.8 Å²	64.8	81%	0.811	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-64.7	-12.6	174.4	-73.6	-172.4	-106.8	-172.7	-5.6	113.3	E180	E180-R182 VanDerWaalsContact C-N 3.31Å; E180-R182 PolarHBondContact O-N 3.36Å
183	K	61.9	Low	77.3	Confident	184 Å²	184	64.8 Å²	64.8	80%	0.8	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-96.6	-11.5	178.4	-61.4	-176.7	179.6	-179.1	0	113.7	E180 W181	E180-K183 PolarHBondContact O-N 3.48Å; W181-K183 PolarHBondContact O-N 3.49Å; W181-K183 VanDerWaalsContact O-N 3.13Å
184	C	66.6	Low	77.8	Confident	70 Å²	70	62 Å²	62	47%	0.473	32%	0.32	S	S	.	.	S	Bend	trans	-95.2	148.9	-177.2	-65	0	0	0	0	111.3	W181 N186	W181-C184 PolarHBondContact O-N 3.26Å; C184-N186 WeakPolarHBondContact CB-OD1 3.17Å; C184-N186 PolarHBondContact O-N 3.29Å; C184-N186 VanDerWaalsContact O-N 3.17Å
185	D	72.1	Confident	78.5	Confident	128 Å²	128	55.6 Å²	55.6	68%	0.684	29%	0.292	S	S	*	.			trans	-75.5	101.5	168.7	-179.7	12.5	0	0	0	109.9	S187	D185-S187 WeakPolarHBondContact OD1-CB 3.4Å; D185-S187 PolarHBondContact OD1-N 3.49Å; D185-S187 PolarHBondContact OD1-OG 2.98Å
186	N	79.9	Confident	79.4	Confident	17 Å²	17	54.5 Å²	54.5	9%	0.091	29%	0.287	C	S	.	.			trans	-96	10.6	-178.3	-55.1	-33.4	0	0	0	112.5	W181 C184 A188 I189 Y190	W181-N186 WeakPolarHBondContact CZ3-OD1 3.08Å; W181-N186 PolarHBondContact O-ND2 3.05Å; C184-N186 WeakPolarHBondContact CB-OD1 3.17Å; C184-N186 PolarHBondContact O-N 3.29Å; C184-N186 VanDerWaalsContact O-N 3.17Å; N186-A188 VanDerWaalsContact C-N 3.25Å; N186-A188 PolarHBondContact O-N 3.32Å; N186-I189 PolarHBondContact O-N 3.16Å; N186-Y190 HydrophobicContact CB-CD2 3.99Å; N186-Y190 HydrophobicContact CB-CE2 3.82Å; N186-Y190 WeakPolarHBondContact O-CD2 3.31Å; N186-Y190 PolarHBondContact O-N 3.44Å; N186-Y190 VanDerWaalsContact O-N 3.11Å
187	S	84	Confident	80.5	Confident	25 Å²	25	53.6 Å²	53.6	18%	0.175	28%	0.282	C	S	.	.	H	α-helix	trans	-55.2	-42.3	-172.9	-56.5	0	0	0	0	111.8	D185 I189 Y190 E191	D185-S187 WeakPolarHBondContact OD1-CB 3.4Å; D185-S187 PolarHBondContact OD1-N 3.49Å; D185-S187 PolarHBondContact OD1-OG 2.98Å; S187-I189 VanDerWaalsContact C-N 3.31Å; S187-I189 PolarHBondContact O-N 3.34Å; S187-Y190 PolarHBondContact O-N 3.2Å; S187-E191 VanDerWaalsContact O-CG 3.3Å; S187-E191 WeakPolarHBondContact O-CG 3.42Å; S187-E191 PolarHBondContact O-N 2.96Å
188	A	88.3	Confident	81.7	Confident	25 Å²	25	49.4 Å²	49.4	21%	0.207	25%	0.252	C	S	.	.	H	α-helix	trans	-64.2	-30.8	178.2	0	0	0	0	0	113.8	N186 H192	N186-A188 VanDerWaalsContact C-N 3.25Å; N186-A188 PolarHBondContact O-N 3.32Å; A188-H192 PolarHBondContact O-N 3.35Å; A188-H192 PolarHBondContact O-ND1 3.18Å
189	I	91.6	Very high	83	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-73.8	-46.5	176.9	-68.7	163.3	0	0	0	109.4	A160 K161 A164 I172 W181 N186 S187 E191 H192 M193	A160-I189 HydrophobicContact CB-CD1 3.87Å; A160-I189 HydrophobicContact CB-CG1 4.46Å; K161-I189 HydrophobicContact CG-CG1 3.92Å; A164-I189 HydrophobicContact CB-CG2 4.35Å; I172-I189 HydrophobicContact CD1-CG2 4.11Å; I172-I189 HydrophobicContact CG2-CG2 4Å; W181-I189 HydrophobicContact CH2-CD1 3.71Å; W181-I189 HydrophobicContact CZ3-CD1 3.52Å; N186-I189 PolarHBondContact O-N 3.16Å; S187-I189 VanDerWaalsContact C-N 3.31Å; S187-I189 PolarHBondContact O-N 3.34Å; I189-E191 VanDerWaalsContact C-N 3.3Å; I189-E191 PolarHBondContact O-N 3.47Å; I189-H192 PolarHBondContact O-N 3.43Å; I189-H192 VanDerWaalsContact O-N 3.16Å; I189-M193 HydrophobicContact CG2-CG 4.46Å; I189-M193 HydrophobicContact CG2-SD 4Å; I189-M193 WeakPolarHBondContact O-CG 3.49Å; I189-M193 PolarHBondContact O-N 2.93Å
190	Y	92.5	Very high	84.9	Confident	37 Å²	37	51.6 Å²	51.6	15%	0.145	25%	0.246	C	C	.	.	H	α-helix	trans	-62.5	-35.5	176.7	-72.9	-61.1	0	0	0	112.5	L176 N186 S187 M193 C194 K212	L176-Y190 HydrophobicContact CD1-CE1 4.37Å; N186-Y190 HydrophobicContact CB-CD2 3.99Å; N186-Y190 HydrophobicContact CB-CE2 3.82Å; N186-Y190 WeakPolarHBondContact O-CD2 3.31Å; N186-Y190 PolarHBondContact O-N 3.44Å; N186-Y190 VanDerWaalsContact O-N 3.11Å; S187-Y190 PolarHBondContact O-N 3.2Å; Y190-M193 HydrophobicContact CD1-CE 4.15Å; Y190-M193 HydrophobicContact CD1-SD 3.65Å; Y190-M193 HydrophobicContact CE1-CE 4.23Å; Y190-M193 HydrophobicContact CE1-SD 4.01Å; Y190-M193 WeakPolarHBondContact O-CB 3.23Å; Y190-M193 PolarHBondContact O-N 2.86Å; Y190-C194 PolarHBondContact O-N 3.35Å; Y190-C194 PolarHBondContact O-SG 2.93Å; Y190-K212 HydrophobicContact CD1-CB 3.77Å; Y190-K212 HydrophobicContact CD1-CD 4.26Å; Y190-K212 HydrophobicContact CE1-CB 3.64Å; Y190-K212 HydrophobicContact CE1-CD 3.65Å; Y190-K212 HydrophobicContact CE1-CG 4.28Å; Y190-K212 HydrophobicContact CE2-CB 4.38Å; Y190-K212 HydrophobicContact CG-CB 4.23Å
191	E	94.8	Very high	86.6	Confident	11 Å²	11	49.7 Å²	49.7	5%	0.051	24%	0.239	C	C	.	.	H	α-helix	trans	-61.3	-43.9	172.3	-75.1	176.4	167.6	0	0	112.5	S187 I189 M193 C194 S195 L213 P217 R218 V221	S187-E191 VanDerWaalsContact O-CG 3.3Å; S187-E191 WeakPolarHBondContact O-CG 3.42Å; S187-E191 PolarHBondContact O-N 2.96Å; I189-E191 VanDerWaalsContact C-N 3.3Å; I189-E191 PolarHBondContact O-N 3.47Å; E191-M193 VanDerWaalsContact C-N 3.34Å; E191-C194 WeakPolarHBondContact O-CB 3.5Å; E191-C194 PolarHBondContact O-N 3.47Å; E191-S195 PolarHBondContact O-N 2.84Å; E191-S195 VanDerWaalsContact O-N 3.1Å; E191-S195 PolarHBondContact O-OG 3.44Å; E191-L213 HydrophobicContact CG-CD2 3.99Å; E191-P217 HydrophobicContact CG-CB 4.2Å; E191-R218 WeakPolarHBondContact OE1-CG 3.43Å; E191-R218 PolarHBondContact OE1-N 3.44Å; E191-R218 VanDerWaalsContact OE2-CD 3.27Å; E191-R218 WeakPolarHBondContact OE2-CD 3.27Å; E191-R218 IonicContact OE2-CZ 2.73Å; E191-R218 IonicContact OE2-NE 3.7Å; E191-R218 PolarHBondContact OE2-NE 2.5Å; E191-R218 IonicContact OE2-NH1 2.63Å; E191-V221 HydrophobicContact CB-CG2 3.99Å; E191-V221 HydrophobicContact CG-CG2 4.12Å
192	H	94.8	Very high	88.1	Confident	46 Å²	46	52.3 Å²	52.3	21%	0.213	26%	0.257	C	S	.	.	H	α-helix	trans	-64.3	-40.2	173.9	-68.4	132.9	0	0	0	111.7	A164 Q165 A188 I189 C194 S195 S196	A164-H192 HydrophobicContact CB-CB 3.49Å; A164-H192 VanDerWaalsContact CB-CB 3.49Å; A164-H192 CarbonylContact O-C 3.54Å; A164-H192 VanDerWaalsContact O-O 3.13Å; Q165-H192 HydrophobicContact CG-CB 4.04Å; Q165-H192 PolarHBondContact NE2-CD2 3.3Å; Q165-H192 PolarHBondContact NE2-CE1 3.05Å; Q165-H192 PolarHBondContact NE2-NE2 2.76Å; A188-H192 PolarHBondContact O-N 3.35Å; A188-H192 PolarHBondContact O-ND1 3.18Å; I189-H192 PolarHBondContact O-N 3.43Å; I189-H192 VanDerWaalsContact O-N 3.16Å; H192-C194 VanDerWaalsContact C-N 3.35Å; H192-C194 PolarHBondContact O-N 3.22Å; H192-S195 PolarHBondContact O-N 2.82Å; H192-S196 WeakPolarHBondContact O-CB 3.33Å; H192-S196 PolarHBondContact O-N 3.14Å; H192-S196 PolarHBondContact O-OG 3.37Å
193	M	96	Very high	89.8	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-61.1	-42.4	174.9	-68.5	167.7	66.5	0	0	111.7	A164 W169 I172 F173 I189 Y190 E191 S195 S196 A197 C209	A164-M193 HydrophobicContact CB-CG 4.21Å; W169-M193 HydrophobicContact CE3-CB 4.18Å; W169-M193 HydrophobicContact CE3-CE 3.85Å; W169-M193 HydrophobicContact CE3-CG 4.27Å; W169-M193 HydrophobicContact CZ3-CE 3.93Å; I172-M193 HydrophobicContact CB-SD 4.31Å; I172-M193 HydrophobicContact CD1-CG 3.83Å; I172-M193 HydrophobicContact CD1-SD 4.11Å; I172-M193 HydrophobicContact CG2-SD 3.86Å; F173-M193 HydrophobicContact CD1-CE 4.14Å; F173-M193 HydrophobicContact CE1-CE 3.39Å; F173-M193 HydrophobicContact CE2-CE 4Å; F173-M193 HydrophobicContact CZ-CE 3.33Å; I189-M193 HydrophobicContact CG2-CG 4.46Å; I189-M193 HydrophobicContact CG2-SD 4Å; I189-M193 WeakPolarHBondContact O-CG 3.49Å; I189-M193 PolarHBondContact O-N 2.93Å; Y190-M193 HydrophobicContact CD1-CE 4.15Å; Y190-M193 HydrophobicContact CD1-SD 3.65Å; Y190-M193 HydrophobicContact CE1-CE 4.23Å; Y190-M193 HydrophobicContact CE1-SD 4.01Å; Y190-M193 WeakPolarHBondContact O-CB 3.23Å; Y190-M193 PolarHBondContact O-N 2.86Å; E191-M193 VanDerWaalsContact C-N 3.34Å; M193-S195 VanDerWaalsContact C-N 3.34Å; M193-S195 PolarHBondContact O-N 3.42Å; M193-S196 PolarHBondContact O-N 3.05Å; M193-A197 VanDerWaalsContact O-CB 3.3Å; M193-A197 WeakPolarHBondContact O-CB 3.43Å; M193-A197 PolarHBondContact O-N 3.36Å; M193-C209 HydrophobicContact CB-CB 4.44Å
194	C	97.1	Very high	91.5	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-57.6	-48.3	174.7	-65.4	0	0	0	0	111	Y190 E191 H192 S196 A197 L198 F206 C209 M210 V221	Y190-C194 PolarHBondContact O-N 3.35Å; Y190-C194 PolarHBondContact O-SG 2.93Å; E191-C194 WeakPolarHBondContact O-CB 3.5Å; E191-C194 PolarHBondContact O-N 3.47Å; H192-C194 VanDerWaalsContact C-N 3.35Å; H192-C194 PolarHBondContact O-N 3.22Å; C194-S196 PolarHBondContact O-N 2.88Å; C194-A197 PolarHBondContact O-N 3.48Å; C194-L198 PolarHBondContact O-N 2.71Å; C194-L198 VanDerWaalsContact O-N 3.12Å; C194-F206 HydrophobicContact CB-CD2 3.89Å; C194-F206 HydrophobicContact CB-CE2 3.92Å; C194-C209 HydrophobicContact CB-CB 4.42Å; C194-C209 WeakPolarHBondContact SG-CB 3.23Å; C194-M210 HydrophobicContact CB-SD 4.16Å; C194-V221 HydrophobicContact CB-CG1 3.73Å
195	S	96.3	Very high	93	Very high	20 Å²	20	35.9 Å²	35.9	14%	0.14	20%	0.196	C	C	.	.	H	α-helix	trans	-63.5	-41.8	-179.8	-47.1	0	0	0	0	111.5	E191 H192 M193 L198 K199	E191-S195 PolarHBondContact O-N 2.84Å; E191-S195 VanDerWaalsContact O-N 3.1Å; E191-S195 PolarHBondContact O-OG 3.44Å; H192-S195 PolarHBondContact O-N 2.82Å; M193-S195 VanDerWaalsContact C-N 3.34Å; M193-S195 PolarHBondContact O-N 3.42Å; S195-L198 PolarHBondContact O-N 3.41Å; S195-K199 WeakPolarHBondContact O-CB 3.07Å; S195-K199 PolarHBondContact O-N 3.42Å; S195-K199 VanDerWaalsContact O-N 3.12Å
196	S	96.9	Very high	94.2	Very high	6 Å²	6	29.9 Å²	29.9	4%	0.042	16%	0.163	C	C	.	.	H	α-helix	trans	-69.2	-36.2	176	-72.5	0	0	0	0	113.3	A164 Q165 H192 M193 C194 L198 K199 F200	A164-S196 VanDerWaalsContact O-CB 3.23Å; A164-S196 WeakPolarHBondContact O-CB 3.31Å; A164-S196 PolarHBondContact O-OG 3.41Å; Q165-S196 VanDerWaalsContact CA-OG 3.3Å; Q165-S196 WeakPolarHBondContact CA-OG 3.41Å; H192-S196 WeakPolarHBondContact O-CB 3.33Å; H192-S196 PolarHBondContact O-N 3.14Å; H192-S196 PolarHBondContact O-OG 3.37Å; M193-S196 PolarHBondContact O-N 3.05Å; C194-S196 PolarHBondContact O-N 2.88Å; S196-L198 VanDerWaalsContact C-N 3.34Å; S196-L198 PolarHBondContact O-N 3.34Å; S196-K199 PolarHBondContact O-N 3.3Å; S196-F200 WeakPolarHBondContact O-CB 3.25Å; S196-F200 WeakPolarHBondContact O-CD2 3.46Å; S196-F200 PolarHBondContact O-N 3.28Å
197	A	97.6	Very high	95.1	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-61.8	-43	175	0	0	0	0	0	111	W169 M193 C194 K199 D201 F206	W169-A197 HydrophobicContact CH2-CB 4.36Å; W169-A197 HydrophobicContact CZ2-CB 3.96Å; M193-A197 VanDerWaalsContact O-CB 3.3Å; M193-A197 WeakPolarHBondContact O-CB 3.43Å; M193-A197 PolarHBondContact O-N 3.36Å; C194-A197 PolarHBondContact O-N 3.48Å; A197-K199 VanDerWaalsContact C-N 3.3Å; A197-K199 PolarHBondContact O-N 2.93Å; A197-D201 CarbonylContact O-C 3.54Å; A197-D201 VanDerWaalsContact O-CA 3.31Å; A197-D201 WeakPolarHBondContact O-CA 3.4Å; A197-D201 WeakPolarHBondContact O-CB 3.41Å; A197-D201 PolarHBondContact O-N 3.23Å; A197-F206 HydrophobicContact CB-CB 4.18Å
198	L	96.7	Very high	95.6	Very high	7 Å²	7	31.9 Å²	31.9	4%	0.037	17%	0.169	C	C	.	.	H	α-helix	trans	-64	-35.2	173.7	-70	169.3	0	0	0	113.1	C194 S195 S196 F203 F206 D224 F225 K228	C194-L198 PolarHBondContact O-N 2.71Å; C194-L198 VanDerWaalsContact O-N 3.12Å; S195-L198 PolarHBondContact O-N 3.41Å; S196-L198 VanDerWaalsContact C-N 3.34Å; S196-L198 PolarHBondContact O-N 3.34Å; L198-F203 HydrophobicContact CD2-CD1 3.73Å; L198-F203 HydrophobicContact CD2-CE1 3.63Å; L198-F206 HydrophobicContact CD1-CD2 3.6Å; L198-F206 HydrophobicContact CD1-CE2 3.62Å; L198-F206 HydrophobicContact CD1-CG 4.29Å; L198-F206 HydrophobicContact CD1-CZ 4.36Å; L198-F206 HydrophobicContact CD2-CB 3.84Å; L198-F206 HydrophobicContact CD2-CD1 4.15Å; L198-F206 HydrophobicContact CD2-CD2 3.86Å; L198-F206 HydrophobicContact CD2-CE2 4.42Å; L198-F206 HydrophobicContact CD2-CG 3.68Å; L198-F206 HydrophobicContact CG-CB 4.01Å; L198-F206 HydrophobicContact CG-CD2 3.47Å; L198-F206 VanDerWaalsContact CG-CD2 3.47Å; L198-F206 HydrophobicContact CG-CE2 4.04Å; L198-F206 HydrophobicContact CG-CG 3.8Å; L198-D224 HydrophobicContact CD1-CB 4Å; L198-F225 HydrophobicContact CD1-CB 4.01Å; L198-F225 HydrophobicContact CD2-CD2 4.11Å; L198-K228 WeakPolarHBondContact O-CE 3.43Å; L198-K228 PolarHBondContact O-NZ 2.91Å
199	K	95	Very high	95.9	Very high	107 Å²	107	30.7 Å²	30.7	47%	0.465	16%	0.16	S	C	.	.	H	α-helix	trans	-79.6	-41.4	-176.8	-172.6	173.6	173.7	-175.5	0	113	S195 S196 A197	S195-K199 WeakPolarHBondContact O-CB 3.07Å; S195-K199 PolarHBondContact O-N 3.42Å; S195-K199 VanDerWaalsContact O-N 3.12Å; S196-K199 PolarHBondContact O-N 3.3Å; A197-K199 VanDerWaalsContact C-N 3.3Å; A197-K199 PolarHBondContact O-N 2.93Å
200	F	95.9	Very high	96.1	Very high	65 Å²	65	30.6 Å²	30.6	29%	0.285	16%	0.159	S	C	.	.	H	α-helix	trans	-121	-6	-165.8	-54.7	-63.9	0	0	0	114.6	H133 P167 S196	H133-F200 AromaticContact NE2-CZ 3.95Å; P167-F200 HydrophobicContact CB-CB 4.34Å; P167-F200 HydrophobicContact CB-CD1 4.35Å; P167-F200 HydrophobicContact CB-CG 4.2Å; P167-F200 HydrophobicContact CG-CD1 3.71Å; P167-F200 HydrophobicContact CG-CD2 4.27Å; P167-F200 HydrophobicContact CG-CE1 3.76Å; P167-F200 HydrophobicContact CG-CE2 4.33Å; P167-F200 HydrophobicContact CG-CG 3.95Å; P167-F200 HydrophobicContact CG-CZ 4.06Å; S196-F200 WeakPolarHBondContact O-CB 3.25Å; S196-F200 WeakPolarHBondContact O-CD2 3.46Å; S196-F200 PolarHBondContact O-N 3.28Å
201	D	95.9	Very high	96.1	Very high	60 Å²	60	33.6 Å²	33.6	32%	0.321	17%	0.174	S	C	.	.	S	Bend	trans	-138.4	-145.6	-176.9	-159.1	-29.2	0	0	0	109.4	W169 R170 A197 S205	W169-D201 HydrophobicContact CZ2-CB 4.17Å; W169-D201 WeakPolarHBondContact CZ2-OD2 3.5Å; R170-D201 IonicContact CZ-OD2 3.24Å; R170-D201 IonicContact NE-OD2 2.73Å; R170-D201 PolarHBondContact NE-OD2 2.64Å; R170-D201 IonicContact NH2-OD2 2.9Å; R170-D201 PolarHBondContact NH2-OD2 3.08Å; A197-D201 CarbonylContact O-C 3.54Å; A197-D201 VanDerWaalsContact O-CA 3.31Å; A197-D201 WeakPolarHBondContact O-CA 3.4Å; A197-D201 WeakPolarHBondContact O-CB 3.41Å; A197-D201 PolarHBondContact O-N 3.23Å; D201-S205 PolarHBondContact OD1-OG 2.68Å; D201-S205 VanDerWaalsContact OD1-OG 3.07Å; D201-S205 PolarHBondContact OD2-OG 3.43Å
202	T	95.6	Very high	95.9	Very high	73 Å²	73	36.9 Å²	36.9	45%	0.448	19%	0.188	S	C	.	.			trans	-110.1	159.9	-171.1	51.9	0	0	0	0	112.2	S204 S205 F206	T202-S204 PolarHBondContact O-N 2.99Å; T202-S205 WeakPolarHBondContact O-CB 3.07Å; T202-S205 PolarHBondContact O-N 2.58Å; T202-S205 PolarHBondContact OG1-N 3.42Å; T202-S205 PolarHBondContact OG1-OG 2.77Å; T202-F206 PolarHBondContact O-N 3.05Å; T202-F206 VanDerWaalsContact O-N 3.09Å
203	F	97.3	Very high	95.6	Very high	30 Å²	30	35.1 Å²	35.1	13%	0.132	18%	0.18	C	C	.	.	H	α-helix	trans	-59.9	-33.6	171.9	-75.2	-77	0	0	0	113.1	L198 S205 F206 F207 F225 K228 L229 L232 L240	L198-F203 HydrophobicContact CD2-CD1 3.73Å; L198-F203 HydrophobicContact CD2-CE1 3.63Å; F203-S205 VanDerWaalsContact C-N 3.27Å; F203-S205 PolarHBondContact O-N 3.31Å; F203-F206 WeakPolarHBondContact O-CB 3.49Å; F203-F206 PolarHBondContact O-N 3.25Å; F203-F206 VanDerWaalsContact O-N 3.16Å; F203-F207 HydrophobicContact CB-CE2 4.19Å; F203-F207 WeakPolarHBondContact O-CD2 3.48Å; F203-F207 WeakPolarHBondContact O-CG 3.29Å; F203-F207 PolarHBondContact O-N 2.59Å; F203-F225 HydrophobicContact CD1-CD2 4.25Å; F203-F225 AromaticContact CD1-CE2 3.91Å; F203-F225 HydrophobicContact CD1-CE2 3.91Å; F203-F225 HydrophobicContact CE1-CD2 4.04Å; F203-F225 AromaticContact CE1-CE2 3.9Å; F203-F225 HydrophobicContact CE1-CE2 3.9Å; F203-K228 HydrophobicContact CE1-CB 4.42Å; F203-K228 HydrophobicContact CE1-CG 4.06Å; F203-K228 HydrophobicContact CE2-CG 4.28Å; F203-K228 HydrophobicContact CZ-CB 4.16Å; F203-K228 HydrophobicContact CZ-CG 3.5Å; F203-K228 VanDerWaalsContact CZ-CG 3.5Å; F203-L229 HydrophobicContact CE1-CD2 3.95Å; F203-L229 HydrophobicContact CZ-CD2 3.93Å; F203-L232 HydrophobicContact CD2-CD1 4.41Å; F203-L232 HydrophobicContact CE2-CD1 3.42Å; F203-L232 VanDerWaalsContact CE2-CD1 3.42Å; F203-L232 HydrophobicContact CE2-CG 4.48Å; F203-L232 HydrophobicContact CZ-CD1 3.69Å; F203-L240 HydrophobicContact CB-CD2 3.63Å; F203-L240 HydrophobicContact CD1-CD1 3.98Å; F203-L240 HydrophobicContact CD1-CD2 4.16Å; F203-L240 HydrophobicContact CD2-CD1 3.64Å; F203-L240 HydrophobicContact CD2-CD2 4.24Å; F203-L240 HydrophobicContact CE1-CD1 3.99Å; F203-L240 HydrophobicContact CE2-CD1 3.67Å; F203-L240 HydrophobicContact CG-CD1 3.8Å; F203-L240 HydrophobicContact CG-CD2 3.77Å; F203-L240 HydrophobicContact CG-CG 4.42Å; F203-L240 HydrophobicContact CZ-CD1 3.83Å
204	S	97.3	Very high	94.8	Very high	91 Å²	91	41.2 Å²	41.2	64%	0.636	21%	0.213	S	C	*	.	H	α-helix	trans	-56.4	-44.2	172.8	-176.8	0	0	0	0	111.5	T202 F207 E208	T202-S204 PolarHBondContact O-N 2.99Å; S204-F207 PolarHBondContact O-N 2.74Å; S204-E208 PolarHBondContact O-N 2.87Å
205	S	97.2	Very high	94.2	Very high	4 Å²	4	42.7 Å²	42.7	3%	0.028	23%	0.228	C	C	.	.	H	α-helix	trans	-67.9	-35.8	177.5	-53.9	0	0	0	0	112.8	R170 D201 T202 F203 E208 C209	R170-S205 VanDerWaalsContact NH2-CB 3.28Å; R170-S205 PolarHBondContact NH2-OG 3.35Å; D201-S205 PolarHBondContact OD1-OG 2.68Å; D201-S205 VanDerWaalsContact OD1-OG 3.07Å; D201-S205 PolarHBondContact OD2-OG 3.43Å; T202-S205 WeakPolarHBondContact O-CB 3.07Å; T202-S205 PolarHBondContact O-N 2.58Å; T202-S205 PolarHBondContact OG1-N 3.42Å; T202-S205 PolarHBondContact OG1-OG 2.77Å; F203-S205 VanDerWaalsContact C-N 3.27Å; F203-S205 PolarHBondContact O-N 3.31Å; S205-E208 WeakPolarHBondContact O-CB 3.36Å; S205-E208 PolarHBondContact O-N 3.47Å; S205-C209 PolarHBondContact O-N 3.3Å; S205-C209 VanDerWaalsContact O-N 3.14Å; S205-C209 PolarHBondContact O-SG 3.39Å
206	F	97.8	Very high	93.8	Very high	1 Å²	1	44 Å²	44	0%	0.004	24%	0.237	C	C	.	.	H	α-helix	trans	-60	-50.5	171.7	164.5	-102.6	0	0	0	110.7	C194 A197 L198 T202 F203 E208 C209 M210 V221 F225	C194-F206 HydrophobicContact CB-CD2 3.89Å; C194-F206 HydrophobicContact CB-CE2 3.92Å; A197-F206 HydrophobicContact CB-CB 4.18Å; L198-F206 HydrophobicContact CD1-CD2 3.6Å; L198-F206 HydrophobicContact CD1-CE2 3.62Å; L198-F206 HydrophobicContact CD1-CG 4.29Å; L198-F206 HydrophobicContact CD1-CZ 4.36Å; L198-F206 HydrophobicContact CD2-CB 3.84Å; L198-F206 HydrophobicContact CD2-CD1 4.15Å; L198-F206 HydrophobicContact CD2-CD2 3.86Å; L198-F206 HydrophobicContact CD2-CE2 4.42Å; L198-F206 HydrophobicContact CD2-CG 3.68Å; L198-F206 HydrophobicContact CG-CB 4.01Å; L198-F206 HydrophobicContact CG-CD2 3.47Å; L198-F206 VanDerWaalsContact CG-CD2 3.47Å; L198-F206 HydrophobicContact CG-CE2 4.04Å; L198-F206 HydrophobicContact CG-CG 3.8Å; T202-F206 PolarHBondContact O-N 3.05Å; T202-F206 VanDerWaalsContact O-N 3.09Å; F203-F206 WeakPolarHBondContact O-CB 3.49Å; F203-F206 PolarHBondContact O-N 3.25Å; F203-F206 VanDerWaalsContact O-N 3.16Å; F206-E208 VanDerWaalsContact C-N 3.34Å; F206-E208 PolarHBondContact O-N 3.26Å; F206-C209 WeakPolarHBondContact O-CB 3.5Å; F206-C209 PolarHBondContact O-N 3Å; F206-C209 VanDerWaalsContact O-N 3.09Å; F206-M210 HydrophobicContact CD1-CG 4.18Å; F206-M210 HydrophobicContact CD2-CG 4.09Å; F206-M210 HydrophobicContact CD2-SD 4.39Å; F206-M210 HydrophobicContact CE1-CG 3.8Å; F206-M210 HydrophobicContact CE1-SD 4.36Å; F206-M210 HydrophobicContact CE2-CG 3.72Å; F206-M210 HydrophobicContact CE2-SD 3.56Å; F206-M210 VanDerWaalsContact CE2-SD 3.56Å; F206-M210 HydrophobicContact CG-CG 4.33Å; F206-M210 HydrophobicContact CZ-CE 3.97Å; F206-M210 HydrophobicContact CZ-CG 3.57Å; F206-M210 HydrophobicContact CZ-SD 3.54Å; F206-M210 VanDerWaalsContact CZ-SD 3.54Å; F206-M210 VanDerWaalsContact O-CG 3.28Å; F206-M210 WeakPolarHBondContact O-CG 3.34Å; F206-M210 PolarHBondContact O-N 3.41Å; F206-V221 HydrophobicContact CE2-CG1 3.82Å; F206-V221 HydrophobicContact CZ-CG1 4.41Å; F206-F225 AromaticContact CD1-CD2 3.87Å; F206-F225 HydrophobicContact CD1-CD2 3.87Å; F206-F225 HydrophobicContact CD1-CE2 4.12Å; F206-F225 HydrophobicContact CE1-CB 4.49Å; F206-F225 AromaticContact CE1-CD2 3.29Å; F206-F225 HydrophobicContact CE1-CD2 3.29Å; F206-F225 AromaticContact CE1-CE2 3.69Å; F206-F225 HydrophobicContact CE1-CE2 3.69Å; F206-F225 HydrophobicContact CE1-CG 4.08Å; F206-F225 HydrophobicContact CZ-CB 4.01Å; F206-F225 AromaticContact CZ-CD2 3.69Å; F206-F225 HydrophobicContact CZ-CD2 3.69Å; F206-F225 HydrophobicContact CZ-CE2 4.48Å; F206-F225 HydrophobicContact CZ-CG 4.07Å
207	F	97.9	Very high	93.6	Very high	11 Å²	11	44.1 Å²	44.1	5%	0.048	24%	0.238	C	C	.	.	H	α-helix	trans	-63.8	-37.7	178.8	-64.7	-48.7	0	0	0	112.7	F203 S204 C209 M210 H211 F225 L240 Q243 L244 I247	F203-F207 HydrophobicContact CB-CE2 4.19Å; F203-F207 WeakPolarHBondContact O-CD2 3.48Å; F203-F207 WeakPolarHBondContact O-CG 3.29Å; F203-F207 PolarHBondContact O-N 2.59Å; S204-F207 PolarHBondContact O-N 2.74Å; F207-C209 VanDerWaalsContact C-N 3.25Å; F207-C209 PolarHBondContact O-N 2.99Å; F207-M210 PolarHBondContact O-N 3.26Å; F207-H211 PolarHBondContact O-CD2 3.46Å; F207-H211 PolarHBondContact O-N 3.19Å; F207-F225 HydrophobicContact CE1-CE2 4.1Å; F207-F225 HydrophobicContact CE1-CZ 4.5Å; F207-F225 AromaticContact CZ-CE2 3.94Å; F207-F225 HydrophobicContact CZ-CE2 3.94Å; F207-F225 HydrophobicContact CZ-CZ 4.29Å; F207-L240 HydrophobicContact CE2-CD2 3.68Å; F207-L240 HydrophobicContact CZ-CB 4.46Å; F207-L240 HydrophobicContact CZ-CD2 4.1Å; F207-L240 WeakPolarHBondContact CZ-O 3.36Å; F207-Q243 HydrophobicContact CD2-CB 4.49Å; F207-Q243 VanDerWaalsContact CD2-OE1 3.27Å; F207-Q243 HydrophobicContact CE1-CB 4.16Å; F207-Q243 HydrophobicContact CE2-CB 3.89Å; F207-Q243 HydrophobicContact CE2-CG 4.48Å; F207-Q243 HydrophobicContact CZ-CB 3.7Å; F207-L244 HydrophobicContact CE1-CB 4.18Å; F207-I247 HydrophobicContact CB-CD1 3.8Å; F207-I247 HydrophobicContact CD1-CD1 3.27Å; F207-I247 HydrophobicContact CE1-CD1 4.09Å; F207-I247 HydrophobicContact CG-CD1 3.82Å
208	E	95.5	Very high	93.4	Very high	74 Å²	74	51.2 Å²	51.2	35%	0.346	27%	0.265	S	S	.	.	H	α-helix	trans	-53.6	-43.2	171.3	-167.9	-156.9	150.3	0	0	111.7	R170 S204 S205 F206	R170-E208 IonicContact CZ-OE2 3.56Å; R170-E208 IonicContact NH1-OE2 3.05Å; R170-E208 PolarHBondContact NH1-OE2 2.89Å; R170-E208 VanDerWaalsContact NH1-OE2 3.14Å; R170-E208 IonicContact NH2-OE2 3.21Å; S204-E208 PolarHBondContact O-N 2.87Å; S205-E208 WeakPolarHBondContact O-CB 3.36Å; S205-E208 PolarHBondContact O-N 3.47Å; F206-E208 VanDerWaalsContact C-N 3.34Å; F206-E208 PolarHBondContact O-N 3.26Å
209	C	94.7	Very high	93.2	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-71.8	-40.8	177.5	-63.8	0	0	0	0	112.3	W169 M193 C194 S205 F206 F207 H211 K212	W169-C209 WeakPolarHBondContact CZ3-SG 3.16Å; M193-C209 HydrophobicContact CB-CB 4.44Å; C194-C209 HydrophobicContact CB-CB 4.42Å; C194-C209 WeakPolarHBondContact SG-CB 3.23Å; S205-C209 PolarHBondContact O-N 3.3Å; S205-C209 VanDerWaalsContact O-N 3.14Å; S205-C209 PolarHBondContact O-SG 3.39Å; F206-C209 WeakPolarHBondContact O-CB 3.5Å; F206-C209 PolarHBondContact O-N 3Å; F206-C209 VanDerWaalsContact O-N 3.09Å; F207-C209 VanDerWaalsContact C-N 3.25Å; F207-C209 PolarHBondContact O-N 2.99Å; C209-H211 VanDerWaalsContact C-N 3.27Å; C209-H211 PolarHBondContact O-N 3.47Å; C209-K212 WeakPolarHBondContact O-CB 3.48Å; C209-K212 PolarHBondContact O-N 3.34Å
210	M	95.2	Very high	93.2	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-59.9	-38.4	179.7	-66.9	-71	-71.6	0	0	111.7	C194 F206 F207 K212 L213 P217 V221 L244 I247 W253	C194-M210 HydrophobicContact CB-SD 4.16Å; F206-M210 HydrophobicContact CD1-CG 4.18Å; F206-M210 HydrophobicContact CD2-CG 4.09Å; F206-M210 HydrophobicContact CD2-SD 4.39Å; F206-M210 HydrophobicContact CE1-CG 3.8Å; F206-M210 HydrophobicContact CE1-SD 4.36Å; F206-M210 HydrophobicContact CE2-CG 3.72Å; F206-M210 HydrophobicContact CE2-SD 3.56Å; F206-M210 VanDerWaalsContact CE2-SD 3.56Å; F206-M210 HydrophobicContact CG-CG 4.33Å; F206-M210 HydrophobicContact CZ-CE 3.97Å; F206-M210 HydrophobicContact CZ-CG 3.57Å; F206-M210 HydrophobicContact CZ-SD 3.54Å; F206-M210 VanDerWaalsContact CZ-SD 3.54Å; F206-M210 VanDerWaalsContact O-CG 3.28Å; F206-M210 WeakPolarHBondContact O-CG 3.34Å; F206-M210 PolarHBondContact O-N 3.41Å; F207-M210 PolarHBondContact O-N 3.26Å; M210-K212 PolarHBondContact O-N 3.11Å; M210-K212 VanDerWaalsContact O-N 3.16Å; M210-L213 HydrophobicContact CE-CD1 4.4Å; M210-L213 WeakPolarHBondContact O-CB 3.47Å; M210-L213 PolarHBondContact O-N 3.08Å; M210-L213 HydrophobicContact SD-CD1 3.86Å; M210-P217 HydrophobicContact CE-CG 3.7Å; M210-P217 HydrophobicContact SD-CG 4.29Å; M210-V221 HydrophobicContact SD-CG1 3.8Å; M210-L244 HydrophobicContact CE-CD1 3.88Å; M210-I247 HydrophobicContact CB-CD1 4.36Å; M210-I247 HydrophobicContact CB-CG2 4.18Å; M210-W253 HydrophobicContact CB-CH2 4.29Å; M210-W253 HydrophobicContact CE-CE3 4.5Å; M210-W253 HydrophobicContact CE-CH2 3.84Å; M210-W253 HydrophobicContact CE-CZ3 3.42Å; M210-W253 VanDerWaalsContact CE-CZ3 3.42Å; M210-W253 WeakPolarHBondContact O-CH2 3.17Å
211	H	93.1	Very high	93.2	Very high	100 Å²	100	48.6 Å²	48.6	46%	0.463	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-14.1	174.8	-83.2	-74	0	0	0	114.8	F207 C209 H251	F207-H211 PolarHBondContact O-CD2 3.46Å; F207-H211 PolarHBondContact O-N 3.19Å; C209-H211 VanDerWaalsContact C-N 3.27Å; C209-H211 PolarHBondContact O-N 3.47Å; H211-H251 AromaticContact CE1-CE1 3.94Å; H211-H251 AromaticContact CG-CE1 3.98Å; H211-H251 AromaticContact ND1-CE1 3.25Å; H211-H251 PolarHBondContact ND1-CE1 3.22Å; H211-H251 VanDerWaalsContact ND1-CE1 3.25Å; H211-H251 AromaticContact ND1-NE2 3.76Å
212	K	89.9	Confident	93.3	Very high	80 Å²	80	45.9 Å²	45.9	35%	0.348	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-1.7	179.9	-61.8	177.7	-169.1	-69.9	0	113.1	F173 Y190 C209 M210	F173-K212 HydrophobicContact CE1-CD 3.84Å; F173-K212 HydrophobicContact CZ-CD 4.42Å; Y190-K212 HydrophobicContact CD1-CB 3.77Å; Y190-K212 HydrophobicContact CD1-CD 4.26Å; Y190-K212 HydrophobicContact CE1-CB 3.64Å; Y190-K212 HydrophobicContact CE1-CD 3.65Å; Y190-K212 HydrophobicContact CE1-CG 4.28Å; Y190-K212 HydrophobicContact CE2-CB 4.38Å; Y190-K212 HydrophobicContact CG-CB 4.23Å; C209-K212 WeakPolarHBondContact O-CB 3.48Å; C209-K212 PolarHBondContact O-N 3.34Å; M210-K212 PolarHBondContact O-N 3.11Å; M210-K212 VanDerWaalsContact O-N 3.16Å
213	L	88.7	Confident	93.4	Very high	8 Å²	8	46 Å²	46	4%	0.042	24%	0.235	C	C	.	.			trans	-75.2	136.8	177.8	-69.5	166.5	0	0	0	111.1	E191 M210 G215 P217 W253	E191-L213 HydrophobicContact CG-CD2 3.99Å; M210-L213 HydrophobicContact CE-CD1 4.4Å; M210-L213 WeakPolarHBondContact O-CB 3.47Å; M210-L213 PolarHBondContact O-N 3.08Å; M210-L213 HydrophobicContact SD-CD1 3.86Å; L213-G215 WeakPolarHBondContact CB-O 3.45Å; L213-G215 PolarHBondContact O-N 2.98Å; L213-P217 HydrophobicContact CD1-CB 3.73Å; L213-P217 HydrophobicContact CD1-CG 3.85Å; L213-W253 HydrophobicContact CB-CH2 4.44Å; L213-W253 HydrophobicContact CB-CZ2 3.96Å; L213-W253 HydrophobicContact CD1-CH2 3.96Å; L213-W253 HydrophobicContact CD1-CZ2 4.23Å
214	N	79.5	Confident	93.4	Very high	129 Å²	129	47.6 Å²	47.6	69%	0.69	25%	0.245	S	C	*	.	S	Bend	trans	-80.1	-3.1	177	-69.2	-25.4	0	0	0	113.5
215	G	83.9	Confident	93.4	Very high	31 Å²	31	43.3 Å²	43.3	32%	0.32	22%	0.215	S	C	.	.	S	Bend	trans	-170.3	178.7	-176.4	0	0	0	0	0	111.3	L213 W253	L213-G215 WeakPolarHBondContact CB-O 3.45Å; L213-G215 PolarHBondContact O-N 2.98Å; G215-W253 PolarHBondContact O-NE1 3.34Å
216	S	88.7	Confident	93.4	Very high	47 Å²	47	43.4 Å²	43.4	33%	0.329	22%	0.215	S	C	.	.	P	Polyproline II helix	trans	-60.8	130.7	178.3	-168.9	0	0	0	0	110
217	P	92.5	Very high	93.3	Very high	8 Å²	8	48.4 Å²	48.4	5%	0.052	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-67.5	160.6	179	24.4	-28.9	0	0	0	111.1	E191 M210 L213 V221 F222 W253	E191-P217 HydrophobicContact CG-CB 4.2Å; M210-P217 HydrophobicContact CE-CG 3.7Å; M210-P217 HydrophobicContact SD-CG 4.29Å; L213-P217 HydrophobicContact CD1-CB 3.73Å; L213-P217 HydrophobicContact CD1-CG 3.85Å; P217-V221 HydrophobicContact CB-CB 3.98Å; P217-V221 HydrophobicContact CB-CG1 4.27Å; P217-V221 HydrophobicContact CB-CG2 4.02Å; P217-V221 HydrophobicContact CG-CB 4.45Å; P217-V221 HydrophobicContact CG-CG1 4.46Å; P217-F222 HydrophobicContact CG-CD2 4.33Å; P217-F222 HydrophobicContact CG-CE2 3.63Å; P217-F222 HydrophobicContact CG-CZ 3.76Å; P217-F222 WeakPolarHBondContact O-CE2 3.39Å; P217-W253 HydrophobicContact CG-CZ3 4.3Å
218	R	92.5	Very high	93.2	Very high	149 Å²	149	52.2 Å²	52.2	56%	0.562	26%	0.258	S	S	*	.	P	Polyproline II helix	trans	-60.3	156.4	169.2	-70.4	172.1	-164.3	163.1	5	112.5	E191 N220 V221	E191-R218 WeakPolarHBondContact OE1-CG 3.43Å; E191-R218 PolarHBondContact OE1-N 3.44Å; E191-R218 VanDerWaalsContact OE2-CD 3.27Å; E191-R218 WeakPolarHBondContact OE2-CD 3.27Å; E191-R218 IonicContact OE2-CZ 2.73Å; E191-R218 IonicContact OE2-NE 3.7Å; E191-R218 PolarHBondContact OE2-NE 2.5Å; E191-R218 IonicContact OE2-NH1 2.63Å; R218-N220 WeakPolarHBondContact CB-OD1 3.24Å; R218-N220 PolarHBondContact O-N 3.46Å; R218-N220 VanDerWaalsContact O-N 3.12Å; R218-V221 PolarHBondContact O-N 3.3Å; R218-V221 VanDerWaalsContact O-N 3.08Å
219	E	93.5	Very high	93.3	Very high	58 Å²	58	48.8 Å²	48.8	27%	0.271	24%	0.242	S	C	.	.	H	α-helix	trans	-53.8	-35.6	-175.9	-59	-172.7	168.4	0	0	113.9	V221 F222 Y223 T256 I259	E219-V221 VanDerWaalsContact C-N 3.25Å; E219-V221 PolarHBondContact O-N 2.97Å; E219-F222 WeakPolarHBondContact O-CB 3.36Å; E219-F222 PolarHBondContact O-N 3.05Å; E219-F222 VanDerWaalsContact O-N 3.1Å; E219-Y223 HydrophobicContact CB-CD2 4.15Å; E219-Y223 HydrophobicContact CB-CE2 3.62Å; E219-Y223 WeakPolarHBondContact O-CD2 3.15Å; E219-Y223 PolarHBondContact O-N 2.94Å; E219-T256 HydrophobicContact CG-CG2 4.38Å; E219-T256 VanDerWaalsContact OE1-CB 3.29Å; E219-T256 WeakPolarHBondContact OE1-CB 3.42Å; E219-T256 WeakPolarHBondContact OE1-CG2 3.44Å; E219-T256 PolarHBondContact OE1-OG1 3.25Å; E219-I259 HydrophobicContact CB-CD1 3.82Å; E219-I259 HydrophobicContact CB-CG1 4.12Å; E219-I259 HydrophobicContact CG-CD1 4.18Å; E219-I259 HydrophobicContact CG-CG1 3.95Å
220	N	94.8	Very high	93.1	Very high	66 Å²	66	54.5 Å²	54.5	35%	0.353	27%	0.273	S	S	.	.	H	α-helix	trans	-57.9	-36.4	179.9	66	-72	0	0	0	112.8	R218 F222 Y223 D224	R218-N220 WeakPolarHBondContact CB-OD1 3.24Å; R218-N220 PolarHBondContact O-N 3.46Å; R218-N220 VanDerWaalsContact O-N 3.12Å; N220-F222 VanDerWaalsContact C-N 3.33Å; N220-F222 PolarHBondContact O-N 3.26Å; N220-Y223 PolarHBondContact O-N 3.33Å; N220-D224 WeakPolarHBondContact O-CB 3.36Å; N220-D224 PolarHBondContact O-N 3.4Å
221	V	96.6	Very high	92.8	Very high	0 Å²	0	58 Å²	58	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-66	-39.7	179.2	-178.4	0	0	0	0	110.7	E191 C194 F206 M210 P217 R218 E219 F225	E191-V221 HydrophobicContact CB-CG2 3.99Å; E191-V221 HydrophobicContact CG-CG2 4.12Å; C194-V221 HydrophobicContact CB-CG1 3.73Å; F206-V221 HydrophobicContact CE2-CG1 3.82Å; F206-V221 HydrophobicContact CZ-CG1 4.41Å; M210-V221 HydrophobicContact SD-CG1 3.8Å; P217-V221 HydrophobicContact CB-CB 3.98Å; P217-V221 HydrophobicContact CB-CG1 4.27Å; P217-V221 HydrophobicContact CB-CG2 4.02Å; P217-V221 HydrophobicContact CG-CB 4.45Å; P217-V221 HydrophobicContact CG-CG1 4.46Å; R218-V221 PolarHBondContact O-N 3.3Å; R218-V221 VanDerWaalsContact O-N 3.08Å; E219-V221 VanDerWaalsContact C-N 3.25Å; E219-V221 PolarHBondContact O-N 2.97Å; V221-F225 WeakPolarHBondContact O-CB 3.29Å; V221-F225 PolarHBondContact O-N 2.79Å; V221-F225 VanDerWaalsContact O-N 3.07Å
222	F	97.3	Very high	92.9	Very high	4 Å²	4	56 Å²	56	2%	0.018	30%	0.301	C	S	.	.	H	α-helix	trans	-67	-44	174.3	-67.2	-78.6	0	0	0	111.4	P217 E219 N220 D224 F225 F226 L244 M248 I255 I259	P217-F222 HydrophobicContact CG-CD2 4.33Å; P217-F222 HydrophobicContact CG-CE2 3.63Å; P217-F222 HydrophobicContact CG-CZ 3.76Å; P217-F222 WeakPolarHBondContact O-CE2 3.39Å; E219-F222 WeakPolarHBondContact O-CB 3.36Å; E219-F222 PolarHBondContact O-N 3.05Å; E219-F222 VanDerWaalsContact O-N 3.1Å; N220-F222 VanDerWaalsContact C-N 3.33Å; N220-F222 PolarHBondContact O-N 3.26Å; F222-D224 PolarHBondContact O-N 3.01Å; F222-F225 WeakPolarHBondContact O-CB 3.29Å; F222-F225 PolarHBondContact O-N 3.17Å; F222-F226 VanDerWaalsContact O-CD2 3.23Å; F222-F226 WeakPolarHBondContact O-CD2 2.98Å; F222-F226 PolarHBondContact O-N 2.93Å; F222-L244 HydrophobicContact CD1-CD2 4.27Å; F222-L244 HydrophobicContact CE1-CD1 4.31Å; F222-L244 HydrophobicContact CE1-CD2 4.47Å; F222-M248 HydrophobicContact CE1-CE 4.18Å; F222-M248 HydrophobicContact CE1-SD 4.03Å; F222-M248 HydrophobicContact CZ-CE 4.46Å; F222-I255 HydrophobicContact CE1-CG2 4.39Å; F222-I255 HydrophobicContact CE2-CG2 4.41Å; F222-I255 HydrophobicContact CZ-CG2 3.97Å; F222-I259 HydrophobicContact CB-CD1 3.68Å; F222-I259 HydrophobicContact CB-CG1 4.23Å; F222-I259 HydrophobicContact CB-CG2 4.03Å; F222-I259 HydrophobicContact CD1-CG2 4.08Å; F222-I259 HydrophobicContact CD2-CD1 4.35Å; F222-I259 HydrophobicContact CD2-CG1 4.08Å; F222-I259 HydrophobicContact CD2-CG2 4.2Å; F222-I259 HydrophobicContact CG-CD1 4.3Å; F222-I259 HydrophobicContact CG-CG1 4.32Å; F222-I259 HydrophobicContact CG-CG2 3.86Å
223	Y	97.5	Very high	93.1	Very high	75 Å²	75	59.3 Å²	59.3	29%	0.294	32%	0.318	S	S	.	.	H	α-helix	trans	-61.5	-44.1	176.8	-65.7	-50.6	0	0	0	112	E219 N220 F225 F226 N227 E258 I259 C262	E219-Y223 HydrophobicContact CB-CD2 4.15Å; E219-Y223 HydrophobicContact CB-CE2 3.62Å; E219-Y223 WeakPolarHBondContact O-CD2 3.15Å; E219-Y223 PolarHBondContact O-N 2.94Å; N220-Y223 PolarHBondContact O-N 3.33Å; Y223-F225 VanDerWaalsContact C-N 3.29Å; Y223-F225 PolarHBondContact O-N 2.96Å; Y223-F226 PolarHBondContact O-N 2.82Å; Y223-N227 WeakPolarHBondContact O-CB 3.46Å; Y223-N227 PolarHBondContact O-N 3.5Å; Y223-N227 PolarHBondContact O-ND2 3.49Å; Y223-N227 VanDerWaalsContact O-ND2 3.1Å; Y223-E258 WeakPolarHBondContact OH-CB 3.39Å; Y223-I259 HydrophobicContact CD1-CD1 4.15Å; Y223-I259 HydrophobicContact CD2-CD1 4.42Å; Y223-I259 HydrophobicContact CE1-CD1 3.68Å; Y223-I259 HydrophobicContact CE2-CD1 3.99Å; Y223-I259 HydrophobicContact CG-CD1 4.48Å; Y223-C262 HydrophobicContact CE1-CB 4.06Å
224	D	96.8	Very high	93.4	Very high	64 Å²	64	60.6 Å²	60.6	34%	0.342	32%	0.324	S	S	.	.	H	α-helix	trans	-59.5	-42	176.5	-70.9	-20.9	0	0	0	111.1	L198 N220 F222 K228	L198-D224 HydrophobicContact CD1-CB 4Å; N220-D224 WeakPolarHBondContact O-CB 3.36Å; N220-D224 PolarHBondContact O-N 3.4Å; F222-D224 PolarHBondContact O-N 3.01Å; D224-K228 WeakPolarHBondContact O-CB 3.25Å; D224-K228 PolarHBondContact O-N 2.83Å
225	F	98.2	Very high	94.1	Very high	1 Å²	1	62.4 Å²	62.4	0%	0.004	33%	0.328	C	S	.	.	H	α-helix	trans	-60.8	-57	175	176.7	-100.1	0	0	0	111.8	L198 F203 F206 F207 V221 F222 Y223 N227 K228 L229 L240 V241 L244	L198-F225 HydrophobicContact CD1-CB 4.01Å; L198-F225 HydrophobicContact CD2-CD2 4.11Å; F203-F225 HydrophobicContact CD1-CD2 4.25Å; F203-F225 AromaticContact CD1-CE2 3.91Å; F203-F225 HydrophobicContact CD1-CE2 3.91Å; F203-F225 HydrophobicContact CE1-CD2 4.04Å; F203-F225 AromaticContact CE1-CE2 3.9Å; F203-F225 HydrophobicContact CE1-CE2 3.9Å; F206-F225 AromaticContact CD1-CD2 3.87Å; F206-F225 HydrophobicContact CD1-CD2 3.87Å; F206-F225 HydrophobicContact CD1-CE2 4.12Å; F206-F225 HydrophobicContact CE1-CB 4.49Å; F206-F225 AromaticContact CE1-CD2 3.29Å; F206-F225 HydrophobicContact CE1-CD2 3.29Å; F206-F225 AromaticContact CE1-CE2 3.69Å; F206-F225 HydrophobicContact CE1-CE2 3.69Å; F206-F225 HydrophobicContact CE1-CG 4.08Å; F206-F225 HydrophobicContact CZ-CB 4.01Å; F206-F225 AromaticContact CZ-CD2 3.69Å; F206-F225 HydrophobicContact CZ-CD2 3.69Å; F206-F225 HydrophobicContact CZ-CE2 4.48Å; F206-F225 HydrophobicContact CZ-CG 4.07Å; F207-F225 HydrophobicContact CE1-CE2 4.1Å; F207-F225 HydrophobicContact CE1-CZ 4.5Å; F207-F225 AromaticContact CZ-CE2 3.94Å; F207-F225 HydrophobicContact CZ-CE2 3.94Å; F207-F225 HydrophobicContact CZ-CZ 4.29Å; V221-F225 WeakPolarHBondContact O-CB 3.29Å; V221-F225 PolarHBondContact O-N 2.79Å; V221-F225 VanDerWaalsContact O-N 3.07Å; F222-F225 WeakPolarHBondContact O-CB 3.29Å; F222-F225 PolarHBondContact O-N 3.17Å; Y223-F225 VanDerWaalsContact C-N 3.29Å; Y223-F225 PolarHBondContact O-N 2.96Å; F225-N227 VanDerWaalsContact C-N 3.31Å; F225-N227 PolarHBondContact O-N 2.91Å; F225-K228 WeakPolarHBondContact O-CB 3.35Å; F225-K228 PolarHBondContact O-N 3.41Å; F225-K228 VanDerWaalsContact O-N 3.1Å; F225-L229 HydrophobicContact CD1-CD1 4.18Å; F225-L229 HydrophobicContact CE1-CD1 3.69Å; F225-L229 HydrophobicContact CE1-CG 4.31Å; F225-L229 HydrophobicContact CE2-CD2 4.42Å; F225-L229 HydrophobicContact CZ-CD1 4.11Å; F225-L229 HydrophobicContact CZ-CD2 4.17Å; F225-L229 HydrophobicContact CZ-CG 4.44Å; F225-L229 WeakPolarHBondContact O-CG 3.41Å; F225-L229 PolarHBondContact O-N 3.45Å; F225-L240 HydrophobicContact CE2-CB 4.49Å; F225-L240 HydrophobicContact CZ-CB 4.11Å; F225-V241 HydrophobicContact CE1-CG2 4.02Å; F225-V241 HydrophobicContact CZ-CG2 4.49Å; F225-L244 HydrophobicContact CD1-CD2 3.69Å; F225-L244 HydrophobicContact CE1-CB 4.14Å; F225-L244 HydrophobicContact CE1-CD2 3.53Å; F225-L244 HydrophobicContact CE1-CG 4.4Å; F225-L244 HydrophobicContact CZ-CB 4.08Å; F225-L244 HydrophobicContact CZ-CD2 4.27Å
226	F	97.3	Very high	94.7	Very high	6 Å²	6	65.2 Å²	65.2	3%	0.026	33%	0.333	C	S	.	.	H	α-helix	trans	-63.6	-35	-178.3	-79.4	-71.6	0	0	0	112.9	F222 Y223 K228 L229 V241 L244 I263 W266	F222-F226 VanDerWaalsContact O-CD2 3.23Å; F222-F226 WeakPolarHBondContact O-CD2 2.98Å; F222-F226 PolarHBondContact O-N 2.93Å; Y223-F226 PolarHBondContact O-N 2.82Å; F226-K228 VanDerWaalsContact C-N 3.34Å; F226-L229 HydrophobicContact CD1-CD1 3.93Å; F226-L229 HydrophobicContact CE1-CD1 4.27Å; F226-L229 PolarHBondContact O-N 2.88Å; F226-V241 HydrophobicContact CE1-CG2 3.82Å; F226-V241 HydrophobicContact CZ-CG2 4.45Å; F226-L244 HydrophobicContact CE2-CD2 4.25Å; F226-L244 HydrophobicContact CZ-CD2 4.26Å; F226-I263 HydrophobicContact CE1-CG1 4.49Å; F226-I263 HydrophobicContact CE2-CG1 3.72Å; F226-I263 HydrophobicContact CZ-CD1 4.49Å; F226-I263 HydrophobicContact CZ-CG1 3.56Å; F226-W266 HydrophobicContact CD1-CB 4Å; F226-W266 AromaticContact CD1-CD1 3.65Å; F226-W266 HydrophobicContact CD1-CD2 4.04Å; F226-W266 AromaticContact CD1-CG 3.59Å; F226-W266 HydrophobicContact CD1-CG 3.59Å; F226-W266 HydrophobicContact CE1-CB 4.16Å; F226-W266 AromaticContact CE1-CD2 3.91Å; F226-W266 HydrophobicContact CE1-CD2 3.91Å; F226-W266 HydrophobicContact CE1-CE3 4.26Å; F226-W266 AromaticContact CE1-CG 3.84Å; F226-W266 HydrophobicContact CE1-CG 3.84Å
227	N	95.6	Very high	95.1	Very high	105 Å²	105	63.3 Å²	63.3	56%	0.561	32%	0.319	S	S	*	.	H	α-helix	trans	-64.9	-38.4	174.4	-74.7	-28.4	0	0	0	111.9	Y223 F225 L229 N230	Y223-N227 WeakPolarHBondContact O-CB 3.46Å; Y223-N227 PolarHBondContact O-N 3.5Å; Y223-N227 PolarHBondContact O-ND2 3.49Å; Y223-N227 VanDerWaalsContact O-ND2 3.1Å; F225-N227 VanDerWaalsContact C-N 3.31Å; F225-N227 PolarHBondContact O-N 2.91Å; N227-L229 VanDerWaalsContact C-N 3.31Å; N227-L229 PolarHBondContact O-N 3.22Å; N227-N230 PolarHBondContact O-N 3.35Å
228	K	95.7	Very high	95.2	Very high	92 Å²	92	63.7 Å²	63.7	40%	0.4	32%	0.321	S	S	.	.	H	α-helix	trans	-65.9	-33.2	177.3	-171.6	73.2	-178.9	-153	0	112.2	L198 F203 D224 F225 F226 N230	L198-K228 WeakPolarHBondContact O-CE 3.43Å; L198-K228 PolarHBondContact O-NZ 2.91Å; F203-K228 HydrophobicContact CE1-CB 4.42Å; F203-K228 HydrophobicContact CE1-CG 4.06Å; F203-K228 HydrophobicContact CE2-CG 4.28Å; F203-K228 HydrophobicContact CZ-CB 4.16Å; F203-K228 HydrophobicContact CZ-CG 3.5Å; F203-K228 VanDerWaalsContact CZ-CG 3.5Å; D224-K228 WeakPolarHBondContact O-CB 3.25Å; D224-K228 PolarHBondContact O-N 2.83Å; F225-K228 WeakPolarHBondContact O-CB 3.35Å; F225-K228 PolarHBondContact O-N 3.41Å; F225-K228 VanDerWaalsContact O-N 3.1Å; F226-K228 VanDerWaalsContact C-N 3.34Å; K228-N230 VanDerWaalsContact C-N 3.28Å; K228-N230 PolarHBondContact O-N 2.92Å
229	L	96.6	Very high	95.4	Very high	2 Å²	2	61.7 Å²	61.7	1%	0.01	32%	0.318	C	S	.	.	H	α-helix	trans	-63.8	-28.8	178.2	-62.2	-179.9	0	0	0	113.5	F203 F225 F226 N227 G231 L232 S237 L240 V241 W266	F203-L229 HydrophobicContact CE1-CD2 3.95Å; F203-L229 HydrophobicContact CZ-CD2 3.93Å; F225-L229 HydrophobicContact CD1-CD1 4.18Å; F225-L229 HydrophobicContact CE1-CD1 3.69Å; F225-L229 HydrophobicContact CE1-CG 4.31Å; F225-L229 HydrophobicContact CE2-CD2 4.42Å; F225-L229 HydrophobicContact CZ-CD1 4.11Å; F225-L229 HydrophobicContact CZ-CD2 4.17Å; F225-L229 HydrophobicContact CZ-CG 4.44Å; F225-L229 WeakPolarHBondContact O-CG 3.41Å; F225-L229 PolarHBondContact O-N 3.45Å; F226-L229 HydrophobicContact CD1-CD1 3.93Å; F226-L229 HydrophobicContact CE1-CD1 4.27Å; F226-L229 PolarHBondContact O-N 2.88Å; N227-L229 VanDerWaalsContact C-N 3.31Å; N227-L229 PolarHBondContact O-N 3.22Å; L229-G231 PolarHBondContact O-N 2.93Å; L229-L232 HydrophobicContact CD2-CD1 4.12Å; L229-L232 PolarHBondContact O-N 3.49Å; L229-S237 PolarHBondContact O-OG 3.44Å; L229-L240 HydrophobicContact CD2-CB 3.99Å; L229-L240 HydrophobicContact CD2-CD1 3.69Å; L229-V241 HydrophobicContact CD1-CG2 3.41Å; L229-V241 VanDerWaalsContact CD1-CG2 3.41Å; L229-W266 HydrophobicContact CD1-CZ2 4.04Å
230	N	91.1	Very high	95.7	Very high	120 Å²	120	59.4 Å²	59.4	64%	0.642	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-16.2	-176.3	-69.4	-30	0	0	0	114.4	N227 K228	N227-N230 PolarHBondContact O-N 3.35Å; K228-N230 VanDerWaalsContact C-N 3.28Å; K228-N230 PolarHBondContact O-N 2.92Å
231	G	88.6	Confident	95.8	Very high	74 Å²	74	56.3 Å²	56.3	76%	0.763	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	1.3	176.6	0	0	0	0	0	115.2	L229	L229-G231 PolarHBondContact O-N 2.93Å
232	L	94.9	Very high	95.8	Very high	56 Å²	56	57.3 Å²	57.3	29%	0.293	30%	0.299	S	S	.	.	S	Bend	trans	-107.2	167.2	-174.7	-58.6	179.4	0	0	0	112.1	F203 L229 E236 S237 L240	F203-L232 HydrophobicContact CD2-CD1 4.41Å; F203-L232 HydrophobicContact CE2-CD1 3.42Å; F203-L232 VanDerWaalsContact CE2-CD1 3.42Å; F203-L232 HydrophobicContact CE2-CG 4.48Å; F203-L232 HydrophobicContact CZ-CD1 3.69Å; L229-L232 HydrophobicContact CD2-CD1 4.12Å; L229-L232 PolarHBondContact O-N 3.49Å; L232-E236 HydrophobicContact CD1-CG 4.35Å; L232-S237 WeakPolarHBondContact CB-OG 3.44Å; L232-L240 HydrophobicContact CD1-CD1 3.55Å
233	E	95.1	Very high	95.9	Very high	150 Å²	150	60.5 Å²	60.5	70%	0.701	31%	0.314	S	S	*	.			trans	-66.6	151.4	168.4	-64.5	-171.8	168.5	0	0	110.8	E235 E236 S237	E233-E235 PolarHBondContact O-N 2.95Å; E233-E236 PolarHBondContact O-N 2.82Å; E233-S237 WeakPolarHBondContact O-CB 3.45Å; E233-S237 PolarHBondContact O-N 3.1Å; E233-S237 PolarHBondContact O-OG 2.85Å
234	E	94.5	Very high	95.9	Very high	35 Å²	35	57 Å²	57	16%	0.164	30%	0.3	C	S	.	.	H	α-helix	trans	-62.8	-43.8	-174	-173.5	172.2	134.4	0	0	112.1	E236 S237 V238 L270 K271 H272 E273	E234-E236 PolarHBondContact O-N 2.94Å; E234-S237 PolarHBondContact O-N 3.25Å; E234-V238 HydrophobicContact CG-CG2 4.27Å; E234-V238 WeakPolarHBondContact O-CB 3.41Å; E234-V238 VanDerWaalsContact O-CG2 3.28Å; E234-V238 WeakPolarHBondContact O-CG2 3.37Å; E234-V238 PolarHBondContact O-N 2.95Å; E234-L270 HydrophobicContact CG-CD2 3.66Å; E234-K271 PolarHBondContact OE1-N 2.96Å; E234-K271 WeakPolarHBondContact OE2-CA 3.41Å; E234-K271 WeakPolarHBondContact OE2-CB 3.44Å; E234-K271 PolarHBondContact OE2-N 3.29Å; E234-H272 VanDerWaalsContact CD-CD2 3.45Å; E234-H272 WeakPolarHBondContact OE1-CB 3.1Å; E234-H272 IonicContact OE1-CD2 2.77Å; E234-H272 IonicContact OE1-CG 3.68Å; E234-H272 PolarHBondContact OE1-N 3.37Å; E234-H272 IonicContact OE2-CD2 3.08Å; E234-H272 PolarHBondContact OE2-CD2 2.92Å; E234-H272 VanDerWaalsContact OE2-CD2 3.28Å; E234-H272 IonicContact OE2-CG 2.59Å; E234-H272 PolarHBondContact OE2-N 3.1Å; E234-E273 PolarHBondContact OE1-N 3.49Å
235	E	94.7	Very high	96	Very high	167 Å²	167	54 Å²	54	78%	0.78	28%	0.284	S	S	*	.	H	α-helix	trans	-60.2	-47.1	-179.6	-175.2	176.7	177.9	0	0	111.6	E233 S237 V238 H239	E233-E235 PolarHBondContact O-N 2.95Å; E235-S237 PolarHBondContact O-N 2.86Å; E235-V238 PolarHBondContact O-N 3.12Å; E235-H239 WeakPolarHBondContact O-CB 3.3Å; E235-H239 PolarHBondContact O-N 3.33Å
236	E	96.4	Very high	95.9	Very high	91 Å²	91	57.2 Å²	57.2	43%	0.425	30%	0.299	S	S	.	.	H	α-helix	trans	-61	-45.9	175	-175.1	-177.9	-175.6	0	0	110.9	L232 E233 E234 V238 H239 L240	L232-E236 HydrophobicContact CD1-CG 4.35Å; E233-E236 PolarHBondContact O-N 2.82Å; E234-E236 PolarHBondContact O-N 2.94Å; E236-V238 PolarHBondContact O-N 3.08Å; E236-H239 WeakPolarHBondContact O-CB 3.17Å; E236-H239 PolarHBondContact O-N 3.41Å; E236-L240 HydrophobicContact CG-CD1 4.13Å; E236-L240 WeakPolarHBondContact O-CG 3.42Å; E236-L240 PolarHBondContact O-N 3.33Å
237	S	96.5	Very high	95.8	Very high	6 Å²	6	57.3 Å²	57.3	4%	0.042	30%	0.299	C	S	.	.	H	α-helix	trans	-62.5	-43.1	-178.9	-55.6	0	0	0	0	112.2	L229 L232 E233 E234 E235 H239 L240 V241	L229-S237 PolarHBondContact O-OG 3.44Å; L232-S237 WeakPolarHBondContact CB-OG 3.44Å; E233-S237 WeakPolarHBondContact O-CB 3.45Å; E233-S237 PolarHBondContact O-N 3.1Å; E233-S237 PolarHBondContact O-OG 2.85Å; E234-S237 PolarHBondContact O-N 3.25Å; E235-S237 PolarHBondContact O-N 2.86Å; S237-H239 VanDerWaalsContact C-N 3.33Å; S237-L240 PolarHBondContact O-N 3.24Å; S237-V241 WeakPolarHBondContact O-CG2 3.45Å; S237-V241 PolarHBondContact O-N 3.23Å
238	V	96.1	Very high	95.8	Very high	16 Å²	16	52.3 Å²	52.3	10%	0.097	27%	0.273	C	S	.	.	H	α-helix	trans	-62.9	-41	175.8	170.3	0	0	0	0	111	E234 E235 E236 V241 S242 W266 L270 L500	E234-V238 HydrophobicContact CG-CG2 4.27Å; E234-V238 WeakPolarHBondContact O-CB 3.41Å; E234-V238 VanDerWaalsContact O-CG2 3.28Å; E234-V238 WeakPolarHBondContact O-CG2 3.37Å; E234-V238 PolarHBondContact O-N 2.95Å; E235-V238 PolarHBondContact O-N 3.12Å; E236-V238 PolarHBondContact O-N 3.08Å; V238-V241 PolarHBondContact O-N 2.91Å; V238-S242 PolarHBondContact O-N 3.38Å; V238-W266 HydrophobicContact CB-CH2 4.48Å; V238-W266 HydrophobicContact CG2-CH2 3.81Å; V238-L270 HydrophobicContact CG2-CD1 4.11Å; V238-L270 HydrophobicContact CG2-CD2 3.91Å; V238-L500 HydrophobicContact CG1-CD1 3.89Å; V238-L500 HydrophobicContact CG1-CD2 3.53Å; V238-L500 HydrophobicContact CG1-CG 4.38Å
239	H	96.6	Very high	95.7	Very high	107 Å²	107	51.1 Å²	51.1	50%	0.495	27%	0.268	S	S	.	.	H	α-helix	trans	-61.9	-45.5	175.4	-178	67.4	0	0	0	112	E235 E236 S237 V241 S242 Q243	E235-H239 WeakPolarHBondContact O-CB 3.3Å; E235-H239 PolarHBondContact O-N 3.33Å; E236-H239 WeakPolarHBondContact O-CB 3.17Å; E236-H239 PolarHBondContact O-N 3.41Å; S237-H239 VanDerWaalsContact C-N 3.33Å; H239-V241 PolarHBondContact O-N 2.96Å; H239-S242 WeakPolarHBondContact O-CB 3.35Å; H239-S242 PolarHBondContact O-N 2.98Å; H239-Q243 PolarHBondContact CD2-NE2 3.37Å; H239-Q243 PolarHBondContact NE2-NE2 3.5Å; H239-Q243 PolarHBondContact O-N 3.24Å
240	L	98.1	Very high	95.5	Very high	10 Å²	10	55.4 Å²	55.4	5%	0.052	29%	0.294	C	S	.	.	H	α-helix	trans	-62.9	-41.7	177	-68.7	169.8	0	0	0	112.3	F203 F207 F225 L229 L232 E236 S237 S242 Q243 L244	F203-L240 HydrophobicContact CB-CD2 3.63Å; F203-L240 HydrophobicContact CD1-CD1 3.98Å; F203-L240 HydrophobicContact CD1-CD2 4.16Å; F203-L240 HydrophobicContact CD2-CD1 3.64Å; F203-L240 HydrophobicContact CD2-CD2 4.24Å; F203-L240 HydrophobicContact CE1-CD1 3.99Å; F203-L240 HydrophobicContact CE2-CD1 3.67Å; F203-L240 HydrophobicContact CG-CD1 3.8Å; F203-L240 HydrophobicContact CG-CD2 3.77Å; F203-L240 HydrophobicContact CG-CG 4.42Å; F203-L240 HydrophobicContact CZ-CD1 3.83Å; F207-L240 HydrophobicContact CE2-CD2 3.68Å; F207-L240 HydrophobicContact CZ-CB 4.46Å; F207-L240 HydrophobicContact CZ-CD2 4.1Å; F207-L240 WeakPolarHBondContact CZ-O 3.36Å; F225-L240 HydrophobicContact CE2-CB 4.49Å; F225-L240 HydrophobicContact CZ-CB 4.11Å; L229-L240 HydrophobicContact CD2-CB 3.99Å; L229-L240 HydrophobicContact CD2-CD1 3.69Å; L232-L240 HydrophobicContact CD1-CD1 3.55Å; E236-L240 HydrophobicContact CG-CD1 4.13Å; E236-L240 WeakPolarHBondContact O-CG 3.42Å; E236-L240 PolarHBondContact O-N 3.33Å; S237-L240 PolarHBondContact O-N 3.24Å; L240-S242 VanDerWaalsContact C-N 3.3Å; L240-S242 PolarHBondContact O-N 3.45Å; L240-Q243 PolarHBondContact O-N 2.96Å; L240-L244 PolarHBondContact O-N 3.39Å
241	V	97.7	Very high	95.4	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.006	27%	0.273	C	S	.	.	H	α-helix	trans	-62.7	-38.9	174.4	171	0	0	0	0	111.2	F225 F226 L229 S237 V238 H239 Q243 L244 F245 W266 F267	F225-V241 HydrophobicContact CE1-CG2 4.02Å; F225-V241 HydrophobicContact CZ-CG2 4.49Å; F226-V241 HydrophobicContact CE1-CG2 3.82Å; F226-V241 HydrophobicContact CZ-CG2 4.45Å; L229-V241 HydrophobicContact CD1-CG2 3.41Å; L229-V241 VanDerWaalsContact CD1-CG2 3.41Å; S237-V241 WeakPolarHBondContact O-CG2 3.45Å; S237-V241 PolarHBondContact O-N 3.23Å; V238-V241 PolarHBondContact O-N 2.91Å; H239-V241 PolarHBondContact O-N 2.96Å; V241-Q243 VanDerWaalsContact C-N 3.33Å; V241-Q243 PolarHBondContact O-N 3.22Å; V241-L244 WeakPolarHBondContact O-CB 3.48Å; V241-L244 PolarHBondContact O-N 3.22Å; V241-F245 HydrophobicContact CG1-CD1 4.45Å; V241-F245 HydrophobicContact CG1-CD2 4.14Å; V241-F245 HydrophobicContact CG1-CE1 3.96Å; V241-F245 HydrophobicContact CG1-CE2 3.62Å; V241-F245 HydrophobicContact CG1-CZ 3.52Å; V241-F245 WeakPolarHBondContact O-CG 3.4Å; V241-F245 PolarHBondContact O-N 2.57Å; V241-W266 HydrophobicContact CB-CH2 4.11Å; V241-W266 HydrophobicContact CB-CZ3 4.15Å; V241-W266 HydrophobicContact CG1-CZ3 4.11Å; V241-W266 HydrophobicContact CG2-CD2 4.39Å; V241-W266 HydrophobicContact CG2-CE3 4.17Å; V241-W266 HydrophobicContact CG2-CH2 3.57Å; V241-W266 HydrophobicContact CG2-CZ2 3.79Å; V241-W266 HydrophobicContact CG2-CZ3 3.77Å; V241-F267 HydrophobicContact CG1-CE2 3.82Å; V241-F267 HydrophobicContact CG1-CZ 4.02Å
242	S	97.5	Very high	95.4	Very high	22 Å²	22	51 Å²	51	15%	0.154	25%	0.247	C	C	.	.	H	α-helix	trans	-62	-40.7	174.1	-169.1	0	0	0	0	112	V238 H239 L240 F245 E246	V238-S242 PolarHBondContact O-N 3.38Å; H239-S242 WeakPolarHBondContact O-CB 3.35Å; H239-S242 PolarHBondContact O-N 2.98Å; L240-S242 VanDerWaalsContact C-N 3.3Å; L240-S242 PolarHBondContact O-N 3.45Å; S242-F245 PolarHBondContact O-N 3.04Å; S242-E246 PolarHBondContact O-N 2.99Å
243	Q	97.7	Very high	95.2	Very high	71 Å²	71	48.8 Å²	48.8	33%	0.332	24%	0.235	S	C	.	.	H	α-helix	trans	-63.9	-43.3	174.9	-68.6	-173.5	37.8	0	0	111.8	F207 H239 L240 V241 F245 E246 I247	F207-Q243 HydrophobicContact CD2-CB 4.49Å; F207-Q243 VanDerWaalsContact CD2-OE1 3.27Å; F207-Q243 HydrophobicContact CE1-CB 4.16Å; F207-Q243 HydrophobicContact CE2-CB 3.89Å; F207-Q243 HydrophobicContact CE2-CG 4.48Å; F207-Q243 HydrophobicContact CZ-CB 3.7Å; H239-Q243 PolarHBondContact CD2-NE2 3.37Å; H239-Q243 PolarHBondContact NE2-NE2 3.5Å; H239-Q243 PolarHBondContact O-N 3.24Å; L240-Q243 PolarHBondContact O-N 2.96Å; V241-Q243 VanDerWaalsContact C-N 3.33Å; V241-Q243 PolarHBondContact O-N 3.22Å; Q243-F245 VanDerWaalsContact C-N 3.28Å; Q243-F245 PolarHBondContact O-N 2.77Å; Q243-E246 PolarHBondContact O-N 2.92Å; Q243-I247 WeakPolarHBondContact O-CG1 3.29Å; Q243-I247 PolarHBondContact O-N 3.22Å
244	L	98.1	Very high	94.9	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-55.5	-45.6	173.3	174.8	66.6	0	0	0	110.9	F207 M210 F222 F225 F226 L240 V241 E246 I247 M248	F207-L244 HydrophobicContact CE1-CB 4.18Å; M210-L244 HydrophobicContact CE-CD1 3.88Å; F222-L244 HydrophobicContact CD1-CD2 4.27Å; F222-L244 HydrophobicContact CE1-CD1 4.31Å; F222-L244 HydrophobicContact CE1-CD2 4.47Å; F225-L244 HydrophobicContact CD1-CD2 3.69Å; F225-L244 HydrophobicContact CE1-CB 4.14Å; F225-L244 HydrophobicContact CE1-CD2 3.53Å; F225-L244 HydrophobicContact CE1-CG 4.4Å; F225-L244 HydrophobicContact CZ-CB 4.08Å; F225-L244 HydrophobicContact CZ-CD2 4.27Å; F226-L244 HydrophobicContact CE2-CD2 4.25Å; F226-L244 HydrophobicContact CZ-CD2 4.26Å; L240-L244 PolarHBondContact O-N 3.39Å; V241-L244 WeakPolarHBondContact O-CB 3.48Å; V241-L244 PolarHBondContact O-N 3.22Å; L244-E246 PolarHBondContact O-N 3.11Å; L244-I247 WeakPolarHBondContact O-CB 3.47Å; L244-I247 PolarHBondContact O-N 3.38Å; L244-M248 HydrophobicContact CD1-CG 4.33Å; L244-M248 HydrophobicContact CD1-SD 4.27Å; L244-M248 HydrophobicContact CD2-SD 4.31Å; L244-M248 HydrophobicContact CG-CG 4.4Å; L244-M248 HydrophobicContact CG-SD 3.85Å; L244-M248 VanDerWaalsContact O-CG 3.24Å; L244-M248 WeakPolarHBondContact O-CG 3.49Å; L244-M248 PolarHBondContact O-N 3.2Å
245	F	98.1	Very high	94.8	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-66.5	-36.2	-179.9	-69.1	-9.2	0	0	0	113.1	V241 S242 Q243 M248 K249 I263 F267 I496 W504 I506 L526	V241-F245 HydrophobicContact CG1-CD1 4.45Å; V241-F245 HydrophobicContact CG1-CD2 4.14Å; V241-F245 HydrophobicContact CG1-CE1 3.96Å; V241-F245 HydrophobicContact CG1-CE2 3.62Å; V241-F245 HydrophobicContact CG1-CZ 3.52Å; V241-F245 WeakPolarHBondContact O-CG 3.4Å; V241-F245 PolarHBondContact O-N 2.57Å; S242-F245 PolarHBondContact O-N 3.04Å; Q243-F245 VanDerWaalsContact C-N 3.28Å; Q243-F245 PolarHBondContact O-N 2.77Å; F245-M248 HydrophobicContact CD1-SD 3.75Å; F245-M248 HydrophobicContact CE1-SD 4.26Å; F245-M248 PolarHBondContact O-N 3.48Å; F245-K249 WeakPolarHBondContact O-CB 3.43Å; F245-K249 PolarHBondContact O-N 2.63Å; F245-I263 HydrophobicContact CE1-CD1 4Å; F245-I263 HydrophobicContact CE1-CG2 4.46Å; F245-I263 HydrophobicContact CZ-CD1 4.34Å; F245-I263 HydrophobicContact CZ-CG2 3.76Å; F245-F267 AromaticContact CE2-CE2 3.78Å; F245-F267 HydrophobicContact CE2-CE2 3.78Å; F245-F267 AromaticContact CE2-CZ 3.94Å; F245-F267 HydrophobicContact CE2-CZ 3.94Å; F245-F267 AromaticContact CZ-CE2 3.87Å; F245-F267 HydrophobicContact CZ-CE2 3.87Å; F245-F267 HydrophobicContact CZ-CZ 4.48Å; F245-I496 HydrophobicContact CB-CD1 3.93Å; F245-I496 HydrophobicContact CB-CG2 4.48Å; F245-I496 HydrophobicContact CD1-CD1 3.9Å; F245-I496 HydrophobicContact CG-CD1 4.01Å; F245-W504 HydrophobicContact CB-CE3 4.32Å; F245-W504 HydrophobicContact CB-CH2 3.84Å; F245-W504 HydrophobicContact CB-CZ2 4.1Å; F245-W504 HydrophobicContact CB-CZ3 3.97Å; F245-W504 AromaticContact CD2-CD1 3.91Å; F245-W504 AromaticContact CD2-CD2 3.66Å; F245-W504 HydrophobicContact CD2-CD2 3.66Å; F245-W504 AromaticContact CD2-CE2 3.59Å; F245-W504 HydrophobicContact CD2-CE3 4.2Å; F245-W504 AromaticContact CD2-CG 3.84Å; F245-W504 HydrophobicContact CD2-CG 3.84Å; F245-W504 HydrophobicContact CD2-CH2 4.48Å; F245-W504 HydrophobicContact CD2-CZ2 4.02Å; F245-W504 AromaticContact CD2-NE1 3.78Å; F245-W504 AromaticContact CE2-CD1 3.94Å; F245-W504 HydrophobicContact CE2-CD2 4.36Å; F245-W504 HydrophobicContact CE2-CG 4.05Å; F245-I506 HydrophobicContact CD1-CD1 4.18Å; F245-I506 HydrophobicContact CD2-CD1 4.27Å; F245-I506 HydrophobicContact CE1-CD1 3.64Å; F245-I506 HydrophobicContact CE2-CD1 3.74Å; F245-I506 HydrophobicContact CG-CD1 4.48Å; F245-I506 HydrophobicContact CZ-CD1 3.4Å; F245-L526 HydrophobicContact CE2-CD1 4.01Å; F245-L526 HydrophobicContact CZ-CD1 4.23Å
246	E	96.8	Very high	94.7	Very high	70 Å²	70	35.4 Å²	35.4	33%	0.327	18%	0.176	S	C	.	.	H	α-helix	trans	-66.5	-37.2	172.9	-70.5	-58.9	145.2	0	0	111.9	S242 Q243 L244 K249 T250 W504	S242-E246 PolarHBondContact O-N 2.99Å; Q243-E246 PolarHBondContact O-N 2.92Å; L244-E246 PolarHBondContact O-N 3.11Å; E246-K249 WeakPolarHBondContact O-CB 3.31Å; E246-K249 PolarHBondContact O-N 3.41Å; E246-K249 IonicContact OE1-NZ 3.66Å; E246-K249 PolarHBondContact OE1-NZ 2.85Å; E246-K249 VanDerWaalsContact OE1-NZ 3.1Å; E246-K249 WeakPolarHBondContact OE2-CD 3.13Å; E246-K249 IonicContact OE2-NZ 2.71Å; E246-K249 PolarHBondContact OE2-NZ 2.92Å; E246-T250 WeakPolarHBondContact O-CB 3.32Å; E246-T250 PolarHBondContact O-N 3.39Å; E246-T250 PolarHBondContact O-OG1 3.38Å; E246-T250 VanDerWaalsContact O-OG1 3.12Å; E246-W504 WeakPolarHBondContact OE1-CH2 3.41Å
247	I	96.3	Very high	94.6	Very high	7 Å²	7	35.1 Å²	35.1	4%	0.036	17%	0.171	C	C	.	.	H	α-helix	trans	-62.5	-49	172.3	-68.7	171.1	0	0	0	110.7	F207 M210 Q243 L244 K249 T250 H251 W253	F207-I247 HydrophobicContact CB-CD1 3.8Å; F207-I247 HydrophobicContact CD1-CD1 3.27Å; F207-I247 HydrophobicContact CE1-CD1 4.09Å; F207-I247 HydrophobicContact CG-CD1 3.82Å; M210-I247 HydrophobicContact CB-CD1 4.36Å; M210-I247 HydrophobicContact CB-CG2 4.18Å; Q243-I247 WeakPolarHBondContact O-CG1 3.29Å; Q243-I247 PolarHBondContact O-N 3.22Å; L244-I247 WeakPolarHBondContact O-CB 3.47Å; L244-I247 PolarHBondContact O-N 3.38Å; I247-K249 PolarHBondContact O-N 3.17Å; I247-T250 PolarHBondContact O-N 3.09Å; I247-H251 PolarHBondContact O-N 2.82Å; I247-H251 PolarHBondContact O-ND1 2.93Å; I247-W253 HydrophobicContact CG2-CH2 3.71Å; I247-W253 HydrophobicContact CG2-CZ3 3.77Å
248	M	95.7	Very high	94.4	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60	-36.3	177.8	-70.8	170.3	75.3	0	0	111.8	F222 L244 F245 R252 W253 I255 I496 I506	F222-M248 HydrophobicContact CE1-CE 4.18Å; F222-M248 HydrophobicContact CE1-SD 4.03Å; F222-M248 HydrophobicContact CZ-CE 4.46Å; L244-M248 HydrophobicContact CD1-CG 4.33Å; L244-M248 HydrophobicContact CD1-SD 4.27Å; L244-M248 HydrophobicContact CD2-SD 4.31Å; L244-M248 HydrophobicContact CG-CG 4.4Å; L244-M248 HydrophobicContact CG-SD 3.85Å; L244-M248 VanDerWaalsContact O-CG 3.24Å; L244-M248 WeakPolarHBondContact O-CG 3.49Å; L244-M248 PolarHBondContact O-N 3.2Å; F245-M248 HydrophobicContact CD1-SD 3.75Å; F245-M248 HydrophobicContact CE1-SD 4.26Å; F245-M248 PolarHBondContact O-N 3.48Å; M248-R252 CarbonylContact O-C 3.57Å; M248-R252 VanDerWaalsContact O-CA 3.28Å; M248-R252 WeakPolarHBondContact O-CA 3.31Å; M248-R252 PolarHBondContact O-N 2.9Å; M248-W253 HydrophobicContact CB-CB 4.44Å; M248-W253 HydrophobicContact CB-CE3 4.35Å; M248-W253 HydrophobicContact CG-CE3 3.72Å; M248-W253 HydrophobicContact CG-CZ3 4.27Å; M248-W253 PolarHBondContact O-N 3.26Å; M248-I255 HydrophobicContact CE-CG2 3.25Å; M248-I496 HydrophobicContact CB-CD1 3.53Å; M248-I496 HydrophobicContact CB-CG1 4.24Å; M248-I496 HydrophobicContact CE-CD1 3.8Å; M248-I496 HydrophobicContact CG-CD1 4.3Å; M248-I496 HydrophobicContact SD-CD1 3.83Å; M248-I506 HydrophobicContact CE-CG2 4.38Å
249	K	93.7	Very high	94.4	Very high	68 Å²	68	36.5 Å²	36.5	30%	0.296	18%	0.176	S	C	.	.	H	α-helix	trans	-67.8	-47.8	175.7	-179.8	172.4	159.7	-154.6	0	111.8	F245 E246 I247 R252 I496	F245-K249 WeakPolarHBondContact O-CB 3.43Å; F245-K249 PolarHBondContact O-N 2.63Å; E246-K249 WeakPolarHBondContact O-CB 3.31Å; E246-K249 PolarHBondContact O-N 3.41Å; E246-K249 IonicContact OE1-NZ 3.66Å; E246-K249 PolarHBondContact OE1-NZ 2.85Å; E246-K249 VanDerWaalsContact OE1-NZ 3.1Å; E246-K249 WeakPolarHBondContact OE2-CD 3.13Å; E246-K249 IonicContact OE2-NZ 2.71Å; E246-K249 PolarHBondContact OE2-NZ 2.92Å; I247-K249 PolarHBondContact O-N 3.17Å; K249-R252 PolarHBondContact O-N 3.33Å; K249-I496 HydrophobicContact CB-CB 4.13Å; K249-I496 WeakPolarHBondContact CD-O 3.21Å; K249-I496 WeakPolarHBondContact CG-O 3.3Å
250	T	90.9	Very high	94.4	Very high	91 Å²	91	31.4 Å²	31.4	56%	0.558	15%	0.153	S	C	*	.	H	α-helix	trans	-59.8	-46.9	177.7	-67.8	0	0	0	0	111.4	E246 I247 R252	E246-T250 WeakPolarHBondContact O-CB 3.32Å; E246-T250 PolarHBondContact O-N 3.39Å; E246-T250 PolarHBondContact O-OG1 3.38Å; E246-T250 VanDerWaalsContact O-OG1 3.12Å; I247-T250 PolarHBondContact O-N 3.09Å; T250-R252 VanDerWaalsContact C-N 3.32Å
251	H	89	Confident	94.3	Very high	45 Å²	45	33.6 Å²	33.6	21%	0.208	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	4.7	179.2	-53.3	89.9	0	0	0	113.8	H211 I247 W253	H211-H251 AromaticContact CE1-CE1 3.94Å; H211-H251 AromaticContact CG-CE1 3.98Å; H211-H251 AromaticContact ND1-CE1 3.25Å; H211-H251 PolarHBondContact ND1-CE1 3.22Å; H211-H251 VanDerWaalsContact ND1-CE1 3.25Å; H211-H251 AromaticContact ND1-NE2 3.76Å; I247-H251 PolarHBondContact O-N 2.82Å; I247-H251 PolarHBondContact O-ND1 2.93Å; H251-W253 VanDerWaalsContact C-N 3.27Å; H251-W253 HydrophobicContact CB-CD2 4.1Å; H251-W253 VanDerWaalsContact CB-CE2 3.45Å; H251-W253 HydrophobicContact CB-CG 4.21Å; H251-W253 HydrophobicContact CB-CZ2 3.85Å; H251-W253 AromaticContact CG-CZ2 3.86Å; H251-W253 PolarHBondContact O-N 3.1Å
252	R	88.5	Confident	94.3	Very high	58 Å²	58	34.5 Å²	34.5	22%	0.219	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	39	172.5	-35.1	179.6	75	72.3	19.4	113.2	M248 K249 T250 E466 D493 C495	M248-R252 CarbonylContact O-C 3.57Å; M248-R252 VanDerWaalsContact O-CA 3.28Å; M248-R252 WeakPolarHBondContact O-CA 3.31Å; M248-R252 PolarHBondContact O-N 2.9Å; K249-R252 PolarHBondContact O-N 3.33Å; T250-R252 VanDerWaalsContact C-N 3.32Å; R252-E466 WeakPolarHBondContact CD-OE1 3.43Å; R252-D493 IonicContact CZ-OD1 3.73Å; R252-D493 IonicContact CZ-OD2 2.75Å; R252-D493 IonicContact NH2-OD1 3.28Å; R252-D493 PolarHBondContact NH2-OD1 3.22Å; R252-D493 IonicContact NH2-OD2 3.02Å; R252-D493 PolarHBondContact NH2-OD2 3.31Å; R252-C495 HydrophobicContact CB-CB 4.29Å
253	W	90.5	Very high	94.3	Very high	8 Å²	8	33.4 Å²	33.4	3%	0.03	16%	0.161	C	C	.	.			trans	-74.7	132.8	-177.6	-66.2	-13.6	0	0	0	111.4	M210 L213 G215 P217 I247 M248 H251	M210-W253 HydrophobicContact CB-CH2 4.29Å; M210-W253 HydrophobicContact CE-CE3 4.5Å; M210-W253 HydrophobicContact CE-CH2 3.84Å; M210-W253 HydrophobicContact CE-CZ3 3.42Å; M210-W253 VanDerWaalsContact CE-CZ3 3.42Å; M210-W253 WeakPolarHBondContact O-CH2 3.17Å; L213-W253 HydrophobicContact CB-CH2 4.44Å; L213-W253 HydrophobicContact CB-CZ2 3.96Å; L213-W253 HydrophobicContact CD1-CH2 3.96Å; L213-W253 HydrophobicContact CD1-CZ2 4.23Å; G215-W253 PolarHBondContact O-NE1 3.34Å; P217-W253 HydrophobicContact CG-CZ3 4.3Å; I247-W253 HydrophobicContact CG2-CH2 3.71Å; I247-W253 HydrophobicContact CG2-CZ3 3.77Å; M248-W253 HydrophobicContact CB-CB 4.44Å; M248-W253 HydrophobicContact CB-CE3 4.35Å; M248-W253 HydrophobicContact CG-CE3 3.72Å; M248-W253 HydrophobicContact CG-CZ3 4.27Å; M248-W253 PolarHBondContact O-N 3.26Å; H251-W253 VanDerWaalsContact C-N 3.27Å; H251-W253 HydrophobicContact CB-CD2 4.1Å; H251-W253 VanDerWaalsContact CB-CE2 3.45Å; H251-W253 HydrophobicContact CB-CG 4.21Å; H251-W253 HydrophobicContact CB-CZ2 3.85Å; H251-W253 AromaticContact CG-CZ2 3.86Å; H251-W253 PolarHBondContact O-N 3.1Å
254	I	89.7	Confident	94.3	Very high	25 Å²	25	32.3 Å²	32.3	13%	0.128	16%	0.156	C	C	.	.			trans	-105.3	126.8	171.1	-56	165.9	0	0	0	106.6	L494 P507 Y509 V520	I254-L494 HydrophobicContact CD1-CB 3.91Å; I254-L494 HydrophobicContact CD1-CD1 3.85Å; I254-L494 HydrophobicContact CD1-CG 4.47Å; I254-L494 HydrophobicContact CG1-CB 4.38Å; I254-P507 HydrophobicContact CG1-CB 4.49Å; I254-P507 HydrophobicContact CG1-CG 4.23Å; I254-P507 HydrophobicContact CG2-CB 4.37Å; I254-Y509 HydrophobicContact CB-CD2 4.35Å; I254-Y509 HydrophobicContact CB-CE2 3.8Å; I254-Y509 HydrophobicContact CD1-CE2 4.33Å; I254-Y509 WeakPolarHBondContact CD1-OH 3.46Å; I254-Y509 HydrophobicContact CG2-CD1 4.36Å; I254-Y509 HydrophobicContact CG2-CD2 3.64Å; I254-Y509 HydrophobicContact CG2-CE1 4.26Å; I254-Y509 HydrophobicContact CG2-CE2 3.49Å; I254-Y509 VanDerWaalsContact CG2-CE2 3.49Å; I254-Y509 HydrophobicContact CG2-CG 4.1Å; I254-V520 HydrophobicContact CD1-CG2 4.19Å; I254-V520 HydrophobicContact CG2-CG2 4.3Å
255	I	92.7	Very high	94.2	Very high	3 Å²	3	37.8 Å²	37.8	2%	0.015	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	168.7	-176.3	56.7	174.2	0	0	0	112.2	F222 M248 I259 A260 I263 I506 P507 Y508 Y509	F222-I255 HydrophobicContact CE1-CG2 4.39Å; F222-I255 HydrophobicContact CE2-CG2 4.41Å; F222-I255 HydrophobicContact CZ-CG2 3.97Å; M248-I255 HydrophobicContact CE-CG2 3.25Å; I255-I259 HydrophobicContact CB-CB 4.17Å; I255-I259 HydrophobicContact CB-CG2 4.1Å; I255-I259 HydrophobicContact CD1-CB 4.35Å; I255-I259 HydrophobicContact CD1-CG2 3.96Å; I255-I259 HydrophobicContact CG2-CG2 4.1Å; I255-A260 HydrophobicContact CD1-CB 3.83Å; I255-A260 HydrophobicContact CG1-CB 4.4Å; I255-I263 HydrophobicContact CD1-CD1 3.61Å; I255-I506 HydrophobicContact CD1-CG2 3.56Å; I255-I506 HydrophobicContact CG1-CG2 3.97Å; I255-P507 PolarHBondContact N-O 2.81Å; I255-Y508 CarbonylContact O-C 3.59Å; I255-Y508 WeakPolarHBondContact O-CA 3.36Å; I255-Y508 WeakPolarHBondContact O-CB 3.45Å; I255-Y509 PolarHBondContact O-N 3.21Å
256	T	92.3	Very high	94.1	Very high	43 Å²	43	39 Å²	39	26%	0.264	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	165.2	170.5	64.9	0	0	0	0	110.9	E219 E258 I259 A260	E219-T256 HydrophobicContact CG-CG2 4.38Å; E219-T256 VanDerWaalsContact OE1-CB 3.29Å; E219-T256 WeakPolarHBondContact OE1-CB 3.42Å; E219-T256 WeakPolarHBondContact OE1-CG2 3.44Å; E219-T256 PolarHBondContact OE1-OG1 3.25Å; T256-E258 VanDerWaalsContact CB-OE2 3.3Å; T256-E258 WeakPolarHBondContact CB-OE2 3.26Å; T256-E258 PolarHBondContact O-N 2.78Å; T256-E258 PolarHBondContact OG1-OE2 3.12Å; T256-I259 PolarHBondContact O-N 3.02Å; T256-A260 PolarHBondContact O-N 3.19Å
257	Y	93.3	Very high	94.1	Very high	85 Å²	85	35.7 Å²	35.7	33%	0.333	17%	0.166	S	C	.	.	H	α-helix	trans	-59.9	-39.7	176.1	173.6	-93.8	0	0	0	111.3	I259 A260 E261 L279 Y508 Y509	Y257-I259 VanDerWaalsContact C-N 3.34Å; Y257-I259 PolarHBondContact O-N 3.13Å; Y257-A260 WeakPolarHBondContact O-CB 3.42Å; Y257-A260 PolarHBondContact O-N 3.38Å; Y257-A260 VanDerWaalsContact O-N 3.14Å; Y257-E261 HydrophobicContact CE1-CB 4.47Å; Y257-E261 WeakPolarHBondContact O-CB 3.48Å; Y257-E261 PolarHBondContact O-N 3.36Å; Y257-L279 HydrophobicContact CE2-CD1 3.84Å; Y257-Y508 HydrophobicContact CD2-CD2 4.17Å; Y257-Y508 AromaticContact CD2-CE2 3.61Å; Y257-Y508 HydrophobicContact CD2-CE2 3.61Å; Y257-Y508 HydrophobicContact CE2-CE2 4.46Å; Y257-Y508 HydrophobicContact CG-CE2 4.48Å; Y257-Y509 PolarHBondContact N-O 3.14Å
258	E	94.1	Very high	94	Very high	51 Å²	51	38.3 Å²	38.3	24%	0.238	19%	0.188	C	C	.	.	H	α-helix	trans	-61.9	-41.9	-178	-64	75.2	-171.7	0	0	111.2	Y223 T256 E261 C262 H512	Y223-E258 WeakPolarHBondContact OH-CB 3.39Å; T256-E258 VanDerWaalsContact CB-OE2 3.3Å; T256-E258 WeakPolarHBondContact CB-OE2 3.26Å; T256-E258 PolarHBondContact O-N 2.78Å; T256-E258 PolarHBondContact OG1-OE2 3.12Å; E258-E261 PolarHBondContact O-N 3.11Å; E258-C262 WeakPolarHBondContact O-CB 3.22Å; E258-C262 PolarHBondContact O-N 2.85Å; E258-H512 IonicContact OE1-CE1 2.92Å
259	I	95.9	Very high	93.9	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-72	-37.6	173.9	-61.3	-50.9	0	0	0	111.6	E219 F222 Y223 I255 T256 Y257 E261 C262 I263	E219-I259 HydrophobicContact CB-CD1 3.82Å; E219-I259 HydrophobicContact CB-CG1 4.12Å; E219-I259 HydrophobicContact CG-CD1 4.18Å; E219-I259 HydrophobicContact CG-CG1 3.95Å; F222-I259 HydrophobicContact CB-CD1 3.68Å; F222-I259 HydrophobicContact CB-CG1 4.23Å; F222-I259 HydrophobicContact CB-CG2 4.03Å; F222-I259 HydrophobicContact CD1-CG2 4.08Å; F222-I259 HydrophobicContact CD2-CD1 4.35Å; F222-I259 HydrophobicContact CD2-CG1 4.08Å; F222-I259 HydrophobicContact CD2-CG2 4.2Å; F222-I259 HydrophobicContact CG-CD1 4.3Å; F222-I259 HydrophobicContact CG-CG1 4.32Å; F222-I259 HydrophobicContact CG-CG2 3.86Å; Y223-I259 HydrophobicContact CD1-CD1 4.15Å; Y223-I259 HydrophobicContact CD2-CD1 4.42Å; Y223-I259 HydrophobicContact CE1-CD1 3.68Å; Y223-I259 HydrophobicContact CE2-CD1 3.99Å; Y223-I259 HydrophobicContact CG-CD1 4.48Å; I255-I259 HydrophobicContact CB-CB 4.17Å; I255-I259 HydrophobicContact CB-CG2 4.1Å; I255-I259 HydrophobicContact CD1-CB 4.35Å; I255-I259 HydrophobicContact CD1-CG2 3.96Å; I255-I259 HydrophobicContact CG2-CG2 4.1Å; T256-I259 PolarHBondContact O-N 3.02Å; Y257-I259 VanDerWaalsContact C-N 3.34Å; Y257-I259 PolarHBondContact O-N 3.13Å; I259-E261 VanDerWaalsContact C-N 3.28Å; I259-E261 PolarHBondContact O-N 3.03Å; I259-C262 WeakPolarHBondContact O-CB 3.1Å; I259-C262 PolarHBondContact O-N 3.49Å; I259-I263 HydrophobicContact CG2-CD1 4.03Å; I259-I263 HydrophobicContact CG2-CG1 4.46Å; I259-I263 VanDerWaalsContact O-CG1 3.29Å; I259-I263 WeakPolarHBondContact O-CG1 3.38Å; I259-I263 PolarHBondContact O-N 2.83Å
260	A	96.4	Very high	93.9	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-61.7	-40.2	174.9	0	0	0	0	0	111.3	I255 T256 Y257 I263 Q264 L279 Y508 L524	I255-A260 HydrophobicContact CD1-CB 3.83Å; I255-A260 HydrophobicContact CG1-CB 4.4Å; T256-A260 PolarHBondContact O-N 3.19Å; Y257-A260 WeakPolarHBondContact O-CB 3.42Å; Y257-A260 PolarHBondContact O-N 3.38Å; Y257-A260 VanDerWaalsContact O-N 3.14Å; A260-I263 PolarHBondContact O-N 2.85Å; A260-Q264 WeakPolarHBondContact O-CB 3.35Å; A260-Q264 PolarHBondContact O-N 3.3Å; A260-L279 HydrophobicContact CB-CD2 3.6Å; A260-Y508 HydrophobicContact CB-CD1 3.88Å; A260-Y508 HydrophobicContact CB-CD2 4.42Å; A260-Y508 HydrophobicContact CB-CG 3.8Å; A260-L524 HydrophobicContact CB-CB 4.45Å; A260-L524 HydrophobicContact CB-CD2 4.44Å; A260-L524 WeakPolarHBondContact O-CD2 3Å
261	E	96.6	Very high	93.9	Very high	56 Å²	56	46.4 Å²	46.4	26%	0.262	22%	0.223	S	C	.	.	H	α-helix	trans	-68.3	-38.8	174.8	-158.2	-169.9	-179.4	0	0	112	Y257 E258 I259 Q264 R265 L279	Y257-E261 HydrophobicContact CE1-CB 4.47Å; Y257-E261 WeakPolarHBondContact O-CB 3.48Å; Y257-E261 PolarHBondContact O-N 3.36Å; E258-E261 PolarHBondContact O-N 3.11Å; I259-E261 VanDerWaalsContact C-N 3.28Å; I259-E261 PolarHBondContact O-N 3.03Å; E261-Q264 PolarHBondContact O-N 2.92Å; E261-R265 VanDerWaalsContact CD-CZ 3.47Å; E261-R265 WeakPolarHBondContact O-CG 3.35Å; E261-R265 PolarHBondContact O-N 3.27Å; E261-R265 PolarHBondContact O-NH1 2.96Å; E261-R265 IonicContact OE1-CZ 2.79Å; E261-R265 IonicContact OE1-NE 3.53Å; E261-R265 IonicContact OE1-NH2 2.74Å; E261-R265 PolarHBondContact OE1-NH2 2.94Å; E261-R265 IonicContact OE2-CZ 2.93Å; E261-R265 IonicContact OE2-NH2 2.75Å; E261-R265 PolarHBondContact OE2-NH2 3.02Å; E261-L279 HydrophobicContact CB-CD1 4.18Å; E261-L279 HydrophobicContact CG-CD1 4.13Å
262	C	96.8	Very high	93.8	Very high	19 Å²	19	51.8 Å²	51.8	13%	0.128	25%	0.248	C	C	.	.	H	α-helix	trans	-56	-50.8	171.6	-173.7	0	0	0	0	111.4	Y223 E258 I259 Q264 R265 W266	Y223-C262 HydrophobicContact CE1-CB 4.06Å; E258-C262 WeakPolarHBondContact O-CB 3.22Å; E258-C262 PolarHBondContact O-N 2.85Å; I259-C262 WeakPolarHBondContact O-CB 3.1Å; I259-C262 PolarHBondContact O-N 3.49Å; C262-Q264 PolarHBondContact O-N 2.68Å; C262-R265 PolarHBondContact O-N 3.43Å; C262-W266 WeakPolarHBondContact O-CB 3.33Å; C262-W266 PolarHBondContact O-N 2.81Å
263	I	97.8	Very high	93.7	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-60.3	-47.3	177.3	-67.5	165.7	0	0	0	110.8	F226 F245 I255 I259 A260 R265 W266 F267 I506 L524 L526	F226-I263 HydrophobicContact CE1-CG1 4.49Å; F226-I263 HydrophobicContact CE2-CG1 3.72Å; F226-I263 HydrophobicContact CZ-CD1 4.49Å; F226-I263 HydrophobicContact CZ-CG1 3.56Å; F245-I263 HydrophobicContact CE1-CD1 4Å; F245-I263 HydrophobicContact CE1-CG2 4.46Å; F245-I263 HydrophobicContact CZ-CD1 4.34Å; F245-I263 HydrophobicContact CZ-CG2 3.76Å; I255-I263 HydrophobicContact CD1-CD1 3.61Å; I259-I263 HydrophobicContact CG2-CD1 4.03Å; I259-I263 HydrophobicContact CG2-CG1 4.46Å; I259-I263 VanDerWaalsContact O-CG1 3.29Å; I259-I263 WeakPolarHBondContact O-CG1 3.38Å; I259-I263 PolarHBondContact O-N 2.83Å; A260-I263 PolarHBondContact O-N 2.85Å; I263-R265 VanDerWaalsContact C-N 3.33Å; I263-R265 PolarHBondContact O-N 3.31Å; I263-W266 PolarHBondContact O-N 2.82Å; I263-F267 HydrophobicContact CG2-CD2 3.79Å; I263-F267 HydrophobicContact CG2-CE2 3.99Å; I263-F267 WeakPolarHBondContact O-CD2 3.43Å; I263-F267 PolarHBondContact O-N 2.94Å; I263-I506 HydrophobicContact CD1-CD1 4.24Å; I263-I506 HydrophobicContact CG2-CD1 4.3Å; I263-L524 HydrophobicContact CB-CD2 3.96Å; I263-L524 HydrophobicContact CG2-CD2 3.69Å; I263-L526 HydrophobicContact CG2-CD1 3.77Å; I263-L526 HydrophobicContact CG2-CD2 4.5Å
264	Q	97.5	Very high	93.7	Very high	48 Å²	48	61 Å²	61	22%	0.224	29%	0.285	C	S	.	.	H	α-helix	trans	-54.8	-49.3	178.4	-176.9	-166.4	25.8	0	0	111.3	A260 E261 C262 F267 A268 G277 L524	A260-Q264 WeakPolarHBondContact O-CB 3.35Å; A260-Q264 PolarHBondContact O-N 3.3Å; E261-Q264 PolarHBondContact O-N 2.92Å; C262-Q264 PolarHBondContact O-N 2.68Å; Q264-F267 PolarHBondContact O-N 3.26Å; Q264-A268 WeakPolarHBondContact O-CB 2.82Å; Q264-A268 PolarHBondContact O-N 3.19Å; Q264-G277 PolarHBondContact NE2-O 3.21Å; Q264-L524 HydrophobicContact CB-CD1 4.04Å; Q264-L524 HydrophobicContact CG-CD1 4.3Å
265	R	96.5	Very high	93.9	Very high	116 Å²	116	60.3 Å²	60.3	44%	0.438	28%	0.281	S	S	.	.	H	α-helix	trans	-64.4	-40.5	178.7	-68.7	-174.6	-143.3	104.3	-14	112.1	E261 C262 I263 A268 N269	E261-R265 VanDerWaalsContact CD-CZ 3.47Å; E261-R265 WeakPolarHBondContact O-CG 3.35Å; E261-R265 PolarHBondContact O-N 3.27Å; E261-R265 PolarHBondContact O-NH1 2.96Å; E261-R265 IonicContact OE1-CZ 2.79Å; E261-R265 IonicContact OE1-NE 3.53Å; E261-R265 IonicContact OE1-NH2 2.74Å; E261-R265 PolarHBondContact OE1-NH2 2.94Å; E261-R265 IonicContact OE2-CZ 2.93Å; E261-R265 IonicContact OE2-NH2 2.75Å; E261-R265 PolarHBondContact OE2-NH2 3.02Å; C262-R265 PolarHBondContact O-N 3.43Å; I263-R265 VanDerWaalsContact C-N 3.33Å; I263-R265 PolarHBondContact O-N 3.31Å; R265-A268 PolarHBondContact O-N 3.32Å; R265-N269 PolarHBondContact O-N 3.17Å; R265-N269 PolarHBondContact O-ND2 3.1Å
266	W	96.3	Very high	94	Very high	25 Å²	25	61.9 Å²	61.9	10%	0.095	29%	0.292	C	S	.	.	H	α-helix	trans	-60.6	-48.2	177.7	-177.4	87	0	0	0	111.2	F226 L229 V238 V241 C262 I263 A268 N269 L270	F226-W266 HydrophobicContact CD1-CB 4Å; F226-W266 AromaticContact CD1-CD1 3.65Å; F226-W266 HydrophobicContact CD1-CD2 4.04Å; F226-W266 AromaticContact CD1-CG 3.59Å; F226-W266 HydrophobicContact CD1-CG 3.59Å; F226-W266 HydrophobicContact CE1-CB 4.16Å; F226-W266 AromaticContact CE1-CD2 3.91Å; F226-W266 HydrophobicContact CE1-CD2 3.91Å; F226-W266 HydrophobicContact CE1-CE3 4.26Å; F226-W266 AromaticContact CE1-CG 3.84Å; F226-W266 HydrophobicContact CE1-CG 3.84Å; L229-W266 HydrophobicContact CD1-CZ2 4.04Å; V238-W266 HydrophobicContact CB-CH2 4.48Å; V238-W266 HydrophobicContact CG2-CH2 3.81Å; V241-W266 HydrophobicContact CB-CH2 4.11Å; V241-W266 HydrophobicContact CB-CZ3 4.15Å; V241-W266 HydrophobicContact CG1-CZ3 4.11Å; V241-W266 HydrophobicContact CG2-CD2 4.39Å; V241-W266 HydrophobicContact CG2-CE3 4.17Å; V241-W266 HydrophobicContact CG2-CH2 3.57Å; V241-W266 HydrophobicContact CG2-CZ2 3.79Å; V241-W266 HydrophobicContact CG2-CZ3 3.77Å; C262-W266 WeakPolarHBondContact O-CB 3.33Å; C262-W266 PolarHBondContact O-N 2.81Å; I263-W266 PolarHBondContact O-N 2.82Å; W266-A268 VanDerWaalsContact C-N 3.35Å; W266-A268 PolarHBondContact O-N 3.36Å; W266-N269 PolarHBondContact O-N 2.75Å; W266-L270 HydrophobicContact CH2-CD1 4.42Å; W266-L270 HydrophobicContact CH2-CD2 3.76Å; W266-L270 HydrophobicContact CZ2-CD2 4Å; W266-L270 HydrophobicContact CZ3-CD1 4.09Å; W266-L270 HydrophobicContact CZ3-CD2 4.1Å; W266-L270 HydrophobicContact CZ3-CG 4.44Å
267	F	96	Very high	94.2	Very high	1 Å²	1	60.4 Å²	60.4	0%	0.004	29%	0.285	C	S	.	.	H	α-helix	trans	-63.1	-37.7	175.9	-90.9	-88.7	0	0	0	112.9	V241 F245 I263 Q264 N269 L270 W275 L526	V241-F267 HydrophobicContact CG1-CE2 3.82Å; V241-F267 HydrophobicContact CG1-CZ 4.02Å; F245-F267 AromaticContact CE2-CE2 3.78Å; F245-F267 HydrophobicContact CE2-CE2 3.78Å; F245-F267 AromaticContact CE2-CZ 3.94Å; F245-F267 HydrophobicContact CE2-CZ 3.94Å; F245-F267 AromaticContact CZ-CE2 3.87Å; F245-F267 HydrophobicContact CZ-CE2 3.87Å; F245-F267 HydrophobicContact CZ-CZ 4.48Å; I263-F267 HydrophobicContact CG2-CD2 3.79Å; I263-F267 HydrophobicContact CG2-CE2 3.99Å; I263-F267 WeakPolarHBondContact O-CD2 3.43Å; I263-F267 PolarHBondContact O-N 2.94Å; Q264-F267 PolarHBondContact O-N 3.26Å; F267-N269 PolarHBondContact O-N 3.14Å; F267-L270 HydrophobicContact CD1-CD1 3.73Å; F267-L270 HydrophobicContact CE1-CD1 4.25Å; F267-L270 HydrophobicContact CG-CD1 4.35Å; F267-L270 WeakPolarHBondContact O-CG 3.29Å; F267-L270 PolarHBondContact O-N 3.21Å; F267-W275 HydrophobicContact CB-CB 4.08Å; F267-W275 HydrophobicContact CD1-CB 3.86Å; F267-W275 AromaticContact CD1-CD2 3.57Å; F267-W275 HydrophobicContact CD1-CD2 3.57Å; F267-W275 AromaticContact CD1-CE3 3.77Å; F267-W275 HydrophobicContact CD1-CE3 3.77Å; F267-W275 AromaticContact CD1-CG 3.63Å; F267-W275 HydrophobicContact CD1-CG 3.63Å; F267-W275 HydrophobicContact CD1-CZ3 4.46Å; F267-W275 AromaticContact CE1-CD2 3.82Å; F267-W275 HydrophobicContact CE1-CD2 3.82Å; F267-W275 AromaticContact CE1-CE3 3.89Å; F267-W275 HydrophobicContact CE1-CE3 3.89Å; F267-W275 HydrophobicContact CE1-CG 4.29Å; F267-W275 HydrophobicContact CE1-CH2 4.3Å; F267-W275 HydrophobicContact CE1-CZ2 4.24Å; F267-W275 HydrophobicContact CE1-CZ3 4.14Å; F267-W275 HydrophobicContact CG-CB 4.47Å; F267-L526 HydrophobicContact CB-CD2 3.98Å; F267-L526 HydrophobicContact CD2-CD1 3.62Å; F267-L526 HydrophobicContact CD2-CD2 3.91Å; F267-L526 HydrophobicContact CD2-CG 4.38Å; F267-L526 HydrophobicContact CE1-CD1 4.47Å; F267-L526 HydrophobicContact CE2-CD1 3.49Å; F267-L526 VanDerWaalsContact CE2-CD1 3.49Å; F267-L526 HydrophobicContact CG-CD1 4.21Å; F267-L526 HydrophobicContact CG-CD2 3.9Å; F267-L526 HydrophobicContact CZ-CD1 3.94Å
268	A	94.3	Very high	94.3	Very high	61 Å²	61	58.6 Å²	58.6	50%	0.504	28%	0.281	S	S	.	.	H	α-helix	trans	-66.1	-20.6	178.1	0	0	0	0	0	113.6	Q264 R265 W266	Q264-A268 WeakPolarHBondContact O-CB 2.82Å; Q264-A268 PolarHBondContact O-N 3.19Å; R265-A268 PolarHBondContact O-N 3.32Å; W266-A268 VanDerWaalsContact C-N 3.35Å; W266-A268 PolarHBondContact O-N 3.36Å
269	N	93.5	Very high	94.4	Very high	127 Å²	127	57 Å²	57	68%	0.679	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-0.3	-179.5	-72.6	-26.1	0	0	0	113.9	R265 W266 F267	R265-N269 PolarHBondContact O-N 3.17Å; R265-N269 PolarHBondContact O-ND2 3.1Å; W266-N269 PolarHBondContact O-N 2.75Å; F267-N269 PolarHBondContact O-N 3.14Å
270	L	93.6	Very high	94.3	Very high	21 Å²	21	60.4 Å²	60.4	11%	0.11	30%	0.298	C	S	.	.			trans	-63.6	135.2	173.6	-63.2	173.6	0	0	0	110.3	E234 V238 W266 F267 E273 W275	E234-L270 HydrophobicContact CG-CD2 3.66Å; V238-L270 HydrophobicContact CG2-CD1 4.11Å; V238-L270 HydrophobicContact CG2-CD2 3.91Å; W266-L270 HydrophobicContact CH2-CD1 4.42Å; W266-L270 HydrophobicContact CH2-CD2 3.76Å; W266-L270 HydrophobicContact CZ2-CD2 4Å; W266-L270 HydrophobicContact CZ3-CD1 4.09Å; W266-L270 HydrophobicContact CZ3-CD2 4.1Å; W266-L270 HydrophobicContact CZ3-CG 4.44Å; F267-L270 HydrophobicContact CD1-CD1 3.73Å; F267-L270 HydrophobicContact CE1-CD1 4.25Å; F267-L270 HydrophobicContact CG-CD1 4.35Å; F267-L270 WeakPolarHBondContact O-CG 3.29Å; F267-L270 PolarHBondContact O-N 3.21Å; L270-E273 WeakPolarHBondContact CB-O 3.37Å; L270-W275 HydrophobicContact CD1-CG 4.21Å
271	K	90.3	Very high	94.1	Very high	182 Å²	182	60.5 Å²	60.5	79%	0.791	30%	0.299	S	S	*	.	S	Bend	trans	-93.2	-37.9	-172.6	-62.4	178.9	-176.4	171.6	0	112.4	E234	E234-K271 PolarHBondContact OE1-N 2.96Å; E234-K271 WeakPolarHBondContact OE2-CA 3.41Å; E234-K271 WeakPolarHBondContact OE2-CB 3.44Å; E234-K271 PolarHBondContact OE2-N 3.29Å
272	H	87.6	Confident	93.9	Very high	158 Å²	158	63 Å²	63	73%	0.731	31%	0.309	S	S	*	.	S	Bend	trans	-87.2	-43	-173.2	-60.2	-67	0	0	0	111.8	E234	E234-H272 VanDerWaalsContact CD-CD2 3.45Å; E234-H272 WeakPolarHBondContact OE1-CB 3.1Å; E234-H272 IonicContact OE1-CD2 2.77Å; E234-H272 IonicContact OE1-CG 3.68Å; E234-H272 PolarHBondContact OE1-N 3.37Å; E234-H272 IonicContact OE2-CD2 3.08Å; E234-H272 PolarHBondContact OE2-CD2 2.92Å; E234-H272 VanDerWaalsContact OE2-CD2 3.28Å; E234-H272 IonicContact OE2-CG 2.59Å; E234-H272 PolarHBondContact OE2-N 3.1Å
273	E	85.4	Confident	93.4	Very high	64 Å²	64	62.7 Å²	62.7	30%	0.299	31%	0.306	S	S	.	.	S	Bend	trans	-108.2	125.2	173.9	-65.5	-169	158.4	0	0	111.1	E234 L270 W275 R528	E234-E273 PolarHBondContact OE1-N 3.49Å; L270-E273 WeakPolarHBondContact CB-O 3.37Å; E273-W275 PolarHBondContact O-N 3.26Å; E273-W275 PolarHBondContact OE2-NE1 3.47Å; E273-R528 VanDerWaalsContact CD-NH2 3.28Å; E273-R528 IonicContact OE1-CZ 3.14Å; E273-R528 IonicContact OE1-NH1 3.81Å; E273-R528 PolarHBondContact OE1-NH1 3.4Å; E273-R528 IonicContact OE1-NH2 3.55Å; E273-R528 PolarHBondContact OE1-NH2 2.84Å; E273-R528 IonicContact OE2-CZ 3Å; E273-R528 IonicContact OE2-NE 3.56Å; E273-R528 PolarHBondContact OE2-NE 3.4Å; E273-R528 IonicContact OE2-NH1 2.64Å; E273-R528 IonicContact OE2-NH2 3.85Å; E273-R528 PolarHBondContact OE2-NH2 3.28Å
274	R	91.2	Very high	92.8	Very high	196 Å²	196	64.7 Å²	64.7	74%	0.74	32%	0.317	S	S	*	.			trans	-78.3	114.4	174	-70.2	-171.8	178.8	-177.6	0.8	110.2	L529	R274-L529 HydrophobicContact CB-CB 4.1Å; R274-L529 HydrophobicContact CB-CD1 4.37Å; R274-L529 PolarHBondContact O-N 3.46Å
275	W	95.1	Very high	91.6	Very high	10 Å²	10	72.3 Å²	72.3	4%	0.038	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	143.9	174.4	-75.3	81.9	0	0	0	111.2	F267 L270 E273 L500 L526 H527 R528	F267-W275 HydrophobicContact CB-CB 4.08Å; F267-W275 HydrophobicContact CD1-CB 3.86Å; F267-W275 AromaticContact CD1-CD2 3.57Å; F267-W275 HydrophobicContact CD1-CD2 3.57Å; F267-W275 AromaticContact CD1-CE3 3.77Å; F267-W275 HydrophobicContact CD1-CE3 3.77Å; F267-W275 AromaticContact CD1-CG 3.63Å; F267-W275 HydrophobicContact CD1-CG 3.63Å; F267-W275 HydrophobicContact CD1-CZ3 4.46Å; F267-W275 AromaticContact CE1-CD2 3.82Å; F267-W275 HydrophobicContact CE1-CD2 3.82Å; F267-W275 AromaticContact CE1-CE3 3.89Å; F267-W275 HydrophobicContact CE1-CE3 3.89Å; F267-W275 HydrophobicContact CE1-CG 4.29Å; F267-W275 HydrophobicContact CE1-CH2 4.3Å; F267-W275 HydrophobicContact CE1-CZ2 4.24Å; F267-W275 HydrophobicContact CE1-CZ3 4.14Å; F267-W275 HydrophobicContact CG-CB 4.47Å; L270-W275 HydrophobicContact CD1-CG 4.21Å; E273-W275 PolarHBondContact O-N 3.26Å; E273-W275 PolarHBondContact OE2-NE1 3.47Å; W275-L500 VanDerWaalsContact CH2-O 3.26Å; W275-L500 WeakPolarHBondContact CH2-O 3.38Å; W275-L500 HydrophobicContact CZ2-CD2 4.34Å; W275-L526 HydrophobicContact CE3-CB 4.15Å; W275-L526 HydrophobicContact CZ3-CB 4.11Å; W275-H527 VanDerWaalsContact CE3-C 3.43Å; W275-R528 HydrophobicContact CD2-CG 3.86Å; W275-R528 VanDerWaalsContact CE2-CG 3.45Å; W275-R528 HydrophobicContact CE3-CG 4.22Å; W275-R528 HydrophobicContact CH2-CG 3.88Å; W275-R528 HydrophobicContact CZ2-CG 3.49Å; W275-R528 VanDerWaalsContact CZ2-CG 3.49Å; W275-R528 VanDerWaalsContact CZ2-NE 3.28Å; W275-R528 HydrophobicContact CZ3-CG 4.22Å
276	S	93.4	Very high	90.8	Very high	36 Å²	36	68.7 Å²	68.7	25%	0.252	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	130.2	168.7	175.7	0	0	0	0	108.5	L526 H527	S276-L526 WeakPolarHBondContact O-CA 3.33Å; S276-H527 PolarHBondContact N-O 3.32Å; S276-H527 PolarHBondContact O-N 2.95Å
277	G	96.7	Very high	90.4	Very high	11 Å²	11	71.8 Å²	71.8	11%	0.113	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	131.1	169.9	0	0	0	0	0	110.3	Q264 C525	Q264-G277 PolarHBondContact NE2-O 3.21Å; G277-C525 CarbonylContact C-O 3.45Å; G277-C525 VanDerWaalsContact CA-O 3.29Å; G277-C525 WeakPolarHBondContact CA-O 3.3Å
278	D	96.3	Very high	90.2	Very high	48 Å²	48	74.3 Å²	74.3	26%	0.257	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	113.7	179.7	-167.7	-33.1	0	0	0	110.4	S280 V291 C525	D278-S280 VanDerWaalsContact C-N 3.32Å; D278-S280 WeakPolarHBondContact OD1-CA 3.43Å; D278-S280 WeakPolarHBondContact OD1-CB 3.34Å; D278-S280 PolarHBondContact OD1-N 3.24Å; D278-S280 PolarHBondContact OD1-OG 2.88Å; D278-S280 PolarHBondContact OD2-OG 2.9Å; D278-V291 HydrophobicContact CB-CB 4.41Å; D278-V291 HydrophobicContact CB-CG1 3.82Å; D278-V291 HydrophobicContact CB-CG2 3.9Å; D278-V291 WeakPolarHBondContact OD2-CG2 3.37Å; D278-C525 PolarHBondContact N-O 3.07Å; D278-C525 PolarHBondContact O-N 3.23Å
279	L	95.8	Very high	90.1	Very high	17 Å²	17	71.5 Å²	71.5	9%	0.089	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	-10.5	178.2	-70.1	168.7	0	0	0	112.9	Y257 A260 E261 A281 Y508 L524	Y257-L279 HydrophobicContact CE2-CD1 3.84Å; A260-L279 HydrophobicContact CB-CD2 3.6Å; E261-L279 HydrophobicContact CB-CD1 4.18Å; E261-L279 HydrophobicContact CG-CD1 4.13Å; L279-A281 PolarHBondContact O-N 3.26Å; L279-Y508 HydrophobicContact CB-CE1 4.5Å; L279-Y508 HydrophobicContact CD2-CD1 4.25Å; L279-Y508 HydrophobicContact CD2-CE1 3.73Å; L279-Y508 PolarHBondContact O-OH 3.07Å; L279-L524 HydrophobicContact CD2-CB 4Å; L279-L524 HydrophobicContact CD2-CD1 3.82Å; L279-L524 HydrophobicContact CD2-CG 4.37Å; L279-L524 HydrophobicContact CG-CD1 4.15Å
280	S	92.8	Very high	90.1	Very high	73 Å²	73	66.5 Å²	66.5	51%	0.51	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	-3.1	176.4	79.8	0	0	0	0	113.1	D278 F282	D278-S280 VanDerWaalsContact C-N 3.32Å; D278-S280 WeakPolarHBondContact OD1-CA 3.43Å; D278-S280 WeakPolarHBondContact OD1-CB 3.34Å; D278-S280 PolarHBondContact OD1-N 3.24Å; D278-S280 PolarHBondContact OD1-OG 2.88Å; D278-S280 PolarHBondContact OD2-OG 2.9Å; S280-F282 PolarHBondContact O-N 3.5Å
281	A	93.6	Very high	90.2	Very high	1 Å²	1	67.2 Å²	67.2	1%	0.008	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	136.3	-175.4	0	0	0	0	0	112.4	L279 S290 V291 W523 C525	L279-A281 PolarHBondContact O-N 3.26Å; A281-S290 WeakPolarHBondContact CA-OG 3.29Å; A281-V291 HydrophobicContact CB-CB 4.37Å; A281-V291 HydrophobicContact CB-CG2 3.65Å; A281-W523 HydrophobicContact CB-CB 4.23Å; A281-W523 WeakPolarHBondContact CB-O 3.37Å; A281-W523 PolarHBondContact O-N 2.91Å; A281-C525 HydrophobicContact CB-CB 3.58Å
282	F	90.6	Very high	90.3	Very high	109 Å²	109	60 Å²	60	48%	0.478	30%	0.297	S	S	.	.			trans	-141.5	159.7	173.7	65.8	-92.9	0	0	0	110.1	S280 S290 N521	S280-F282 PolarHBondContact O-N 3.5Å; F282-S290 VanDerWaalsContact CD1-OG 3.32Å; F282-S290 WeakPolarHBondContact CD1-OG 3.41Å; F282-S290 VanDerWaalsContact CE1-CB 3.42Å; F282-S290 PolarHBondContact N-OG 2.96Å; F282-S290 WeakPolarHBondContact O-CB 3.32Å; F282-S290 PolarHBondContact O-N 3.49Å; F282-S290 PolarHBondContact O-OG 3.25Å; F282-N521 WeakPolarHBondContact CB-O 3.48Å
283	V	88	Confident	90.5	Very high	12 Å²	12	60.3 Å²	60.3	7%	0.073	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-97.5	120.2	-178.6	-175	0	0	0	0	110.5	L296 K491 W523	V283-L296 HydrophobicContact CG2-CD1 4.35Å; V283-L296 HydrophobicContact CG2-CD2 3.69Å; V283-K491 PolarHBondContact O-NZ 3.33Å; V283-W523 HydrophobicContact CG2-CD2 4.45Å; V283-W523 HydrophobicContact CG2-CG 4.4Å
284	N	84.9	Confident	90.8	Very high	43 Å²	43	61.6 Å²	61.6	23%	0.23	30%	0.296	C	S	.	.			trans	-77.9	-172.8	179.5	78.1	16.4	0	0	0	112.2	G286 Y287 L288 K491	N284-G286 VanDerWaalsContact C-N 3.27Å; N284-G286 PolarHBondContact O-N 2.84Å; N284-G286 PolarHBondContact OD1-N 3.34Å; N284-Y287 PolarHBondContact O-N 3.33Å; N284-L288 PolarHBondContact N-O 3.23Å; N284-L288 WeakPolarHBondContact OD1-CB 3.4Å; N284-L288 PolarHBondContact OD1-N 3.01Å; N284-L288 VanDerWaalsContact OD1-N 3.15Å; N284-K491 VanDerWaalsContact O-CD 3.29Å; N284-K491 WeakPolarHBondContact O-CD 3.46Å; N284-K491 PolarHBondContact O-NZ 3.35Å
285	R	72.8	Confident	90.7	Very high	208 Å²	208	57.6 Å²	57.6	79%	0.785	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-23.7	-176.5	-72.3	-173.7	-174.2	-176.1	1.3	113.7	Y287	R285-Y287 VanDerWaalsContact C-N 3.33Å
286	G	78.6	Confident	90.4	Very high	40 Å²	40	57.3 Å²	57.3	41%	0.412	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	18.4	178.7	0	0	0	0	0	113.8	N284 L288 N295	N284-G286 VanDerWaalsContact C-N 3.27Å; N284-G286 PolarHBondContact O-N 2.84Å; N284-G286 PolarHBondContact OD1-N 3.34Å; G286-L288 PolarHBondContact O-N 3.12Å; G286-N295 PolarHBondContact O-OD1 3.39Å
287	Y	87.5	Confident	90	Very high	90 Å²	90	60.2 Å²	60.2	35%	0.353	31%	0.305	S	S	.	.	S	Bend	trans	63.8	13	-173.6	-47.1	-76.4	0	0	0	115.1	N284 R285 N295 L296 P298 K491	N284-Y287 PolarHBondContact O-N 3.33Å; R285-Y287 VanDerWaalsContact C-N 3.33Å; Y287-N295 WeakPolarHBondContact O-CA 3.5Å; Y287-L296 WeakPolarHBondContact CB-O 3.39Å; Y287-L296 PolarHBondContact O-N 3.33Å; Y287-P298 HydrophobicContact CD1-CB 4.45Å; Y287-P298 HydrophobicContact CD2-CB 4.46Å; Y287-P298 HydrophobicContact CE1-CB 4.16Å; Y287-P298 HydrophobicContact CE2-CB 4.16Å; Y287-K491 HydrophobicContact CD1-CB 4.23Å; Y287-K491 HydrophobicContact CE1-CB 4.04Å; Y287-K491 VanDerWaalsContact CE1-O 3.31Å; Y287-K491 WeakPolarHBondContact CE1-O 3.16Å
288	L	91.7	Very high	89.5	Confident	54 Å²	54	63 Å²	63	28%	0.283	32%	0.321	S	S	.	.	B	Isolated β-bridge	trans	-82.1	136.1	178.4	-60.5	157.3	0	0	0	110.5	N284 G286 R293 K294 N295	N284-L288 PolarHBondContact N-O 3.23Å; N284-L288 WeakPolarHBondContact OD1-CB 3.4Å; N284-L288 PolarHBondContact OD1-N 3.01Å; N284-L288 VanDerWaalsContact OD1-N 3.15Å; G286-L288 PolarHBondContact O-N 3.12Å; L288-R293 WeakPolarHBondContact CD2-O 3.35Å; L288-K294 WeakPolarHBondContact CA-O 3.47Å; L288-N295 WeakPolarHBondContact CD2-OD1 3.4Å; L288-N295 WeakPolarHBondContact CG-OD1 3.28Å
289	C	93.2	Very high	88.9	Confident	2 Å²	2	61.7 Å²	61.7	1%	0.014	32%	0.315	C	S	.	.	B	Isolated β-bridge	trans	-62.2	132.9	164.7	178.9	0	0	0	0	110.4	V291 R293 K294 L296 H505 C525	C289-V291 PolarHBondContact O-N 2.81Å; C289-V291 PolarHBondContact SG-N 2.94Å; C289-V291 VanDerWaalsContact SG-N 3.43Å; C289-R293 VanDerWaalsContact O-CA 3.25Å; C289-R293 WeakPolarHBondContact O-CA 3.13Å; C289-R293 PolarHBondContact O-N 3.01Å; C289-K294 PolarHBondContact N-O 3.44Å; C289-L296 HydrophobicContact CB-CD1 3.97Å; C289-H505 WeakPolarHBondContact CB-NE2 3.39Å; C289-H505 PolarHBondContact SG-NE2 3.38Å; C289-H505 VanDerWaalsContact SG-NE2 3.36Å; C289-C525 VanDerWaalsContact SG-SG 3.69Å
290	S	93.8	Very high	88.4	Confident	21 Å²	21	64 Å²	64	15%	0.147	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-24.2	177.2	57.7	0	0	0	0	113.7	A281 F282	A281-S290 WeakPolarHBondContact CA-OG 3.29Å; F282-S290 VanDerWaalsContact CD1-OG 3.32Å; F282-S290 WeakPolarHBondContact CD1-OG 3.41Å; F282-S290 VanDerWaalsContact CE1-CB 3.42Å; F282-S290 PolarHBondContact N-OG 2.96Å; F282-S290 WeakPolarHBondContact O-CB 3.32Å; F282-S290 PolarHBondContact O-N 3.49Å; F282-S290 PolarHBondContact O-OG 3.25Å
291	V	94.3	Very high	88	Confident	37 Å²	37	61.3 Å²	61.3	22%	0.224	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-73.2	-175.7	179.4	0	0	0	0	110.6	D278 A281 C289 R293 C525	D278-V291 HydrophobicContact CB-CB 4.41Å; D278-V291 HydrophobicContact CB-CG1 3.82Å; D278-V291 HydrophobicContact CB-CG2 3.9Å; D278-V291 WeakPolarHBondContact OD2-CG2 3.37Å; A281-V291 HydrophobicContact CB-CB 4.37Å; A281-V291 HydrophobicContact CB-CG2 3.65Å; C289-V291 PolarHBondContact O-N 2.81Å; C289-V291 PolarHBondContact SG-N 2.94Å; C289-V291 VanDerWaalsContact SG-N 3.43Å; V291-R293 VanDerWaalsContact C-N 3.29Å; V291-R293 PolarHBondContact O-N 3.47Å; V291-C525 HydrophobicContact CB-CB 4.24Å
292	C	93.3	Very high	87.6	Confident	30 Å²	30	66 Å²	66	20%	0.203	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-5.2	-173.8	74.8	0	0	0	0	114.2	K294 H505 C525 H527	C292-K294 PolarHBondContact O-N 3.41Å; C292-K294 PolarHBondContact SG-N 2.87Å; C292-H505 VanDerWaalsContact SG-CE1 3.57Å; C292-H505 PolarHBondContact SG-NE2 3.08Å; C292-C525 VanDerWaalsContact SG-SG 3.61Å; C292-H527 HydrophobicContact CB-CB 4.45Å
293	R	92.2	Very high	87.3	Confident	164 Å²	164	66.1 Å²	66.1	62%	0.619	34%	0.342	S	S	*	.			trans	58.8	13.4	-178	-51.9	-59.6	-173	172.7	0.6	115.4	L288 C289 V291	L288-R293 WeakPolarHBondContact CD2-O 3.35Å; C289-R293 VanDerWaalsContact O-CA 3.25Å; C289-R293 WeakPolarHBondContact O-CA 3.13Å; C289-R293 PolarHBondContact O-N 3.01Å; V291-R293 VanDerWaalsContact C-N 3.29Å; V291-R293 PolarHBondContact O-N 3.47Å
294	K	91	Very high	87.2	Confident	91 Å²	91	66.1 Å²	66.1	40%	0.396	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-79.2	149.8	172.2	-62.9	-173.7	-179.2	-176.7	0	110.7	L288 C289 C292 T502	L288-K294 WeakPolarHBondContact CA-O 3.47Å; C289-K294 PolarHBondContact N-O 3.44Å; C292-K294 PolarHBondContact O-N 3.41Å; C292-K294 PolarHBondContact SG-N 2.87Å; K294-T502 WeakPolarHBondContact CD-O 3.27Å; K294-T502 PolarHBondContact NZ-O 3.37Å
295	N	88.6	Confident	87.4	Confident	113 Å²	113	66 Å²	66	60%	0.604	34%	0.343	S	S	*	.	B	Isolated β-bridge	trans	-75.6	133	173	-77	-40.6	0	0	0	110.3	G286 Y287 L288	G286-N295 PolarHBondContact O-OD1 3.39Å; Y287-N295 WeakPolarHBondContact O-CA 3.5Å; L288-N295 WeakPolarHBondContact CD2-OD1 3.4Å; L288-N295 WeakPolarHBondContact CG-OD1 3.28Å
296	L	89.3	Confident	88.2	Confident	4 Å²	4	56.7 Å²	56.7	2%	0.021	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-84.7	143.9	162.2	-82.8	75.4	0	0	0	108.5	V283 Y287 C289 C492 H497 H505 W523	V283-L296 HydrophobicContact CG2-CD1 4.35Å; V283-L296 HydrophobicContact CG2-CD2 3.69Å; Y287-L296 WeakPolarHBondContact CB-O 3.39Å; Y287-L296 PolarHBondContact O-N 3.33Å; C289-L296 HydrophobicContact CB-CD1 3.97Å; L296-C492 HydrophobicContact CB-CB 4.44Å; L296-C492 WeakPolarHBondContact CB-SG 3.45Å; L296-C492 HydrophobicContact CD2-CB 4.45Å; L296-H497 WeakPolarHBondContact CB-ND1 3.31Å; L296-H497 HydrophobicContact CG-CB 4.34Å; L296-H505 HydrophobicContact CD1-CB 4.47Å; L296-H505 HydrophobicContact CD2-CB 4.02Å; L296-H505 HydrophobicContact CG-CB 4.34Å; L296-W523 HydrophobicContact CD2-CD2 4.19Å; L296-W523 HydrophobicContact CD2-CE3 3.99Å; L296-W523 HydrophobicContact CD2-CH2 4.02Å; L296-W523 HydrophobicContact CD2-CZ2 4.24Å; L296-W523 HydrophobicContact CD2-CZ3 3.89Å
297	T	85.7	Confident	88.8	Confident	97 Å²	97	58.7 Å²	58.7	60%	0.595	32%	0.316	S	S	*	.	P	Polyproline II helix	trans	-60.5	128.1	179	-47.6	0	0	0	0	110.1	H497	T297-H497 PolarHBondContact N-ND1 2.85Å; T297-H497 PolarHBondContact O-CE1 3.13Å; T297-H497 VanDerWaalsContact O-CE1 3.3Å
298	P	84.5	Confident	89	Confident	68 Å²	68	60.6 Å²	60.6	44%	0.442	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-65.9	153.9	171.3	28.5	-33.8	0	0	0	110	Y287 D300	Y287-P298 HydrophobicContact CD1-CB 4.45Å; Y287-P298 HydrophobicContact CD2-CB 4.46Å; Y287-P298 HydrophobicContact CE1-CB 4.16Å; Y287-P298 HydrophobicContact CE2-CB 4.16Å; P298-D300 PolarHBondContact O-N 2.75Å
299	P	83.7	Confident	89.1	Confident	21 Å²	21	58.1 Å²	58.1	14%	0.136	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-63.4	126.1	176.7	-12.6	24.6	0	0	0	110.3	M301 L474 K491	P299-M301 HydrophobicContact CB-SD 4.15Å; P299-M301 PolarHBondContact O-N 3.01Å; P299-M301 VanDerWaalsContact O-N 3.14Å; P299-L474 HydrophobicContact CB-CD1 3.54Å; P299-L474 HydrophobicContact CB-CD2 3.88Å; P299-L474 HydrophobicContact CB-CG 4.32Å; P299-L474 HydrophobicContact CG-CD1 4.08Å; P299-L474 HydrophobicContact CG-CD2 3.42Å; P299-L474 VanDerWaalsContact CG-CD2 3.42Å; P299-L474 HydrophobicContact CG-CG 4.32Å; P299-K491 WeakPolarHBondContact CD-O 3.23Å; P299-K491 VanDerWaalsContact CG-O 3.31Å; P299-K491 WeakPolarHBondContact CG-O 3.43Å
300	D	85.7	Confident	89.1	Confident	67 Å²	67	58 Å²	58	36%	0.358	31%	0.314	S	S	.	.			trans	-79.6	96	172.2	-176.8	3.6	0	0	0	109.9	P298 S302 Q303	P298-D300 PolarHBondContact O-N 2.75Å; D300-S302 VanDerWaalsContact CG-OG 3.31Å; D300-S302 PolarHBondContact O-N 3.2Å; D300-S302 WeakPolarHBondContact OD1-CB 3.08Å; D300-S302 PolarHBondContact OD1-N 2.93Å; D300-S302 PolarHBondContact OD1-OG 2.9Å; D300-S302 PolarHBondContact OD2-OG 3.24Å; D300-Q303 HydrophobicContact CB-CG 4.12Å; D300-Q303 PolarHBondContact O-N 2.91Å; D300-Q303 WeakPolarHBondContact OD2-CG 3.12Å; D300-Q303 PolarHBondContact OD2-NE2 3.16Å
301	M	85.8	Confident	89.1	Confident	15 Å²	15	60.5 Å²	60.5	7%	0.074	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-70.2	-15.6	-179.7	-61	-54.9	-61	0	0	113.3	P299 Q303 F304 P443 L474 R475	P299-M301 HydrophobicContact CB-SD 4.15Å; P299-M301 PolarHBondContact O-N 3.01Å; P299-M301 VanDerWaalsContact O-N 3.14Å; M301-Q303 PolarHBondContact O-N 2.95Å; M301-F304 HydrophobicContact CE-CD2 4.14Å; M301-F304 HydrophobicContact CE-CE2 4.01Å; M301-F304 HydrophobicContact SD-CD2 4.45Å; M301-F304 HydrophobicContact SD-CE2 4Å; M301-P443 HydrophobicContact CB-CB 4.2Å; M301-P443 HydrophobicContact CE-CB 3.82Å; M301-P443 WeakPolarHBondContact CE-O 3.35Å; M301-L474 HydrophobicContact SD-CD1 3.91Å; M301-R475 HydrophobicContact CE-CG 4.36Å; M301-R475 VanDerWaalsContact CG-NH2 3.3Å; M301-R475 PolarHBondContact SD-NH2 3.06Å; M301-R475 VanDerWaalsContact SD-NH2 3.43Å
302	S	84.6	Confident	89	Confident	100 Å²	100	61.8 Å²	61.8	70%	0.699	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-72.6	-17.4	179.1	74.4	0	0	0	0	112.8	D300 F304	D300-S302 VanDerWaalsContact CG-OG 3.31Å; D300-S302 PolarHBondContact O-N 3.2Å; D300-S302 WeakPolarHBondContact OD1-CB 3.08Å; D300-S302 PolarHBondContact OD1-N 2.93Å; D300-S302 PolarHBondContact OD1-OG 2.9Å; D300-S302 PolarHBondContact OD2-OG 3.24Å; S302-F304 VanDerWaalsContact C-N 3.29Å; S302-F304 PolarHBondContact O-N 3.29Å
303	Q	83.4	Confident	89	Confident	111 Å²	111	60.4 Å²	60.4	52%	0.519	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-76.3	-13.1	179.3	-67.6	174.4	4.2	0	0	114.2	D300 M301 P305	D300-Q303 HydrophobicContact CB-CG 4.12Å; D300-Q303 PolarHBondContact O-N 2.91Å; D300-Q303 WeakPolarHBondContact OD2-CG 3.12Å; D300-Q303 PolarHBondContact OD2-NE2 3.16Å; M301-Q303 PolarHBondContact O-N 2.95Å; Q303-P305 VanDerWaalsContact O-CD 3.31Å; Q303-P305 WeakPolarHBondContact O-CD 3.49Å
304	F	86.3	Confident	88.9	Confident	12 Å²	12	53.8 Å²	53.8	5%	0.053	30%	0.3	C	S	.	.			trans	-84.9	116.4	179.2	-68.6	-91.5	0	0	0	110	M301 S302 F306 M309 R470 W471 L474	M301-F304 HydrophobicContact CE-CD2 4.14Å; M301-F304 HydrophobicContact CE-CE2 4.01Å; M301-F304 HydrophobicContact SD-CD2 4.45Å; M301-F304 HydrophobicContact SD-CE2 4Å; S302-F304 VanDerWaalsContact C-N 3.29Å; S302-F304 PolarHBondContact O-N 3.29Å; F304-F306 HydrophobicContact CB-CD2 3.32Å; F304-F306 HydrophobicContact CB-CE2 3.28Å; F304-F306 HydrophobicContact CB-CZ 4.5Å; F304-F306 HydrophobicContact CD1-CE2 4.07Å; F304-F306 HydrophobicContact CD2-CE2 4.42Å; F304-F306 HydrophobicContact CG-CD2 4.26Å; F304-F306 AromaticContact CG-CE2 3.71Å; F304-F306 HydrophobicContact CG-CE2 3.71Å; F304-F306 PolarHBondContact O-N 3.35Å; F304-M309 HydrophobicContact CB-SD 4.16Å; F304-M309 HydrophobicContact CD1-SD 4.18Å; F304-R470 HydrophobicContact CE1-CB 4Å; F304-R470 HydrophobicContact CE1-CG 4.08Å; F304-R470 HydrophobicContact CZ-CB 4.1Å; F304-R470 VanDerWaalsContact CZ-CD 3.49Å; F304-R470 HydrophobicContact CZ-CG 3.69Å; F304-W471 HydrophobicContact CD1-CB 4.3Å; F304-W471 HydrophobicContact CE1-CB 3.79Å; F304-W471 HydrophobicContact CZ-CB 4.24Å; F304-L474 HydrophobicContact CE2-CD1 4.17Å; F304-L474 HydrophobicContact CZ-CD1 4.05Å
305	P	90.2	Very high	88.8	Confident	42 Å²	42	53.7 Å²	53.7	27%	0.273	30%	0.301	S	S	.	.			trans	-79.2	64.3	179.4	34.7	-35.9	0	0	0	110.5	Q303 S307 Q308 M309	Q303-P305 VanDerWaalsContact O-CD 3.31Å; Q303-P305 WeakPolarHBondContact O-CD 3.49Å; P305-S307 VanDerWaalsContact C-N 3.25Å; P305-S307 PolarHBondContact O-N 3.39Å; P305-S307 VanDerWaalsContact O-N 3.09Å; P305-Q308 HydrophobicContact CB-CB 4.19Å; P305-Q308 HydrophobicContact CB-CG 4.36Å; P305-Q308 WeakPolarHBondContact O-CA 3.37Å; P305-Q308 WeakPolarHBondContact O-CB 3.2Å; P305-Q308 PolarHBondContact O-N 3.3Å; P305-M309 HydrophobicContact CG-CG 4.27Å; P305-M309 WeakPolarHBondContact O-CG 3.32Å; P305-M309 PolarHBondContact O-N 3.44Å
306	F	89.7	Confident	88.7	Confident	12 Å²	12	50 Å²	50	5%	0.053	28%	0.282	C	S	.	.	H	α-helix	trans	-56.3	-32.9	-168.3	-98.9	-88.6	0	0	0	115	F304 M309 A310 M439 P443 W471	F304-F306 HydrophobicContact CB-CD2 3.32Å; F304-F306 HydrophobicContact CB-CE2 3.28Å; F304-F306 HydrophobicContact CB-CZ 4.5Å; F304-F306 HydrophobicContact CD1-CE2 4.07Å; F304-F306 HydrophobicContact CD2-CE2 4.42Å; F304-F306 HydrophobicContact CG-CD2 4.26Å; F304-F306 AromaticContact CG-CE2 3.71Å; F304-F306 HydrophobicContact CG-CE2 3.71Å; F304-F306 PolarHBondContact O-N 3.35Å; F306-M309 HydrophobicContact CD1-SD 4.48Å; F306-M309 HydrophobicContact CD2-SD 4.16Å; F306-M309 HydrophobicContact CE1-CE 4.32Å; F306-M309 HydrophobicContact CE2-SD 4.22Å; F306-M309 HydrophobicContact CG-SD 4.28Å; F306-M309 HydrophobicContact CZ-CE 4.24Å; F306-M309 HydrophobicContact CZ-SD 4.42Å; F306-M309 PolarHBondContact O-N 2.88Å; F306-A310 VanDerWaalsContact O-CB 3.31Å; F306-A310 WeakPolarHBondContact O-CB 3.25Å; F306-A310 PolarHBondContact O-N 2.85Å; F306-M439 HydrophobicContact CD1-CB 4.01Å; F306-M439 HydrophobicContact CD1-CG 4.26Å; F306-M439 WeakPolarHBondContact CD1-O 3.22Å; F306-M439 HydrophobicContact CE1-CB 4.24Å; F306-M439 HydrophobicContact CE1-CG 4.09Å; F306-P443 HydrophobicContact CD2-CB 3.57Å; F306-P443 HydrophobicContact CD2-CG 4.14Å; F306-P443 VanDerWaalsContact CE2-CA 3.41Å; F306-P443 HydrophobicContact CE2-CB 3.52Å; F306-P443 HydrophobicContact CG-CB 4.49Å; F306-P443 HydrophobicContact CZ-CB 4.39Å; F306-W471 HydrophobicContact CE1-CD2 4.12Å; F306-W471 AromaticContact CE1-CE2 3.92Å; F306-W471 HydrophobicContact CE1-CG 4.42Å; F306-W471 HydrophobicContact CE1-CZ2 4.14Å; F306-W471 HydrophobicContact CE2-CG 4.43Å; F306-W471 HydrophobicContact CZ-CB 4.19Å; F306-W471 AromaticContact CZ-CD1 3.49Å; F306-W471 VanDerWaalsContact CZ-CD1 3.49Å; F306-W471 AromaticContact CZ-CD2 3.72Å; F306-W471 HydrophobicContact CZ-CD2 3.72Å; F306-W471 AromaticContact CZ-CE2 3.69Å; F306-W471 HydrophobicContact CZ-CE3 4.49Å; F306-W471 AromaticContact CZ-CG 3.56Å; F306-W471 HydrophobicContact CZ-CG 3.56Å; F306-W471 HydrophobicContact CZ-CZ2 4.37Å; F306-W471 AromaticContact CZ-NE1 3.56Å
307	S	89.5	Confident	88.6	Confident	82 Å²	82	50.2 Å²	50.2	57%	0.573	28%	0.284	S	S	*	.	H	α-helix	trans	-61	-49.4	173.4	-167.5	0	0	0	0	110.7	P305 A310 D311	P305-S307 VanDerWaalsContact C-N 3.25Å; P305-S307 PolarHBondContact O-N 3.39Å; P305-S307 VanDerWaalsContact O-N 3.09Å; S307-A310 PolarHBondContact O-N 3.45Å; S307-D311 WeakPolarHBondContact O-CB 2.98Å; S307-D311 PolarHBondContact O-N 2.9Å; S307-D311 VanDerWaalsContact O-OD2 3.13Å
308	Q	92.7	Very high	88.5	Confident	130 Å²	130	45.6 Å²	45.6	61%	0.607	26%	0.256	S	S	*	.	H	α-helix	trans	-65.7	-42.9	178	-61.4	174.7	-2.5	0	0	110.8	P305 A310 D311 T312	P305-Q308 HydrophobicContact CB-CB 4.19Å; P305-Q308 HydrophobicContact CB-CG 4.36Å; P305-Q308 WeakPolarHBondContact O-CA 3.37Å; P305-Q308 WeakPolarHBondContact O-CB 3.2Å; P305-Q308 PolarHBondContact O-N 3.3Å; Q308-A310 VanDerWaalsContact C-N 3.33Å; Q308-A310 PolarHBondContact O-N 2.89Å; Q308-D311 PolarHBondContact O-N 3.32Å; Q308-T312 WeakPolarHBondContact O-CB 3.09Å; Q308-T312 PolarHBondContact O-N 3.24Å; Q308-T312 PolarHBondContact O-OG1 3.16Å; Q308-T312 VanDerWaalsContact O-OG1 3.04Å
309	M	94.2	Very high	88.5	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-55.8	-48.1	175.7	-66.8	173.4	62.1	0	0	111.4	F304 P305 F306 F313 M439 L464 Q467 I468	F304-M309 HydrophobicContact CB-SD 4.16Å; F304-M309 HydrophobicContact CD1-SD 4.18Å; P305-M309 HydrophobicContact CG-CG 4.27Å; P305-M309 WeakPolarHBondContact O-CG 3.32Å; P305-M309 PolarHBondContact O-N 3.44Å; F306-M309 HydrophobicContact CD1-SD 4.48Å; F306-M309 HydrophobicContact CD2-SD 4.16Å; F306-M309 HydrophobicContact CE1-CE 4.32Å; F306-M309 HydrophobicContact CE2-SD 4.22Å; F306-M309 HydrophobicContact CG-SD 4.28Å; F306-M309 HydrophobicContact CZ-CE 4.24Å; F306-M309 HydrophobicContact CZ-SD 4.42Å; F306-M309 PolarHBondContact O-N 2.88Å; M309-F313 WeakPolarHBondContact O-CB 3.46Å; M309-F313 PolarHBondContact O-N 3.5Å; M309-M439 HydrophobicContact CB-SD 4.31Å; M309-L464 HydrophobicContact CB-CD1 3.68Å; M309-L464 HydrophobicContact CE-CD1 4.14Å; M309-L464 HydrophobicContact CG-CD1 3.7Å; M309-Q467 HydrophobicContact CE-CB 3.81Å; M309-Q467 VanDerWaalsContact CG-OE1 3.3Å; M309-Q467 HydrophobicContact SD-CB 4.15Å; M309-I468 HydrophobicContact CE-CG1 4.37Å
310	A	93.7	Very high	88	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-64	-43.5	178.9	0	0	0	0	0	111.6	F306 S307 Q308 F313 Y314 Y436 M439 K440	F306-A310 VanDerWaalsContact O-CB 3.31Å; F306-A310 WeakPolarHBondContact O-CB 3.25Å; F306-A310 PolarHBondContact O-N 2.85Å; S307-A310 PolarHBondContact O-N 3.45Å; Q308-A310 VanDerWaalsContact C-N 3.33Å; Q308-A310 PolarHBondContact O-N 2.89Å; A310-F313 PolarHBondContact O-N 3.47Å; A310-Y314 WeakPolarHBondContact O-CB 3.48Å; A310-Y314 PolarHBondContact O-N 3.13Å; A310-Y436 HydrophobicContact CB-CE2 4.2Å; A310-Y436 VanDerWaalsContact O-CE2 3.3Å; A310-Y436 WeakPolarHBondContact O-CE2 3.21Å; A310-M439 HydrophobicContact CB-CB 3.85Å; A310-K440 HydrophobicContact CB-CD 3.85Å; A310-K440 HydrophobicContact CB-CG 4.12Å
311	D	93	Very high	87.3	Confident	74 Å²	74	47.1 Å²	47.1	40%	0.396	26%	0.262	S	S	.	.	H	α-helix	trans	-68.3	-44.6	-178.2	-63.9	-21	0	0	0	111.2	S307 Q308 Y314 E315 K440	S307-D311 WeakPolarHBondContact O-CB 2.98Å; S307-D311 PolarHBondContact O-N 2.9Å; S307-D311 VanDerWaalsContact O-OD2 3.13Å; Q308-D311 PolarHBondContact O-N 3.32Å; D311-Y314 WeakPolarHBondContact O-CB 3.12Å; D311-Y314 PolarHBondContact O-N 3.23Å; D311-E315 PolarHBondContact O-N 2.84Å; D311-K440 IonicContact OD1-NZ 2.86Å; D311-K440 PolarHBondContact OD1-NZ 3.41Å
312	T	92.5	Very high	86.6	Confident	64 Å²	64	50.3 Å²	50.3	39%	0.393	28%	0.28	S	S	.	.	H	α-helix	trans	-63	-42.5	173.4	-58.7	0	0	0	0	111.3	Q308 Y314 E315 T316 L464	Q308-T312 WeakPolarHBondContact O-CB 3.09Å; Q308-T312 PolarHBondContact O-N 3.24Å; Q308-T312 PolarHBondContact O-OG1 3.16Å; Q308-T312 VanDerWaalsContact O-OG1 3.04Å; T312-Y314 VanDerWaalsContact C-N 3.32Å; T312-Y314 PolarHBondContact O-N 3.4Å; T312-E315 PolarHBondContact O-N 3.45Å; T312-T316 HydrophobicContact CG2-CG2 4.13Å; T312-T316 WeakPolarHBondContact O-CB 3.32Å; T312-T316 WeakPolarHBondContact O-CG2 3.24Å; T312-T316 PolarHBondContact O-N 2.91Å; T312-T316 PolarHBondContact O-OG1 3.11Å; T312-L464 HydrophobicContact CG2-CD2 3.63Å
313	F	92.2	Very high	85.6	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-61.9	-41	176	-171.1	-92.5	0	0	0	111.7	M309 A310 V317 I318 V432 L435 Y436 M439 S460 L464 I468	M309-F313 WeakPolarHBondContact O-CB 3.46Å; M309-F313 PolarHBondContact O-N 3.5Å; A310-F313 PolarHBondContact O-N 3.47Å; F313-V317 HydrophobicContact CD1-CB 4.38Å; F313-V317 HydrophobicContact CD2-CB 4.34Å; F313-V317 HydrophobicContact CD2-CG2 3.94Å; F313-V317 HydrophobicContact CE1-CB 4.19Å; F313-V317 HydrophobicContact CE1-CG1 4.21Å; F313-V317 HydrophobicContact CE2-CB 4.15Å; F313-V317 HydrophobicContact CE2-CG1 4.22Å; F313-V317 HydrophobicContact CE2-CG2 3.87Å; F313-V317 HydrophobicContact CG-CB 4.46Å; F313-V317 HydrophobicContact CG-CG2 4.42Å; F313-V317 HydrophobicContact CZ-CB 4.07Å; F313-V317 HydrophobicContact CZ-CG1 3.85Å; F313-V317 HydrophobicContact CZ-CG2 4.3Å; F313-V317 WeakPolarHBondContact O-CA 3.49Å; F313-V317 VanDerWaalsContact O-CB 3.3Å; F313-V317 WeakPolarHBondContact O-CB 3.5Å; F313-V317 PolarHBondContact O-N 3.33Å; F313-I318 HydrophobicContact CD1-CD1 4.38Å; F313-I318 HydrophobicContact CD1-CG1 4.47Å; F313-I318 HydrophobicContact CE1-CD1 4.5Å; F313-I318 HydrophobicContact CE1-CG1 4.39Å; F313-I318 PolarHBondContact O-N 2.69Å; F313-V432 HydrophobicContact CE1-CG1 3.96Å; F313-V432 HydrophobicContact CZ-CG1 4.4Å; F313-L435 HydrophobicContact CE1-CB 4.21Å; F313-L435 HydrophobicContact CE2-CB 4.45Å; F313-L435 HydrophobicContact CE2-CD1 4.09Å; F313-L435 HydrophobicContact CZ-CB 3.86Å; F313-L435 HydrophobicContact CZ-CD1 3.89Å; F313-Y436 HydrophobicContact CD1-CD2 4.18Å; F313-M439 HydrophobicContact CB-CE 4.26Å; F313-M439 HydrophobicContact CB-SD 3.83Å; F313-M439 HydrophobicContact CD2-CE 3.66Å; F313-M439 HydrophobicContact CD2-SD 4.34Å; F313-M439 HydrophobicContact CE2-CE 4.1Å; F313-M439 HydrophobicContact CG-CE 3.91Å; F313-M439 HydrophobicContact CG-SD 4.02Å; F313-S460 VanDerWaalsContact CD2-OG 3.31Å; F313-S460 WeakPolarHBondContact CD2-OG 3.39Å; F313-L464 HydrophobicContact CB-CD2 4.16Å; F313-I468 HydrophobicContact CD2-CD1 4.04Å; F313-I468 HydrophobicContact CE2-CD1 4.25Å
314	Y	91	Very high	84.7	Confident	26 Å²	26	56.9 Å²	56.9	10%	0.102	30%	0.3	C	S	.	.	I	π-helix	trans	-61.2	-50.8	175.9	-179.7	-89.6	0	0	0	111.7	A310 D311 T312 I318 K319 V335 K339 Y436	A310-Y314 WeakPolarHBondContact O-CB 3.48Å; A310-Y314 PolarHBondContact O-N 3.13Å; D311-Y314 WeakPolarHBondContact O-CB 3.12Å; D311-Y314 PolarHBondContact O-N 3.23Å; T312-Y314 VanDerWaalsContact C-N 3.32Å; T312-Y314 PolarHBondContact O-N 3.4Å; Y314-I318 HydrophobicContact CD2-CB 4.08Å; Y314-I318 HydrophobicContact CD2-CD1 3.88Å; Y314-I318 HydrophobicContact CD2-CG2 4Å; Y314-I318 HydrophobicContact CE2-CG2 3.94Å; Y314-I318 WeakPolarHBondContact O-CB 3.34Å; Y314-I318 PolarHBondContact O-N 3.25Å; Y314-K319 HydrophobicContact CE1-CB 4.39Å; Y314-K319 WeakPolarHBondContact O-CB 2.74Å; Y314-K319 PolarHBondContact O-N 3.11Å; Y314-V335 HydrophobicContact CE2-CG1 4.1Å; Y314-K339 VanDerWaalsContact OH-CE 3.31Å; Y314-K339 WeakPolarHBondContact OH-CE 3.33Å; Y314-K339 PolarHBondContact OH-NZ 2.9Å; Y314-K339 VanDerWaalsContact OH-NZ 3.11Å; Y314-Y436 HydrophobicContact CD2-CE1 4.42Å; Y314-Y436 HydrophobicContact CD2-CE2 4.08Å; Y314-Y436 AromaticContact CD2-CZ 3.85Å; Y314-Y436 HydrophobicContact CG-CE2 4.31Å
315	E	88.5	Confident	83.6	Confident	88 Å²	88	57.5 Å²	57.5	41%	0.411	31%	0.306	S	S	.	.	I	π-helix	trans	-67.3	-39.9	-177.8	-69.8	-62.2	133.2	0	0	112.3	D311 T312 K319 G320	D311-E315 PolarHBondContact O-N 2.84Å; T312-E315 PolarHBondContact O-N 3.45Å; E315-K319 IonicContact OE1-NZ 3.93Å; E315-K319 VanDerWaalsContact OE2-CD 3.24Å; E315-K319 WeakPolarHBondContact OE2-CD 3.13Å; E315-K319 IonicContact OE2-NZ 2.67Å; E315-K319 PolarHBondContact OE2-NZ 2.79Å; E315-G320 CarbonylContact O-C 3.52Å; E315-G320 PolarHBondContact O-N 2.95Å
316	T	86.8	Confident	82.4	Confident	36 Å²	36	59.1 Å²	59.1	22%	0.221	31%	0.312	C	S	.	.	I	π-helix	trans	-84.6	-35.2	-174.9	57.1	0	0	0	0	114.1	T312 T321	T312-T316 HydrophobicContact CG2-CG2 4.13Å; T312-T316 WeakPolarHBondContact O-CB 3.32Å; T312-T316 WeakPolarHBondContact O-CG2 3.24Å; T312-T316 PolarHBondContact O-N 2.91Å; T312-T316 PolarHBondContact O-OG1 3.11Å; T316-T321 HydrophobicContact CG2-CG2 4.28Å
317	V	86.4	Confident	81.1	Confident	9 Å²	9	63 Å²	63	6%	0.055	33%	0.327	C	S	.	.	I	π-helix	trans	-111.8	-45.9	-170.5	-176.4	0	0	0	0	113.3	F313 T329 V432 Y456 S460	F313-V317 HydrophobicContact CD1-CB 4.38Å; F313-V317 HydrophobicContact CD2-CB 4.34Å; F313-V317 HydrophobicContact CD2-CG2 3.94Å; F313-V317 HydrophobicContact CE1-CB 4.19Å; F313-V317 HydrophobicContact CE1-CG1 4.21Å; F313-V317 HydrophobicContact CE2-CB 4.15Å; F313-V317 HydrophobicContact CE2-CG1 4.22Å; F313-V317 HydrophobicContact CE2-CG2 3.87Å; F313-V317 HydrophobicContact CG-CB 4.46Å; F313-V317 HydrophobicContact CG-CG2 4.42Å; F313-V317 HydrophobicContact CZ-CB 4.07Å; F313-V317 HydrophobicContact CZ-CG1 3.85Å; F313-V317 HydrophobicContact CZ-CG2 4.3Å; F313-V317 WeakPolarHBondContact O-CA 3.49Å; F313-V317 VanDerWaalsContact O-CB 3.3Å; F313-V317 WeakPolarHBondContact O-CB 3.5Å; F313-V317 PolarHBondContact O-N 3.33Å; V317-T329 PolarHBondContact O-OG1 3.35Å; V317-V432 HydrophobicContact CG1-CG1 4.09Å; V317-V432 HydrophobicContact CG1-CG2 4.27Å; V317-Y456 HydrophobicContact CG1-CD1 3.72Å; V317-Y456 HydrophobicContact CG1-CE1 4.4Å; V317-S460 WeakPolarHBondContact CG2-OG 3.48Å
318	I	85.1	Confident	79.9	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	33%	0.333	C	S	.	.	I	π-helix	trans	-76.5	-53.6	-178.5	-69.4	173.2	0	0	0	110.4	F313 Y314 T329 A330 V335 L338 V432 Y436	F313-I318 HydrophobicContact CD1-CD1 4.38Å; F313-I318 HydrophobicContact CD1-CG1 4.47Å; F313-I318 HydrophobicContact CE1-CD1 4.5Å; F313-I318 HydrophobicContact CE1-CG1 4.39Å; F313-I318 PolarHBondContact O-N 2.69Å; Y314-I318 HydrophobicContact CD2-CB 4.08Å; Y314-I318 HydrophobicContact CD2-CD1 3.88Å; Y314-I318 HydrophobicContact CD2-CG2 4Å; Y314-I318 HydrophobicContact CE2-CG2 3.94Å; Y314-I318 WeakPolarHBondContact O-CB 3.34Å; Y314-I318 PolarHBondContact O-N 3.25Å; I318-T329 PolarHBondContact O-OG1 3.3Å; I318-A330 HydrophobicContact CG2-CB 4.4Å; I318-V335 HydrophobicContact CG2-CG2 3.8Å; I318-L338 HydrophobicContact CD1-CD2 4.18Å; I318-V432 HydrophobicContact CD1-CG1 4.24Å; I318-V432 HydrophobicContact CG1-CG1 3.41Å; I318-V432 VanDerWaalsContact CG1-CG1 3.41Å; I318-Y436 HydrophobicContact CD1-CD1 3.86Å; I318-Y436 HydrophobicContact CD1-CD2 3.75Å; I318-Y436 HydrophobicContact CD1-CE1 4.4Å; I318-Y436 HydrophobicContact CD1-CE2 4.35Å; I318-Y436 HydrophobicContact CD1-CG 3.45Å; I318-Y436 VanDerWaalsContact CD1-CG 3.45Å
319	K	82.8	Confident	78.7	Confident	68 Å²	68	60.3 Å²	60.3	30%	0.296	31%	0.31	S	S	.	.	I	π-helix	trans	-75.6	-45	-179.5	-175	-177.9	173	-173.1	0	110.3	Y314 E315 L326 Y327	Y314-K319 HydrophobicContact CE1-CB 4.39Å; Y314-K319 WeakPolarHBondContact O-CB 2.74Å; Y314-K319 PolarHBondContact O-N 3.11Å; E315-K319 IonicContact OE1-NZ 3.93Å; E315-K319 VanDerWaalsContact OE2-CD 3.24Å; E315-K319 WeakPolarHBondContact OE2-CD 3.13Å; E315-K319 IonicContact OE2-NZ 2.67Å; E315-K319 PolarHBondContact OE2-NZ 2.79Å; K319-L326 HydrophobicContact CG-CD1 3.88Å; K319-L326 CarbonylContact O-C 3.54Å; K319-L326 WeakPolarHBondContact O-CA 3.14Å; K319-L326 WeakPolarHBondContact O-CD1 3.31Å; K319-Y327 PolarHBondContact O-N 3.47Å
320	G	74.7	Confident	77.7	Confident	11 Å²	11	60.3 Å²	60.3	11%	0.113	31%	0.311	C	S	.	.	I	π-helix	trans	91.7	148.5	-173.8	0	0	0	0	0	111.9	E315	E315-G320 CarbonylContact O-C 3.52Å; E315-G320 PolarHBondContact O-N 2.95Å
321	T	71.1	Confident	76.9	Confident	109 Å²	109	62.7 Å²	62.7	67%	0.669	33%	0.325	S	S	*	.	S	Bend	trans	-85.1	-20.9	-172.1	51.5	0	0	0	0	114.6	T316 S325	T316-T321 HydrophobicContact CG2-CG2 4.28Å; T321-S325 PolarHBondContact N-OG 2.91Å; T321-S325 VanDerWaalsContact N-OG 3.12Å
322	D	69.4	Low	76.3	Confident	82 Å²	82	62.5 Å²	62.5	44%	0.439	33%	0.33	S	S	.	.	S	Bend	trans	-134.5	162.9	-178.5	70.3	58.9	0	0	0	112.3	K324 S325 L326	D322-K324 PolarHBondContact O-N 3.5Å; D322-K324 VanDerWaalsContact O-N 3.17Å; D322-K324 WeakPolarHBondContact OD1-CA 3.49Å; D322-K324 VanDerWaalsContact OD1-CB 3.31Å; D322-K324 WeakPolarHBondContact OD1-CB 3.15Å; D322-K324 PolarHBondContact OD1-N 2.88Å; D322-S325 PolarHBondContact N-OG 3.41Å; D322-S325 CarbonylContact O-C 3.52Å; D322-S325 WeakPolarHBondContact O-CA 3.02Å; D322-S325 PolarHBondContact O-N 3.39Å; D322-S325 PolarHBondContact O-OG 3.07Å; D322-S325 PolarHBondContact OD1-N 2.94Å; D322-S325 PolarHBondContact OD1-OG 2.74Å; D322-L326 PolarHBondContact O-N 3.34Å
323	I	63.5	Low	75.9	Confident	163 Å²	163	62.3 Å²	62.3	84%	0.836	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-31.7	-177.1	-67.6	167	0	0	0	112.4
324	K	65.1	Low	75.5	Confident	185 Å²	185	62.7 Å²	62.7	80%	0.804	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-31.7	178.4	-62.6	-178.6	178.4	179.8	0	111.7	D322 L328	D322-K324 PolarHBondContact O-N 3.5Å; D322-K324 VanDerWaalsContact O-N 3.17Å; D322-K324 WeakPolarHBondContact OD1-CA 3.49Å; D322-K324 VanDerWaalsContact OD1-CB 3.31Å; D322-K324 WeakPolarHBondContact OD1-CB 3.15Å; D322-K324 PolarHBondContact OD1-N 2.88Å; K324-L328 WeakPolarHBondContact O-CD1 3.27Å; K324-L328 WeakPolarHBondContact O-CG 3.42Å
325	S	64.2	Low	75.3	Confident	26 Å²	26	61.9 Å²	61.9	18%	0.182	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-11.2	177.5	71.5	0	0	0	0	114.1	T321 D322 Y327 L328	T321-S325 PolarHBondContact N-OG 2.91Å; T321-S325 VanDerWaalsContact N-OG 3.12Å; D322-S325 PolarHBondContact N-OG 3.41Å; D322-S325 CarbonylContact O-C 3.52Å; D322-S325 WeakPolarHBondContact O-CA 3.02Å; D322-S325 PolarHBondContact O-N 3.39Å; D322-S325 PolarHBondContact O-OG 3.07Å; D322-S325 PolarHBondContact OD1-N 2.94Å; D322-S325 PolarHBondContact OD1-OG 2.74Å; S325-Y327 PolarHBondContact O-N 2.89Å; S325-Y327 VanDerWaalsContact O-N 3.11Å; S325-L328 PolarHBondContact O-N 3.04Å; S325-L328 VanDerWaalsContact O-N 3.13Å
326	L	64.3	Low	75.2	Confident	76 Å²	76	63 Å²	63	40%	0.398	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	116.9	-173.1	-165.2	79.2	0	0	0	110.1	K319 D322 L328	K319-L326 HydrophobicContact CG-CD1 3.88Å; K319-L326 CarbonylContact O-C 3.54Å; K319-L326 WeakPolarHBondContact O-CA 3.14Å; K319-L326 WeakPolarHBondContact O-CD1 3.31Å; D322-L326 PolarHBondContact O-N 3.34Å; L326-L328 PolarHBondContact O-N 2.79Å
327	Y	62.1	Low	75.4	Confident	93 Å²	93	64.6 Å²	64.6	37%	0.365	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.3	23	179.4	-55.9	-61.1	0	0	0	115.4	K319 S325 T329 A330 V335	K319-Y327 PolarHBondContact O-N 3.47Å; S325-Y327 PolarHBondContact O-N 2.89Å; S325-Y327 VanDerWaalsContact O-N 3.11Å; Y327-T329 VanDerWaalsContact C-N 3.25Å; Y327-T329 PolarHBondContact O-N 3.43Å; Y327-A330 CarbonylContact C-O 3.4Å; Y327-A330 WeakPolarHBondContact CA-O 3.42Å; Y327-A330 WeakPolarHBondContact CB-O 3.27Å; Y327-A330 VanDerWaalsContact O-O 3.08Å; Y327-V335 HydrophobicContact CD1-CG2 4.33Å; Y327-V335 HydrophobicContact CE1-CG2 4.32Å
328	L	63.7	Low	75.6	Confident	136 Å²	136	64.1 Å²	64.1	71%	0.712	34%	0.344	S	S	*	.	S	Bend	trans	-64.7	-29.8	175.1	-76.8	-175.4	0	0	0	113	K324 S325 L326	K324-L328 WeakPolarHBondContact O-CD1 3.27Å; K324-L328 WeakPolarHBondContact O-CG 3.42Å; S325-L328 PolarHBondContact O-N 3.04Å; S325-L328 VanDerWaalsContact O-N 3.13Å; L326-L328 PolarHBondContact O-N 2.79Å
329	T	68.4	Low	75.8	Confident	20 Å²	20	68.5 Å²	68.5	12%	0.123	36%	0.363	C	S	.	.	S	Bend	trans	-91.9	-27.7	-177.2	49.4	0	0	0	0	113.1	V317 I318 Y327 V432	V317-T329 PolarHBondContact O-OG1 3.35Å; I318-T329 PolarHBondContact O-OG1 3.3Å; Y327-T329 VanDerWaalsContact C-N 3.25Å; Y327-T329 PolarHBondContact O-N 3.43Å; T329-V432 HydrophobicContact CG2-CG2 4.34Å
330	A	72.6	Confident	76.3	Confident	1 Å²	1	73.7 Å²	73.7	1%	0.008	38%	0.381	C	S	.	.	S	Bend	trans	-147.8	135	-173.4	0	0	0	0	0	110.9	I318 Y327 V335 F433	I318-A330 HydrophobicContact CG2-CB 4.4Å; Y327-A330 CarbonylContact C-O 3.4Å; Y327-A330 WeakPolarHBondContact CA-O 3.42Å; Y327-A330 WeakPolarHBondContact CB-O 3.27Å; Y327-A330 VanDerWaalsContact O-O 3.08Å; A330-V335 HydrophobicContact CB-CG2 3.95Å; A330-F433 HydrophobicContact CB-CE1 4.06Å; A330-F433 HydrophobicContact CB-CE2 4.14Å; A330-F433 HydrophobicContact CB-CZ 3.41Å; A330-F433 VanDerWaalsContact CB-CZ 3.41Å
331	T	77.7	Confident	77.3	Confident	50 Å²	50	74.5 Å²	74.5	31%	0.307	38%	0.381	S	S	.	.			trans	-74.4	160.3	175.7	74	0	0	0	0	111.9	S333 E334 V335	T331-S333 VanDerWaalsContact C-N 3.25Å; T331-S333 PolarHBondContact O-N 2.98Å; T331-S333 PolarHBondContact OG1-OG 3.35Å; T331-E334 PolarHBondContact N-OE2 3.02Å; T331-E334 PolarHBondContact O-N 3.4Å; T331-E334 VanDerWaalsContact O-N 3.13Å; T331-E334 VanDerWaalsContact OG1-CG 3.29Å; T331-E334 WeakPolarHBondContact OG1-CG 3.44Å; T331-E334 PolarHBondContact OG1-N 3.28Å; T331-E334 PolarHBondContact OG1-OE2 2.87Å; T331-V335 WeakPolarHBondContact O-CG2 3.46Å; T331-V335 PolarHBondContact O-N 3.32Å
332	S	79.9	Confident	78.3	Confident	70 Å²	70	71.2 Å²	71.2	49%	0.49	36%	0.359	S	S	.	.	H	α-helix	trans	-58.2	-36	176.2	59.8	0	0	0	0	113.2	M336	S332-M336 WeakPolarHBondContact O-CE 3.3Å; S332-M336 WeakPolarHBondContact O-CG 3.26Å; S332-M336 PolarHBondContact O-N 3.44Å
333	S	84.1	Confident	79.3	Confident	60 Å²	60	73.6 Å²	73.6	42%	0.42	37%	0.371	S	S	.	.	H	α-helix	trans	-70	-36.9	176.3	58.5	0	0	0	0	112.7	T331 M336 T337	T331-S333 VanDerWaalsContact C-N 3.25Å; T331-S333 PolarHBondContact O-N 2.98Å; T331-S333 PolarHBondContact OG1-OG 3.35Å; S333-M336 PolarHBondContact O-N 3.49Å; S333-T337 WeakPolarHBondContact O-CB 3.1Å; S333-T337 PolarHBondContact O-N 3.23Å; S333-T337 PolarHBondContact O-OG1 3.07Å
334	E	85.2	Confident	80.8	Confident	8 Å²	8	69.7 Å²	69.7	4%	0.037	36%	0.359	C	S	.	.	H	α-helix	trans	-67.5	-41.5	174.1	-71.4	176.5	137.6	0	0	111.6	T331 M336 T337 L338 N425 S428 F433	T331-E334 PolarHBondContact N-OE2 3.02Å; T331-E334 PolarHBondContact O-N 3.4Å; T331-E334 VanDerWaalsContact O-N 3.13Å; T331-E334 VanDerWaalsContact OG1-CG 3.29Å; T331-E334 WeakPolarHBondContact OG1-CG 3.44Å; T331-E334 PolarHBondContact OG1-N 3.28Å; T331-E334 PolarHBondContact OG1-OE2 2.87Å; E334-M336 VanDerWaalsContact C-N 3.32Å; E334-M336 PolarHBondContact O-N 3.27Å; E334-T337 PolarHBondContact O-N 3.44Å; E334-L338 WeakPolarHBondContact O-CB 3.23Å; E334-L338 PolarHBondContact O-N 3.25Å; E334-N425 VanDerWaalsContact OE1-CB 3.31Å; E334-N425 WeakPolarHBondContact OE1-CB 3.48Å; E334-N425 PolarHBondContact OE1-N 2.77Å; E334-N425 PolarHBondContact OE1-ND2 2.91Å; E334-S428 WeakPolarHBondContact OE1-CB 3.43Å; E334-S428 PolarHBondContact OE1-OG 3.49Å; E334-S428 WeakPolarHBondContact OE2-CB 3.47Å; E334-S428 PolarHBondContact OE2-OG 2.89Å; E334-F433 HydrophobicContact CB-CE1 3.94Å; E334-F433 HydrophobicContact CB-CZ 3.7Å; E334-F433 HydrophobicContact CG-CZ 4.43Å
335	V	85.5	Confident	82	Confident	8 Å²	8	62.6 Å²	62.6	5%	0.048	33%	0.328	C	S	.	.	H	α-helix	trans	-61.4	-41.3	174.7	174.2	0	0	0	0	111.2	Y314 I318 Y327 A330 T331 L338 K339	Y314-V335 HydrophobicContact CE2-CG1 4.1Å; I318-V335 HydrophobicContact CG2-CG2 3.8Å; Y327-V335 HydrophobicContact CD1-CG2 4.33Å; Y327-V335 HydrophobicContact CE1-CG2 4.32Å; A330-V335 HydrophobicContact CB-CG2 3.95Å; T331-V335 WeakPolarHBondContact O-CG2 3.46Å; T331-V335 PolarHBondContact O-N 3.32Å; V335-L338 PolarHBondContact O-N 3.28Å; V335-K339 WeakPolarHBondContact O-CG 3.47Å; V335-K339 PolarHBondContact O-N 2.95Å
336	M	87.6	Confident	83.2	Confident	113 Å²	113	66.2 Å²	66.2	56%	0.557	35%	0.354	S	S	*	.	H	α-helix	trans	-64.5	-39.7	174.4	-76	-173.4	-84.3	0	0	112.5	S332 S333 E334 K339 R340	S332-M336 WeakPolarHBondContact O-CE 3.3Å; S332-M336 WeakPolarHBondContact O-CG 3.26Å; S332-M336 PolarHBondContact O-N 3.44Å; S333-M336 PolarHBondContact O-N 3.49Å; E334-M336 VanDerWaalsContact C-N 3.32Å; E334-M336 PolarHBondContact O-N 3.27Å; M336-K339 PolarHBondContact O-N 3.14Å; M336-R340 WeakPolarHBondContact O-CB 3.5Å; M336-R340 PolarHBondContact O-N 3.02Å
337	T	90.2	Very high	84.6	Confident	68 Å²	68	68 Å²	68	42%	0.417	36%	0.36	S	S	.	.	H	α-helix	trans	-66.6	-41.9	177.7	-57.1	0	0	0	0	111.2	S333 E334 R340 F341 F422	S333-T337 WeakPolarHBondContact O-CB 3.1Å; S333-T337 PolarHBondContact O-N 3.23Å; S333-T337 PolarHBondContact O-OG1 3.07Å; E334-T337 PolarHBondContact O-N 3.44Å; T337-R340 PolarHBondContact O-N 3.25Å; T337-F341 WeakPolarHBondContact O-CB 3.46Å; T337-F341 PolarHBondContact O-N 3.06Å; T337-F422 HydrophobicContact CG2-CE2 4.08Å
338	L	90.3	Very high	86.1	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-59	-50.6	174.2	176.6	64.4	0	0	0	111.6	I318 E334 V335 R340 F341 I342 F422 F433 Y436 M437	I318-L338 HydrophobicContact CD1-CD2 4.18Å; E334-L338 WeakPolarHBondContact O-CB 3.23Å; E334-L338 PolarHBondContact O-N 3.25Å; V335-L338 PolarHBondContact O-N 3.28Å; L338-R340 PolarHBondContact O-N 2.88Å; L338-F341 WeakPolarHBondContact O-CB 3.47Å; L338-F341 PolarHBondContact O-N 3.32Å; L338-I342 HydrophobicContact CD1-CD1 3.81Å; L338-I342 HydrophobicContact CD1-CG1 4.32Å; L338-I342 HydrophobicContact CG-CD1 3.9Å; L338-I342 WeakPolarHBondContact O-CG1 3.41Å; L338-I342 PolarHBondContact O-N 2.75Å; L338-F422 HydrophobicContact CB-CE2 4.29Å; L338-F422 HydrophobicContact CB-CZ 3.98Å; L338-F422 HydrophobicContact CD1-CE1 4.48Å; L338-F422 HydrophobicContact CD1-CE2 4.32Å; L338-F422 HydrophobicContact CD1-CZ 4.06Å; L338-F433 HydrophobicContact CB-CD1 4.15Å; L338-F433 HydrophobicContact CB-CE1 4.33Å; L338-F433 HydrophobicContact CD1-CD1 4.05Å; L338-F433 HydrophobicContact CD2-CD1 3.7Å; L338-F433 HydrophobicContact CD2-CE1 4.12Å; L338-F433 HydrophobicContact CG-CD1 4.17Å; L338-Y436 HydrophobicContact CD1-CD1 4.28Å; L338-Y436 HydrophobicContact CD2-CD1 3.61Å; L338-Y436 HydrophobicContact CD2-CE1 3.89Å; L338-Y436 HydrophobicContact CG-CD1 4.17Å; L338-Y436 HydrophobicContact CG-CE1 4.31Å; L338-M437 HydrophobicContact CD1-CG 3.52Å; L338-M437 HydrophobicContact CD1-SD 3.88Å
339	K	90	Very high	87.7	Confident	91 Å²	91	61 Å²	61	40%	0.396	33%	0.334	S	S	.	.	H	α-helix	trans	-58	-50.2	177.7	-74.8	-178.6	178.8	-176.4	0	111.2	Y314 V335 M336 F341 I342 D343	Y314-K339 VanDerWaalsContact OH-CE 3.31Å; Y314-K339 WeakPolarHBondContact OH-CE 3.33Å; Y314-K339 PolarHBondContact OH-NZ 2.9Å; Y314-K339 VanDerWaalsContact OH-NZ 3.11Å; V335-K339 WeakPolarHBondContact O-CG 3.47Å; V335-K339 PolarHBondContact O-N 2.95Å; M336-K339 PolarHBondContact O-N 3.14Å; K339-F341 VanDerWaalsContact C-N 3.28Å; K339-F341 PolarHBondContact O-N 3.04Å; K339-I342 PolarHBondContact O-N 3.04Å; K339-I342 VanDerWaalsContact O-N 3.14Å; K339-D343 WeakPolarHBondContact O-CB 3.37Å; K339-D343 PolarHBondContact O-N 3.47Å
340	R	93.5	Very high	89.1	Confident	178 Å²	178	62.4 Å²	62.4	67%	0.672	34%	0.341	S	S	*	.	H	α-helix	trans	-57.6	-41.6	176.7	-170.6	-171.8	-55.7	165.5	4.2	112.4	M336 T337 L338 S344	M336-R340 WeakPolarHBondContact O-CB 3.5Å; M336-R340 PolarHBondContact O-N 3.02Å; T337-R340 PolarHBondContact O-N 3.25Å; L338-R340 PolarHBondContact O-N 2.88Å; R340-S344 WeakPolarHBondContact O-CB 3.24Å; R340-S344 PolarHBondContact O-N 3.4Å; R340-S344 PolarHBondContact O-OG 3.43Å
341	F	94.2	Very high	90.3	Very high	28 Å²	28	62.4 Å²	62.4	12%	0.123	34%	0.34	C	S	.	.	H	α-helix	trans	-62.2	-48.4	177.2	177.9	-87.8	0	0	0	111.1	T337 L338 K339 S344 Q345 L349 Q420 F422 M437	T337-F341 WeakPolarHBondContact O-CB 3.46Å; T337-F341 PolarHBondContact O-N 3.06Å; L338-F341 WeakPolarHBondContact O-CB 3.47Å; L338-F341 PolarHBondContact O-N 3.32Å; K339-F341 VanDerWaalsContact C-N 3.28Å; K339-F341 PolarHBondContact O-N 3.04Å; F341-S344 PolarHBondContact O-N 3.29Å; F341-S344 PolarHBondContact O-OG 3.2Å; F341-Q345 HydrophobicContact CE1-CG 4.2Å; F341-Q345 VanDerWaalsContact CZ-NE2 3.35Å; F341-Q345 WeakPolarHBondContact O-CG 3.46Å; F341-Q345 PolarHBondContact O-NE2 2.97Å; F341-Q345 VanDerWaalsContact O-NE2 3.15Å; F341-L349 HydrophobicContact CE1-CD1 4.16Å; F341-L349 HydrophobicContact CZ-CD1 4.47Å; F341-Q420 HydrophobicContact CZ-CB 4.47Å; F341-F422 HydrophobicContact CB-CD2 3.99Å; F341-F422 HydrophobicContact CB-CE2 4.15Å; F341-F422 HydrophobicContact CD1-CD2 4.37Å; F341-F422 HydrophobicContact CD2-CD2 4.15Å; F341-F422 AromaticContact CG-CD2 3.88Å; F341-F422 HydrophobicContact CG-CD2 3.88Å; F341-M437 HydrophobicContact CD1-CE 3.72Å; F341-M437 HydrophobicContact CD1-SD 4.41Å; F341-M437 HydrophobicContact CE1-CE 3.25Å; F341-M437 HydrophobicContact CE1-SD 4.48Å; F341-M437 HydrophobicContact CZ-CE 3.97Å
342	I	92	Very high	91.3	Very high	39 Å²	39	60 Å²	60	20%	0.2	33%	0.326	C	S	.	.	H	α-helix	trans	-62.3	-47.7	179	-68.4	167.6	0	0	0	110.6	L338 K339 S344 Q345 Y436 K440	L338-I342 HydrophobicContact CD1-CD1 3.81Å; L338-I342 HydrophobicContact CD1-CG1 4.32Å; L338-I342 HydrophobicContact CG-CD1 3.9Å; L338-I342 WeakPolarHBondContact O-CG1 3.41Å; L338-I342 PolarHBondContact O-N 2.75Å; K339-I342 PolarHBondContact O-N 3.04Å; K339-I342 VanDerWaalsContact O-N 3.14Å; I342-S344 PolarHBondContact O-N 3.39Å; I342-Q345 WeakPolarHBondContact O-CB 3.47Å; I342-Q345 PolarHBondContact O-N 3.17Å; I342-Y436 HydrophobicContact CD1-CD1 3.78Å; I342-Y436 HydrophobicContact CD1-CE1 3.37Å; I342-K440 HydrophobicContact CD1-CG 4.34Å
343	D	92	Very high	92.2	Very high	132 Å²	132	56.7 Å²	56.7	71%	0.706	30%	0.303	S	S	*	.	H	α-helix	trans	-64.8	-25.6	-179.6	-62.2	-22.7	0	0	0	112.4	K339 Q345	K339-D343 WeakPolarHBondContact O-CB 3.37Å; K339-D343 PolarHBondContact O-N 3.47Å; D343-Q345 VanDerWaalsContact C-N 3.28Å
344	S	93.4	Very high	92.8	Very high	81 Å²	81	54 Å²	54	57%	0.566	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-11.4	174.8	74.3	0	0	0	0	114	R340 F341 I342 S346	R340-S344 WeakPolarHBondContact O-CB 3.24Å; R340-S344 PolarHBondContact O-N 3.4Å; R340-S344 PolarHBondContact O-OG 3.43Å; F341-S344 PolarHBondContact O-N 3.29Å; F341-S344 PolarHBondContact O-OG 3.2Å; I342-S344 PolarHBondContact O-N 3.39Å; S344-S346 PolarHBondContact O-N 3.49Å
345	Q	91.9	Very high	93.3	Very high	37 Å²	37	53.7 Å²	53.7	17%	0.173	28%	0.282	C	S	.	.			trans	-78.8	116.5	179	-57.1	-52.4	-55.4	0	0	110.3	F341 I342 D343 E347	F341-Q345 HydrophobicContact CE1-CG 4.2Å; F341-Q345 VanDerWaalsContact CZ-NE2 3.35Å; F341-Q345 WeakPolarHBondContact O-CG 3.46Å; F341-Q345 PolarHBondContact O-NE2 2.97Å; F341-Q345 VanDerWaalsContact O-NE2 3.15Å; I342-Q345 WeakPolarHBondContact O-CB 3.47Å; I342-Q345 PolarHBondContact O-N 3.17Å; D343-Q345 VanDerWaalsContact C-N 3.28Å; Q345-E347 VanDerWaalsContact C-N 3.29Å; Q345-E347 PolarHBondContact O-N 2.79Å
346	S	89.4	Confident	93.7	Very high	102 Å²	102	56.1 Å²	56.1	71%	0.713	29%	0.294	S	S	*	.	S	Bend	trans	-71.5	-24.7	174	64.1	0	0	0	0	113.4	S344	S344-S346 PolarHBondContact O-N 3.49Å
347	E	92.5	Very high	94	Very high	112 Å²	112	51.9 Å²	51.9	52%	0.523	27%	0.273	S	S	.	.	S	Bend	trans	-146.5	154	-179.2	-59.1	176.5	118.8	0	0	109	Q345 R388	Q345-E347 VanDerWaalsContact C-N 3.29Å; Q345-E347 PolarHBondContact O-N 2.79Å; E347-R388 PolarHBondContact O-NH2 2.75Å; E347-R388 IonicContact OE2-CZ 2.78Å; E347-R388 IonicContact OE2-NE 3.82Å; E347-R388 IonicContact OE2-NH1 4Å; E347-R388 PolarHBondContact OE2-NH1 3.03Å
348	P	94	Very high	94.2	Very high	80 Å²	80	48.7 Å²	48.7	52%	0.519	25%	0.254	S	S	.	.			trans	-54.7	152.9	176.3	-25.6	35.1	0	0	0	113.7	R388 S441	P348-R388 WeakPolarHBondContact O-CD 3.42Å; P348-R388 PolarHBondContact O-NE 2.96Å; P348-S441 WeakPolarHBondContact CB-O 3.2Å
349	L	97.4	Very high	94.4	Very high	4 Å²	4	49.9 Å²	49.9	2%	0.021	26%	0.26	C	S	.	.			trans	-79.8	141.6	169.7	-62.5	168.2	0	0	0	109.7	F341 I352 R388 C390 M437 S441	F341-L349 HydrophobicContact CE1-CD1 4.16Å; F341-L349 HydrophobicContact CZ-CD1 4.47Å; L349-I352 HydrophobicContact CB-CG1 4.43Å; L349-I352 HydrophobicContact CD1-CD1 4Å; L349-I352 HydrophobicContact CD1-CG1 4.16Å; L349-R388 HydrophobicContact CD2-CB 4.41Å; L349-C390 HydrophobicContact CD1-CB 3.58Å; L349-C390 HydrophobicContact CD2-CB 4.18Å; L349-C390 HydrophobicContact CG-CB 4.48Å; L349-M437 HydrophobicContact CD1-CE 4.08Å; L349-S441 PolarHBondContact N-OG 3.08Å; L349-S441 WeakPolarHBondContact O-CB 3.45Å
350	D	98	Very high	94.5	Very high	49 Å²	49	50.1 Å²	50.1	26%	0.262	27%	0.265	S	S	.	.	S	Bend	trans	-83.4	-31.9	177.1	-64.2	-38.3	0	0	0	111.6	L386 R387 R388 C445 Y446	D350-L386 HydrophobicContact CB-CB 3.8Å; D350-L386 HydrophobicContact CB-CD2 4.06Å; D350-L386 HydrophobicContact CB-CG 4.35Å; D350-R387 WeakPolarHBondContact OD2-CA 3.47Å; D350-R387 PolarHBondContact OD2-N 2.99Å; D350-R388 HydrophobicContact CB-CB 4.47Å; D350-R388 PolarHBondContact N-O 2.91Å; D350-R388 PolarHBondContact OD2-N 3.48Å; D350-C445 WeakPolarHBondContact O-CA 3.3Å; D350-Y446 PolarHBondContact O-N 3.21Å
351	C	98.4	Very high	94.5	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	129.9	-175.7	-173.5	0	0	0	0	112.5	L386 R388 F389 C390 Y446	C351-L386 HydrophobicContact CB-CD1 3.8Å; C351-R388 PolarHBondContact N-O 3.34Å; C351-F389 HydrophobicContact CB-CD1 3.57Å; C351-F389 HydrophobicContact CB-CE1 3.75Å; C351-F389 CarbonylContact O-C 3.49Å; C351-F389 VanDerWaalsContact O-CA 3.32Å; C351-F389 WeakPolarHBondContact O-CA 3.27Å; C351-C390 PolarHBondContact O-N 2.74Å; C351-Y446 CarbonylContact C-O 3.59Å; C351-Y446 VanDerWaalsContact CA-O 3.28Å; C351-Y446 WeakPolarHBondContact CA-O 3.32Å
352	I	98.1	Very high	94.4	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	129.2	173	-51.2	-166.7	0	0	0	109	L349 C390 V392 L434 M437 A438 Y446 I447 V448	L349-I352 HydrophobicContact CB-CG1 4.43Å; L349-I352 HydrophobicContact CD1-CD1 4Å; L349-I352 HydrophobicContact CD1-CG1 4.16Å; I352-C390 WeakPolarHBondContact CA-O 3.4Å; I352-V392 HydrophobicContact CG2-CB 4.31Å; I352-V392 HydrophobicContact CG2-CG2 3.44Å; I352-V392 VanDerWaalsContact CG2-CG2 3.44Å; I352-L434 HydrophobicContact CG2-CD1 4.42Å; I352-L434 HydrophobicContact CG2-CG 3.89Å; I352-M437 HydrophobicContact CD1-CB 3.34Å; I352-M437 HydrophobicContact CD1-CE 4.22Å; I352-A438 HydrophobicContact CD1-CB 3.78Å; I352-A438 HydrophobicContact CG1-CB 4.26Å; I352-Y446 PolarHBondContact N-O 2.98Å; I352-I447 CarbonylContact O-C 3.53Å; I352-I447 VanDerWaalsContact O-CA 3.32Å; I352-I447 WeakPolarHBondContact O-CA 3.49Å; I352-V448 PolarHBondContact O-N 3.38Å
353	I	98.2	Very high	94.4	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.005	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	121.4	-171	-58.7	178.8	0	0	0	108.2	F355 L358 L377 I380 F389 C390 F391 V392 V448	I353-F355 PolarHBondContact O-N 3.39Å; I353-F355 VanDerWaalsContact O-N 3.1Å; I353-L358 HydrophobicContact CG2-CB 4.33Å; I353-L358 HydrophobicContact CG2-CD2 3.96Å; I353-L377 HydrophobicContact CD1-CD2 3.61Å; I353-I380 HydrophobicContact CD1-CD1 4.46Å; I353-F389 HydrophobicContact CD1-CD1 3.89Å; I353-C390 PolarHBondContact N-O 3.36Å; I353-F391 HydrophobicContact CB-CD1 3.8Å; I353-F391 HydrophobicContact CB-CE1 4.12Å; I353-F391 HydrophobicContact CD1-CD1 4.29Å; I353-F391 HydrophobicContact CD1-CE1 3.79Å; I353-F391 HydrophobicContact CG2-CD1 3.88Å; I353-F391 HydrophobicContact CG2-CE1 4.01Å; I353-F391 WeakPolarHBondContact O-CA 3.47Å; I353-V392 PolarHBondContact O-N 2.75Å; I353-V448 HydrophobicContact CB-CB 4.21Å; I353-V448 HydrophobicContact CD1-CG2 4.43Å; I353-V448 HydrophobicContact CG1-CB 3.94Å; I353-V448 HydrophobicContact CG1-CG2 3.84Å; I353-V448 HydrophobicContact CG2-CB 4.05Å; I353-V448 HydrophobicContact CG2-CG1 4.24Å
354	D	96.4	Very high	94.4	Very high	4 Å²	4	44.5 Å²	44.5	2%	0.021	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	107.6	163.6	-179.8	-22.9	0	0	0	108.6	M356 N357 L358 L434 V448	D354-M356 PolarHBondContact OD1-N 3.15Å; D354-N357 HydrophobicContact CB-CB 3.88Å; D354-N357 PolarHBondContact OD1-N 2.96Å; D354-N357 VanDerWaalsContact OD2-CG 3.31Å; D354-N357 PolarHBondContact OD2-ND2 3.41Å; D354-L358 WeakPolarHBondContact O-CB 3.34Å; D354-L358 PolarHBondContact O-N 3.4Å; D354-L434 HydrophobicContact CB-CD1 3.67Å; D354-V448 PolarHBondContact N-O 3Å
355	F	96.6	Very high	94.2	Very high	1 Å²	1	43.6 Å²	43.6	0%	0.004	23%	0.23	C	C	.	.	H	α-helix	trans	-68.2	-37.2	-176.4	-175.4	-107.6	0	0	0	112.2	I353 L358 I359 V373 F391 V392 S396 T398 L399 F404	I353-F355 PolarHBondContact O-N 3.39Å; I353-F355 VanDerWaalsContact O-N 3.1Å; F355-L358 WeakPolarHBondContact O-CB 3.27Å; F355-L358 PolarHBondContact O-N 3.48Å; F355-I359 HydrophobicContact CD1-CG1 4.16Å; F355-I359 HydrophobicContact CD2-CG1 4.33Å; F355-I359 HydrophobicContact CE1-CD1 4.39Å; F355-I359 HydrophobicContact CE1-CG1 3.69Å; F355-I359 HydrophobicContact CE2-CD1 3.84Å; F355-I359 HydrophobicContact CE2-CG1 3.86Å; F355-I359 HydrophobicContact CG-CG1 4.46Å; F355-I359 HydrophobicContact CZ-CD1 3.72Å; F355-I359 HydrophobicContact CZ-CG1 3.53Å; F355-I359 WeakPolarHBondContact O-CG1 3.01Å; F355-I359 PolarHBondContact O-N 3.05Å; F355-V373 HydrophobicContact CE2-CG2 4.38Å; F355-F391 HydrophobicContact CB-CB 4.24Å; F355-F391 HydrophobicContact CD2-CB 4.42Å; F355-F391 HydrophobicContact CD2-CD1 4.04Å; F355-F391 HydrophobicContact CD2-CD2 4.41Å; F355-F391 HydrophobicContact CD2-CE1 4.49Å; F355-F391 HydrophobicContact CD2-CG 4.05Å; F355-V392 WeakPolarHBondContact CB-O 3.45Å; F355-V392 PolarHBondContact N-O 3.08Å; F355-S396 WeakPolarHBondContact CE1-OG 3.48Å; F355-T398 HydrophobicContact CZ-CG2 4.1Å; F355-L399 HydrophobicContact CD1-CD1 3.88Å; F355-L399 HydrophobicContact CD1-CD2 4.23Å; F355-L399 HydrophobicContact CD1-CG 3.93Å; F355-L399 HydrophobicContact CD2-CD2 4.02Å; F355-L399 HydrophobicContact CE1-CD1 4.19Å; F355-L399 HydrophobicContact CE1-CD2 3.96Å; F355-L399 HydrophobicContact CE1-CG 3.71Å; F355-L399 HydrophobicContact CE2-CD2 3.74Å; F355-L399 HydrophobicContact CE2-CG 4.41Å; F355-L399 HydrophobicContact CG-CD1 4.15Å; F355-L399 HydrophobicContact CG-CD2 4.26Å; F355-L399 HydrophobicContact CG-CG 4.37Å; F355-L399 HydrophobicContact CZ-CD2 3.7Å; F355-L399 HydrophobicContact CZ-CG 3.97Å; F355-F404 HydrophobicContact CE2-CE1 4.43Å; F355-F404 AromaticContact CE2-CE2 3.85Å; F355-F404 HydrophobicContact CE2-CE2 3.85Å; F355-F404 AromaticContact CE2-CZ 3.51Å; F355-F404 HydrophobicContact CE2-CZ 3.51Å; F355-F404 AromaticContact CZ-CE2 3.94Å; F355-F404 HydrophobicContact CZ-CE2 3.94Å; F355-F404 AromaticContact CZ-CZ 3.9Å; F355-F404 HydrophobicContact CZ-CZ 3.9Å
356	M	93.1	Very high	94.1	Very high	58 Å²	58	46.7 Å²	46.7	29%	0.286	24%	0.243	S	C	.	.	H	α-helix	trans	-71.4	-41.4	-178.5	-70.9	-54.7	-52	0	0	110.8	D354 L358 I359 N360	D354-M356 PolarHBondContact OD1-N 3.15Å; M356-L358 VanDerWaalsContact C-N 3.31Å; M356-L358 PolarHBondContact O-N 3.1Å; M356-I359 PolarHBondContact O-N 3.35Å; M356-N360 WeakPolarHBondContact CE-ND2 3.2Å; M356-N360 WeakPolarHBondContact O-CB 3.06Å; M356-N360 PolarHBondContact O-N 3.34Å; M356-N360 PolarHBondContact O-ND2 3.26Å
357	N	93.5	Very high	94.2	Very high	25 Å²	25	48 Å²	48	13%	0.134	24%	0.242	C	C	.	.	H	α-helix	trans	-55.8	-48	168.9	-95.6	-110.2	0	0	0	110.5	D354 I359 N360 I361 N450 D451 L479	D354-N357 HydrophobicContact CB-CB 3.88Å; D354-N357 PolarHBondContact OD1-N 2.96Å; D354-N357 VanDerWaalsContact OD2-CG 3.31Å; D354-N357 PolarHBondContact OD2-ND2 3.41Å; N357-I359 PolarHBondContact O-N 2.84Å; N357-N360 PolarHBondContact O-N 3.38Å; N357-I361 HydrophobicContact CB-CD1 3.88Å; N357-I361 WeakPolarHBondContact O-CB 3.35Å; N357-I361 WeakPolarHBondContact O-CD1 3.29Å; N357-I361 VanDerWaalsContact O-CG1 3.29Å; N357-I361 WeakPolarHBondContact O-CG1 3.5Å; N357-I361 PolarHBondContact O-N 2.94Å; N357-I361 VanDerWaalsContact OD1-CD1 3.27Å; N357-I361 WeakPolarHBondContact OD1-CD1 3.3Å; N357-N450 WeakPolarHBondContact OD1-CB 3.32Å; N357-N450 PolarHBondContact OD1-N 2.96Å; N357-D451 PolarHBondContact ND2-OD2 3.43Å; N357-L479 HydrophobicContact CB-CD1 4.26Å
358	L	95.5	Very high	94.2	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-56.1	-53.4	179	-179.3	59.2	0	0	0	112.9	I353 D354 F355 M356 R362 F364 V373 V376 F391 L479	I353-L358 HydrophobicContact CG2-CB 4.33Å; I353-L358 HydrophobicContact CG2-CD2 3.96Å; D354-L358 WeakPolarHBondContact O-CB 3.34Å; D354-L358 PolarHBondContact O-N 3.4Å; F355-L358 WeakPolarHBondContact O-CB 3.27Å; F355-L358 PolarHBondContact O-N 3.48Å; M356-L358 VanDerWaalsContact C-N 3.31Å; M356-L358 PolarHBondContact O-N 3.1Å; L358-R362 HydrophobicContact CD1-CG 4.2Å; L358-R362 VanDerWaalsContact O-CB 3.27Å; L358-R362 WeakPolarHBondContact O-CB 3.49Å; L358-R362 WeakPolarHBondContact O-CG 3.22Å; L358-R362 PolarHBondContact O-N 3.19Å; L358-F364 HydrophobicContact CD1-CE2 3.98Å; L358-F364 HydrophobicContact CG-CE2 4.14Å; L358-V373 HydrophobicContact CD2-CG1 4.17Å; L358-V373 HydrophobicContact CD2-CG2 3.85Å; L358-V373 HydrophobicContact CG-CG2 4.44Å; L358-V376 HydrophobicContact CD1-CB 4.49Å; L358-V376 HydrophobicContact CD1-CG1 4.05Å; L358-V376 HydrophobicContact CD1-CG2 4.12Å; L358-F391 HydrophobicContact CD2-CE1 4.39Å; L358-L479 VanDerWaalsContact CA-CD1 3.49Å; L358-L479 HydrophobicContact CB-CD1 4.17Å; L358-L479 HydrophobicContact CD1-CD1 4.18Å; L358-L479 HydrophobicContact CD1-CD2 3.64Å
359	I	94.2	Very high	94.3	Very high	24 Å²	24	40.4 Å²	40.4	12%	0.123	21%	0.205	C	C	.	.	H	α-helix	trans	-66.8	-46.4	-178.2	-62.6	-52.7	0	0	0	111.1	F355 M356 N357 K363 F364 A369 V373	F355-I359 HydrophobicContact CD1-CG1 4.16Å; F355-I359 HydrophobicContact CD2-CG1 4.33Å; F355-I359 HydrophobicContact CE1-CD1 4.39Å; F355-I359 HydrophobicContact CE1-CG1 3.69Å; F355-I359 HydrophobicContact CE2-CD1 3.84Å; F355-I359 HydrophobicContact CE2-CG1 3.86Å; F355-I359 HydrophobicContact CG-CG1 4.46Å; F355-I359 HydrophobicContact CZ-CD1 3.72Å; F355-I359 HydrophobicContact CZ-CG1 3.53Å; F355-I359 WeakPolarHBondContact O-CG1 3.01Å; F355-I359 PolarHBondContact O-N 3.05Å; M356-I359 PolarHBondContact O-N 3.35Å; N357-I359 PolarHBondContact O-N 2.84Å; I359-K363 WeakPolarHBondContact O-CA 3.22Å; I359-K363 PolarHBondContact O-N 3.2Å; I359-F364 HydrophobicContact CD1-CB 4.23Å; I359-F364 HydrophobicContact CD1-CD2 3.92Å; I359-F364 PolarHBondContact O-N 3.19Å; I359-F364 VanDerWaalsContact O-N 3.12Å; I359-A369 HydrophobicContact CD1-CB 4.21Å; I359-V373 HydrophobicContact CD1-CG2 3.95Å
360	N	92.9	Very high	94.2	Very high	96 Å²	96	40.2 Å²	40.2	51%	0.513	20%	0.204	S	C	.	.	H	α-helix	trans	-74.2	-44.3	-171.4	-68.5	-23.7	0	0	0	112.8	M356 N357 K363	M356-N360 WeakPolarHBondContact CE-ND2 3.2Å; M356-N360 WeakPolarHBondContact O-CB 3.06Å; M356-N360 PolarHBondContact O-N 3.34Å; M356-N360 PolarHBondContact O-ND2 3.26Å; N357-N360 PolarHBondContact O-N 3.38Å; N360-K363 WeakPolarHBondContact O-CG 3.49Å; N360-K363 PolarHBondContact O-N 3.01Å
361	I	92.6	Very high	94.2	Very high	33 Å²	33	42.8 Å²	42.8	17%	0.169	22%	0.218	C	C	.	.	H	α-helix	trans	-68.1	-42.4	-178.2	-68.3	160.4	0	0	0	110.3	N357 K363 N450 L479 H481	N357-I361 HydrophobicContact CB-CD1 3.88Å; N357-I361 WeakPolarHBondContact O-CB 3.35Å; N357-I361 WeakPolarHBondContact O-CD1 3.29Å; N357-I361 VanDerWaalsContact O-CG1 3.29Å; N357-I361 WeakPolarHBondContact O-CG1 3.5Å; N357-I361 PolarHBondContact O-N 2.94Å; N357-I361 VanDerWaalsContact OD1-CD1 3.27Å; N357-I361 WeakPolarHBondContact OD1-CD1 3.3Å; I361-K363 VanDerWaalsContact C-N 3.25Å; I361-K363 PolarHBondContact O-N 3.46Å; I361-N450 HydrophobicContact CD1-CB 3.61Å; I361-N450 WeakPolarHBondContact CD1-ND2 3.28Å; I361-L479 HydrophobicContact CB-CB 4.42Å; I361-L479 HydrophobicContact CD1-CB 4.29Å; I361-L479 HydrophobicContact CD1-CD1 4.15Å; I361-L479 HydrophobicContact CG2-CB 3.94Å; I361-H481 PolarHBondContact O-CD2 3.34Å
362	R	91.8	Very high	94.1	Very high	56 Å²	56	45 Å²	45	21%	0.211	23%	0.228	C	C	.	.	H	α-helix	trans	-80	-9.2	178.9	-60.3	-63	-60.2	-169.3	-4.7	113.3	L358 F364 L479 Q480 P484 I485	L358-R362 HydrophobicContact CD1-CG 4.2Å; L358-R362 VanDerWaalsContact O-CB 3.27Å; L358-R362 WeakPolarHBondContact O-CB 3.49Å; L358-R362 WeakPolarHBondContact O-CG 3.22Å; L358-R362 PolarHBondContact O-N 3.19Å; R362-F364 VanDerWaalsContact C-N 3.25Å; R362-F364 HydrophobicContact CB-CD1 3.41Å; R362-F364 VanDerWaalsContact CB-CD1 3.41Å; R362-F364 HydrophobicContact CB-CD2 4.17Å; R362-F364 HydrophobicContact CB-CE1 3.23Å; R362-F364 HydrophobicContact CB-CE2 3.95Å; R362-F364 HydrophobicContact CB-CG 3.93Å; R362-F364 HydrophobicContact CB-CZ 3.49Å; R362-F364 VanDerWaalsContact CB-CZ 3.49Å; R362-F364 HydrophobicContact CG-CE1 3.92Å; R362-F364 HydrophobicContact CG-CE2 4.21Å; R362-F364 HydrophobicContact CG-CZ 3.72Å; R362-F364 PolarHBondContact O-N 3.47Å; R362-L479 HydrophobicContact CG-CD2 4.48Å; R362-Q480 WeakPolarHBondContact CD-O 3.36Å; R362-Q480 PolarHBondContact NH1-O 3.4Å; R362-P484 PolarHBondContact NH1-O 3.06Å; R362-P484 VanDerWaalsContact NH1-O 3.09Å; R362-I485 PolarHBondContact NH1-O 2.96Å; R362-I485 VanDerWaalsContact NH1-O 3.16Å
363	K	91.6	Very high	94.1	Very high	147 Å²	147	45 Å²	45	64%	0.639	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.8	45.7	-177.7	-60.1	-174.1	172.8	-178.2	0	111.7	I359 N360 I361 P365 H481	I359-K363 WeakPolarHBondContact O-CA 3.22Å; I359-K363 PolarHBondContact O-N 3.2Å; N360-K363 WeakPolarHBondContact O-CG 3.49Å; N360-K363 PolarHBondContact O-N 3.01Å; I361-K363 VanDerWaalsContact C-N 3.25Å; I361-K363 PolarHBondContact O-N 3.46Å; K363-P365 WeakPolarHBondContact O-CD 3.35Å; K363-H481 WeakPolarHBondContact CD-NE2 3.28Å; K363-H481 WeakPolarHBondContact CE-NE2 3.3Å
364	F	91.9	Very high	94.1	Very high	24 Å²	24	45.3 Å²	45.3	11%	0.105	23%	0.231	C	C	.	.			trans	-67.3	122.6	-179	-71.4	-16.8	0	0	0	110.4	L358 I359 R362 Q372 V373 V376	L358-F364 HydrophobicContact CD1-CE2 3.98Å; L358-F364 HydrophobicContact CG-CE2 4.14Å; I359-F364 HydrophobicContact CD1-CB 4.23Å; I359-F364 HydrophobicContact CD1-CD2 3.92Å; I359-F364 PolarHBondContact O-N 3.19Å; I359-F364 VanDerWaalsContact O-N 3.12Å; R362-F364 VanDerWaalsContact C-N 3.25Å; R362-F364 HydrophobicContact CB-CD1 3.41Å; R362-F364 VanDerWaalsContact CB-CD1 3.41Å; R362-F364 HydrophobicContact CB-CD2 4.17Å; R362-F364 HydrophobicContact CB-CE1 3.23Å; R362-F364 HydrophobicContact CB-CE2 3.95Å; R362-F364 HydrophobicContact CB-CG 3.93Å; R362-F364 HydrophobicContact CB-CZ 3.49Å; R362-F364 VanDerWaalsContact CB-CZ 3.49Å; R362-F364 HydrophobicContact CG-CE1 3.92Å; R362-F364 HydrophobicContact CG-CE2 4.21Å; R362-F364 HydrophobicContact CG-CZ 3.72Å; R362-F364 PolarHBondContact O-N 3.47Å; F364-Q372 HydrophobicContact CD1-CB 3.83Å; F364-Q372 HydrophobicContact CD1-CG 4.26Å; F364-Q372 HydrophobicContact CD2-CB 3.88Å; F364-Q372 HydrophobicContact CE1-CB 3.74Å; F364-Q372 HydrophobicContact CE1-CG 4.33Å; F364-Q372 HydrophobicContact CE2-CB 3.86Å; F364-Q372 HydrophobicContact CG-CB 3.88Å; F364-Q372 HydrophobicContact CZ-CB 3.78Å; F364-V373 HydrophobicContact CD2-CG2 4.07Å; F364-V373 HydrophobicContact CE2-CG2 4.11Å; F364-V376 HydrophobicContact CE2-CG2 4.04Å; F364-V376 HydrophobicContact CZ-CG2 3.74Å
365	P	91.2	Very high	94.1	Very high	61 Å²	61	50.3 Å²	50.3	40%	0.396	25%	0.254	S	S	.	.			trans	-57.8	142.8	173	-22.6	34.4	0	0	0	110.2	K363 D367 A368 A369	K363-P365 WeakPolarHBondContact O-CD 3.35Å; P365-D367 WeakPolarHBondContact CB-OD1 3.41Å; P365-D367 PolarHBondContact O-N 3.5Å; P365-A368 HydrophobicContact CB-CB 4.25Å; P365-A368 PolarHBondContact O-N 2.97Å; P365-A369 WeakPolarHBondContact O-CB 3.16Å; P365-A369 PolarHBondContact O-N 3.29Å
366	F	89.8	Confident	94.1	Very high	103 Å²	103	50.4 Å²	50.4	45%	0.452	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-52.1	-175	177.8	-98.1	0	0	0	111.6	A368 A369 T398 W403	F366-A368 VanDerWaalsContact C-N 3.32Å; F366-A368 PolarHBondContact O-N 3.01Å; F366-A369 VanDerWaalsContact O-CB 3.32Å; F366-A369 WeakPolarHBondContact O-CB 3.11Å; F366-A369 PolarHBondContact O-N 3.16Å; F366-T398 WeakPolarHBondContact CD2-OG1 3.34Å; F366-T398 HydrophobicContact CE2-CG2 4.41Å; F366-T398 VanDerWaalsContact CE2-OG1 3.23Å; F366-T398 WeakPolarHBondContact CE2-OG1 3.46Å; F366-W403 HydrophobicContact CD1-CH2 4.48Å; F366-W403 HydrophobicContact CD1-CZ2 4.05Å; F366-W403 HydrophobicContact CE1-CH2 4.41Å; F366-W403 AromaticContact CE1-CZ2 3.58Å; F366-W403 HydrophobicContact CE1-CZ2 3.58Å; F366-W403 HydrophobicContact CE2-CZ2 4.16Å; F366-W403 AromaticContact CZ-CZ2 3.66Å; F366-W403 HydrophobicContact CZ-CZ2 3.66Å; F366-W403 WeakPolarHBondContact O-CH2 3.44Å; F366-W403 VanDerWaalsContact O-CZ3 3.27Å; F366-W403 WeakPolarHBondContact O-CZ3 3.36Å
367	D	90.2	Very high	94.4	Very high	128 Å²	128	47.7 Å²	47.7	68%	0.684	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-28.4	-179.2	59.9	-21.1	0	0	0	114.6	P365	P365-D367 WeakPolarHBondContact CB-OD1 3.41Å; P365-D367 PolarHBondContact O-N 3.5Å
368	A	93.1	Very high	94.6	Very high	32 Å²	32	51.7 Å²	51.7	26%	0.264	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-4	178.3	0	0	0	0	0	114.1	P365 F366 G370 L371 Q372	P365-A368 HydrophobicContact CB-CB 4.25Å; P365-A368 PolarHBondContact O-N 2.97Å; F366-A368 VanDerWaalsContact C-N 3.32Å; F366-A368 PolarHBondContact O-N 3.01Å; A368-G370 VanDerWaalsContact C-N 3.32Å; A368-G370 PolarHBondContact O-N 3.21Å; A368-L371 PolarHBondContact O-N 2.97Å; A368-Q372 HydrophobicContact CB-CG 4.49Å; A368-Q372 WeakPolarHBondContact O-CG 3.46Å; A368-Q372 PolarHBondContact O-N 3.46Å; A368-Q372 VanDerWaalsContact O-N 3.12Å
369	A	95.1	Very high	94.7	Very high	1 Å²	1	54.5 Å²	54.5	1%	0.008	27%	0.267	C	S	.	.	H	α-helix	trans	-57.6	-41.1	-169.2	0	0	0	0	0	113	I359 P365 F366 L371 Q372 V373 T398 W403 F404	I359-A369 HydrophobicContact CD1-CB 4.21Å; P365-A369 WeakPolarHBondContact O-CB 3.16Å; P365-A369 PolarHBondContact O-N 3.29Å; F366-A369 VanDerWaalsContact O-CB 3.32Å; F366-A369 WeakPolarHBondContact O-CB 3.11Å; F366-A369 PolarHBondContact O-N 3.16Å; A369-L371 PolarHBondContact O-N 3.41Å; A369-Q372 PolarHBondContact O-N 3.45Å; A369-V373 VanDerWaalsContact O-CB 3.29Å; A369-V373 WeakPolarHBondContact O-CB 3.27Å; A369-V373 WeakPolarHBondContact O-CG2 3.39Å; A369-V373 PolarHBondContact O-N 3.1Å; A369-T398 HydrophobicContact CB-CG2 4.25Å; A369-W403 HydrophobicContact CB-CH2 4.37Å; A369-W403 HydrophobicContact CB-CZ3 4.44Å; A369-F404 HydrophobicContact CB-CD2 4.2Å; A369-F404 HydrophobicContact CB-CE2 4.35Å
370	G	97	Very high	94.8	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-60.8	-44.7	-179.7	0	0	0	0	0	112.8	A368 A374 F404 P407	A368-G370 VanDerWaalsContact C-N 3.32Å; A368-G370 PolarHBondContact O-N 3.21Å; G370-A374 WeakPolarHBondContact O-CB 3.36Å; G370-A374 PolarHBondContact O-N 3.3Å; G370-F404 VanDerWaalsContact CA-O 3.31Å; G370-F404 WeakPolarHBondContact CA-O 3.38Å; G370-P407 WeakPolarHBondContact O-CG 3.28Å
371	L	97.1	Very high	95	Very high	103 Å²	103	49.8 Å²	49.8	54%	0.539	24%	0.242	S	C	.	.	H	α-helix	trans	-67.7	-42.2	179	-178.4	63.6	0	0	0	111.3	A368 A369 A374 Q375	A368-L371 PolarHBondContact O-N 2.97Å; A369-L371 PolarHBondContact O-N 3.41Å; L371-A374 PolarHBondContact O-N 2.89Å; L371-Q375 WeakPolarHBondContact O-CG 3.21Å; L371-Q375 PolarHBondContact O-N 3.12Å
372	Q	96.1	Very high	95.2	Very high	47 Å²	47	55.8 Å²	55.8	22%	0.22	27%	0.267	C	S	.	.	H	α-helix	trans	-69.2	-40.3	-179.4	-68.6	178.7	-16.4	0	0	111.9	F364 A368 A369 Q375 V376	F364-Q372 HydrophobicContact CD1-CB 3.83Å; F364-Q372 HydrophobicContact CD1-CG 4.26Å; F364-Q372 HydrophobicContact CD2-CB 3.88Å; F364-Q372 HydrophobicContact CE1-CB 3.74Å; F364-Q372 HydrophobicContact CE1-CG 4.33Å; F364-Q372 HydrophobicContact CE2-CB 3.86Å; F364-Q372 HydrophobicContact CG-CB 3.88Å; F364-Q372 HydrophobicContact CZ-CB 3.78Å; A368-Q372 HydrophobicContact CB-CG 4.49Å; A368-Q372 WeakPolarHBondContact O-CG 3.46Å; A368-Q372 PolarHBondContact O-N 3.46Å; A368-Q372 VanDerWaalsContact O-N 3.12Å; A369-Q372 PolarHBondContact O-N 3.45Å; Q372-Q375 WeakPolarHBondContact O-CB 3.47Å; Q372-Q375 PolarHBondContact O-N 3.26Å; Q372-V376 WeakPolarHBondContact O-CG2 3.31Å; Q372-V376 PolarHBondContact O-N 3.17Å; Q372-V376 VanDerWaalsContact O-N 3.11Å
373	V	97.5	Very high	95.3	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-63	-41.8	172.2	170.4	0	0	0	0	110.9	F355 L358 I359 F364 A369 Q375 V376 L377 F391 F404 I408	F355-V373 HydrophobicContact CE2-CG2 4.38Å; L358-V373 HydrophobicContact CD2-CG1 4.17Å; L358-V373 HydrophobicContact CD2-CG2 3.85Å; L358-V373 HydrophobicContact CG-CG2 4.44Å; I359-V373 HydrophobicContact CD1-CG2 3.95Å; F364-V373 HydrophobicContact CD2-CG2 4.07Å; F364-V373 HydrophobicContact CE2-CG2 4.11Å; A369-V373 VanDerWaalsContact O-CB 3.29Å; A369-V373 WeakPolarHBondContact O-CB 3.27Å; A369-V373 WeakPolarHBondContact O-CG2 3.39Å; A369-V373 PolarHBondContact O-N 3.1Å; V373-Q375 VanDerWaalsContact C-N 3.29Å; V373-Q375 PolarHBondContact O-N 2.93Å; V373-V376 WeakPolarHBondContact O-CB 3.35Å; V373-V376 PolarHBondContact O-N 3.32Å; V373-V376 VanDerWaalsContact O-N 3.13Å; V373-L377 HydrophobicContact CG1-CD1 4.26Å; V373-L377 HydrophobicContact CG1-CG 4.42Å; V373-L377 WeakPolarHBondContact O-CG 3.45Å; V373-L377 PolarHBondContact O-N 3.12Å; V373-F391 HydrophobicContact CG1-CE1 4.02Å; V373-F391 HydrophobicContact CG1-CE2 4.14Å; V373-F391 HydrophobicContact CG1-CZ 3.36Å; V373-F404 HydrophobicContact CB-CE2 4.24Å; V373-F404 HydrophobicContact CB-CZ 4.39Å; V373-F404 HydrophobicContact CG1-CZ 4.21Å; V373-F404 HydrophobicContact CG2-CE2 3.99Å; V373-F404 HydrophobicContact CG2-CZ 4.32Å; V373-I408 HydrophobicContact CG1-CD1 3.93Å
374	A	97.8	Very high	95.5	Very high	7 Å²	7	50.2 Å²	50.2	6%	0.058	25%	0.247	C	C	.	.	H	α-helix	trans	-60.2	-37.6	174.4	0	0	0	0	0	112.4	G370 L371 L377 R378 P407 I408 L411	G370-A374 WeakPolarHBondContact O-CB 3.36Å; G370-A374 PolarHBondContact O-N 3.3Å; L371-A374 PolarHBondContact O-N 2.89Å; A374-L377 PolarHBondContact O-N 3.47Å; A374-R378 WeakPolarHBondContact O-CB 3.26Å; A374-R378 PolarHBondContact O-N 3.42Å; A374-P407 HydrophobicContact CB-CB 4.28Å; A374-I408 HydrophobicContact CB-CG1 4.28Å; A374-L411 HydrophobicContact CB-CD2 4.08Å; A374-L411 WeakPolarHBondContact O-CD2 3.15Å
375	Q	96.6	Very high	95.7	Very high	108 Å²	108	54.1 Å²	54.1	51%	0.505	27%	0.269	S	S	.	.	H	α-helix	trans	-64.3	-39.6	174.1	-70.8	172.7	-7.6	0	0	112.4	L371 Q372 V373 R378 Q379	L371-Q375 WeakPolarHBondContact O-CG 3.21Å; L371-Q375 PolarHBondContact O-N 3.12Å; Q372-Q375 WeakPolarHBondContact O-CB 3.47Å; Q372-Q375 PolarHBondContact O-N 3.26Å; V373-Q375 VanDerWaalsContact C-N 3.29Å; V373-Q375 PolarHBondContact O-N 2.93Å; Q375-R378 PolarHBondContact O-N 3.09Å; Q375-Q379 WeakPolarHBondContact O-CB 3.31Å; Q375-Q379 PolarHBondContact O-N 3.07Å
376	V	97.5	Very high	96	Very high	3 Å²	3	51.9 Å²	51.9	2%	0.018	25%	0.253	C	S	.	.	H	α-helix	trans	-63	-49.6	175.4	176	0	0	0	0	110.4	L358 F364 Q372 V373 R378 Q379 I380 I485	L358-V376 HydrophobicContact CD1-CB 4.49Å; L358-V376 HydrophobicContact CD1-CG1 4.05Å; L358-V376 HydrophobicContact CD1-CG2 4.12Å; F364-V376 HydrophobicContact CE2-CG2 4.04Å; F364-V376 HydrophobicContact CZ-CG2 3.74Å; Q372-V376 WeakPolarHBondContact O-CG2 3.31Å; Q372-V376 PolarHBondContact O-N 3.17Å; Q372-V376 VanDerWaalsContact O-N 3.11Å; V373-V376 WeakPolarHBondContact O-CB 3.35Å; V373-V376 PolarHBondContact O-N 3.32Å; V373-V376 VanDerWaalsContact O-N 3.13Å; V376-R378 VanDerWaalsContact C-N 3.34Å; V376-R378 PolarHBondContact O-N 3.2Å; V376-Q379 PolarHBondContact O-N 3.24Å; V376-Q379 VanDerWaalsContact O-N 3.12Å; V376-I380 HydrophobicContact CG1-CD1 3.94Å; V376-I380 HydrophobicContact CG1-CG1 4.48Å; V376-I380 WeakPolarHBondContact O-CG1 3.49Å; V376-I380 PolarHBondContact O-N 2.57Å; V376-I485 HydrophobicContact CB-CG2 4.31Å; V376-I485 HydrophobicContact CG1-CG2 4.07Å; V376-I485 HydrophobicContact CG2-CG2 3.74Å
377	L	98.4	Very high	96.3	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-59	-43.2	177.2	-69.1	175	0	0	0	112.1	I353 V373 A374 Q379 I380 N381 F389 F391 I408 L411 I417 V419	I353-L377 HydrophobicContact CD1-CD2 3.61Å; V373-L377 HydrophobicContact CG1-CD1 4.26Å; V373-L377 HydrophobicContact CG1-CG 4.42Å; V373-L377 WeakPolarHBondContact O-CG 3.45Å; V373-L377 PolarHBondContact O-N 3.12Å; A374-L377 PolarHBondContact O-N 3.47Å; L377-Q379 VanDerWaalsContact C-N 3.3Å; L377-Q379 PolarHBondContact O-N 2.96Å; L377-I380 PolarHBondContact O-N 3.32Å; L377-N381 WeakPolarHBondContact O-CB 3.5Å; L377-N381 PolarHBondContact O-N 2.87Å; L377-F389 HydrophobicContact CD2-CB 4.25Å; L377-F389 HydrophobicContact CD2-CD1 3.59Å; L377-F389 HydrophobicContact CD2-CD2 4.21Å; L377-F389 HydrophobicContact CD2-CE1 3.92Å; L377-F389 HydrophobicContact CD2-CE2 4.5Å; L377-F389 HydrophobicContact CD2-CG 3.75Å; L377-F389 HydrophobicContact CD2-CZ 4.36Å; L377-F391 HydrophobicContact CD1-CZ 4.1Å; L377-F391 HydrophobicContact CD2-CZ 4.43Å; L377-I408 HydrophobicContact CD1-CG1 4.48Å; L377-I408 HydrophobicContact CD1-CG2 4.09Å; L377-L411 HydrophobicContact CB-CD2 3.75Å; L377-L411 HydrophobicContact CD1-CD2 4.48Å; L377-I417 HydrophobicContact CB-CD1 4.21Å; L377-I417 HydrophobicContact CD1-CD1 4.47Å; L377-V419 HydrophobicContact CD1-CG2 3.81Å
378	R	98.1	Very high	96.7	Very high	110 Å²	110	49 Å²	49	42%	0.415	23%	0.23	S	C	.	.	H	α-helix	trans	-58.2	-43.9	175	-176.9	-178.9	-64.7	-96.2	2	111.2	A374 Q375 V376 K382 L411 L415	A374-R378 WeakPolarHBondContact O-CB 3.26Å; A374-R378 PolarHBondContact O-N 3.42Å; Q375-R378 PolarHBondContact O-N 3.09Å; V376-R378 VanDerWaalsContact C-N 3.34Å; V376-R378 PolarHBondContact O-N 3.2Å; R378-K382 WeakPolarHBondContact O-CB 3.38Å; R378-K382 PolarHBondContact O-N 2.91Å; R378-L411 HydrophobicContact CB-CD1 3.94Å; R378-L411 HydrophobicContact CB-CD2 4.31Å; R378-L411 HydrophobicContact CG-CD1 4.25Å; R378-L411 VanDerWaalsContact CZ-CD1 3.45Å; R378-L411 VanDerWaalsContact NH2-CD1 3.27Å; R378-L415 HydrophobicContact CG-CD1 4.17Å
379	Q	97.2	Very high	97	Very high	59 Å²	59	47.5 Å²	47.5	28%	0.276	22%	0.217	S	C	.	.	H	α-helix	trans	-68	-41.2	179.9	-173.1	56.9	43.5	0	0	111.7	Q375 V376 L377 K382 D383 I485 Y486	Q375-Q379 WeakPolarHBondContact O-CB 3.31Å; Q375-Q379 PolarHBondContact O-N 3.07Å; V376-Q379 PolarHBondContact O-N 3.24Å; V376-Q379 VanDerWaalsContact O-N 3.12Å; L377-Q379 VanDerWaalsContact C-N 3.3Å; L377-Q379 PolarHBondContact O-N 2.96Å; Q379-K382 PolarHBondContact O-N 2.87Å; Q379-D383 PolarHBondContact NE2-OD1 2.92Å; Q379-D383 PolarHBondContact NE2-OD2 3.36Å; Q379-D383 WeakPolarHBondContact O-CB 3.44Å; Q379-D383 PolarHBondContact O-N 2.91Å; Q379-I485 HydrophobicContact CB-CD1 3.82Å; Q379-I485 HydrophobicContact CG-CD1 3.97Å; Q379-Y486 VanDerWaalsContact C-OH 3.31Å; Q379-Y486 HydrophobicContact CB-CE1 4.36Å; Q379-Y486 HydrophobicContact CG-CE1 4.01Å; Q379-Y486 PolarHBondContact O-OH 2.93Å; Q379-Y486 VanDerWaalsContact O-OH 3.13Å
380	I	97.6	Very high	97.1	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-62.7	-47.7	174.9	-64.7	171.6	0	0	0	110.5	I353 V376 L377 K382 D383 F384 L386 F389 V448 I477 Y486	I353-I380 HydrophobicContact CD1-CD1 4.46Å; V376-I380 HydrophobicContact CG1-CD1 3.94Å; V376-I380 HydrophobicContact CG1-CG1 4.48Å; V376-I380 WeakPolarHBondContact O-CG1 3.49Å; V376-I380 PolarHBondContact O-N 2.57Å; L377-I380 PolarHBondContact O-N 3.32Å; I380-K382 VanDerWaalsContact C-N 3.33Å; I380-K382 PolarHBondContact O-N 2.79Å; I380-D383 PolarHBondContact O-N 3.25Å; I380-F384 HydrophobicContact CG2-CD2 4.03Å; I380-F384 WeakPolarHBondContact O-CD2 3.42Å; I380-F384 PolarHBondContact O-N 2.97Å; I380-L386 HydrophobicContact CG2-CD1 3.78Å; I380-L386 HydrophobicContact CG2-CG 4.4Å; I380-F389 HydrophobicContact CB-CE1 4.3Å; I380-F389 HydrophobicContact CG2-CE1 3.76Å; I380-F389 HydrophobicContact CG2-CZ 4.13Å; I380-V448 HydrophobicContact CD1-CG2 3.8Å; I380-I477 HydrophobicContact CG2-CD1 4.28Å; I380-Y486 WeakPolarHBondContact CA-OH 3.47Å; I380-Y486 HydrophobicContact CD1-CE1 4.42Å; I380-Y486 HydrophobicContact CG1-CD1 4.24Å; I380-Y486 HydrophobicContact CG1-CE1 3.49Å; I380-Y486 VanDerWaalsContact CG1-CE1 3.49Å; I380-Y486 PolarHBondContact N-OH 3.32Å
381	N	97.7	Very high	97.1	Very high	21 Å²	21	47.4 Å²	47.4	11%	0.112	22%	0.217	C	C	.	.	H	α-helix	trans	-58	-44.9	175.9	173.4	-96.2	0	0	0	111.6	L377 D383 N385 L386 L415 I417	L377-N381 WeakPolarHBondContact O-CB 3.5Å; L377-N381 PolarHBondContact O-N 2.87Å; N381-D383 VanDerWaalsContact C-N 3.33Å; N381-D383 PolarHBondContact O-N 3.24Å; N381-N385 WeakPolarHBondContact O-CA 3.26Å; N381-N385 PolarHBondContact O-N 3.14Å; N381-L386 PolarHBondContact ND2-O 3.49Å; N381-L415 HydrophobicContact CB-CD1 4.47Å; N381-I417 HydrophobicContact CB-CG2 4.44Å
382	K	96.4	Very high	97.1	Very high	159 Å²	159	42.6 Å²	42.6	69%	0.691	19%	0.191	S	C	*	.	H	α-helix	trans	-61.6	-40.6	176.8	179.8	-179.5	178.4	179.5	0	112.8	R378 Q379 I380	R378-K382 WeakPolarHBondContact O-CB 3.38Å; R378-K382 PolarHBondContact O-N 2.91Å; Q379-K382 PolarHBondContact O-N 2.87Å; I380-K382 VanDerWaalsContact C-N 3.33Å; I380-K382 PolarHBondContact O-N 2.79Å
383	D	94.3	Very high	97	Very high	45 Å²	45	40.3 Å²	40.3	24%	0.241	18%	0.181	C	C	.	.	H	α-helix	trans	-81.4	-31	-173.7	-80.9	-32.1	0	0	0	113.9	Q379 I380 N381 Y486 K488	Q379-D383 PolarHBondContact NE2-OD1 2.92Å; Q379-D383 PolarHBondContact NE2-OD2 3.36Å; Q379-D383 WeakPolarHBondContact O-CB 3.44Å; Q379-D383 PolarHBondContact O-N 2.91Å; I380-D383 PolarHBondContact O-N 3.25Å; N381-D383 VanDerWaalsContact C-N 3.33Å; N381-D383 PolarHBondContact O-N 3.24Å; D383-Y486 WeakPolarHBondContact CB-OH 3.36Å; D383-Y486 PolarHBondContact OD2-OH 3.11Å; D383-K488 VanDerWaalsContact CG-CE 3.42Å; D383-K488 IonicContact OD1-NZ 3.41Å; D383-K488 PolarHBondContact OD1-NZ 3.12Å; D383-K488 WeakPolarHBondContact OD2-CE 3.27Å; D383-K488 IonicContact OD2-NZ 3.59Å; D383-K488 PolarHBondContact OD2-NZ 3.28Å; D383-K488 VanDerWaalsContact OD2-NZ 3.16Å
384	F	94.6	Very high	96.6	Very high	42 Å²	42	43.7 Å²	43.7	18%	0.184	20%	0.195	C	C	.	.	H	α-helix	trans	-129.7	-5.7	-168.7	-58.5	-77.3	0	0	0	114.1	I380 L386 Y446 I477 Y486 K488	I380-F384 HydrophobicContact CG2-CD2 4.03Å; I380-F384 WeakPolarHBondContact O-CD2 3.42Å; I380-F384 PolarHBondContact O-N 2.97Å; F384-L386 VanDerWaalsContact C-N 3.26Å; F384-L386 HydrophobicContact CB-CD1 3.97Å; F384-L386 HydrophobicContact CB-CD2 4.1Å; F384-L386 HydrophobicContact CB-CG 3.66Å; F384-L386 PolarHBondContact O-N 3.33Å; F384-Y446 AromaticContact CD1-CE1 3.8Å; F384-Y446 HydrophobicContact CD1-CE1 3.8Å; F384-Y446 AromaticContact CD1-CZ 3.82Å; F384-Y446 AromaticContact CE1-CE1 3.82Å; F384-Y446 HydrophobicContact CE1-CE1 3.82Å; F384-Y446 HydrophobicContact CG-CE1 4.41Å; F384-Y446 HydrophobicContact CZ-CE1 4.45Å; F384-I477 HydrophobicContact CD2-CD1 4.05Å; F384-I477 HydrophobicContact CE2-CD1 3.62Å; F384-I477 HydrophobicContact CE2-CG1 4.15Å; F384-I477 HydrophobicContact CZ-CD1 4.12Å; F384-I477 HydrophobicContact CZ-CG1 4.21Å; F384-Y486 AromaticContact CE2-CE2 3.85Å; F384-Y486 HydrophobicContact CE2-CE2 3.85Å; F384-Y486 HydrophobicContact CZ-CE2 4.4Å; F384-K488 HydrophobicContact CZ-CB 4.05Å; F384-K488 HydrophobicContact CZ-CD 4.04Å; F384-K488 HydrophobicContact CZ-CG 3.8Å
385	N	96.3	Very high	95.9	Very high	106 Å²	106	48.2 Å²	48.2	57%	0.567	22%	0.215	S	C	*	.			trans	57.8	32.7	-177.6	-168.4	41.1	0	0	0	114.2	N381	N381-N385 WeakPolarHBondContact O-CA 3.26Å; N381-N385 PolarHBondContact O-N 3.14Å
386	L	97.5	Very high	95.3	Very high	13 Å²	13	43.6 Å²	43.6	7%	0.068	20%	0.195	C	C	.	.			trans	-81.3	143.8	176.9	-49.7	-179.6	0	0	0	110.6	D350 C351 I380 N381 F384 F389 Y446	D350-L386 HydrophobicContact CB-CB 3.8Å; D350-L386 HydrophobicContact CB-CD2 4.06Å; D350-L386 HydrophobicContact CB-CG 4.35Å; C351-L386 HydrophobicContact CB-CD1 3.8Å; I380-L386 HydrophobicContact CG2-CD1 3.78Å; I380-L386 HydrophobicContact CG2-CG 4.4Å; N381-L386 PolarHBondContact ND2-O 3.49Å; F384-L386 VanDerWaalsContact C-N 3.26Å; F384-L386 HydrophobicContact CB-CD1 3.97Å; F384-L386 HydrophobicContact CB-CD2 4.1Å; F384-L386 HydrophobicContact CB-CG 3.66Å; F384-L386 PolarHBondContact O-N 3.33Å; L386-F389 HydrophobicContact CB-CE1 4.16Å; L386-F389 HydrophobicContact CB-CZ 3.8Å; L386-F389 WeakPolarHBondContact O-CE2 3.42Å; L386-F389 WeakPolarHBondContact O-CZ 3.43Å; L386-Y446 HydrophobicContact CD1-CD2 3.61Å; L386-Y446 HydrophobicContact CD1-CE2 4.29Å; L386-Y446 HydrophobicContact CD1-CG 3.8Å; L386-Y446 HydrophobicContact CD2-CD2 3.86Å; L386-Y446 HydrophobicContact CD2-CE2 3.99Å; L386-Y446 HydrophobicContact CG-CD2 4.39Å
387	R	97.3	Very high	94.8	Very high	130 Å²	130	47.8 Å²	47.8	49%	0.491	22%	0.221	S	C	.	.			trans	-127.5	-32.9	-173.2	-61.6	-177.5	-178.2	-178.4	-2.6	114	D350 F389 I417 S418	D350-R387 WeakPolarHBondContact OD2-CA 3.47Å; D350-R387 PolarHBondContact OD2-N 2.99Å; R387-F389 WeakPolarHBondContact O-CD2 3.27Å; R387-I417 HydrophobicContact CB-CG2 4.49Å; R387-I417 CarbonylContact O-C 3.52Å; R387-I417 VanDerWaalsContact O-CA 3.26Å; R387-I417 WeakPolarHBondContact O-CA 3.48Å; R387-I417 WeakPolarHBondContact O-CB 3.4Å; R387-S418 PolarHBondContact O-N 3.31Å
388	R	97.9	Very high	94.5	Very high	42 Å²	42	48.3 Å²	48.3	16%	0.158	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	100.1	-175.9	-61.6	178.6	65.4	101.7	6.6	110.4	E347 P348 L349 D350 C351	E347-R388 PolarHBondContact O-NH2 2.75Å; E347-R388 IonicContact OE2-CZ 2.78Å; E347-R388 IonicContact OE2-NE 3.82Å; E347-R388 IonicContact OE2-NH1 4Å; E347-R388 PolarHBondContact OE2-NH1 3.03Å; P348-R388 WeakPolarHBondContact O-CD 3.42Å; P348-R388 PolarHBondContact O-NE 2.96Å; L349-R388 HydrophobicContact CD2-CB 4.41Å; D350-R388 HydrophobicContact CB-CB 4.47Å; D350-R388 PolarHBondContact N-O 2.91Å; D350-R388 PolarHBondContact OD2-N 3.48Å; C351-R388 PolarHBondContact N-O 3.34Å
389	F	98.4	Very high	94.2	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	148.3	-177.2	-60.9	-91.1	0	0	0	111.9	C351 I353 L377 I380 L386 R387 I417 S418 V419 Q420	C351-F389 HydrophobicContact CB-CD1 3.57Å; C351-F389 HydrophobicContact CB-CE1 3.75Å; C351-F389 CarbonylContact O-C 3.49Å; C351-F389 VanDerWaalsContact O-CA 3.32Å; C351-F389 WeakPolarHBondContact O-CA 3.27Å; I353-F389 HydrophobicContact CD1-CD1 3.89Å; L377-F389 HydrophobicContact CD2-CB 4.25Å; L377-F389 HydrophobicContact CD2-CD1 3.59Å; L377-F389 HydrophobicContact CD2-CD2 4.21Å; L377-F389 HydrophobicContact CD2-CE1 3.92Å; L377-F389 HydrophobicContact CD2-CE2 4.5Å; L377-F389 HydrophobicContact CD2-CG 3.75Å; L377-F389 HydrophobicContact CD2-CZ 4.36Å; I380-F389 HydrophobicContact CB-CE1 4.3Å; I380-F389 HydrophobicContact CG2-CE1 3.76Å; I380-F389 HydrophobicContact CG2-CZ 4.13Å; L386-F389 HydrophobicContact CB-CE1 4.16Å; L386-F389 HydrophobicContact CB-CZ 3.8Å; L386-F389 WeakPolarHBondContact O-CE2 3.42Å; L386-F389 WeakPolarHBondContact O-CZ 3.43Å; R387-F389 WeakPolarHBondContact O-CD2 3.27Å; F389-I417 HydrophobicContact CD2-CB 4.35Å; F389-I417 HydrophobicContact CD2-CD1 4.34Å; F389-I417 HydrophobicContact CE2-CB 4.1Å; F389-I417 HydrophobicContact CE2-CD1 4.13Å; F389-I417 HydrophobicContact CE2-CG2 4.15Å; F389-S418 PolarHBondContact N-O 2.88Å; F389-V419 HydrophobicContact CB-CG1 4.29Å; F389-V419 HydrophobicContact CB-CG2 4.22Å; F389-V419 HydrophobicContact CD2-CG2 4.45Å; F389-V419 WeakPolarHBondContact O-CA 3.3Å; F389-Q420 PolarHBondContact O-N 3.39Å
390	C	98.1	Very high	93.9	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	127.1	168	-172.9	0	0	0	0	111.2	L349 C351 I352 I353 Q420 M437	L349-C390 HydrophobicContact CD1-CB 3.58Å; L349-C390 HydrophobicContact CD2-CB 4.18Å; L349-C390 HydrophobicContact CG-CB 4.48Å; C351-C390 PolarHBondContact O-N 2.74Å; I352-C390 WeakPolarHBondContact CA-O 3.4Å; I353-C390 PolarHBondContact N-O 3.36Å; C390-Q420 WeakPolarHBondContact CA-O 3.3Å; C390-M437 HydrophobicContact CB-CE 4.48Å
391	F	97.7	Very high	93.8	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	121.8	168	-64.6	-46.4	0	0	0	110.3	I353 F355 L358 V373 L377 L399 F404 W405 I408 V419 Q420 K421 F422	I353-F391 HydrophobicContact CB-CD1 3.8Å; I353-F391 HydrophobicContact CB-CE1 4.12Å; I353-F391 HydrophobicContact CD1-CD1 4.29Å; I353-F391 HydrophobicContact CD1-CE1 3.79Å; I353-F391 HydrophobicContact CG2-CD1 3.88Å; I353-F391 HydrophobicContact CG2-CE1 4.01Å; I353-F391 WeakPolarHBondContact O-CA 3.47Å; F355-F391 HydrophobicContact CB-CB 4.24Å; F355-F391 HydrophobicContact CD2-CB 4.42Å; F355-F391 HydrophobicContact CD2-CD1 4.04Å; F355-F391 HydrophobicContact CD2-CD2 4.41Å; F355-F391 HydrophobicContact CD2-CE1 4.49Å; F355-F391 HydrophobicContact CD2-CG 4.05Å; L358-F391 HydrophobicContact CD2-CE1 4.39Å; V373-F391 HydrophobicContact CG1-CE1 4.02Å; V373-F391 HydrophobicContact CG1-CE2 4.14Å; V373-F391 HydrophobicContact CG1-CZ 3.36Å; L377-F391 HydrophobicContact CD1-CZ 4.1Å; L377-F391 HydrophobicContact CD2-CZ 4.43Å; F391-L399 HydrophobicContact CD2-CD2 4.1Å; F391-F404 HydrophobicContact CE2-CE1 4.26Å; F391-F404 HydrophobicContact CE2-CZ 4.16Å; F391-W405 AromaticContact CD2-CH2 3.93Å; F391-W405 HydrophobicContact CD2-CH2 3.93Å; F391-W405 HydrophobicContact CD2-CZ3 4.39Å; F391-W405 HydrophobicContact CE2-CH2 4.28Å; F391-W405 HydrophobicContact CE2-CZ3 4.31Å; F391-I408 HydrophobicContact CE2-CD1 4.09Å; F391-I408 HydrophobicContact CZ-CD1 4.46Å; F391-V419 HydrophobicContact CD2-CG1 3.8Å; F391-V419 HydrophobicContact CE2-CG1 3.36Å; F391-V419 HydrophobicContact CZ-CG1 3.78Å; F391-Q420 PolarHBondContact N-O 3.26Å; F391-K421 HydrophobicContact CB-CB 4.39Å; F391-K421 CarbonylContact O-C 3.6Å; F391-K421 VanDerWaalsContact O-CA 3.3Å; F391-K421 WeakPolarHBondContact O-CA 3.47Å; F391-F422 PolarHBondContact O-N 3.14Å
392	V	96	Very high	93.6	Very high	1 Å²	1	55.8 Å²	55.8	1%	0.006	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	133.3	167.5	177.5	0	0	0	0	108.3	I352 I353 F355 F422 D430 L434 M437	I352-V392 HydrophobicContact CG2-CB 4.31Å; I352-V392 HydrophobicContact CG2-CG2 3.44Å; I352-V392 VanDerWaalsContact CG2-CG2 3.44Å; I353-V392 PolarHBondContact O-N 2.75Å; F355-V392 WeakPolarHBondContact CB-O 3.45Å; F355-V392 PolarHBondContact N-O 3.08Å; V392-F422 WeakPolarHBondContact CA-O 3.45Å; V392-F422 HydrophobicContact CG2-CB 4.36Å; V392-D430 HydrophobicContact CG1-CB 4.12Å; V392-L434 HydrophobicContact CB-CB 4.24Å; V392-L434 HydrophobicContact CB-CD1 4.42Å; V392-L434 HydrophobicContact CG1-CB 4.03Å; V392-L434 HydrophobicContact CG2-CB 4.34Å; V392-M437 HydrophobicContact CG2-CE 4.22Å; V392-M437 HydrophobicContact CG2-SD 4.11Å
393	S	94.1	Very high	93.6	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159	146.3	-176	-169.6	0	0	0	0	110.1	F422 C423 T424	S393-F422 PolarHBondContact N-O 2.87Å; S393-C423 CarbonylContact O-C 3.53Å; S393-C423 WeakPolarHBondContact O-CA 3.46Å; S393-T424 PolarHBondContact O-N 3.42Å
394	K	89.2	Confident	93.7	Very high	70 Å²	70	50 Å²	50	30%	0.304	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	161.2	151.7	-55.5	-168.6	-169.1	-156.4	0	110.7	S396 S428 D430	K394-S396 PolarHBondContact O-N 3.22Å; K394-S428 WeakPolarHBondContact CE-O 3.21Å; K394-S428 PolarHBondContact NZ-O 3.49Å; K394-D430 WeakPolarHBondContact CE-OD1 3.42Å; K394-D430 HydrophobicContact CG-CB 4.12Å; K394-D430 WeakPolarHBondContact CG-OD2 3.23Å; K394-D430 PolarHBondContact N-OD2 3.36Å
395	E	82.9	Confident	93.9	Very high	102 Å²	102	49.7 Å²	49.7	48%	0.477	23%	0.232	S	C	.	.	S	Bend	trans	-37.6	114.1	176.4	-74.3	-152.4	-176.1	0	0	113	R400 T424	E395-R400 IonicContact OE1-NH2 3.71Å; E395-R400 IonicContact OE2-CZ 3.93Å; E395-R400 IonicContact OE2-NH1 2.75Å; E395-R400 IonicContact OE2-NH2 3.67Å; E395-R400 PolarHBondContact OE2-NH2 3.05Å; E395-T424 PolarHBondContact N-O 2.9Å
396	S	84.9	Confident	93.9	Very high	11 Å²	11	48.3 Å²	48.3	8%	0.077	23%	0.225	C	C	.	.			trans	-123.3	121.5	-177.4	-178.2	0	0	0	0	110.7	F355 K394 T398 L399	F355-S396 WeakPolarHBondContact CE1-OG 3.48Å; K394-S396 PolarHBondContact O-N 3.22Å; S396-T398 PolarHBondContact O-N 3.05Å; S396-L399 PolarHBondContact O-N 3.44Å
397	T	87	Confident	93.9	Very high	91 Å²	91	49.4 Å²	49.4	56%	0.558	23%	0.232	S	C	*	.	S	Bend	trans	-62.6	-33.6	177.1	53.2	0	0	0	0	111.7	R400	T397-R400 PolarHBondContact O-N 3.23Å
398	T	90.9	Very high	94	Very high	13 Å²	13	43.4 Å²	43.4	8%	0.08	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-59.4	-47.4	177.7	-50.9	0	0	0	0	111.5	F355 F366 A369 S396 R400 K401 W403 F404	F355-T398 HydrophobicContact CZ-CG2 4.1Å; F366-T398 WeakPolarHBondContact CD2-OG1 3.34Å; F366-T398 HydrophobicContact CE2-CG2 4.41Å; F366-T398 VanDerWaalsContact CE2-OG1 3.23Å; F366-T398 WeakPolarHBondContact CE2-OG1 3.46Å; A369-T398 HydrophobicContact CB-CG2 4.25Å; S396-T398 PolarHBondContact O-N 3.05Å; T398-R400 PolarHBondContact O-N 3.48Å; T398-R400 VanDerWaalsContact O-N 3.08Å; T398-K401 PolarHBondContact O-N 2.86Å; T398-W403 HydrophobicContact CG2-CH2 3.86Å; T398-W403 HydrophobicContact CG2-CZ2 4.34Å; T398-F404 HydrophobicContact CG2-CB 4.34Å; T398-F404 HydrophobicContact CG2-CD2 3.58Å; T398-F404 HydrophobicContact CG2-CE2 4.12Å; T398-F404 HydrophobicContact CG2-CG 4Å
399	L	92.4	Very high	94	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.005	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-66.5	-11.9	-178.9	-68.5	179.8	0	0	0	113.8	F355 F391 S396 F404 W405 K421	F355-L399 HydrophobicContact CD1-CD1 3.88Å; F355-L399 HydrophobicContact CD1-CD2 4.23Å; F355-L399 HydrophobicContact CD1-CG 3.93Å; F355-L399 HydrophobicContact CD2-CD2 4.02Å; F355-L399 HydrophobicContact CE1-CD1 4.19Å; F355-L399 HydrophobicContact CE1-CD2 3.96Å; F355-L399 HydrophobicContact CE1-CG 3.71Å; F355-L399 HydrophobicContact CE2-CD2 3.74Å; F355-L399 HydrophobicContact CE2-CG 4.41Å; F355-L399 HydrophobicContact CG-CD1 4.15Å; F355-L399 HydrophobicContact CG-CD2 4.26Å; F355-L399 HydrophobicContact CG-CG 4.37Å; F355-L399 HydrophobicContact CZ-CD2 3.7Å; F355-L399 HydrophobicContact CZ-CG 3.97Å; F391-L399 HydrophobicContact CD2-CD2 4.1Å; S396-L399 PolarHBondContact O-N 3.44Å; L399-F404 HydrophobicContact CD2-CD1 4.21Å; L399-F404 HydrophobicContact CD2-CE1 3.53Å; L399-F404 HydrophobicContact CD2-CZ 3.95Å; L399-W405 HydrophobicContact CD2-CH2 4.45Å; L399-W405 HydrophobicContact CD2-CZ2 3.93Å; L399-W405 PolarHBondContact O-NE1 3.39Å; L399-K421 HydrophobicContact CB-CD 4.21Å; L399-K421 PolarHBondContact O-NZ 3.04Å
400	R	91.7	Very high	94	Very high	156 Å²	156	50.9 Å²	50.9	59%	0.589	25%	0.25	S	S	*	.	G	3₁₀ helix	trans	-91.1	-12.1	175.8	-63.5	-178.7	-177	156.4	4.9	113.2	E395 T397 T398	E395-R400 IonicContact OE1-NH2 3.71Å; E395-R400 IonicContact OE2-CZ 3.93Å; E395-R400 IonicContact OE2-NH1 2.75Å; E395-R400 IonicContact OE2-NH2 3.67Å; E395-R400 PolarHBondContact OE2-NH2 3.05Å; T397-R400 PolarHBondContact O-N 3.23Å; T398-R400 PolarHBondContact O-N 3.48Å; T398-R400 VanDerWaalsContact O-N 3.08Å
401	K	94.3	Very high	94	Very high	105 Å²	105	51 Å²	51	46%	0.457	25%	0.251	S	S	.	.			trans	-91.4	134.3	-175.6	-59.8	-63.8	-177.7	176.5	0	111.8	T398 W403 F404 W405	T398-K401 PolarHBondContact O-N 2.86Å; K401-W403 HydrophobicContact CB-CD2 4.35Å; K401-W403 HydrophobicContact CB-CG 4.26Å; K401-W403 HydrophobicContact CB-CZ2 4.09Å; K401-W403 HydrophobicContact CG-CZ2 4.25Å; K401-W403 PolarHBondContact O-N 3.06Å; K401-F404 PolarHBondContact O-N 3Å; K401-W405 VanDerWaalsContact O-CD1 3.24Å
402	S	94.3	Very high	94	Very high	85 Å²	85	51.4 Å²	51.4	59%	0.594	26%	0.256	S	S	*	.	H	α-helix	trans	-60.6	-43.4	179.6	50.2	0	0	0	0	113	F404 W405 D406	S402-F404 PolarHBondContact O-N 3.22Å; S402-F404 VanDerWaalsContact O-N 3.08Å; S402-W405 PolarHBondContact O-N 3.08Å; S402-D406 PolarHBondContact O-N 3Å
403	W	95.6	Very high	94.1	Very high	81 Å²	81	58.4 Å²	58.4	31%	0.307	29%	0.293	S	S	.	.	H	α-helix	trans	-56.4	-29.3	-178.5	65.3	-106.8	0	0	0	113.3	F366 A369 T398 K401 W405 P407	F366-W403 HydrophobicContact CD1-CH2 4.48Å; F366-W403 HydrophobicContact CD1-CZ2 4.05Å; F366-W403 HydrophobicContact CE1-CH2 4.41Å; F366-W403 AromaticContact CE1-CZ2 3.58Å; F366-W403 HydrophobicContact CE1-CZ2 3.58Å; F366-W403 HydrophobicContact CE2-CZ2 4.16Å; F366-W403 AromaticContact CZ-CZ2 3.66Å; F366-W403 HydrophobicContact CZ-CZ2 3.66Å; F366-W403 WeakPolarHBondContact O-CH2 3.44Å; F366-W403 VanDerWaalsContact O-CZ3 3.27Å; F366-W403 WeakPolarHBondContact O-CZ3 3.36Å; A369-W403 HydrophobicContact CB-CH2 4.37Å; A369-W403 HydrophobicContact CB-CZ3 4.44Å; T398-W403 HydrophobicContact CG2-CH2 3.86Å; T398-W403 HydrophobicContact CG2-CZ2 4.34Å; K401-W403 HydrophobicContact CB-CD2 4.35Å; K401-W403 HydrophobicContact CB-CG 4.26Å; K401-W403 HydrophobicContact CB-CZ2 4.09Å; K401-W403 HydrophobicContact CG-CZ2 4.25Å; K401-W403 PolarHBondContact O-N 3.06Å; W403-W405 VanDerWaalsContact C-N 3.33Å; W403-P407 VanDerWaalsContact O-CD 3.28Å; W403-P407 WeakPolarHBondContact O-CD 3.44Å
404	F	97	Very high	94.3	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-67.3	-38.1	177.2	168.9	-96.1	0	0	0	111.1	F355 A369 G370 V373 F391 T398 L399 K401 S402 I408	F355-F404 HydrophobicContact CE2-CE1 4.43Å; F355-F404 AromaticContact CE2-CE2 3.85Å; F355-F404 HydrophobicContact CE2-CE2 3.85Å; F355-F404 AromaticContact CE2-CZ 3.51Å; F355-F404 HydrophobicContact CE2-CZ 3.51Å; F355-F404 AromaticContact CZ-CE2 3.94Å; F355-F404 HydrophobicContact CZ-CE2 3.94Å; F355-F404 AromaticContact CZ-CZ 3.9Å; F355-F404 HydrophobicContact CZ-CZ 3.9Å; A369-F404 HydrophobicContact CB-CD2 4.2Å; A369-F404 HydrophobicContact CB-CE2 4.35Å; G370-F404 VanDerWaalsContact CA-O 3.31Å; G370-F404 WeakPolarHBondContact CA-O 3.38Å; V373-F404 HydrophobicContact CB-CE2 4.24Å; V373-F404 HydrophobicContact CB-CZ 4.39Å; V373-F404 HydrophobicContact CG1-CZ 4.21Å; V373-F404 HydrophobicContact CG2-CE2 3.99Å; V373-F404 HydrophobicContact CG2-CZ 4.32Å; F391-F404 HydrophobicContact CE2-CE1 4.26Å; F391-F404 HydrophobicContact CE2-CZ 4.16Å; T398-F404 HydrophobicContact CG2-CB 4.34Å; T398-F404 HydrophobicContact CG2-CD2 3.58Å; T398-F404 HydrophobicContact CG2-CE2 4.12Å; T398-F404 HydrophobicContact CG2-CG 4Å; L399-F404 HydrophobicContact CD2-CD1 4.21Å; L399-F404 HydrophobicContact CD2-CE1 3.53Å; L399-F404 HydrophobicContact CD2-CZ 3.95Å; K401-F404 PolarHBondContact O-N 3Å; S402-F404 PolarHBondContact O-N 3.22Å; S402-F404 VanDerWaalsContact O-N 3.08Å; F404-I408 HydrophobicContact CD1-CD1 4.24Å; F404-I408 HydrophobicContact CE1-CD1 3.57Å; F404-I408 HydrophobicContact CE2-CD1 4.31Å; F404-I408 HydrophobicContact CZ-CD1 3.61Å
405	W	97.8	Very high	94.7	Very high	37 Å²	37	63.3 Å²	63.3	14%	0.14	32%	0.318	C	S	.	.	H	α-helix	trans	-82.6	-24.5	-175.4	-67.7	101.4	0	0	0	113.6	F391 L399 K401 S402 W403 I408 K409 V419 K421	F391-W405 AromaticContact CD2-CH2 3.93Å; F391-W405 HydrophobicContact CD2-CH2 3.93Å; F391-W405 HydrophobicContact CD2-CZ3 4.39Å; F391-W405 HydrophobicContact CE2-CH2 4.28Å; F391-W405 HydrophobicContact CE2-CZ3 4.31Å; L399-W405 HydrophobicContact CD2-CH2 4.45Å; L399-W405 HydrophobicContact CD2-CZ2 3.93Å; L399-W405 PolarHBondContact O-NE1 3.39Å; K401-W405 VanDerWaalsContact O-CD1 3.24Å; S402-W405 PolarHBondContact O-N 3.08Å; W403-W405 VanDerWaalsContact C-N 3.33Å; W405-I408 HydrophobicContact CE3-CD1 4.34Å; W405-I408 HydrophobicContact CE3-CG2 4.44Å; W405-I408 CarbonylContact O-C 3.56Å; W405-I408 WeakPolarHBondContact O-CB 3.42Å; W405-I408 PolarHBondContact O-N 2.98Å; W405-I408 VanDerWaalsContact O-N 3.1Å; W405-K409 WeakPolarHBondContact O-CG 3.43Å; W405-K409 PolarHBondContact O-N 3.08Å; W405-V419 HydrophobicContact CZ3-CB 4.3Å; W405-V419 HydrophobicContact CZ3-CG1 3.96Å; W405-K421 HydrophobicContact CH2-CB 4.2Å; W405-K421 HydrophobicContact CH2-CG 4.3Å; W405-K421 HydrophobicContact CZ2-CB 4.36Å; W405-K421 HydrophobicContact CZ2-CD 3.91Å; W405-K421 HydrophobicContact CZ2-CG 4.16Å
406	D	97.6	Very high	95.3	Very high	77 Å²	77	61 Å²	61	41%	0.412	32%	0.323	S	S	.	.	H	α-helix	trans	-55.4	-51.7	-176.8	-64.1	-24.2	0	0	0	113.8	S402 I408 K409 V410	S402-D406 PolarHBondContact O-N 3Å; D406-I408 VanDerWaalsContact C-N 3.27Å; D406-I408 PolarHBondContact O-N 2.73Å; D406-K409 PolarHBondContact O-N 3.39Å; D406-K409 IonicContact OD1-NZ 2.63Å; D406-V410 WeakPolarHBondContact O-CG2 3.49Å; D406-V410 PolarHBondContact O-N 3.42Å
407	P	97.9	Very high	95.9	Very high	35 Å²	35	61.1 Å²	61.1	23%	0.227	32%	0.322	C	S	.	.	H	α-helix	trans	-64.6	-30.1	175.9	24.6	-34.1	0	0	0	113.2	G370 A374 W403 L411	G370-P407 WeakPolarHBondContact O-CG 3.28Å; A374-P407 HydrophobicContact CB-CB 4.28Å; W403-P407 VanDerWaalsContact O-CD 3.28Å; W403-P407 WeakPolarHBondContact O-CD 3.44Å; P407-L411 WeakPolarHBondContact O-CB 3.47Å; P407-L411 PolarHBondContact O-N 2.85Å
408	I	98.1	Very high	96.4	Very high	5 Å²	5	59.1 Å²	59.1	3%	0.026	31%	0.312	C	S	.	.	H	α-helix	trans	-71.5	-39.7	178	-62.4	173.8	0	0	0	110.6	V373 A374 L377 F391 F404 W405 D406 L411 G412 V419	V373-I408 HydrophobicContact CG1-CD1 3.93Å; A374-I408 HydrophobicContact CB-CG1 4.28Å; L377-I408 HydrophobicContact CD1-CG1 4.48Å; L377-I408 HydrophobicContact CD1-CG2 4.09Å; F391-I408 HydrophobicContact CE2-CD1 4.09Å; F391-I408 HydrophobicContact CZ-CD1 4.46Å; F404-I408 HydrophobicContact CD1-CD1 4.24Å; F404-I408 HydrophobicContact CE1-CD1 3.57Å; F404-I408 HydrophobicContact CE2-CD1 4.31Å; F404-I408 HydrophobicContact CZ-CD1 3.61Å; W405-I408 HydrophobicContact CE3-CD1 4.34Å; W405-I408 HydrophobicContact CE3-CG2 4.44Å; W405-I408 CarbonylContact O-C 3.56Å; W405-I408 WeakPolarHBondContact O-CB 3.42Å; W405-I408 PolarHBondContact O-N 2.98Å; W405-I408 VanDerWaalsContact O-N 3.1Å; D406-I408 VanDerWaalsContact C-N 3.27Å; D406-I408 PolarHBondContact O-N 2.73Å; I408-L411 WeakPolarHBondContact O-CB 3.29Å; I408-L411 PolarHBondContact O-N 3.37Å; I408-G412 PolarHBondContact O-N 3.14Å; I408-V419 HydrophobicContact CG2-CB 3.87Å; I408-V419 HydrophobicContact CG2-CG1 4.29Å; I408-V419 HydrophobicContact CG2-CG2 3.56Å
409	K	97.9	Very high	96.7	Very high	119 Å²	119	59.9 Å²	59.9	52%	0.517	32%	0.316	S	S	.	.	H	α-helix	trans	-64.7	-43.3	174.3	-70.9	169.9	-175.9	169.3	0	111.6	W405 D406 L411 G412 N413	W405-K409 WeakPolarHBondContact O-CG 3.43Å; W405-K409 PolarHBondContact O-N 3.08Å; D406-K409 PolarHBondContact O-N 3.39Å; D406-K409 IonicContact OD1-NZ 2.63Å; K409-L411 VanDerWaalsContact C-N 3.3Å; K409-L411 PolarHBondContact O-N 3.11Å; K409-G412 WeakPolarHBondContact O-CA 3.44Å; K409-G412 PolarHBondContact O-N 2.83Å; K409-G412 VanDerWaalsContact O-N 3.15Å; K409-N413 PolarHBondContact O-N 3.31Å
410	V	98.1	Very high	96.9	Very high	79 Å²	79	62.4 Å²	62.4	48%	0.479	33%	0.328	S	S	.	.	H	α-helix	trans	-58.7	-45	174.6	172	0	0	0	0	110.4	D406 G412 N413 Q414	D406-V410 WeakPolarHBondContact O-CG2 3.49Å; D406-V410 PolarHBondContact O-N 3.42Å; V410-G412 VanDerWaalsContact C-N 3.35Å; V410-G412 PolarHBondContact O-N 3.44Å; V410-N413 PolarHBondContact O-N 3.11Å; V410-Q414 VanDerWaalsContact O-CG 3.3Å; V410-Q414 WeakPolarHBondContact O-CG 3.44Å; V410-Q414 PolarHBondContact O-N 3.24Å; V410-Q414 VanDerWaalsContact O-N 3.12Å
411	L	98.2	Very high	97.1	Very high	2 Å²	2	59 Å²	59	1%	0.01	32%	0.318	C	S	.	.	H	α-helix	trans	-61.4	-42.6	174.5	-176.4	69.8	0	0	0	112.3	A374 L377 R378 P407 I408 K409 N413 Q414 L415 I417	A374-L411 HydrophobicContact CB-CD2 4.08Å; A374-L411 WeakPolarHBondContact O-CD2 3.15Å; L377-L411 HydrophobicContact CB-CD2 3.75Å; L377-L411 HydrophobicContact CD1-CD2 4.48Å; R378-L411 HydrophobicContact CB-CD1 3.94Å; R378-L411 HydrophobicContact CB-CD2 4.31Å; R378-L411 HydrophobicContact CG-CD1 4.25Å; R378-L411 VanDerWaalsContact CZ-CD1 3.45Å; R378-L411 VanDerWaalsContact NH2-CD1 3.27Å; P407-L411 WeakPolarHBondContact O-CB 3.47Å; P407-L411 PolarHBondContact O-N 2.85Å; I408-L411 WeakPolarHBondContact O-CB 3.29Å; I408-L411 PolarHBondContact O-N 3.37Å; K409-L411 VanDerWaalsContact C-N 3.3Å; K409-L411 PolarHBondContact O-N 3.11Å; L411-N413 PolarHBondContact O-N 2.85Å; L411-Q414 PolarHBondContact O-N 3.03Å; L411-Q414 VanDerWaalsContact O-N 3.15Å; L411-L415 HydrophobicContact CD1-CD1 3.43Å; L411-L415 VanDerWaalsContact CD1-CD1 3.43Å; L411-L415 HydrophobicContact CD1-CG 4Å; L411-L415 HydrophobicContact CG-CD1 4.09Å; L411-L415 PolarHBondContact O-N 3.05Å; L411-I417 HydrophobicContact CD2-CD1 3.64Å; L411-I417 HydrophobicContact CG-CD1 3.84Å; L411-I417 HydrophobicContact CG-CG1 4.44Å
412	G	98	Very high	97.1	Very high	10 Å²	10	54.5 Å²	54.5	10%	0.103	30%	0.298	C	S	.	.	H	α-helix	trans	-54.3	-49.4	175.2	0	0	0	0	0	112.5	I408 K409 V410 Q414 L415 G416 I417	I408-G412 PolarHBondContact O-N 3.14Å; K409-G412 WeakPolarHBondContact O-CA 3.44Å; K409-G412 PolarHBondContact O-N 2.83Å; K409-G412 VanDerWaalsContact O-N 3.15Å; V410-G412 VanDerWaalsContact C-N 3.35Å; V410-G412 PolarHBondContact O-N 3.44Å; G412-Q414 VanDerWaalsContact C-N 3.3Å; G412-Q414 PolarHBondContact O-N 2.8Å; G412-L415 PolarHBondContact O-N 3.43Å; G412-G416 VanDerWaalsContact O-CA 3.28Å; G412-G416 WeakPolarHBondContact O-CA 3.45Å; G412-G416 PolarHBondContact O-N 2.98Å; G412-I417 WeakPolarHBondContact CA-O 3.29Å; G412-I417 PolarHBondContact O-N 3.37Å
413	N	97.8	Very high	96.9	Very high	148 Å²	148	53 Å²	53	79%	0.791	29%	0.287	S	S	*	.	H	α-helix	trans	-64.4	-33.1	177.3	-67.1	-14.9	0	0	0	112.9	K409 V410 L411	K409-N413 PolarHBondContact O-N 3.31Å; V410-N413 PolarHBondContact O-N 3.11Å; L411-N413 PolarHBondContact O-N 2.85Å
414	Q	97.8	Very high	96.5	Very high	115 Å²	115	49.3 Å²	49.3	54%	0.537	27%	0.273	S	S	.	.	H	α-helix	trans	-76.2	-39	-179.7	-73.7	175.3	-3.2	0	0	113.4	V410 L411 G412	V410-Q414 VanDerWaalsContact O-CG 3.3Å; V410-Q414 WeakPolarHBondContact O-CG 3.44Å; V410-Q414 PolarHBondContact O-N 3.24Å; V410-Q414 VanDerWaalsContact O-N 3.12Å; L411-Q414 PolarHBondContact O-N 3.03Å; L411-Q414 VanDerWaalsContact O-N 3.15Å; G412-Q414 VanDerWaalsContact C-N 3.3Å; G412-Q414 PolarHBondContact O-N 2.8Å
415	L	97.6	Very high	95.9	Very high	57 Å²	57	52.3 Å²	52.3	30%	0.298	29%	0.289	S	S	.	.	H	α-helix	trans	-112.3	-4	-169.8	-60.6	-176.1	0	0	0	113.8	R378 N381 L411 G412 I417	R378-L415 HydrophobicContact CG-CD1 4.17Å; N381-L415 HydrophobicContact CB-CD1 4.47Å; L411-L415 HydrophobicContact CD1-CD1 3.43Å; L411-L415 VanDerWaalsContact CD1-CD1 3.43Å; L411-L415 HydrophobicContact CD1-CG 4Å; L411-L415 HydrophobicContact CG-CD1 4.09Å; L411-L415 PolarHBondContact O-N 3.05Å; G412-L415 PolarHBondContact O-N 3.43Å; L415-I417 VanDerWaalsContact C-N 3.32Å; L415-I417 HydrophobicContact CB-CG2 3.94Å
416	G	96.9	Very high	94.9	Very high	55 Å²	55	54.9 Å²	54.9	57%	0.567	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	66	35.2	-174.1	0	0	0	0	0	112.6	G412	G412-G416 VanDerWaalsContact O-CA 3.28Å; G412-G416 WeakPolarHBondContact O-CA 3.45Å; G412-G416 PolarHBondContact O-N 2.98Å
417	I	97.4	Very high	93.8	Very high	13 Å²	13	56.1 Å²	56.1	7%	0.067	33%	0.327	C	S	.	.			trans	-99.6	147.7	176.1	72.2	166.2	0	0	0	111	L377 N381 R387 F389 L411 G412 L415 V419	L377-I417 HydrophobicContact CB-CD1 4.21Å; L377-I417 HydrophobicContact CD1-CD1 4.47Å; N381-I417 HydrophobicContact CB-CG2 4.44Å; R387-I417 HydrophobicContact CB-CG2 4.49Å; R387-I417 CarbonylContact O-C 3.52Å; R387-I417 VanDerWaalsContact O-CA 3.26Å; R387-I417 WeakPolarHBondContact O-CA 3.48Å; R387-I417 WeakPolarHBondContact O-CB 3.4Å; F389-I417 HydrophobicContact CD2-CB 4.35Å; F389-I417 HydrophobicContact CD2-CD1 4.34Å; F389-I417 HydrophobicContact CE2-CB 4.1Å; F389-I417 HydrophobicContact CE2-CD1 4.13Å; F389-I417 HydrophobicContact CE2-CG2 4.15Å; L411-I417 HydrophobicContact CD2-CD1 3.64Å; L411-I417 HydrophobicContact CG-CD1 3.84Å; L411-I417 HydrophobicContact CG-CG1 4.44Å; G412-I417 WeakPolarHBondContact CA-O 3.29Å; G412-I417 PolarHBondContact O-N 3.37Å; L415-I417 VanDerWaalsContact C-N 3.32Å; L415-I417 HydrophobicContact CB-CG2 3.94Å; I417-V419 HydrophobicContact CD1-CG2 4.35Å
418	S	97.2	Very high	92.7	Very high	48 Å²	48	54.8 Å²	54.8	34%	0.336	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	141.4	172.6	66	0	0	0	0	110	R387 F389	R387-S418 PolarHBondContact O-N 3.31Å; F389-S418 PolarHBondContact N-O 2.88Å
419	V	97.7	Very high	91.9	Very high	30 Å²	30	57.4 Å²	57.4	18%	0.182	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	119.1	-178.5	-170.8	0	0	0	0	109.2	L377 F389 F391 W405 I408 I417	L377-V419 HydrophobicContact CD1-CG2 3.81Å; F389-V419 HydrophobicContact CB-CG1 4.29Å; F389-V419 HydrophobicContact CB-CG2 4.22Å; F389-V419 HydrophobicContact CD2-CG2 4.45Å; F389-V419 WeakPolarHBondContact O-CA 3.3Å; F391-V419 HydrophobicContact CD2-CG1 3.8Å; F391-V419 HydrophobicContact CE2-CG1 3.36Å; F391-V419 HydrophobicContact CZ-CG1 3.78Å; W405-V419 HydrophobicContact CZ3-CB 4.3Å; W405-V419 HydrophobicContact CZ3-CG1 3.96Å; I408-V419 HydrophobicContact CG2-CB 3.87Å; I408-V419 HydrophobicContact CG2-CG1 4.29Å; I408-V419 HydrophobicContact CG2-CG2 3.56Å; I417-V419 HydrophobicContact CD1-CG2 4.35Å
420	Q	95.9	Very high	91.3	Very high	53 Å²	53	52.6 Å²	52.6	25%	0.248	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	172.9	176.7	-61.3	-178.4	56.3	0	0	110.3	F341 F389 C390 F391	F341-Q420 HydrophobicContact CZ-CB 4.47Å; F389-Q420 PolarHBondContact O-N 3.39Å; C390-Q420 WeakPolarHBondContact CA-O 3.3Å; F391-Q420 PolarHBondContact N-O 3.26Å
421	K	95.4	Very high	90.9	Very high	86 Å²	86	50.2 Å²	50.2	37%	0.374	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	146.3	170.3	57.5	165.4	171.6	-174.6	0	111.1	F391 L399 W405	F391-K421 HydrophobicContact CB-CB 4.39Å; F391-K421 CarbonylContact O-C 3.6Å; F391-K421 VanDerWaalsContact O-CA 3.3Å; F391-K421 WeakPolarHBondContact O-CA 3.47Å; L399-K421 HydrophobicContact CB-CD 4.21Å; L399-K421 PolarHBondContact O-NZ 3.04Å; W405-K421 HydrophobicContact CH2-CB 4.2Å; W405-K421 HydrophobicContact CH2-CG 4.3Å; W405-K421 HydrophobicContact CZ2-CB 4.36Å; W405-K421 HydrophobicContact CZ2-CD 3.91Å; W405-K421 HydrophobicContact CZ2-CG 4.16Å
422	F	94.4	Very high	90.5	Very high	9 Å²	9	50.1 Å²	50.1	4%	0.039	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	120.2	167.1	-178.5	-94.5	0	0	0	108	T337 L338 F341 F391 V392 S393 T424 F433 M437	T337-F422 HydrophobicContact CG2-CE2 4.08Å; L338-F422 HydrophobicContact CB-CE2 4.29Å; L338-F422 HydrophobicContact CB-CZ 3.98Å; L338-F422 HydrophobicContact CD1-CE1 4.48Å; L338-F422 HydrophobicContact CD1-CE2 4.32Å; L338-F422 HydrophobicContact CD1-CZ 4.06Å; F341-F422 HydrophobicContact CB-CD2 3.99Å; F341-F422 HydrophobicContact CB-CE2 4.15Å; F341-F422 HydrophobicContact CD1-CD2 4.37Å; F341-F422 HydrophobicContact CD2-CD2 4.15Å; F341-F422 AromaticContact CG-CD2 3.88Å; F341-F422 HydrophobicContact CG-CD2 3.88Å; F391-F422 PolarHBondContact O-N 3.14Å; V392-F422 WeakPolarHBondContact CA-O 3.45Å; V392-F422 HydrophobicContact CG2-CB 4.36Å; S393-F422 PolarHBondContact N-O 2.87Å; F422-T424 HydrophobicContact CD1-CG2 4.31Å; F422-T424 HydrophobicContact CE1-CG2 3.73Å; F422-F433 HydrophobicContact CD1-CB 4.28Å; F422-F433 HydrophobicContact CE1-CB 3.76Å; F422-F433 AromaticContact CE1-CD1 3.7Å; F422-F433 HydrophobicContact CE1-CD1 3.7Å; F422-F433 HydrophobicContact CE1-CE1 4.47Å; F422-F433 AromaticContact CE1-CG 3.78Å; F422-F433 HydrophobicContact CE1-CG 3.78Å; F422-F433 AromaticContact CZ-CD1 3.91Å; F422-F433 HydrophobicContact CZ-CD1 3.91Å; F422-F433 HydrophobicContact CZ-CE1 4.42Å; F422-F433 HydrophobicContact CZ-CG 4.45Å; F422-M437 HydrophobicContact CB-CE 4.09Å; F422-M437 HydrophobicContact CB-SD 4.13Å; F422-M437 HydrophobicContact CD1-SD 3.93Å; F422-M437 HydrophobicContact CD2-SD 4.39Å; F422-M437 HydrophobicContact CE1-SD 4.47Å; F422-M437 HydrophobicContact CG-CE 4.42Å; F422-M437 HydrophobicContact CG-SD 3.88Å
423	C	91.7	Very high	90.2	Very high	53 Å²	53	49.6 Å²	49.6	36%	0.358	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	133.2	-178.6	-63.4	0	0	0	0	111.1	S393	S393-C423 CarbonylContact O-C 3.53Å; S393-C423 WeakPolarHBondContact O-CA 3.46Å
424	T	87.1	Confident	90.1	Very high	4 Å²	4	42.6 Å²	42.6	3%	0.025	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	166.9	173.3	60	0	0	0	0	111.1	S393 E395 F422 D430 F433	S393-T424 PolarHBondContact O-N 3.42Å; E395-T424 PolarHBondContact N-O 2.9Å; F422-T424 HydrophobicContact CD1-CG2 4.31Å; F422-T424 HydrophobicContact CE1-CG2 3.73Å; T424-D430 HydrophobicContact CG2-CB 4.35Å; T424-F433 HydrophobicContact CG2-CB 4.46Å; T424-F433 HydrophobicContact CG2-CD1 4.5Å; T424-F433 HydrophobicContact CG2-CD2 3.4Å; T424-F433 VanDerWaalsContact CG2-CD2 3.4Å; T424-F433 HydrophobicContact CG2-CE2 3.6Å; T424-F433 HydrophobicContact CG2-CG 3.88Å; T424-F433 HydrophobicContact CG2-CZ 4.25Å
425	N	83.7	Confident	89.9	Confident	64 Å²	64	37.1 Å²	37.1	34%	0.342	23%	0.227	S	C	.	.			trans	-67.1	155.6	173	-63	-34.9	0	0	0	110.8	E334 S427 S428	E334-N425 VanDerWaalsContact OE1-CB 3.31Å; E334-N425 WeakPolarHBondContact OE1-CB 3.48Å; E334-N425 PolarHBondContact OE1-N 2.77Å; E334-N425 PolarHBondContact OE1-ND2 2.91Å; N425-S427 PolarHBondContact O-N 3.42Å; N425-S427 VanDerWaalsContact O-N 3.15Å; N425-S428 PolarHBondContact O-N 3.24Å; N425-S428 VanDerWaalsContact O-N 3.1Å
426	S	76.9	Confident	89.8	Confident	91 Å²	91	35.2 Å²	35.2	64%	0.636	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-27.5	-177	56	0	0	0	0	114.4
427	S	73.5	Confident	89.7	Confident	102 Å²	102	32.8 Å²	32.8	71%	0.713	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-15.1	179.3	53.4	0	0	0	0	114.2	N425	N425-S427 PolarHBondContact O-N 3.42Å; N425-S427 VanDerWaalsContact O-N 3.15Å
428	S	75.7	Confident	89.6	Confident	8 Å²	8	32.1 Å²	32.1	6%	0.056	19%	0.187	C	C	.	.	S	Bend	trans	-90.3	163.5	-169.7	-60	0	0	0	0	112.6	E334 K394 N425	E334-S428 WeakPolarHBondContact OE1-CB 3.43Å; E334-S428 PolarHBondContact OE1-OG 3.49Å; E334-S428 WeakPolarHBondContact OE2-CB 3.47Å; E334-S428 PolarHBondContact OE2-OG 2.89Å; K394-S428 WeakPolarHBondContact CE-O 3.21Å; K394-S428 PolarHBondContact NZ-O 3.49Å; N425-S428 PolarHBondContact O-N 3.24Å; N425-S428 VanDerWaalsContact O-N 3.1Å
429	E	81.3	Confident	89.5	Confident	60 Å²	60	30 Å²	30	28%	0.28	17%	0.171	S	C	.	.			trans	-92	99.1	178	-64.3	-172.5	171.5	0	0	110.1	D431 V432 F433 K455 Y456	E429-D431 VanDerWaalsContact C-N 3.27Å; E429-D431 PolarHBondContact O-N 2.76Å; E429-V432 HydrophobicContact CB-CG2 4.13Å; E429-V432 PolarHBondContact O-N 3.28Å; E429-F433 VanDerWaalsContact O-CD2 3.23Å; E429-F433 WeakPolarHBondContact O-CD2 3.29Å; E429-F433 WeakPolarHBondContact O-CE2 3.05Å; E429-K455 IonicContact OE1-NZ 3.16Å; E429-K455 PolarHBondContact OE1-NZ 3.48Å; E429-K455 IonicContact OE2-NZ 3.1Å; E429-K455 PolarHBondContact OE2-NZ 3.01Å; E429-Y456 VanDerWaalsContact CD-OH 3.29Å; E429-Y456 WeakPolarHBondContact OE2-CE1 3.34Å; E429-Y456 PolarHBondContact OE2-OH 3.45Å
430	D	85	Confident	89.3	Confident	17 Å²	17	32.2 Å²	32.2	9%	0.091	18%	0.179	C	C	.	.	H	α-helix	trans	-62.4	-30.1	179.8	46.5	-24.7	0	0	0	113.8	V392 K394 T424 V432 F433 L434	V392-D430 HydrophobicContact CG1-CB 4.12Å; K394-D430 WeakPolarHBondContact CE-OD1 3.42Å; K394-D430 HydrophobicContact CG-CB 4.12Å; K394-D430 WeakPolarHBondContact CG-OD2 3.23Å; K394-D430 PolarHBondContact N-OD2 3.36Å; T424-D430 HydrophobicContact CG2-CB 4.35Å; D430-V432 VanDerWaalsContact C-N 3.25Å; D430-V432 PolarHBondContact O-N 3.36Å; D430-F433 PolarHBondContact O-N 2.81Å; D430-L434 PolarHBondContact O-N 3.02Å
431	D	90.1	Very high	89.3	Confident	29 Å²	29	30.6 Å²	30.6	16%	0.155	17%	0.173	C	C	.	.	H	α-helix	trans	-54.6	-37.4	175.8	-75.5	-20.7	0	0	0	113.8	E429 L434 L435 F453 Y456	E429-D431 VanDerWaalsContact C-N 3.27Å; E429-D431 PolarHBondContact O-N 2.76Å; D431-L434 PolarHBondContact O-N 2.75Å; D431-L435 WeakPolarHBondContact O-CG 3.38Å; D431-L435 PolarHBondContact O-N 3.45Å; D431-F453 HydrophobicContact CB-CD1 4.03Å; D431-F453 HydrophobicContact CB-CE1 3.8Å; D431-Y456 HydrophobicContact CB-CD2 4.35Å; D431-Y456 HydrophobicContact CB-CE2 3.44Å; D431-Y456 VanDerWaalsContact CB-CE2 3.44Å
432	V	90.2	Very high	89.2	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-66	-43.3	-178.9	178.1	0	0	0	0	110.5	F313 V317 I318 T329 E429 D430 Y436 Y456	F313-V432 HydrophobicContact CE1-CG1 3.96Å; F313-V432 HydrophobicContact CZ-CG1 4.4Å; V317-V432 HydrophobicContact CG1-CG1 4.09Å; V317-V432 HydrophobicContact CG1-CG2 4.27Å; I318-V432 HydrophobicContact CD1-CG1 4.24Å; I318-V432 HydrophobicContact CG1-CG1 3.41Å; I318-V432 VanDerWaalsContact CG1-CG1 3.41Å; T329-V432 HydrophobicContact CG2-CG2 4.34Å; E429-V432 HydrophobicContact CB-CG2 4.13Å; E429-V432 PolarHBondContact O-N 3.28Å; D430-V432 VanDerWaalsContact C-N 3.25Å; D430-V432 PolarHBondContact O-N 3.36Å; V432-Y436 WeakPolarHBondContact O-CB 3.45Å; V432-Y436 PolarHBondContact O-N 2.84Å; V432-Y436 VanDerWaalsContact O-N 3.09Å; V432-Y456 HydrophobicContact CG2-CD1 3.8Å; V432-Y456 HydrophobicContact CG2-CE1 3.16Å; V432-Y456 HydrophobicContact CG2-CE2 4.34Å; V432-Y456 VanDerWaalsContact CG2-CZ 3.47Å
433	F	91.6	Very high	89.1	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-68.5	-42	178.6	-59.8	-89.3	0	0	0	110.8	A330 E334 L338 F422 T424 E429 D430 L435 Y436 M437	A330-F433 HydrophobicContact CB-CE1 4.06Å; A330-F433 HydrophobicContact CB-CE2 4.14Å; A330-F433 HydrophobicContact CB-CZ 3.41Å; A330-F433 VanDerWaalsContact CB-CZ 3.41Å; E334-F433 HydrophobicContact CB-CE1 3.94Å; E334-F433 HydrophobicContact CB-CZ 3.7Å; E334-F433 HydrophobicContact CG-CZ 4.43Å; L338-F433 HydrophobicContact CB-CD1 4.15Å; L338-F433 HydrophobicContact CB-CE1 4.33Å; L338-F433 HydrophobicContact CD1-CD1 4.05Å; L338-F433 HydrophobicContact CD2-CD1 3.7Å; L338-F433 HydrophobicContact CD2-CE1 4.12Å; L338-F433 HydrophobicContact CG-CD1 4.17Å; F422-F433 HydrophobicContact CD1-CB 4.28Å; F422-F433 HydrophobicContact CE1-CB 3.76Å; F422-F433 AromaticContact CE1-CD1 3.7Å; F422-F433 HydrophobicContact CE1-CD1 3.7Å; F422-F433 HydrophobicContact CE1-CE1 4.47Å; F422-F433 AromaticContact CE1-CG 3.78Å; F422-F433 HydrophobicContact CE1-CG 3.78Å; F422-F433 AromaticContact CZ-CD1 3.91Å; F422-F433 HydrophobicContact CZ-CD1 3.91Å; F422-F433 HydrophobicContact CZ-CE1 4.42Å; F422-F433 HydrophobicContact CZ-CG 4.45Å; T424-F433 HydrophobicContact CG2-CB 4.46Å; T424-F433 HydrophobicContact CG2-CD1 4.5Å; T424-F433 HydrophobicContact CG2-CD2 3.4Å; T424-F433 VanDerWaalsContact CG2-CD2 3.4Å; T424-F433 HydrophobicContact CG2-CE2 3.6Å; T424-F433 HydrophobicContact CG2-CG 3.88Å; T424-F433 HydrophobicContact CG2-CZ 4.25Å; E429-F433 VanDerWaalsContact O-CD2 3.23Å; E429-F433 WeakPolarHBondContact O-CD2 3.29Å; E429-F433 WeakPolarHBondContact O-CE2 3.05Å; D430-F433 PolarHBondContact O-N 2.81Å; F433-L435 PolarHBondContact O-N 3.47Å; F433-Y436 PolarHBondContact O-N 3.16Å; F433-M437 VanDerWaalsContact O-CB 3.32Å; F433-M437 WeakPolarHBondContact O-CB 3.44Å; F433-M437 WeakPolarHBondContact O-CG 3.42Å; F433-M437 PolarHBondContact O-N 3.06Å
434	L	94.8	Very high	89.1	Confident	1 Å²	1	31.3 Å²	31.3	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-55.5	-52.7	175.8	179.3	156.4	0	0	0	111.3	I352 D354 V392 D430 D431 A438 I447 F453	I352-L434 HydrophobicContact CG2-CD1 4.42Å; I352-L434 HydrophobicContact CG2-CG 3.89Å; D354-L434 HydrophobicContact CB-CD1 3.67Å; V392-L434 HydrophobicContact CB-CB 4.24Å; V392-L434 HydrophobicContact CB-CD1 4.42Å; V392-L434 HydrophobicContact CG1-CB 4.03Å; V392-L434 HydrophobicContact CG2-CB 4.34Å; D430-L434 PolarHBondContact O-N 3.02Å; D431-L434 PolarHBondContact O-N 2.75Å; L434-A438 VanDerWaalsContact O-CB 3.31Å; L434-A438 WeakPolarHBondContact O-CB 3.43Å; L434-A438 PolarHBondContact O-N 3.47Å; L434-I447 HydrophobicContact CD2-CD1 3.89Å; L434-I447 HydrophobicContact CD2-CG1 4.03Å; L434-I447 HydrophobicContact CD2-CG2 3.74Å; L434-F453 HydrophobicContact CD2-CE1 4.27Å; L434-F453 HydrophobicContact CD2-CZ 3.94Å
435	L	94.3	Very high	89.6	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.9	-46.7	-179.4	-75.7	178.8	0	0	0	111.8	F313 D431 F433 A438 M439 I447 F453 Y456 W471	F313-L435 HydrophobicContact CE1-CB 4.21Å; F313-L435 HydrophobicContact CE2-CB 4.45Å; F313-L435 HydrophobicContact CE2-CD1 4.09Å; F313-L435 HydrophobicContact CZ-CB 3.86Å; F313-L435 HydrophobicContact CZ-CD1 3.89Å; D431-L435 WeakPolarHBondContact O-CG 3.38Å; D431-L435 PolarHBondContact O-N 3.45Å; F433-L435 PolarHBondContact O-N 3.47Å; L435-A438 PolarHBondContact O-N 3.39Å; L435-M439 HydrophobicContact CB-CE 4.38Å; L435-M439 WeakPolarHBondContact O-CG 3.35Å; L435-M439 PolarHBondContact O-N 2.85Å; L435-I447 HydrophobicContact CD2-CD1 3.92Å; L435-F453 HydrophobicContact CD1-CB 3.95Å; L435-F453 HydrophobicContact CD1-CD1 3.55Å; L435-F453 HydrophobicContact CD1-CE1 4.25Å; L435-F453 HydrophobicContact CD1-CG 3.87Å; L435-F453 HydrophobicContact CD2-CD1 4.08Å; L435-F453 HydrophobicContact CD2-CD2 4.31Å; L435-F453 HydrophobicContact CD2-CE1 4.2Å; L435-F453 HydrophobicContact CD2-CE2 4.38Å; L435-F453 HydrophobicContact CD2-CG 4.11Å; L435-F453 HydrophobicContact CD2-CZ 4.33Å; L435-F453 HydrophobicContact CG-CD1 3.78Å; L435-F453 HydrophobicContact CG-CE1 3.96Å; L435-F453 HydrophobicContact CG-CG 4.24Å; L435-Y456 HydrophobicContact CD1-CD2 3.98Å; L435-Y456 HydrophobicContact CD1-CG 4.25Å; L435-W471 HydrophobicContact CD2-CZ3 4.23Å
436	Y	94.3	Very high	90.2	Very high	17 Å²	17	29.7 Å²	29.7	7%	0.067	17%	0.168	C	C	.	.	H	α-helix	trans	-64.6	-44.2	-178.7	179.5	-106.9	0	0	0	112.9	A310 F313 Y314 I318 L338 I342 V432 F433 A438 M439 K440	A310-Y436 HydrophobicContact CB-CE2 4.2Å; A310-Y436 VanDerWaalsContact O-CE2 3.3Å; A310-Y436 WeakPolarHBondContact O-CE2 3.21Å; F313-Y436 HydrophobicContact CD1-CD2 4.18Å; Y314-Y436 HydrophobicContact CD2-CE1 4.42Å; Y314-Y436 HydrophobicContact CD2-CE2 4.08Å; Y314-Y436 AromaticContact CD2-CZ 3.85Å; Y314-Y436 HydrophobicContact CG-CE2 4.31Å; I318-Y436 HydrophobicContact CD1-CD1 3.86Å; I318-Y436 HydrophobicContact CD1-CD2 3.75Å; I318-Y436 HydrophobicContact CD1-CE1 4.4Å; I318-Y436 HydrophobicContact CD1-CE2 4.35Å; I318-Y436 HydrophobicContact CD1-CG 3.45Å; I318-Y436 VanDerWaalsContact CD1-CG 3.45Å; L338-Y436 HydrophobicContact CD1-CD1 4.28Å; L338-Y436 HydrophobicContact CD2-CD1 3.61Å; L338-Y436 HydrophobicContact CD2-CE1 3.89Å; L338-Y436 HydrophobicContact CG-CD1 4.17Å; L338-Y436 HydrophobicContact CG-CE1 4.31Å; I342-Y436 HydrophobicContact CD1-CD1 3.78Å; I342-Y436 HydrophobicContact CD1-CE1 3.37Å; V432-Y436 WeakPolarHBondContact O-CB 3.45Å; V432-Y436 PolarHBondContact O-N 2.84Å; V432-Y436 VanDerWaalsContact O-N 3.09Å; F433-Y436 PolarHBondContact O-N 3.16Å; Y436-A438 VanDerWaalsContact C-N 3.27Å; Y436-A438 PolarHBondContact O-N 3.35Å; Y436-M439 PolarHBondContact O-N 3.13Å; Y436-K440 HydrophobicContact CD1-CG 4.46Å; Y436-K440 HydrophobicContact CE1-CG 4.03Å; Y436-K440 HydrophobicContact CE2-CG 4.1Å; Y436-K440 PolarHBondContact O-N 3.22Å; Y436-K440 WeakPolarHBondContact OH-CE 2.95Å
437	M	95.2	Very high	91.2	Very high	3 Å²	3	25.4 Å²	25.4	2%	0.015	14%	0.138	C	C	.	.	H	α-helix	trans	-61.9	-38.6	176.4	-71.3	173	54.2	0	0	111.4	L338 F341 L349 I352 C390 V392 F422 F433 K440 S441	L338-M437 HydrophobicContact CD1-CG 3.52Å; L338-M437 HydrophobicContact CD1-SD 3.88Å; F341-M437 HydrophobicContact CD1-CE 3.72Å; F341-M437 HydrophobicContact CD1-SD 4.41Å; F341-M437 HydrophobicContact CE1-CE 3.25Å; F341-M437 HydrophobicContact CE1-SD 4.48Å; F341-M437 HydrophobicContact CZ-CE 3.97Å; L349-M437 HydrophobicContact CD1-CE 4.08Å; I352-M437 HydrophobicContact CD1-CB 3.34Å; I352-M437 HydrophobicContact CD1-CE 4.22Å; C390-M437 HydrophobicContact CB-CE 4.48Å; V392-M437 HydrophobicContact CG2-CE 4.22Å; V392-M437 HydrophobicContact CG2-SD 4.11Å; F422-M437 HydrophobicContact CB-CE 4.09Å; F422-M437 HydrophobicContact CB-SD 4.13Å; F422-M437 HydrophobicContact CD1-SD 3.93Å; F422-M437 HydrophobicContact CD2-SD 4.39Å; F422-M437 HydrophobicContact CE1-SD 4.47Å; F422-M437 HydrophobicContact CG-CE 4.42Å; F422-M437 HydrophobicContact CG-SD 3.88Å; F433-M437 VanDerWaalsContact O-CB 3.32Å; F433-M437 WeakPolarHBondContact O-CB 3.44Å; F433-M437 WeakPolarHBondContact O-CG 3.42Å; F433-M437 PolarHBondContact O-N 3.06Å; M437-K440 PolarHBondContact O-N 2.9Å; M437-S441 WeakPolarHBondContact O-CB 3.41Å; M437-S441 PolarHBondContact O-N 3.07Å; M437-S441 PolarHBondContact O-OG 2.79Å
438	A	95.8	Very high	92.3	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-69.6	-37.4	178.8	0	0	0	0	0	110.7	I352 L434 L435 Y436 S441 G442 I447 W471	I352-A438 HydrophobicContact CD1-CB 3.78Å; I352-A438 HydrophobicContact CG1-CB 4.26Å; L434-A438 VanDerWaalsContact O-CB 3.31Å; L434-A438 WeakPolarHBondContact O-CB 3.43Å; L434-A438 PolarHBondContact O-N 3.47Å; L435-A438 PolarHBondContact O-N 3.39Å; Y436-A438 VanDerWaalsContact C-N 3.27Å; Y436-A438 PolarHBondContact O-N 3.35Å; A438-S441 PolarHBondContact O-N 3.28Å; A438-G442 PolarHBondContact O-N 2.94Å; A438-I447 HydrophobicContact CB-CD1 3.83Å; A438-I447 HydrophobicContact CB-CG1 3.78Å; A438-W471 HydrophobicContact CB-CH2 3.46Å; A438-W471 VanDerWaalsContact CB-CH2 3.46Å; A438-W471 HydrophobicContact CB-CZ2 3.84Å
439	M	94.6	Very high	93.2	Very high	2 Å²	2	20.2 Å²	20.2	1%	0.01	10%	0.102	C	C	.	.	H	α-helix	trans	-64.4	-43.8	171.5	-67	178.8	-159.1	0	0	112.9	F306 M309 A310 F313 L435 Y436 S441 G442 I468 W471	F306-M439 HydrophobicContact CD1-CB 4.01Å; F306-M439 HydrophobicContact CD1-CG 4.26Å; F306-M439 WeakPolarHBondContact CD1-O 3.22Å; F306-M439 HydrophobicContact CE1-CB 4.24Å; F306-M439 HydrophobicContact CE1-CG 4.09Å; M309-M439 HydrophobicContact CB-SD 4.31Å; A310-M439 HydrophobicContact CB-CB 3.85Å; F313-M439 HydrophobicContact CB-CE 4.26Å; F313-M439 HydrophobicContact CB-SD 3.83Å; F313-M439 HydrophobicContact CD2-CE 3.66Å; F313-M439 HydrophobicContact CD2-SD 4.34Å; F313-M439 HydrophobicContact CE2-CE 4.1Å; F313-M439 HydrophobicContact CG-CE 3.91Å; F313-M439 HydrophobicContact CG-SD 4.02Å; L435-M439 HydrophobicContact CB-CE 4.38Å; L435-M439 WeakPolarHBondContact O-CG 3.35Å; L435-M439 PolarHBondContact O-N 2.85Å; Y436-M439 PolarHBondContact O-N 3.13Å; M439-S441 PolarHBondContact O-N 3Å; M439-G442 WeakPolarHBondContact O-CA 3.2Å; M439-G442 PolarHBondContact O-N 2.85Å; M439-I468 HydrophobicContact CE-CD1 3.64Å; M439-I468 HydrophobicContact CE-CG1 3.65Å; M439-W471 HydrophobicContact CG-CH2 4.39Å; M439-W471 HydrophobicContact CG-CZ3 4.33Å
440	K	94.4	Very high	93.7	Very high	78 Å²	78	18.7 Å²	18.7	34%	0.339	10%	0.096	S	C	.	.	H	α-helix	trans	-66.1	-23.8	176	-75.4	-66.2	-177	-168.8	0	113	A310 D311 I342 Y436 M437 G442	A310-K440 HydrophobicContact CB-CD 3.85Å; A310-K440 HydrophobicContact CB-CG 4.12Å; D311-K440 IonicContact OD1-NZ 2.86Å; D311-K440 PolarHBondContact OD1-NZ 3.41Å; I342-K440 HydrophobicContact CD1-CG 4.34Å; Y436-K440 HydrophobicContact CD1-CG 4.46Å; Y436-K440 HydrophobicContact CE1-CG 4.03Å; Y436-K440 HydrophobicContact CE2-CG 4.1Å; Y436-K440 PolarHBondContact O-N 3.22Å; Y436-K440 WeakPolarHBondContact OH-CE 2.95Å; M437-K440 PolarHBondContact O-N 2.9Å; K440-G442 PolarHBondContact O-N 3.21Å
441	S	95	Very high	94	Very high	18 Å²	18	20.2 Å²	20.2	13%	0.126	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-5.5	171.6	-55.9	0	0	0	0	113.3	P348 L349 M437 A438 M439	P348-S441 WeakPolarHBondContact CB-O 3.2Å; L349-S441 PolarHBondContact N-OG 3.08Å; L349-S441 WeakPolarHBondContact O-CB 3.45Å; M437-S441 WeakPolarHBondContact O-CB 3.41Å; M437-S441 PolarHBondContact O-N 3.07Å; M437-S441 PolarHBondContact O-OG 2.79Å; A438-S441 PolarHBondContact O-N 3.28Å; M439-S441 PolarHBondContact O-N 3Å
442	G	93.4	Very high	93.8	Very high	13 Å²	13	20.8 Å²	20.8	13%	0.134	11%	0.106	C	C	.	.			trans	83.8	-178.9	172.7	0	0	0	0	0	114.8	A438 M439 K440 Q444 C445	A438-G442 PolarHBondContact O-N 2.94Å; M439-G442 WeakPolarHBondContact O-CA 3.2Å; M439-G442 PolarHBondContact O-N 2.85Å; K440-G442 PolarHBondContact O-N 3.21Å; G442-Q444 VanDerWaalsContact C-N 3.25Å; G442-Q444 PolarHBondContact O-N 2.94Å; G442-Q444 VanDerWaalsContact O-N 3.14Å; G442-C445 WeakPolarHBondContact O-CB 3.34Å; G442-C445 PolarHBondContact O-N 3.28Å; G442-C445 VanDerWaalsContact O-N 3.13Å
443	P	92.7	Very high	93.7	Very high	38 Å²	38	21.2 Å²	21.2	25%	0.247	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-24.6	-166.6	22.1	-32.8	0	0	0	114.7	M301 F306 C445 R475	M301-P443 HydrophobicContact CB-CB 4.2Å; M301-P443 HydrophobicContact CE-CB 3.82Å; M301-P443 WeakPolarHBondContact CE-O 3.35Å; F306-P443 HydrophobicContact CD2-CB 3.57Å; F306-P443 HydrophobicContact CD2-CG 4.14Å; F306-P443 VanDerWaalsContact CE2-CA 3.41Å; F306-P443 HydrophobicContact CE2-CB 3.52Å; F306-P443 HydrophobicContact CG-CB 4.49Å; F306-P443 HydrophobicContact CZ-CB 4.39Å; P443-C445 VanDerWaalsContact C-N 3.29Å; P443-R475 PolarHBondContact O-NE 3.02Å
444	Q	92.6	Very high	93.4	Very high	113 Å²	113	27.4 Å²	27.4	53%	0.528	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-10	-178.9	-58.1	-58.4	-9.2	0	0	113.5	G442 Y446	G442-Q444 VanDerWaalsContact C-N 3.25Å; G442-Q444 PolarHBondContact O-N 2.94Å; G442-Q444 VanDerWaalsContact O-N 3.14Å; Q444-Y446 VanDerWaalsContact O-CD2 3.3Å; Q444-Y446 WeakPolarHBondContact O-CD2 3.22Å; Q444-Y446 PolarHBondContact O-N 2.95Å
445	C	95.8	Very high	92.9	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.007	16%	0.155	C	C	.	.			trans	-67.4	131.9	179.9	-174.9	0	0	0	0	111.4	D350 G442 P443 W471 R475	D350-C445 WeakPolarHBondContact O-CA 3.3Å; G442-C445 WeakPolarHBondContact O-CB 3.34Å; G442-C445 PolarHBondContact O-N 3.28Å; G442-C445 VanDerWaalsContact O-N 3.13Å; P443-C445 VanDerWaalsContact C-N 3.29Å; C445-W471 PolarHBondContact O-NE1 2.73Å; C445-R475 WeakPolarHBondContact O-CB 3.41Å
446	Y	97.2	Very high	92.6	Very high	33 Å²	33	32.8 Å²	32.8	13%	0.129	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	150.8	173.2	-76.5	-103.5	0	0	0	111.4	D350 C351 I352 F384 L386 Q444 R475 I477 P489	D350-Y446 PolarHBondContact O-N 3.21Å; C351-Y446 CarbonylContact C-O 3.59Å; C351-Y446 VanDerWaalsContact CA-O 3.28Å; C351-Y446 WeakPolarHBondContact CA-O 3.32Å; I352-Y446 PolarHBondContact N-O 2.98Å; F384-Y446 AromaticContact CD1-CE1 3.8Å; F384-Y446 HydrophobicContact CD1-CE1 3.8Å; F384-Y446 AromaticContact CD1-CZ 3.82Å; F384-Y446 AromaticContact CE1-CE1 3.82Å; F384-Y446 HydrophobicContact CE1-CE1 3.82Å; F384-Y446 HydrophobicContact CG-CE1 4.41Å; F384-Y446 HydrophobicContact CZ-CE1 4.45Å; L386-Y446 HydrophobicContact CD1-CD2 3.61Å; L386-Y446 HydrophobicContact CD1-CE2 4.29Å; L386-Y446 HydrophobicContact CD1-CG 3.8Å; L386-Y446 HydrophobicContact CD2-CD2 3.86Å; L386-Y446 HydrophobicContact CD2-CE2 3.99Å; L386-Y446 HydrophobicContact CG-CD2 4.39Å; Q444-Y446 VanDerWaalsContact O-CD2 3.3Å; Q444-Y446 WeakPolarHBondContact O-CD2 3.22Å; Q444-Y446 PolarHBondContact O-N 2.95Å; Y446-R475 WeakPolarHBondContact CA-O 3.36Å; Y446-R475 VanDerWaalsContact CD1-O 3.24Å; Y446-R475 WeakPolarHBondContact CD1-O 3.26Å; Y446-I477 HydrophobicContact CD1-CD1 3.81Å; Y446-I477 HydrophobicContact CD1-CG1 3.98Å; Y446-I477 HydrophobicContact CG-CD1 4.38Å; Y446-P489 HydrophobicContact CD1-CG 4.26Å; Y446-P489 HydrophobicContact CE1-CG 3.75Å
447	I	97	Very high	92.2	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.005	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	135	170.5	-70	168.9	0	0	0	108.9	I352 L434 L435 A438 W471 R475 Q476 I477	I352-I447 CarbonylContact O-C 3.53Å; I352-I447 VanDerWaalsContact O-CA 3.32Å; I352-I447 WeakPolarHBondContact O-CA 3.49Å; L434-I447 HydrophobicContact CD2-CD1 3.89Å; L434-I447 HydrophobicContact CD2-CG1 4.03Å; L434-I447 HydrophobicContact CD2-CG2 3.74Å; L435-I447 HydrophobicContact CD2-CD1 3.92Å; A438-I447 HydrophobicContact CB-CD1 3.83Å; A438-I447 HydrophobicContact CB-CG1 3.78Å; I447-W471 HydrophobicContact CD1-CE3 4.5Å; I447-W471 HydrophobicContact CD1-CH2 3.23Å; I447-W471 HydrophobicContact CD1-CZ2 3.86Å; I447-W471 HydrophobicContact CD1-CZ3 3.58Å; I447-W471 HydrophobicContact CG1-CH2 4.1Å; I447-W471 HydrophobicContact CG1-CZ2 4.32Å; I447-R475 PolarHBondContact N-O 3.48Å; I447-Q476 HydrophobicContact CG2-CG 4.47Å; I447-Q476 CarbonylContact O-C 3.32Å; I447-Q476 WeakPolarHBondContact O-CA 3.42Å; I447-I477 PolarHBondContact O-N 2.81Å
448	V	97	Very high	91.5	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.006	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	106.5	166	-178.8	0	0	0	0	108.5	I352 I353 D354 I380 I477 L479	I352-V448 PolarHBondContact O-N 3.38Å; I353-V448 HydrophobicContact CB-CB 4.21Å; I353-V448 HydrophobicContact CD1-CG2 4.43Å; I353-V448 HydrophobicContact CG1-CB 3.94Å; I353-V448 HydrophobicContact CG1-CG2 3.84Å; I353-V448 HydrophobicContact CG2-CB 4.05Å; I353-V448 HydrophobicContact CG2-CG1 4.24Å; D354-V448 PolarHBondContact N-O 3Å; I380-V448 HydrophobicContact CD1-CG2 3.8Å; V448-I477 WeakPolarHBondContact CA-O 3.45Å; V448-I477 HydrophobicContact CG2-CB 3.96Å; V448-I477 HydrophobicContact CG2-CD1 4.14Å; V448-I477 HydrophobicContact CG2-CG2 4.22Å; V448-L479 HydrophobicContact CG1-CD1 3.98Å; V448-L479 HydrophobicContact CG1-CD2 3.79Å; V448-L479 HydrophobicContact CG1-CG 3.76Å
449	S	94.5	Very high	90.9	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.215	C	C	.	.			trans	-165.5	155.2	176.5	171.4	0	0	0	0	109.7	D451 Q476 I477	S449-D451 WeakPolarHBondContact OG-CB 3.31Å; S449-D451 PolarHBondContact OG-N 2.96Å; S449-D451 PolarHBondContact OG-OD2 2.86Å; S449-D451 VanDerWaalsContact OG-OD2 3.13Å; S449-Q476 PolarHBondContact O-NE2 3.47Å; S449-I477 PolarHBondContact N-O 3.45Å
450	N	92.5	Very high	90.5	Very high	27 Å²	27	44.6 Å²	44.6	14%	0.144	22%	0.217	C	C	.	.			trans	-101.6	2.8	170.7	-72.4	28.3	0	0	0	113.2	N357 I361 V478 L479 K515	N357-N450 WeakPolarHBondContact OD1-CB 3.32Å; N357-N450 PolarHBondContact OD1-N 2.96Å; I361-N450 HydrophobicContact CD1-CB 3.61Å; I361-N450 WeakPolarHBondContact CD1-ND2 3.28Å; N450-V478 HydrophobicContact CB-CG1 4.49Å; N450-V478 WeakPolarHBondContact OD1-CG1 3.41Å; N450-L479 PolarHBondContact ND2-O 3.29Å; N450-L479 WeakPolarHBondContact OD1-CA 3.33Å; N450-L479 WeakPolarHBondContact OD1-CB 3.44Å; N450-L479 PolarHBondContact OD1-N 3Å; N450-L479 PolarHBondContact OD1-O 3.32Å; N450-K515 PolarHBondContact O-NZ 2.88Å
451	D	91.1	Very high	89.9	Confident	50 Å²	50	42.1 Å²	42.1	27%	0.267	21%	0.213	S	C	.	.			trans	-72.1	143.3	177.5	-66.4	-56.9	0	0	0	111.2	N357 S449 F453 Q476	N357-D451 PolarHBondContact ND2-OD2 3.43Å; S449-D451 WeakPolarHBondContact OG-CB 3.31Å; S449-D451 PolarHBondContact OG-N 2.96Å; S449-D451 PolarHBondContact OG-OD2 2.86Å; S449-D451 VanDerWaalsContact OG-OD2 3.13Å; D451-F453 HydrophobicContact CB-CD1 4.42Å; D451-F453 HydrophobicContact CB-CD2 4.3Å; D451-F453 HydrophobicContact CB-CE1 4.13Å; D451-F453 HydrophobicContact CB-CE2 4.05Å; D451-F453 HydrophobicContact CB-CZ 3.97Å; D451-F453 WeakPolarHBondContact O-CD2 3.38Å; D451-F453 VanDerWaalsContact O-CE2 3.3Å; D451-F453 WeakPolarHBondContact O-CE2 3.47Å; D451-Q476 PolarHBondContact O-NE2 3.21Å
452	E	86.4	Confident	89.3	Confident	41 Å²	41	47.1 Å²	47.1	19%	0.192	25%	0.245	C	C	.	.			trans	-88.4	-11.3	-179.1	-66.9	179.4	-159.4	0	0	112.7	K454 R457 K515 H517	E452-K454 HydrophobicContact CB-CD 4.3Å; E452-K454 HydrophobicContact CB-CG 3.95Å; E452-K454 PolarHBondContact O-N 3.44Å; E452-K454 WeakPolarHBondContact OE2-CD 3.45Å; E452-K454 WeakPolarHBondContact OE2-CE 3.42Å; E452-K454 IonicContact OE2-NZ 3.96Å; E452-K454 PolarHBondContact OE2-NZ 2.97Å; E452-R457 PolarHBondContact O-NE 3.46Å; E452-R457 VanDerWaalsContact O-NE 3.17Å; E452-R457 PolarHBondContact O-NH2 2.78Å; E452-K515 HydrophobicContact CG-CB 4.42Å; E452-K515 HydrophobicContact CG-CD 4Å; E452-K515 HydrophobicContact CG-CG 4.49Å; E452-K515 VanDerWaalsContact OE1-CD 3.23Å; E452-K515 WeakPolarHBondContact OE1-CD 3.48Å; E452-K515 VanDerWaalsContact OE1-CE 3.31Å; E452-K515 WeakPolarHBondContact OE1-CE 3.32Å; E452-K515 VanDerWaalsContact OE1-CG 3.32Å; E452-K515 WeakPolarHBondContact OE1-CG 3.38Å; E452-K515 IonicContact OE1-NZ 2.72Å; E452-H517 WeakPolarHBondContact CG-CE1 3.26Å; E452-H517 WeakPolarHBondContact CG-ND1 2.95Å
453	F	88.6	Confident	89	Confident	8 Å²	8	53.3 Å²	53.3	4%	0.035	27%	0.271	C	S	.	.			trans	47.8	29	-177.3	-54.1	-80.6	0	0	0	113.5	D431 L434 L435 D451 K455 Y456 R457	D431-F453 HydrophobicContact CB-CD1 4.03Å; D431-F453 HydrophobicContact CB-CE1 3.8Å; L434-F453 HydrophobicContact CD2-CE1 4.27Å; L434-F453 HydrophobicContact CD2-CZ 3.94Å; L435-F453 HydrophobicContact CD1-CB 3.95Å; L435-F453 HydrophobicContact CD1-CD1 3.55Å; L435-F453 HydrophobicContact CD1-CE1 4.25Å; L435-F453 HydrophobicContact CD1-CG 3.87Å; L435-F453 HydrophobicContact CD2-CD1 4.08Å; L435-F453 HydrophobicContact CD2-CD2 4.31Å; L435-F453 HydrophobicContact CD2-CE1 4.2Å; L435-F453 HydrophobicContact CD2-CE2 4.38Å; L435-F453 HydrophobicContact CD2-CG 4.11Å; L435-F453 HydrophobicContact CD2-CZ 4.33Å; L435-F453 HydrophobicContact CG-CD1 3.78Å; L435-F453 HydrophobicContact CG-CE1 3.96Å; L435-F453 HydrophobicContact CG-CG 4.24Å; D451-F453 HydrophobicContact CB-CD1 4.42Å; D451-F453 HydrophobicContact CB-CD2 4.3Å; D451-F453 HydrophobicContact CB-CE1 4.13Å; D451-F453 HydrophobicContact CB-CE2 4.05Å; D451-F453 HydrophobicContact CB-CZ 3.97Å; D451-F453 WeakPolarHBondContact O-CD2 3.38Å; D451-F453 VanDerWaalsContact O-CE2 3.3Å; D451-F453 WeakPolarHBondContact O-CE2 3.47Å; F453-K455 VanDerWaalsContact C-N 3.31Å; F453-K455 PolarHBondContact O-N 3.5Å; F453-Y456 HydrophobicContact CB-CD2 4.07Å; F453-Y456 AromaticContact CD1-CD2 3.97Å; F453-Y456 HydrophobicContact CD1-CD2 3.97Å; F453-Y456 HydrophobicContact CD1-CE2 4.27Å; F453-Y456 PolarHBondContact O-N 3.32Å; F453-Y456 VanDerWaalsContact O-N 3.11Å; F453-R457 PolarHBondContact O-N 2.95Å
454	K	85	Confident	88.8	Confident	130 Å²	130	52 Å²	52	57%	0.565	26%	0.262	S	S	*	.	H	α-helix	trans	-54.6	-46.4	-174.1	-87.6	173	162	155.3	0	111.8	E452 Y456 R457 F458	E452-K454 HydrophobicContact CB-CD 4.3Å; E452-K454 HydrophobicContact CB-CG 3.95Å; E452-K454 PolarHBondContact O-N 3.44Å; E452-K454 WeakPolarHBondContact OE2-CD 3.45Å; E452-K454 WeakPolarHBondContact OE2-CE 3.42Å; E452-K454 IonicContact OE2-NZ 3.96Å; E452-K454 PolarHBondContact OE2-NZ 2.97Å; K454-Y456 VanDerWaalsContact C-N 3.34Å; K454-Y456 PolarHBondContact O-N 3.21Å; K454-R457 PolarHBondContact O-N 3.02Å; K454-F458 WeakPolarHBondContact O-CB 3.48Å; K454-F458 PolarHBondContact O-N 3.2Å
455	K	84.6	Confident	88.6	Confident	103 Å²	103	46.9 Å²	46.9	45%	0.448	24%	0.239	S	C	.	.	H	α-helix	trans	-55.5	-49.6	177.6	-179.2	-171.1	174.9	-164.6	0	110.9	E429 F453 F458 S459	E429-K455 IonicContact OE1-NZ 3.16Å; E429-K455 PolarHBondContact OE1-NZ 3.48Å; E429-K455 IonicContact OE2-NZ 3.1Å; E429-K455 PolarHBondContact OE2-NZ 3.01Å; F453-K455 VanDerWaalsContact C-N 3.31Å; F453-K455 PolarHBondContact O-N 3.5Å; K455-F458 PolarHBondContact O-N 3.36Å; K455-S459 WeakPolarHBondContact O-CB 3.43Å; K455-S459 PolarHBondContact O-N 2.79Å; K455-S459 PolarHBondContact O-OG 3.5Å; K455-S459 VanDerWaalsContact O-OG 3.13Å
456	Y	86.5	Confident	88.1	Confident	12 Å²	12	51.6 Å²	51.6	5%	0.047	26%	0.261	C	S	.	.	H	α-helix	trans	-72.1	-39.6	-175.1	-50.9	-58.4	0	0	0	112.5	V317 E429 D431 V432 L435 F453 K454 F458 S459 S460	V317-Y456 HydrophobicContact CG1-CD1 3.72Å; V317-Y456 HydrophobicContact CG1-CE1 4.4Å; E429-Y456 VanDerWaalsContact CD-OH 3.29Å; E429-Y456 WeakPolarHBondContact OE2-CE1 3.34Å; E429-Y456 PolarHBondContact OE2-OH 3.45Å; D431-Y456 HydrophobicContact CB-CD2 4.35Å; D431-Y456 HydrophobicContact CB-CE2 3.44Å; D431-Y456 VanDerWaalsContact CB-CE2 3.44Å; V432-Y456 HydrophobicContact CG2-CD1 3.8Å; V432-Y456 HydrophobicContact CG2-CE1 3.16Å; V432-Y456 HydrophobicContact CG2-CE2 4.34Å; V432-Y456 VanDerWaalsContact CG2-CZ 3.47Å; L435-Y456 HydrophobicContact CD1-CD2 3.98Å; L435-Y456 HydrophobicContact CD1-CG 4.25Å; F453-Y456 HydrophobicContact CB-CD2 4.07Å; F453-Y456 AromaticContact CD1-CD2 3.97Å; F453-Y456 HydrophobicContact CD1-CD2 3.97Å; F453-Y456 HydrophobicContact CD1-CE2 4.27Å; F453-Y456 PolarHBondContact O-N 3.32Å; F453-Y456 VanDerWaalsContact O-N 3.11Å; K454-Y456 VanDerWaalsContact C-N 3.34Å; K454-Y456 PolarHBondContact O-N 3.21Å; Y456-F458 VanDerWaalsContact C-N 3.26Å; Y456-F458 PolarHBondContact O-N 2.94Å; Y456-S459 PolarHBondContact O-N 3.42Å; Y456-S460 VanDerWaalsContact O-CB 3.27Å; Y456-S460 WeakPolarHBondContact O-CB 3.31Å; Y456-S460 PolarHBondContact O-N 2.94Å; Y456-S460 PolarHBondContact O-OG 3.16Å
457	R	85.6	Confident	87.8	Confident	28 Å²	28	52.1 Å²	52.1	11%	0.106	27%	0.265	C	S	.	.	H	α-helix	trans	-57.9	-41.3	172.2	-71.2	-170.5	-77.4	158.9	-2.1	112.1	E452 F453 K454 G465 I468 S469	E452-R457 PolarHBondContact O-NE 3.46Å; E452-R457 VanDerWaalsContact O-NE 3.17Å; E452-R457 PolarHBondContact O-NH2 2.78Å; F453-R457 PolarHBondContact O-N 2.95Å; K454-R457 PolarHBondContact O-N 3.02Å; R457-G465 VanDerWaalsContact O-CA 3.29Å; R457-G465 WeakPolarHBondContact O-CA 3.4Å; R457-I468 HydrophobicContact CG-CB 4.06Å; R457-I468 HydrophobicContact CG-CG2 3.69Å; R457-S469 WeakPolarHBondContact CD-OG 3.37Å; R457-S469 PolarHBondContact NH1-OG 3.14Å
458	F	82.2	Confident	87.5	Confident	174 Å²	174	52 Å²	52	76%	0.763	27%	0.265	S	S	*	.	H	α-helix	trans	-68	-48.7	175.9	-177.9	-96.1	0	0	0	112	K454 K455 Y456 S460 G461	K454-F458 WeakPolarHBondContact O-CB 3.48Å; K454-F458 PolarHBondContact O-N 3.2Å; K455-F458 PolarHBondContact O-N 3.36Å; Y456-F458 VanDerWaalsContact C-N 3.26Å; Y456-F458 PolarHBondContact O-N 2.94Å; F458-S460 VanDerWaalsContact C-N 3.25Å; F458-S460 PolarHBondContact O-N 3.24Å; F458-G461 PolarHBondContact O-N 2.86Å; F458-G461 VanDerWaalsContact O-N 3.08Å
459	S	82.5	Confident	87	Confident	59 Å²	59	53.5 Å²	53.5	41%	0.413	28%	0.275	S	S	.	.	H	α-helix	trans	-64.3	-27.2	-179.7	-66.1	0	0	0	0	113.7	K455 Y456 G461	K455-S459 WeakPolarHBondContact O-CB 3.43Å; K455-S459 PolarHBondContact O-N 2.79Å; K455-S459 PolarHBondContact O-OG 3.5Å; K455-S459 VanDerWaalsContact O-OG 3.13Å; Y456-S459 PolarHBondContact O-N 3.42Å; S459-G461 PolarHBondContact O-N 3.18Å
460	S	85.2	Confident	86.6	Confident	9 Å²	9	55.3 Å²	55.3	6%	0.063	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-9.8	174.3	-71.6	0	0	0	0	114.3	F313 V317 Y456 F458	F313-S460 VanDerWaalsContact CD2-OG 3.31Å; F313-S460 WeakPolarHBondContact CD2-OG 3.39Å; V317-S460 WeakPolarHBondContact CG2-OG 3.48Å; Y456-S460 VanDerWaalsContact O-CB 3.27Å; Y456-S460 WeakPolarHBondContact O-CB 3.31Å; Y456-S460 PolarHBondContact O-N 2.94Å; Y456-S460 PolarHBondContact O-OG 3.16Å; F458-S460 VanDerWaalsContact C-N 3.25Å; F458-S460 PolarHBondContact O-N 3.24Å
461	G	83.2	Confident	86.5	Confident	25 Å²	25	54 Å²	54	26%	0.258	28%	0.275	S	S	.	.			trans	86.2	166.3	-173.2	0	0	0	0	0	113.1	F458 S459 E463 G465	F458-G461 PolarHBondContact O-N 2.86Å; F458-G461 VanDerWaalsContact O-N 3.08Å; S459-G461 PolarHBondContact O-N 3.18Å; G461-E463 PolarHBondContact O-N 3.09Å; G461-G465 WeakPolarHBondContact O-CA 3.49Å; G461-G465 PolarHBondContact O-N 3.37Å
462	P	81.5	Confident	86.5	Confident	123 Å²	123	51.7 Å²	51.7	80%	0.799	26%	0.263	S	S	*	.	H	α-helix	trans	-62.5	-46.2	-168.9	22.7	-32.9	0	0	0	113.4	E466	P462-E466 WeakPolarHBondContact O-CB 3.38Å; P462-E466 PolarHBondContact O-N 3.47Å
463	E	86.4	Confident	86.5	Confident	144 Å²	144	50.1 Å²	50.1	67%	0.673	26%	0.256	S	S	*	.	H	α-helix	trans	-65.7	-53.1	-177.2	-176.2	-178.7	177.2	0	0	112.1	G461 G465 E466 Q467	G461-E463 PolarHBondContact O-N 3.09Å; E463-G465 VanDerWaalsContact C-N 3.33Å; E463-G465 PolarHBondContact O-N 3.07Å; E463-E466 PolarHBondContact O-N 3.32Å; E463-Q467 WeakPolarHBondContact O-CG 3.47Å; E463-Q467 PolarHBondContact O-N 2.92Å
464	L	90	Very high	86.6	Confident	9 Å²	9	49.8 Å²	49.8	5%	0.047	25%	0.254	C	S	.	.	H	α-helix	trans	-66.8	-37	178.7	178.5	57.2	0	0	0	111.4	M309 T312 F313 E466 Q467 I468	M309-L464 HydrophobicContact CB-CD1 3.68Å; M309-L464 HydrophobicContact CE-CD1 4.14Å; M309-L464 HydrophobicContact CG-CD1 3.7Å; T312-L464 HydrophobicContact CG2-CD2 3.63Å; F313-L464 HydrophobicContact CB-CD2 4.16Å; L464-E466 VanDerWaalsContact C-N 3.3Å; L464-E466 PolarHBondContact O-N 2.94Å; L464-Q467 PolarHBondContact O-N 3.47Å; L464-I468 HydrophobicContact CD1-CD1 4.18Å; L464-I468 HydrophobicContact CD1-CG1 4.11Å; L464-I468 HydrophobicContact CG-CD1 3.92Å; L464-I468 HydrophobicContact CG-CG1 4.35Å; L464-I468 WeakPolarHBondContact O-CB 3.36Å; L464-I468 VanDerWaalsContact O-CG1 3.23Å; L464-I468 WeakPolarHBondContact O-CG1 3.39Å; L464-I468 PolarHBondContact O-N 3.29Å
465	G	88.4	Confident	87	Confident	6 Å²	6	44.7 Å²	44.7	6%	0.062	23%	0.232	C	C	.	.	H	α-helix	trans	-59	-39.5	174.1	0	0	0	0	0	113.1	R457 G461 E463 S469	R457-G465 VanDerWaalsContact O-CA 3.29Å; R457-G465 WeakPolarHBondContact O-CA 3.4Å; G461-G465 WeakPolarHBondContact O-CA 3.49Å; G461-G465 PolarHBondContact O-N 3.37Å; E463-G465 VanDerWaalsContact C-N 3.33Å; E463-G465 PolarHBondContact O-N 3.07Å; G465-S469 WeakPolarHBondContact O-CB 3.31Å; G465-S469 PolarHBondContact O-N 2.99Å; G465-S469 PolarHBondContact O-OG 3.4Å
466	E	84.8	Confident	87.5	Confident	100 Å²	100	39.9 Å²	39.9	47%	0.467	21%	0.211	S	C	.	.	H	α-helix	trans	-67.1	-46	173.8	-171.7	-178.2	169.5	0	0	111.6	R252 P462 E463 L464 I468 S469 R470	R252-E466 WeakPolarHBondContact CD-OE1 3.43Å; P462-E466 WeakPolarHBondContact O-CB 3.38Å; P462-E466 PolarHBondContact O-N 3.47Å; E463-E466 PolarHBondContact O-N 3.32Å; L464-E466 VanDerWaalsContact C-N 3.3Å; L464-E466 PolarHBondContact O-N 2.94Å; E466-I468 VanDerWaalsContact C-N 3.34Å; E466-I468 PolarHBondContact O-N 3.08Å; E466-S469 WeakPolarHBondContact O-CB 3.44Å; E466-S469 PolarHBondContact O-N 3.22Å; E466-S469 VanDerWaalsContact O-N 3.11Å; E466-R470 PolarHBondContact O-N 2.8Å
467	Q	90	Very high	87.9	Confident	44 Å²	44	39.3 Å²	39.3	21%	0.206	21%	0.209	C	C	.	.	H	α-helix	trans	-59.5	-43.5	177.1	-70	173.4	-15.1	0	0	112	M309 E463 L464 S469 R470 W471	M309-Q467 HydrophobicContact CE-CB 3.81Å; M309-Q467 VanDerWaalsContact CG-OE1 3.3Å; M309-Q467 HydrophobicContact SD-CB 4.15Å; E463-Q467 WeakPolarHBondContact O-CG 3.47Å; E463-Q467 PolarHBondContact O-N 2.92Å; L464-Q467 PolarHBondContact O-N 3.47Å; Q467-S469 VanDerWaalsContact C-N 3.34Å; Q467-S469 PolarHBondContact O-N 3.33Å; Q467-R470 PolarHBondContact O-N 3.22Å; Q467-W471 WeakPolarHBondContact O-CB 3.41Å; Q467-W471 PolarHBondContact O-N 2.96Å
468	I	90.4	Very high	88.2	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-60.8	-45.4	174.4	-67.6	167.6	0	0	0	110.2	M309 F313 M439 R457 L464 E466 R470 W471 Q472	M309-I468 HydrophobicContact CE-CG1 4.37Å; F313-I468 HydrophobicContact CD2-CD1 4.04Å; F313-I468 HydrophobicContact CE2-CD1 4.25Å; M439-I468 HydrophobicContact CE-CD1 3.64Å; M439-I468 HydrophobicContact CE-CG1 3.65Å; R457-I468 HydrophobicContact CG-CB 4.06Å; R457-I468 HydrophobicContact CG-CG2 3.69Å; L464-I468 HydrophobicContact CD1-CD1 4.18Å; L464-I468 HydrophobicContact CD1-CG1 4.11Å; L464-I468 HydrophobicContact CG-CD1 3.92Å; L464-I468 HydrophobicContact CG-CG1 4.35Å; L464-I468 WeakPolarHBondContact O-CB 3.36Å; L464-I468 VanDerWaalsContact O-CG1 3.23Å; L464-I468 WeakPolarHBondContact O-CG1 3.39Å; L464-I468 PolarHBondContact O-N 3.29Å; E466-I468 VanDerWaalsContact C-N 3.34Å; E466-I468 PolarHBondContact O-N 3.08Å; I468-R470 PolarHBondContact O-N 3.35Å; I468-W471 PolarHBondContact O-N 3.15Å; I468-Q472 HydrophobicContact CG2-CG 4.23Å; I468-Q472 WeakPolarHBondContact O-CB 3.36Å; I468-Q472 VanDerWaalsContact O-CG 3.25Å; I468-Q472 WeakPolarHBondContact O-CG 3.41Å; I468-Q472 PolarHBondContact O-N 3.28Å
469	S	86.8	Confident	88.8	Confident	32 Å²	32	30.1 Å²	30.1	22%	0.224	17%	0.17	C	C	.	.	H	α-helix	trans	-59.2	-46.4	178.7	-57.1	0	0	0	0	111.8	R457 G465 E466 Q467 Q472 S473	R457-S469 WeakPolarHBondContact CD-OG 3.37Å; R457-S469 PolarHBondContact NH1-OG 3.14Å; G465-S469 WeakPolarHBondContact O-CB 3.31Å; G465-S469 PolarHBondContact O-N 2.99Å; G465-S469 PolarHBondContact O-OG 3.4Å; E466-S469 WeakPolarHBondContact O-CB 3.44Å; E466-S469 PolarHBondContact O-N 3.22Å; E466-S469 VanDerWaalsContact O-N 3.11Å; Q467-S469 VanDerWaalsContact C-N 3.34Å; Q467-S469 PolarHBondContact O-N 3.33Å; S469-Q472 PolarHBondContact O-N 3.07Å; S469-S473 PolarHBondContact O-N 3.03Å
470	R	87	Confident	89.2	Confident	38 Å²	38	30.2 Å²	30.2	14%	0.143	16%	0.164	C	C	.	.	H	α-helix	trans	-62.2	-49.8	178.9	-171.2	-169.5	170.9	-163.1	0.7	110.3	F304 E466 Q467 I468 Q472 S473 L474 D493	F304-R470 HydrophobicContact CE1-CB 4Å; F304-R470 HydrophobicContact CE1-CG 4.08Å; F304-R470 HydrophobicContact CZ-CB 4.1Å; F304-R470 VanDerWaalsContact CZ-CD 3.49Å; F304-R470 HydrophobicContact CZ-CG 3.69Å; E466-R470 PolarHBondContact O-N 2.8Å; Q467-R470 PolarHBondContact O-N 3.22Å; I468-R470 PolarHBondContact O-N 3.35Å; R470-Q472 PolarHBondContact O-N 3.17Å; R470-S473 PolarHBondContact O-N 3.01Å; R470-S473 PolarHBondContact O-OG 3.41Å; R470-L474 WeakPolarHBondContact O-CG 3.44Å; R470-L474 PolarHBondContact O-N 2.95Å; R470-D493 IonicContact CZ-OD2 3.39Å; R470-D493 IonicContact NE-OD1 3.93Å; R470-D493 IonicContact NE-OD2 3.9Å; R470-D493 PolarHBondContact NE-OD2 2.86Å; R470-D493 VanDerWaalsContact NE-OD2 3.08Å; R470-D493 IonicContact NH2-OD2 3.74Å; R470-D493 PolarHBondContact NH2-OD2 2.92Å
471	W	90.7	Very high	89.3	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-60.7	-43	177.7	168.2	62.9	0	0	0	112.7	F304 F306 L435 A438 M439 C445 I447 Q467 I468 S473 L474 R475	F304-W471 HydrophobicContact CD1-CB 4.3Å; F304-W471 HydrophobicContact CE1-CB 3.79Å; F304-W471 HydrophobicContact CZ-CB 4.24Å; F306-W471 HydrophobicContact CE1-CD2 4.12Å; F306-W471 AromaticContact CE1-CE2 3.92Å; F306-W471 HydrophobicContact CE1-CG 4.42Å; F306-W471 HydrophobicContact CE1-CZ2 4.14Å; F306-W471 HydrophobicContact CE2-CG 4.43Å; F306-W471 HydrophobicContact CZ-CB 4.19Å; F306-W471 AromaticContact CZ-CD1 3.49Å; F306-W471 VanDerWaalsContact CZ-CD1 3.49Å; F306-W471 AromaticContact CZ-CD2 3.72Å; F306-W471 HydrophobicContact CZ-CD2 3.72Å; F306-W471 AromaticContact CZ-CE2 3.69Å; F306-W471 HydrophobicContact CZ-CE3 4.49Å; F306-W471 AromaticContact CZ-CG 3.56Å; F306-W471 HydrophobicContact CZ-CG 3.56Å; F306-W471 HydrophobicContact CZ-CZ2 4.37Å; F306-W471 AromaticContact CZ-NE1 3.56Å; L435-W471 HydrophobicContact CD2-CZ3 4.23Å; A438-W471 HydrophobicContact CB-CH2 3.46Å; A438-W471 VanDerWaalsContact CB-CH2 3.46Å; A438-W471 HydrophobicContact CB-CZ2 3.84Å; M439-W471 HydrophobicContact CG-CH2 4.39Å; M439-W471 HydrophobicContact CG-CZ3 4.33Å; C445-W471 PolarHBondContact O-NE1 2.73Å; I447-W471 HydrophobicContact CD1-CE3 4.5Å; I447-W471 HydrophobicContact CD1-CH2 3.23Å; I447-W471 HydrophobicContact CD1-CZ2 3.86Å; I447-W471 HydrophobicContact CD1-CZ3 3.58Å; I447-W471 HydrophobicContact CG1-CH2 4.1Å; I447-W471 HydrophobicContact CG1-CZ2 4.32Å; Q467-W471 WeakPolarHBondContact O-CB 3.41Å; Q467-W471 PolarHBondContact O-N 2.96Å; I468-W471 PolarHBondContact O-N 3.15Å; W471-S473 VanDerWaalsContact C-N 3.33Å; W471-S473 PolarHBondContact O-N 3.26Å; W471-L474 CarbonylContact O-C 3.6Å; W471-L474 PolarHBondContact O-N 3.33Å; W471-R475 VanDerWaalsContact CD1-CG 3.5Å; W471-R475 WeakPolarHBondContact O-CB 3.33Å; W471-R475 PolarHBondContact O-N 3.32Å
472	Q	90.2	Very high	89.3	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-55.9	-46.5	175.3	-80.1	175.4	-26.7	0	0	111.8	I468 S469 R470 L474 R475 Q476 H517	I468-Q472 HydrophobicContact CG2-CG 4.23Å; I468-Q472 WeakPolarHBondContact O-CB 3.36Å; I468-Q472 VanDerWaalsContact O-CG 3.25Å; I468-Q472 WeakPolarHBondContact O-CG 3.41Å; I468-Q472 PolarHBondContact O-N 3.28Å; S469-Q472 PolarHBondContact O-N 3.07Å; R470-Q472 PolarHBondContact O-N 3.17Å; Q472-L474 PolarHBondContact O-N 2.75Å; Q472-R475 PolarHBondContact O-N 3.09Å; Q472-Q476 HydrophobicContact CB-CB 4.42Å; Q472-Q476 WeakPolarHBondContact O-CA 3.28Å; Q472-Q476 WeakPolarHBondContact O-CB 3.45Å; Q472-Q476 PolarHBondContact O-N 2.93Å; Q472-H517 HydrophobicContact CB-CB 4.38Å
473	S	87.6	Confident	89.5	Confident	7 Å²	7	39.7 Å²	39.7	5%	0.049	20%	0.198	C	C	.	.	H	α-helix	trans	-58.1	-27	178.4	78.9	0	0	0	0	113.4	S469 R470 W471 P489 S490	S469-S473 PolarHBondContact O-N 3.03Å; R470-S473 PolarHBondContact O-N 3.01Å; R470-S473 PolarHBondContact O-OG 3.41Å; W471-S473 VanDerWaalsContact C-N 3.33Å; W471-S473 PolarHBondContact O-N 3.26Å; S473-P489 WeakPolarHBondContact O-CB 3.49Å; S473-S490 VanDerWaalsContact O-CB 3.29Å; S473-S490 WeakPolarHBondContact O-CB 3.33Å; S473-S490 PolarHBondContact O-N 3.09Å; S473-S490 PolarHBondContact O-OG 3.43Å
474	L	90.3	Very high	89.6	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-97.3	-18.3	-176.3	-62.2	176.2	0	0	0	114	P299 M301 F304 R470 W471 Q472 P489 C492	P299-L474 HydrophobicContact CB-CD1 3.54Å; P299-L474 HydrophobicContact CB-CD2 3.88Å; P299-L474 HydrophobicContact CB-CG 4.32Å; P299-L474 HydrophobicContact CG-CD1 4.08Å; P299-L474 HydrophobicContact CG-CD2 3.42Å; P299-L474 VanDerWaalsContact CG-CD2 3.42Å; P299-L474 HydrophobicContact CG-CG 4.32Å; M301-L474 HydrophobicContact SD-CD1 3.91Å; F304-L474 HydrophobicContact CE2-CD1 4.17Å; F304-L474 HydrophobicContact CZ-CD1 4.05Å; R470-L474 WeakPolarHBondContact O-CG 3.44Å; R470-L474 PolarHBondContact O-N 2.95Å; W471-L474 CarbonylContact O-C 3.6Å; W471-L474 PolarHBondContact O-N 3.33Å; Q472-L474 PolarHBondContact O-N 2.75Å; L474-P489 VanDerWaalsContact C-CB 3.41Å; L474-P489 WeakPolarHBondContact O-CB 3.36Å; L474-C492 WeakPolarHBondContact CD2-O 3.4Å
475	R	93	Very high	89.7	Confident	24 Å²	24	39 Å²	39	9%	0.091	20%	0.204	C	C	.	.	H	α-helix	trans	-134.7	-8.2	-169.4	-67.4	-63	-179.8	-91.4	6.9	114.8	M301 P443 C445 Y446 I447 W471 Q472	M301-R475 HydrophobicContact CE-CG 4.36Å; M301-R475 VanDerWaalsContact CG-NH2 3.3Å; M301-R475 PolarHBondContact SD-NH2 3.06Å; M301-R475 VanDerWaalsContact SD-NH2 3.43Å; P443-R475 PolarHBondContact O-NE 3.02Å; C445-R475 WeakPolarHBondContact O-CB 3.41Å; Y446-R475 WeakPolarHBondContact CA-O 3.36Å; Y446-R475 VanDerWaalsContact CD1-O 3.24Å; Y446-R475 WeakPolarHBondContact CD1-O 3.26Å; I447-R475 PolarHBondContact N-O 3.48Å; W471-R475 VanDerWaalsContact CD1-CG 3.5Å; W471-R475 WeakPolarHBondContact O-CB 3.33Å; W471-R475 PolarHBondContact O-N 3.32Å; Q472-R475 PolarHBondContact O-N 3.09Å
476	Q	94.3	Very high	89.9	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.009	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	119	177	-168.1	170	-7	0	0	111.3	I447 S449 D451 Q472 V478 P489	I447-Q476 HydrophobicContact CG2-CG 4.47Å; I447-Q476 CarbonylContact O-C 3.32Å; I447-Q476 WeakPolarHBondContact O-CA 3.42Å; S449-Q476 PolarHBondContact O-NE2 3.47Å; D451-Q476 PolarHBondContact O-NE2 3.21Å; Q472-Q476 HydrophobicContact CB-CB 4.42Å; Q472-Q476 WeakPolarHBondContact O-CA 3.28Å; Q472-Q476 WeakPolarHBondContact O-CB 3.45Å; Q472-Q476 PolarHBondContact O-N 2.93Å; Q476-V478 HydrophobicContact CG-CG2 4.32Å; Q476-P489 WeakPolarHBondContact O-CB 3.49Å
477	I	94.9	Very high	90.1	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	117.2	170.8	-64.6	167.8	0	0	0	107.3	I380 F384 Y446 I447 V448 S449 Y486	I380-I477 HydrophobicContact CG2-CD1 4.28Å; F384-I477 HydrophobicContact CD2-CD1 4.05Å; F384-I477 HydrophobicContact CE2-CD1 3.62Å; F384-I477 HydrophobicContact CE2-CG1 4.15Å; F384-I477 HydrophobicContact CZ-CD1 4.12Å; F384-I477 HydrophobicContact CZ-CG1 4.21Å; Y446-I477 HydrophobicContact CD1-CD1 3.81Å; Y446-I477 HydrophobicContact CD1-CG1 3.98Å; Y446-I477 HydrophobicContact CG-CD1 4.38Å; I447-I477 PolarHBondContact O-N 2.81Å; V448-I477 WeakPolarHBondContact CA-O 3.45Å; V448-I477 HydrophobicContact CG2-CB 3.96Å; V448-I477 HydrophobicContact CG2-CD1 4.14Å; V448-I477 HydrophobicContact CG2-CG2 4.22Å; S449-I477 PolarHBondContact N-O 3.45Å; I477-Y486 VanDerWaalsContact CG2-CB 3.43Å; I477-Y486 HydrophobicContact CG2-CD1 3.83Å; I477-Y486 HydrophobicContact CG2-CD2 3.56Å; I477-Y486 HydrophobicContact CG2-CE1 4.49Å; I477-Y486 HydrophobicContact CG2-CE2 4.27Å; I477-Y486 HydrophobicContact CG2-CG 3.32Å
478	V	93.2	Very high	90.1	Very high	8 Å²	8	38.3 Å²	38.3	5%	0.048	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	118.6	-175.5	-179	0	0	0	0	109.4	N450 Q476 Y486 Q487 T518	N450-V478 HydrophobicContact CB-CG1 4.49Å; N450-V478 WeakPolarHBondContact OD1-CG1 3.41Å; Q476-V478 HydrophobicContact CG-CG2 4.32Å; V478-Y486 CarbonylContact O-C 3.52Å; V478-Y486 WeakPolarHBondContact O-CA 3.45Å; V478-Y486 VanDerWaalsContact O-CB 3.26Å; V478-Y486 WeakPolarHBondContact O-CB 3.31Å; V478-Q487 HydrophobicContact CB-CB 4.4Å; V478-Q487 PolarHBondContact N-O 3.43Å; V478-Q487 VanDerWaalsContact N-O 3.11Å; V478-Q487 PolarHBondContact O-N 3.19Å; V478-T518 HydrophobicContact CG2-CG2 4.49Å
479	L	93.5	Very high	90.1	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	140.9	179	-63.6	160.3	0	0	0	111.1	N357 L358 I361 R362 V448 N450	N357-L479 HydrophobicContact CB-CD1 4.26Å; L358-L479 VanDerWaalsContact CA-CD1 3.49Å; L358-L479 HydrophobicContact CB-CD1 4.17Å; L358-L479 HydrophobicContact CD1-CD1 4.18Å; L358-L479 HydrophobicContact CD1-CD2 3.64Å; I361-L479 HydrophobicContact CB-CB 4.42Å; I361-L479 HydrophobicContact CD1-CB 4.29Å; I361-L479 HydrophobicContact CD1-CD1 4.15Å; I361-L479 HydrophobicContact CG2-CB 3.94Å; R362-L479 HydrophobicContact CG-CD2 4.48Å; V448-L479 HydrophobicContact CG1-CD1 3.98Å; V448-L479 HydrophobicContact CG1-CD2 3.79Å; V448-L479 HydrophobicContact CG1-CG 3.76Å; N450-L479 PolarHBondContact ND2-O 3.29Å; N450-L479 WeakPolarHBondContact OD1-CA 3.33Å; N450-L479 WeakPolarHBondContact OD1-CB 3.44Å; N450-L479 PolarHBondContact OD1-N 3Å; N450-L479 PolarHBondContact OD1-O 3.32Å
480	Q	91.1	Very high	90.1	Very high	61 Å²	61	37.5 Å²	37.5	29%	0.285	19%	0.192	S	C	.	.			trans	-107.5	141.4	179.4	-65.9	-65.5	-32.3	0	0	110.4	R362 P484 I485 Q487	R362-Q480 WeakPolarHBondContact CD-O 3.36Å; R362-Q480 PolarHBondContact NH1-O 3.4Å; Q480-P484 WeakPolarHBondContact CB-O 3.09Å; Q480-I485 PolarHBondContact N-O 3.49Å; Q480-I485 VanDerWaalsContact N-O 3.13Å; Q480-Q487 HydrophobicContact CG-CB 4.5Å
481	H	87.2	Confident	89.9	Confident	88 Å²	88	39.3 Å²	39.3	41%	0.407	20%	0.2	S	C	.	.	S	Bend	trans	-70.4	-39.5	177.7	-173.9	-84.4	0	0	0	112	I361 K363	I361-H481 PolarHBondContact O-CD2 3.34Å; K363-H481 WeakPolarHBondContact CD-NE2 3.28Å; K363-H481 WeakPolarHBondContact CE-NE2 3.3Å
482	R	83.7	Confident	89.6	Confident	203 Å²	203	39.4 Å²	39.4	77%	0.766	20%	0.201	S	C	*	.	S	Bend	trans	-135.5	156.1	-178.6	-56.6	-174.2	-179.7	173.9	-4.5	110.6
483	G	86.6	Confident	89.3	Confident	65 Å²	65	40 Å²	40	67%	0.67	21%	0.205	S	C	*	.	S	Bend	trans	79.4	-133.1	177.9	0	0	0	0	0	112.2
484	P	88.1	Confident	89.3	Confident	96 Å²	96	40.1 Å²	40.1	62%	0.623	21%	0.205	S	C	*	.	S	Bend	trans	-49.3	156	177.1	-26.3	34.9	0	0	0	112.7	R362 Q480 Y486	R362-P484 PolarHBondContact NH1-O 3.06Å; R362-P484 VanDerWaalsContact NH1-O 3.09Å; Q480-P484 WeakPolarHBondContact CB-O 3.09Å; P484-Y486 VanDerWaalsContact C-N 3.29Å; P484-Y486 PolarHBondContact O-N 3.26Å
485	I	91.5	Very high	89.2	Confident	42 Å²	42	40.7 Å²	40.7	22%	0.215	21%	0.208	C	C	.	.	S	Bend	trans	-63.3	-42.6	179.4	-61	-172.9	0	0	0	110.6	R362 V376 Q379 Q480	R362-I485 PolarHBondContact NH1-O 2.96Å; R362-I485 VanDerWaalsContact NH1-O 3.16Å; V376-I485 HydrophobicContact CB-CG2 4.31Å; V376-I485 HydrophobicContact CG1-CG2 4.07Å; V376-I485 HydrophobicContact CG2-CG2 3.74Å; Q379-I485 HydrophobicContact CB-CD1 3.82Å; Q379-I485 HydrophobicContact CG-CD1 3.97Å; Q480-I485 PolarHBondContact N-O 3.49Å; Q480-I485 VanDerWaalsContact N-O 3.13Å
486	Y	92.8	Very high	89.3	Confident	13 Å²	13	39.6 Å²	39.6	5%	0.051	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	164.4	-179.2	50.3	-106.9	0	0	0	110.5	Q379 I380 D383 F384 I477 V478 P484 K488	Q379-Y486 VanDerWaalsContact C-OH 3.31Å; Q379-Y486 HydrophobicContact CB-CE1 4.36Å; Q379-Y486 HydrophobicContact CG-CE1 4.01Å; Q379-Y486 PolarHBondContact O-OH 2.93Å; Q379-Y486 VanDerWaalsContact O-OH 3.13Å; I380-Y486 WeakPolarHBondContact CA-OH 3.47Å; I380-Y486 HydrophobicContact CD1-CE1 4.42Å; I380-Y486 HydrophobicContact CG1-CD1 4.24Å; I380-Y486 HydrophobicContact CG1-CE1 3.49Å; I380-Y486 VanDerWaalsContact CG1-CE1 3.49Å; I380-Y486 PolarHBondContact N-OH 3.32Å; D383-Y486 WeakPolarHBondContact CB-OH 3.36Å; D383-Y486 PolarHBondContact OD2-OH 3.11Å; F384-Y486 AromaticContact CE2-CE2 3.85Å; F384-Y486 HydrophobicContact CE2-CE2 3.85Å; F384-Y486 HydrophobicContact CZ-CE2 4.4Å; I477-Y486 VanDerWaalsContact CG2-CB 3.43Å; I477-Y486 HydrophobicContact CG2-CD1 3.83Å; I477-Y486 HydrophobicContact CG2-CD2 3.56Å; I477-Y486 HydrophobicContact CG2-CE1 4.49Å; I477-Y486 HydrophobicContact CG2-CE2 4.27Å; I477-Y486 HydrophobicContact CG2-CG 3.32Å; V478-Y486 CarbonylContact O-C 3.52Å; V478-Y486 WeakPolarHBondContact O-CA 3.45Å; V478-Y486 VanDerWaalsContact O-CB 3.26Å; V478-Y486 WeakPolarHBondContact O-CB 3.31Å; P484-Y486 VanDerWaalsContact C-N 3.29Å; P484-Y486 PolarHBondContact O-N 3.26Å; Y486-K488 HydrophobicContact CD2-CG 4.19Å; Y486-K488 HydrophobicContact CE2-CG 3.89Å
487	Q	89.7	Confident	89.3	Confident	49 Å²	49	40.1 Å²	40.1	23%	0.229	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	130.8	161.6	174.9	176	-4.7	0	0	108.7	V478 Q480 A519	V478-Q487 HydrophobicContact CB-CB 4.4Å; V478-Q487 PolarHBondContact N-O 3.43Å; V478-Q487 VanDerWaalsContact N-O 3.11Å; V478-Q487 PolarHBondContact O-N 3.19Å; Q480-Q487 HydrophobicContact CG-CB 4.5Å; Q487-A519 HydrophobicContact CG-CB 4.39Å; Q487-A519 PolarHBondContact NE2-O 2.96Å
488	K	90.1	Very high	89.2	Confident	73 Å²	73	41.4 Å²	41.4	32%	0.317	22%	0.22	S	C	.	.	P	Polyproline II helix	trans	-73	148.8	175.6	-59.8	-172.4	177.6	-171.4	0	109.8	D383 F384 Y486 A519	D383-K488 VanDerWaalsContact CG-CE 3.42Å; D383-K488 IonicContact OD1-NZ 3.41Å; D383-K488 PolarHBondContact OD1-NZ 3.12Å; D383-K488 WeakPolarHBondContact OD2-CE 3.27Å; D383-K488 IonicContact OD2-NZ 3.59Å; D383-K488 PolarHBondContact OD2-NZ 3.28Å; D383-K488 VanDerWaalsContact OD2-NZ 3.16Å; F384-K488 HydrophobicContact CZ-CB 4.05Å; F384-K488 HydrophobicContact CZ-CD 4.04Å; F384-K488 HydrophobicContact CZ-CG 3.8Å; Y486-K488 HydrophobicContact CD2-CG 4.19Å; Y486-K488 HydrophobicContact CE2-CG 3.89Å; K488-A519 WeakPolarHBondContact O-CB 3.34Å
489	P	90	Very high	89.3	Confident	11 Å²	11	43.9 Å²	43.9	7%	0.071	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-62.1	168.7	172	24.1	-31.5	0	0	0	112	Y446 S473 L474 Q476	Y446-P489 HydrophobicContact CD1-CG 4.26Å; Y446-P489 HydrophobicContact CE1-CG 3.75Å; S473-P489 WeakPolarHBondContact O-CB 3.49Å; L474-P489 VanDerWaalsContact C-CB 3.41Å; L474-P489 WeakPolarHBondContact O-CB 3.36Å; Q476-P489 WeakPolarHBondContact O-CB 3.49Å
490	S	86.5	Confident	89.2	Confident	5 Å²	5	45.6 Å²	45.6	4%	0.035	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-61.3	136.4	174.9	-60.1	0	0	0	0	110.4	S473 C492 L494 A519 V520	S473-S490 VanDerWaalsContact O-CB 3.29Å; S473-S490 WeakPolarHBondContact O-CB 3.33Å; S473-S490 PolarHBondContact O-N 3.09Å; S473-S490 PolarHBondContact O-OG 3.43Å; S490-C492 WeakPolarHBondContact CB-O 3.47Å; S490-L494 WeakPolarHBondContact OG-CD1 3.25Å; S490-L494 VanDerWaalsContact OG-CD2 3.25Å; S490-L494 WeakPolarHBondContact OG-CD2 3.23Å; S490-L494 WeakPolarHBondContact OG-CG 3.45Å; S490-A519 WeakPolarHBondContact OG-CA 3.43Å; S490-V520 PolarHBondContact OG-N 3.46Å
491	K	81.9	Confident	89.2	Confident	75 Å²	75	50.3 Å²	50.3	33%	0.326	26%	0.264	S	S	.	.	S	Bend	trans	-79.8	-39.1	177.8	-62.4	178.5	-170.6	161.3	0	111.9	V283 N284 Y287 P299	V283-K491 PolarHBondContact O-NZ 3.33Å; N284-K491 VanDerWaalsContact O-CD 3.29Å; N284-K491 WeakPolarHBondContact O-CD 3.46Å; N284-K491 PolarHBondContact O-NZ 3.35Å; Y287-K491 HydrophobicContact CD1-CB 4.23Å; Y287-K491 HydrophobicContact CE1-CB 4.04Å; Y287-K491 VanDerWaalsContact CE1-O 3.31Å; Y287-K491 WeakPolarHBondContact CE1-O 3.16Å; P299-K491 WeakPolarHBondContact CD-O 3.23Å; P299-K491 VanDerWaalsContact CG-O 3.31Å; P299-K491 WeakPolarHBondContact CG-O 3.43Å
492	C	85.2	Confident	89.5	Confident	3 Å²	3	49 Å²	49	2%	0.02	26%	0.262	C	S	.	.	S	Bend	trans	-104.4	163.9	178.1	-69.6	0	0	0	0	109.2	L296 L474 S490 L494 W523	L296-C492 HydrophobicContact CB-CB 4.44Å; L296-C492 WeakPolarHBondContact CB-SG 3.45Å; L296-C492 HydrophobicContact CD2-CB 4.45Å; L474-C492 WeakPolarHBondContact CD2-O 3.4Å; S490-C492 WeakPolarHBondContact CB-O 3.47Å; C492-L494 PolarHBondContact O-N 3Å; C492-W523 HydrophobicContact CB-CZ2 4.31Å
493	D	84.9	Confident	90	Very high	13 Å²	13	39.5 Å²	39.5	7%	0.07	23%	0.227	C	C	.	.			trans	-62.3	137.7	171.1	-138.5	-21.1	0	0	0	110.3	R252 R470 C495 H497 W523	R252-D493 IonicContact CZ-OD1 3.73Å; R252-D493 IonicContact CZ-OD2 2.75Å; R252-D493 IonicContact NH2-OD1 3.28Å; R252-D493 PolarHBondContact NH2-OD1 3.22Å; R252-D493 IonicContact NH2-OD2 3.02Å; R252-D493 PolarHBondContact NH2-OD2 3.31Å; R470-D493 IonicContact CZ-OD2 3.39Å; R470-D493 IonicContact NE-OD1 3.93Å; R470-D493 IonicContact NE-OD2 3.9Å; R470-D493 PolarHBondContact NE-OD2 2.86Å; R470-D493 VanDerWaalsContact NE-OD2 3.08Å; R470-D493 IonicContact NH2-OD2 3.74Å; R470-D493 PolarHBondContact NH2-OD2 2.92Å; D493-C495 PolarHBondContact O-N 3.13Å; D493-H497 PolarHBondContact O-NE2 2.73Å; D493-W523 WeakPolarHBondContact O-CH2 3.29Å
494	L	86.1	Confident	90.5	Very high	10 Å²	10	36.4 Å²	36.4	5%	0.052	20%	0.196	C	C	.	.	S	Bend	trans	-83	60.9	-177.8	-67.2	-171.8	0	0	0	111.3	I254 S490 C492 V520 W523	I254-L494 HydrophobicContact CD1-CB 3.91Å; I254-L494 HydrophobicContact CD1-CD1 3.85Å; I254-L494 HydrophobicContact CD1-CG 4.47Å; I254-L494 HydrophobicContact CG1-CB 4.38Å; S490-L494 WeakPolarHBondContact OG-CD1 3.25Å; S490-L494 VanDerWaalsContact OG-CD2 3.25Å; S490-L494 WeakPolarHBondContact OG-CD2 3.23Å; S490-L494 WeakPolarHBondContact OG-CG 3.45Å; C492-L494 PolarHBondContact O-N 3Å; L494-V520 HydrophobicContact CD1-CB 4.32Å; L494-V520 HydrophobicContact CD1-CG2 4.09Å; L494-V520 HydrophobicContact CD2-CB 3.77Å; L494-V520 HydrophobicContact CD2-CG2 4.4Å; L494-W523 HydrophobicContact CD2-CZ2 4.24Å
495	C	89.2	Confident	90.9	Very high	12 Å²	12	32.2 Å²	32.2	8%	0.081	17%	0.168	C	C	.	.	S	Bend	trans	-137.3	174.9	173.4	66.2	0	0	0	0	110.4	R252 D493 H497 P507 W523	R252-C495 HydrophobicContact CB-CB 4.29Å; D493-C495 PolarHBondContact O-N 3.13Å; C495-H497 PolarHBondContact O-CD2 3.36Å; C495-H497 VanDerWaalsContact O-CD2 3.23Å; C495-P507 WeakPolarHBondContact O-CD 3.45Å; C495-W523 WeakPolarHBondContact O-CZ3 3.3Å
496	I	94.2	Very high	91.1	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.005	16%	0.157	C	C	.	.			trans	-67.9	133.9	174.6	-63.3	-172.3	0	0	0	110.3	F245 M248 K249 W504 H505 I506	F245-I496 HydrophobicContact CB-CD1 3.93Å; F245-I496 HydrophobicContact CB-CG2 4.48Å; F245-I496 HydrophobicContact CD1-CD1 3.9Å; F245-I496 HydrophobicContact CG-CD1 4.01Å; M248-I496 HydrophobicContact CB-CD1 3.53Å; M248-I496 HydrophobicContact CB-CG1 4.24Å; M248-I496 HydrophobicContact CE-CD1 3.8Å; M248-I496 HydrophobicContact CG-CD1 4.3Å; M248-I496 HydrophobicContact SD-CD1 3.83Å; K249-I496 HydrophobicContact CB-CB 4.13Å; K249-I496 WeakPolarHBondContact CD-O 3.21Å; K249-I496 WeakPolarHBondContact CG-O 3.3Å; I496-W504 HydrophobicContact CG2-CD2 4.37Å; I496-W504 HydrophobicContact CG2-CE3 3.31Å; I496-W504 HydrophobicContact CG2-CZ3 3.62Å; I496-H505 WeakPolarHBondContact CA-O 3.31Å; I496-I506 HydrophobicContact CD1-CD1 4.24Å; I496-I506 HydrophobicContact CD1-CG1 4Å; I496-I506 HydrophobicContact CD1-CG2 4.05Å; I496-I506 HydrophobicContact CG1-CB 4.36Å; I496-I506 HydrophobicContact CG1-CG1 4.11Å; I496-I506 HydrophobicContact CG1-CG2 4.01Å; I496-I506 HydrophobicContact CG2-CG1 4.23Å
497	H	94.3	Very high	91.1	Very high	14 Å²	14	29.6 Å²	29.6	7%	0.065	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	149.7	174.8	-68.2	-163.4	0	0	0	111.2	L296 T297 D493 C495 W504 H505	L296-H497 WeakPolarHBondContact CB-ND1 3.31Å; L296-H497 HydrophobicContact CG-CB 4.34Å; T297-H497 PolarHBondContact N-ND1 2.85Å; T297-H497 PolarHBondContact O-CE1 3.13Å; T297-H497 VanDerWaalsContact O-CE1 3.3Å; D493-H497 PolarHBondContact O-NE2 2.73Å; C495-H497 PolarHBondContact O-CD2 3.36Å; C495-H497 VanDerWaalsContact O-CD2 3.23Å; H497-W504 CarbonylContact O-C 3.54Å; H497-W504 WeakPolarHBondContact O-CA 3.21Å; H497-H505 HydrophobicContact CB-CB 4.29Å; H497-H505 PolarHBondContact N-O 2.95Å; H497-H505 PolarHBondContact O-N 3.12Å
498	G	94.2	Very high	91.2	Very high	26 Å²	26	27.4 Å²	27.4	27%	0.268	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	95.6	-161.3	175.5	0	0	0	0	0	113.7	G503 W504	G498-G503 VanDerWaalsContact CA-O 3.3Å; G498-G503 WeakPolarHBondContact CA-O 3.31Å; G498-W504 WeakPolarHBondContact O-CZ3 3.4Å
499	N	94.7	Very high	91.1	Very high	60 Å²	60	25.2 Å²	25.2	32%	0.321	14%	0.135	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.2	-178.5	-179.6	59.5	29.8	0	0	0	110.2	E501 T502 G503 W504	N499-E501 VanDerWaalsContact C-N 3.27Å; N499-E501 PolarHBondContact O-N 3.09Å; N499-E501 PolarHBondContact OD1-N 3.42Å; N499-E501 VanDerWaalsContact OD1-N 3.15Å; N499-T502 PolarHBondContact N-OG1 2.93Å; N499-T502 VanDerWaalsContact N-OG1 3.14Å; N499-T502 PolarHBondContact O-N 2.99Å; N499-T502 WeakPolarHBondContact OD1-CB 3.44Å; N499-T502 PolarHBondContact OD1-N 3Å; N499-T502 PolarHBondContact OD1-OG1 3.24Å; N499-G503 PolarHBondContact N-O 3.42Å; N499-G503 CarbonylContact O-C 3.15Å; N499-G503 VanDerWaalsContact O-C 3.25Å; N499-G503 VanDerWaalsContact O-CA 3.27Å; N499-G503 WeakPolarHBondContact O-CA 3.37Å; N499-G503 PolarHBondContact O-N 3.05Å; N499-W504 VanDerWaalsContact C-CE2 3.48Å; N499-W504 VanDerWaalsContact CA-CZ2 3.47Å; N499-W504 HydrophobicContact CB-CH2 4.4Å; N499-W504 HydrophobicContact CB-CZ2 4.39Å
500	L	92.1	Very high	90.7	Very high	37 Å²	37	30.1 Å²	30.1	19%	0.194	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-35.5	179.3	-71.9	173.2	0	0	0	114.1	V238 W275 R528	V238-L500 HydrophobicContact CG1-CD1 3.89Å; V238-L500 HydrophobicContact CG1-CD2 3.53Å; V238-L500 HydrophobicContact CG1-CG 4.38Å; W275-L500 VanDerWaalsContact CH2-O 3.26Å; W275-L500 WeakPolarHBondContact CH2-O 3.38Å; W275-L500 HydrophobicContact CZ2-CD2 4.34Å; L500-R528 PolarHBondContact O-NE 3.3Å; L500-R528 VanDerWaalsContact O-NE 3.08Å
501	E	91	Very high	89.9	Confident	161 Å²	161	31.8 Å²	31.8	75%	0.752	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76	-42.9	-179.2	-60.2	179.1	171	0	0	112.1	N499	N499-E501 VanDerWaalsContact C-N 3.27Å; N499-E501 PolarHBondContact O-N 3.09Å; N499-E501 PolarHBondContact OD1-N 3.42Å; N499-E501 VanDerWaalsContact OD1-N 3.15Å
502	T	92.1	Very high	88.7	Confident	60 Å²	60	35.2 Å²	35.2	37%	0.368	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-10.2	-175.5	58.8	0	0	0	0	113	K294 N499	K294-T502 WeakPolarHBondContact CD-O 3.27Å; K294-T502 PolarHBondContact NZ-O 3.37Å; N499-T502 PolarHBondContact N-OG1 2.93Å; N499-T502 VanDerWaalsContact N-OG1 3.14Å; N499-T502 PolarHBondContact O-N 2.99Å; N499-T502 WeakPolarHBondContact OD1-CB 3.44Å; N499-T502 PolarHBondContact OD1-N 3Å; N499-T502 PolarHBondContact OD1-OG1 3.24Å
503	G	94.7	Very high	87.1	Confident	4 Å²	4	43.8 Å²	43.8	4%	0.041	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	80.8	165.9	-168	0	0	0	0	0	111.6	G498 N499 L526	G498-G503 VanDerWaalsContact CA-O 3.3Å; G498-G503 WeakPolarHBondContact CA-O 3.31Å; N499-G503 PolarHBondContact N-O 3.42Å; N499-G503 CarbonylContact O-C 3.15Å; N499-G503 VanDerWaalsContact O-C 3.25Å; N499-G503 VanDerWaalsContact O-CA 3.27Å; N499-G503 WeakPolarHBondContact O-CA 3.37Å; N499-G503 PolarHBondContact O-N 3.05Å; G503-L526 CarbonylContact C-O 3.6Å; G503-L526 WeakPolarHBondContact CA-O 3.4Å
504	W	97	Very high	85.7	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	146.4	-175.2	-62.8	101.7	0	0	0	111.3	F245 E246 I496 H497 G498 N499 I506 L526	F245-W504 HydrophobicContact CB-CE3 4.32Å; F245-W504 HydrophobicContact CB-CH2 3.84Å; F245-W504 HydrophobicContact CB-CZ2 4.1Å; F245-W504 HydrophobicContact CB-CZ3 3.97Å; F245-W504 AromaticContact CD2-CD1 3.91Å; F245-W504 AromaticContact CD2-CD2 3.66Å; F245-W504 HydrophobicContact CD2-CD2 3.66Å; F245-W504 AromaticContact CD2-CE2 3.59Å; F245-W504 HydrophobicContact CD2-CE3 4.2Å; F245-W504 AromaticContact CD2-CG 3.84Å; F245-W504 HydrophobicContact CD2-CG 3.84Å; F245-W504 HydrophobicContact CD2-CH2 4.48Å; F245-W504 HydrophobicContact CD2-CZ2 4.02Å; F245-W504 AromaticContact CD2-NE1 3.78Å; F245-W504 AromaticContact CE2-CD1 3.94Å; F245-W504 HydrophobicContact CE2-CD2 4.36Å; F245-W504 HydrophobicContact CE2-CG 4.05Å; E246-W504 WeakPolarHBondContact OE1-CH2 3.41Å; I496-W504 HydrophobicContact CG2-CD2 4.37Å; I496-W504 HydrophobicContact CG2-CE3 3.31Å; I496-W504 HydrophobicContact CG2-CZ3 3.62Å; H497-W504 CarbonylContact O-C 3.54Å; H497-W504 WeakPolarHBondContact O-CA 3.21Å; G498-W504 WeakPolarHBondContact O-CZ3 3.4Å; N499-W504 VanDerWaalsContact C-CE2 3.48Å; N499-W504 VanDerWaalsContact CA-CZ2 3.47Å; N499-W504 HydrophobicContact CB-CH2 4.4Å; N499-W504 HydrophobicContact CB-CZ2 4.39Å; W504-I506 HydrophobicContact CB-CG1 4.34Å; W504-L526 HydrophobicContact CB-CB 4.15Å; W504-L526 HydrophobicContact CB-CD1 4.08Å; W504-L526 PolarHBondContact N-O 3.17Å; W504-L526 PolarHBondContact O-N 2.86Å
505	H	96.3	Very high	84.3	Confident	8 Å²	8	50.2 Å²	50.2	4%	0.037	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	117	166.2	-59.8	84.2	0	0	0	108.4	C289 C292 L296 I496 H497 W523 L524 C525	C289-H505 WeakPolarHBondContact CB-NE2 3.39Å; C289-H505 PolarHBondContact SG-NE2 3.38Å; C289-H505 VanDerWaalsContact SG-NE2 3.36Å; C292-H505 VanDerWaalsContact SG-CE1 3.57Å; C292-H505 PolarHBondContact SG-NE2 3.08Å; L296-H505 HydrophobicContact CD1-CB 4.47Å; L296-H505 HydrophobicContact CD2-CB 4.02Å; L296-H505 HydrophobicContact CG-CB 4.34Å; I496-H505 WeakPolarHBondContact CA-O 3.31Å; H497-H505 HydrophobicContact CB-CB 4.29Å; H497-H505 PolarHBondContact N-O 2.95Å; H497-H505 PolarHBondContact O-N 3.12Å; H505-W523 HydrophobicContact CB-CE3 3.88Å; H505-W523 HydrophobicContact CB-CZ3 4.33Å; H505-L524 CarbonylContact C-O 3.45Å; H505-L524 VanDerWaalsContact CA-O 3.3Å; H505-L524 WeakPolarHBondContact CA-O 3.27Å; H505-C525 PolarHBondContact NE2-SG 2.89Å
506	I	96	Very high	82.8	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	118.1	-173.2	-53.4	179.4	0	0	0	108.5	F245 M248 I255 I263 I496 W504 W523 L524 L526	F245-I506 HydrophobicContact CD1-CD1 4.18Å; F245-I506 HydrophobicContact CD2-CD1 4.27Å; F245-I506 HydrophobicContact CE1-CD1 3.64Å; F245-I506 HydrophobicContact CE2-CD1 3.74Å; F245-I506 HydrophobicContact CG-CD1 4.48Å; F245-I506 HydrophobicContact CZ-CD1 3.4Å; M248-I506 HydrophobicContact CE-CG2 4.38Å; I255-I506 HydrophobicContact CD1-CG2 3.56Å; I255-I506 HydrophobicContact CG1-CG2 3.97Å; I263-I506 HydrophobicContact CD1-CD1 4.24Å; I263-I506 HydrophobicContact CG2-CD1 4.3Å; I496-I506 HydrophobicContact CD1-CD1 4.24Å; I496-I506 HydrophobicContact CD1-CG1 4Å; I496-I506 HydrophobicContact CD1-CG2 4.05Å; I496-I506 HydrophobicContact CG1-CB 4.36Å; I496-I506 HydrophobicContact CG1-CG1 4.11Å; I496-I506 HydrophobicContact CG1-CG2 4.01Å; I496-I506 HydrophobicContact CG2-CG1 4.23Å; W504-I506 HydrophobicContact CB-CG1 4.34Å; I506-W523 CarbonylContact O-C 3.25Å; I506-W523 WeakPolarHBondContact O-CA 3.33Å; I506-L524 HydrophobicContact CB-CB 4.29Å; I506-L524 HydrophobicContact CD1-CD2 4.36Å; I506-L524 PolarHBondContact N-O 3.33Å; I506-L524 PolarHBondContact O-N 3.09Å; I506-L526 HydrophobicContact CD1-CD1 3.98Å
507	P	93.2	Very high	81	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	139.4	178.8	29.6	-31.9	0	0	0	110	I254 I255 C495 V520 W523	I254-P507 HydrophobicContact CG1-CB 4.49Å; I254-P507 HydrophobicContact CG1-CG 4.23Å; I254-P507 HydrophobicContact CG2-CB 4.37Å; I255-P507 PolarHBondContact N-O 2.81Å; C495-P507 WeakPolarHBondContact O-CD 3.45Å; P507-V520 HydrophobicContact CB-CG1 4.19Å; P507-W523 HydrophobicContact CB-CD2 4.31Å; P507-W523 HydrophobicContact CB-CE3 3.98Å; P507-W523 HydrophobicContact CB-CH2 3.91Å; P507-W523 HydrophobicContact CB-CZ2 4.21Å; P507-W523 HydrophobicContact CB-CZ3 3.8Å; P507-W523 HydrophobicContact CG-CE3 4.47Å; P507-W523 HydrophobicContact CG-CH2 4.21Å; P507-W523 HydrophobicContact CG-CZ3 3.95Å
508	Y	92.6	Very high	79.6	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.008	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	153.2	177.4	74.5	-96.6	0	0	0	112.8	I255 Y257 A260 L279 K510 V520 S522 L524	I255-Y508 CarbonylContact O-C 3.59Å; I255-Y508 WeakPolarHBondContact O-CA 3.36Å; I255-Y508 WeakPolarHBondContact O-CB 3.45Å; Y257-Y508 HydrophobicContact CD2-CD2 4.17Å; Y257-Y508 AromaticContact CD2-CE2 3.61Å; Y257-Y508 HydrophobicContact CD2-CE2 3.61Å; Y257-Y508 HydrophobicContact CE2-CE2 4.46Å; Y257-Y508 HydrophobicContact CG-CE2 4.48Å; A260-Y508 HydrophobicContact CB-CD1 3.88Å; A260-Y508 HydrophobicContact CB-CD2 4.42Å; A260-Y508 HydrophobicContact CB-CG 3.8Å; L279-Y508 HydrophobicContact CB-CE1 4.5Å; L279-Y508 HydrophobicContact CD2-CD1 4.25Å; L279-Y508 HydrophobicContact CD2-CE1 3.73Å; L279-Y508 PolarHBondContact O-OH 3.07Å; Y508-K510 HydrophobicContact CD2-CG 4.47Å; Y508-K510 HydrophobicContact CE2-CG 3.64Å; Y508-K510 WeakPolarHBondContact OH-CE 3.47Å; Y508-V520 VanDerWaalsContact O-CG1 3.23Å; Y508-V520 WeakPolarHBondContact O-CG1 3.28Å; Y508-S522 PolarHBondContact N-O 3.46Å; Y508-S522 VanDerWaalsContact N-O 3.14Å; Y508-L524 HydrophobicContact CD1-CB 4.3Å
509	Y	87.8	Confident	78.3	Confident	28 Å²	28	55.5 Å²	55.5	11%	0.11	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	131.3	175.2	-66.4	-61.5	0	0	0	112	I254 I255 Y257 G511 Q514 V520	I254-Y509 HydrophobicContact CB-CD2 4.35Å; I254-Y509 HydrophobicContact CB-CE2 3.8Å; I254-Y509 HydrophobicContact CD1-CE2 4.33Å; I254-Y509 WeakPolarHBondContact CD1-OH 3.46Å; I254-Y509 HydrophobicContact CG2-CD1 4.36Å; I254-Y509 HydrophobicContact CG2-CD2 3.64Å; I254-Y509 HydrophobicContact CG2-CE1 4.26Å; I254-Y509 HydrophobicContact CG2-CE2 3.49Å; I254-Y509 VanDerWaalsContact CG2-CE2 3.49Å; I254-Y509 HydrophobicContact CG2-CG 4.1Å; I255-Y509 PolarHBondContact O-N 3.21Å; Y257-Y509 PolarHBondContact N-O 3.14Å; Y509-G511 PolarHBondContact O-N 2.72Å; Y509-Q514 HydrophobicContact CD1-CB 3.41Å; Y509-Q514 VanDerWaalsContact CD1-CB 3.41Å; Y509-Q514 HydrophobicContact CD1-CG 4.06Å; Y509-Q514 VanDerWaalsContact CD1-OE1 3.31Å; Y509-Q514 HydrophobicContact CE1-CB 3.68Å; Y509-Q514 HydrophobicContact CG-CB 4.04Å; Y509-V520 HydrophobicContact CD1-CG2 3.68Å; Y509-V520 HydrophobicContact CE1-CG2 3.3Å
510	K	81.1	Confident	77.4	Confident	114 Å²	114	52.8 Å²	52.8	50%	0.496	26%	0.259	S	S	.	.	S	Bend	trans	-82.2	98	165.6	-72.4	-177.9	178.2	174.7	0	108.5	Y508 Q514 S522	Y508-K510 HydrophobicContact CD2-CG 4.47Å; Y508-K510 HydrophobicContact CE2-CG 3.64Å; Y508-K510 WeakPolarHBondContact OH-CE 3.47Å; K510-Q514 PolarHBondContact O-NE2 3.05Å; K510-S522 VanDerWaalsContact CD-OG 3.3Å; K510-S522 WeakPolarHBondContact CD-OG 3.26Å; K510-S522 WeakPolarHBondContact CE-OG 3.49Å
511	G	70.3	Confident	76.8	Confident	39 Å²	39	55.1 Å²	55.1	40%	0.402	27%	0.272	S	S	.	.	S	Bend	trans	96.9	169.4	175.9	0	0	0	0	0	115.7	Y509 H513	Y509-G511 PolarHBondContact O-N 2.72Å; G511-H513 PolarHBondContact O-N 3.21Å
512	H	56.2	Low	76.7	Confident	147 Å²	147	48.3 Å²	48.3	68%	0.681	24%	0.241	S	C	*	.	S	Bend	trans	-78.1	-5.7	-166.8	-55.2	-59.1	0	0	0	116.3	E258	E258-H512 IonicContact OE1-CE1 2.92Å
513	H	50.7	Low	76.8	Confident	184 Å²	184	45.7 Å²	45.7	85%	0.852	23%	0.225	S	C	*	.			trans	-133.2	51.6	-165.6	-62.1	-42.9	0	0	0	114.2	G511	G511-H513 PolarHBondContact O-N 3.21Å
514	Q	56.3	Low	76.9	Confident	73 Å²	73	45.5 Å²	45.5	34%	0.341	22%	0.223	S	C	.	.			trans	-100.5	134.3	172.3	-66.6	-165.5	23.2	0	0	111.6	Y509 K510	Y509-Q514 HydrophobicContact CD1-CB 3.41Å; Y509-Q514 VanDerWaalsContact CD1-CB 3.41Å; Y509-Q514 HydrophobicContact CD1-CG 4.06Å; Y509-Q514 VanDerWaalsContact CD1-OE1 3.31Å; Y509-Q514 HydrophobicContact CE1-CB 3.68Å; Y509-Q514 HydrophobicContact CG-CB 4.04Å; K510-Q514 PolarHBondContact O-NE2 3.05Å
515	K	56.2	Low	76.9	Confident	84 Å²	84	45.5 Å²	45.5	37%	0.365	22%	0.223	S	C	.	.			trans	-73.1	139.5	179.4	-57.9	-177.3	169.4	-173.7	0	108	N450 E452 H517 T518	N450-K515 PolarHBondContact O-NZ 2.88Å; E452-K515 HydrophobicContact CG-CB 4.42Å; E452-K515 HydrophobicContact CG-CD 4Å; E452-K515 HydrophobicContact CG-CG 4.49Å; E452-K515 VanDerWaalsContact OE1-CD 3.23Å; E452-K515 WeakPolarHBondContact OE1-CD 3.48Å; E452-K515 VanDerWaalsContact OE1-CE 3.31Å; E452-K515 WeakPolarHBondContact OE1-CE 3.32Å; E452-K515 VanDerWaalsContact OE1-CG 3.32Å; E452-K515 WeakPolarHBondContact OE1-CG 3.38Å; E452-K515 IonicContact OE1-NZ 2.72Å; K515-H517 VanDerWaalsContact CD-CE1 3.44Å; K515-H517 WeakPolarHBondContact CD-CE1 3.45Å; K515-H517 PolarHBondContact O-N 2.9Å; K515-T518 HydrophobicContact CB-CG2 4.02Å; K515-T518 PolarHBondContact N-OG1 3.45Å; K515-T518 PolarHBondContact O-N 2.73Å; K515-T518 PolarHBondContact O-OG1 3.44Å
516	F	57	Low	77	Confident	142 Å²	142	45.1 Å²	45.1	62%	0.623	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-23.8	179.8	-89.1	-88.5	0	0	0	115.1
517	H	56.7	Low	76.9	Confident	2 Å²	2	47 Å²	47	1%	0.009	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-5	179.9	68.2	-102	0	0	0	114.1	E452 Q472 K515	E452-H517 WeakPolarHBondContact CG-CE1 3.26Å; E452-H517 WeakPolarHBondContact CG-ND1 2.95Å; Q472-H517 HydrophobicContact CB-CB 4.38Å; K515-H517 VanDerWaalsContact CD-CE1 3.44Å; K515-H517 WeakPolarHBondContact CD-CE1 3.45Å; K515-H517 PolarHBondContact O-N 2.9Å
518	T	64.5	Low	76.9	Confident	15 Å²	15	51.7 Å²	51.7	9%	0.092	25%	0.247	C	C	.	.	S	Bend	trans	-77.3	136.9	178.6	50.3	0	0	0	0	110.4	V478 K515 V520	V478-T518 HydrophobicContact CG2-CG2 4.49Å; K515-T518 HydrophobicContact CB-CG2 4.02Å; K515-T518 PolarHBondContact N-OG1 3.45Å; K515-T518 PolarHBondContact O-N 2.73Å; K515-T518 PolarHBondContact O-OG1 3.44Å; T518-V520 PolarHBondContact O-N 2.8Å
519	A	67.8	Low	76.6	Confident	5 Å²	5	55.8 Å²	55.8	4%	0.041	27%	0.269	C	S	.	.			trans	-60.3	127.9	-179.9	0	0	0	0	0	111.6	Q487 K488 S490	Q487-A519 HydrophobicContact CG-CB 4.39Å; Q487-A519 PolarHBondContact NE2-O 2.96Å; K488-A519 WeakPolarHBondContact O-CB 3.34Å; S490-A519 WeakPolarHBondContact OG-CA 3.43Å
520	V	74.9	Confident	75.8	Confident	3 Å²	3	67.8 Å²	67.8	2%	0.018	32%	0.322	C	S	.	.			trans	-89.9	112.4	172.6	178.4	0	0	0	0	108.7	I254 S490 L494 P507 Y508 Y509 T518 S522	I254-V520 HydrophobicContact CD1-CG2 4.19Å; I254-V520 HydrophobicContact CG2-CG2 4.3Å; S490-V520 PolarHBondContact OG-N 3.46Å; L494-V520 HydrophobicContact CD1-CB 4.32Å; L494-V520 HydrophobicContact CD1-CG2 4.09Å; L494-V520 HydrophobicContact CD2-CB 3.77Å; L494-V520 HydrophobicContact CD2-CG2 4.4Å; P507-V520 HydrophobicContact CB-CG1 4.19Å; Y508-V520 VanDerWaalsContact O-CG1 3.23Å; Y508-V520 WeakPolarHBondContact O-CG1 3.28Å; Y509-V520 HydrophobicContact CD1-CG2 3.68Å; Y509-V520 HydrophobicContact CE1-CG2 3.3Å; T518-V520 PolarHBondContact O-N 2.8Å; V520-S522 WeakPolarHBondContact CG1-O 3.35Å
521	N	80.2	Confident	75.5	Confident	87 Å²	87	65.5 Å²	65.5	47%	0.465	31%	0.313	S	S	.	.			trans	-98.7	-1	175	-72.6	-32.9	0	0	0	113.1	F282	F282-N521 WeakPolarHBondContact CB-O 3.48Å
522	S	89.6	Confident	75.8	Confident	17 Å²	17	66.9 Å²	66.9	12%	0.119	31%	0.309	C	S	.	.			trans	-105.2	126.5	-176	-51.6	0	0	0	0	110.3	Y508 K510 V520	Y508-S522 PolarHBondContact N-O 3.46Å; Y508-S522 VanDerWaalsContact N-O 3.14Å; K510-S522 VanDerWaalsContact CD-OG 3.3Å; K510-S522 WeakPolarHBondContact CD-OG 3.26Å; K510-S522 WeakPolarHBondContact CE-OG 3.49Å; V520-S522 WeakPolarHBondContact CG1-O 3.35Å
523	W	93.7	Very high	76.9	Confident	6 Å²	6	62.4 Å²	62.4	2%	0.023	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	140.6	-176.1	-64.6	79	0	0	0	109.1	A281 V283 L296 C492 D493 L494 C495 H505 I506 P507	A281-W523 HydrophobicContact CB-CB 4.23Å; A281-W523 WeakPolarHBondContact CB-O 3.37Å; A281-W523 PolarHBondContact O-N 2.91Å; V283-W523 HydrophobicContact CG2-CD2 4.45Å; V283-W523 HydrophobicContact CG2-CG 4.4Å; L296-W523 HydrophobicContact CD2-CD2 4.19Å; L296-W523 HydrophobicContact CD2-CE3 3.99Å; L296-W523 HydrophobicContact CD2-CH2 4.02Å; L296-W523 HydrophobicContact CD2-CZ2 4.24Å; L296-W523 HydrophobicContact CD2-CZ3 3.89Å; C492-W523 HydrophobicContact CB-CZ2 4.31Å; D493-W523 WeakPolarHBondContact O-CH2 3.29Å; L494-W523 HydrophobicContact CD2-CZ2 4.24Å; C495-W523 WeakPolarHBondContact O-CZ3 3.3Å; H505-W523 HydrophobicContact CB-CE3 3.88Å; H505-W523 HydrophobicContact CB-CZ3 4.33Å; I506-W523 CarbonylContact O-C 3.25Å; I506-W523 WeakPolarHBondContact O-CA 3.33Å; P507-W523 HydrophobicContact CB-CD2 4.31Å; P507-W523 HydrophobicContact CB-CE3 3.98Å; P507-W523 HydrophobicContact CB-CH2 3.91Å; P507-W523 HydrophobicContact CB-CZ2 4.21Å; P507-W523 HydrophobicContact CB-CZ3 3.8Å; P507-W523 HydrophobicContact CG-CE3 4.47Å; P507-W523 HydrophobicContact CG-CH2 4.21Å; P507-W523 HydrophobicContact CG-CZ3 3.95Å
524	L	97	Very high	78.4	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	117.5	161.6	169.5	62.3	0	0	0	107	A260 I263 Q264 L279 H505 I506 Y508 L526	A260-L524 HydrophobicContact CB-CB 4.45Å; A260-L524 HydrophobicContact CB-CD2 4.44Å; A260-L524 WeakPolarHBondContact O-CD2 3Å; I263-L524 HydrophobicContact CB-CD2 3.96Å; I263-L524 HydrophobicContact CG2-CD2 3.69Å; Q264-L524 HydrophobicContact CB-CD1 4.04Å; Q264-L524 HydrophobicContact CG-CD1 4.3Å; L279-L524 HydrophobicContact CD2-CB 4Å; L279-L524 HydrophobicContact CD2-CD1 3.82Å; L279-L524 HydrophobicContact CD2-CG 4.37Å; L279-L524 HydrophobicContact CG-CD1 4.15Å; H505-L524 CarbonylContact C-O 3.45Å; H505-L524 VanDerWaalsContact CA-O 3.3Å; H505-L524 WeakPolarHBondContact CA-O 3.27Å; I506-L524 HydrophobicContact CB-CB 4.29Å; I506-L524 HydrophobicContact CD1-CD2 4.36Å; I506-L524 PolarHBondContact N-O 3.33Å; I506-L524 PolarHBondContact O-N 3.09Å; Y508-L524 HydrophobicContact CD1-CB 4.3Å; L524-L526 HydrophobicContact CD1-CD2 4.07Å; L524-L526 HydrophobicContact CD1-CG 4.42Å; L524-L526 HydrophobicContact CD2-CD1 4.25Å; L524-L526 HydrophobicContact CD2-CD2 4.08Å; L524-L526 HydrophobicContact CD2-CG 4.08Å; L524-L526 HydrophobicContact CG-CD2 4.1Å; L524-L526 HydrophobicContact CG-CG 3.98Å
525	C	97.5	Very high	79.8	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	114.1	170.9	-176.5	0	0	0	0	109.3	G277 D278 A281 C289 V291 C292 H505	G277-C525 CarbonylContact C-O 3.45Å; G277-C525 VanDerWaalsContact CA-O 3.29Å; G277-C525 WeakPolarHBondContact CA-O 3.3Å; D278-C525 PolarHBondContact N-O 3.07Å; D278-C525 PolarHBondContact O-N 3.23Å; A281-C525 HydrophobicContact CB-CB 3.58Å; C289-C525 VanDerWaalsContact SG-SG 3.69Å; V291-C525 HydrophobicContact CB-CB 4.24Å; C292-C525 VanDerWaalsContact SG-SG 3.61Å; H505-C525 PolarHBondContact NE2-SG 2.89Å
526	L	97.7	Very high	81.4	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	122.3	171.6	-62.4	169.2	0	0	0	108.6	F245 I263 F267 W275 S276 G503 W504 I506 L524	F245-L526 HydrophobicContact CE2-CD1 4.01Å; F245-L526 HydrophobicContact CZ-CD1 4.23Å; I263-L526 HydrophobicContact CG2-CD1 3.77Å; I263-L526 HydrophobicContact CG2-CD2 4.5Å; F267-L526 HydrophobicContact CB-CD2 3.98Å; F267-L526 HydrophobicContact CD2-CD1 3.62Å; F267-L526 HydrophobicContact CD2-CD2 3.91Å; F267-L526 HydrophobicContact CD2-CG 4.38Å; F267-L526 HydrophobicContact CE1-CD1 4.47Å; F267-L526 HydrophobicContact CE2-CD1 3.49Å; F267-L526 VanDerWaalsContact CE2-CD1 3.49Å; F267-L526 HydrophobicContact CG-CD1 4.21Å; F267-L526 HydrophobicContact CG-CD2 3.9Å; F267-L526 HydrophobicContact CZ-CD1 3.94Å; W275-L526 HydrophobicContact CE3-CB 4.15Å; W275-L526 HydrophobicContact CZ3-CB 4.11Å; S276-L526 WeakPolarHBondContact O-CA 3.33Å; G503-L526 CarbonylContact C-O 3.6Å; G503-L526 WeakPolarHBondContact CA-O 3.4Å; W504-L526 HydrophobicContact CB-CB 4.15Å; W504-L526 HydrophobicContact CB-CD1 4.08Å; W504-L526 PolarHBondContact N-O 3.17Å; W504-L526 PolarHBondContact O-N 2.86Å; I506-L526 HydrophobicContact CD1-CD1 3.98Å; L524-L526 HydrophobicContact CD1-CD2 4.07Å; L524-L526 HydrophobicContact CD1-CG 4.42Å; L524-L526 HydrophobicContact CD2-CD1 4.25Å; L524-L526 HydrophobicContact CD2-CD2 4.08Å; L524-L526 HydrophobicContact CD2-CG 4.08Å; L524-L526 HydrophobicContact CG-CD2 4.1Å; L524-L526 HydrophobicContact CG-CG 3.98Å
527	H	94.2	Very high	83.2	Confident	39 Å²	39	45.8 Å²	45.8	18%	0.181	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	148.4	175.7	67	88.5	0	0	0	111.5	W275 S276 C292	W275-H527 VanDerWaalsContact CE3-C 3.43Å; S276-H527 PolarHBondContact N-O 3.32Å; S276-H527 PolarHBondContact O-N 2.95Å; C292-H527 HydrophobicContact CB-CB 4.45Å
528	R	91.9	Very high	85.2	Confident	98 Å²	98	49.2 Å²	49.2	37%	0.37	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	137.3	171.3	-63.6	176.2	-174.5	-145.9	-13.2	109.6	E273 W275 L500	E273-R528 VanDerWaalsContact CD-NH2 3.28Å; E273-R528 IonicContact OE1-CZ 3.14Å; E273-R528 IonicContact OE1-NH1 3.81Å; E273-R528 PolarHBondContact OE1-NH1 3.4Å; E273-R528 IonicContact OE1-NH2 3.55Å; E273-R528 PolarHBondContact OE1-NH2 2.84Å; E273-R528 IonicContact OE2-CZ 3Å; E273-R528 IonicContact OE2-NE 3.56Å; E273-R528 PolarHBondContact OE2-NE 3.4Å; E273-R528 IonicContact OE2-NH1 2.64Å; E273-R528 IonicContact OE2-NH2 3.85Å; E273-R528 PolarHBondContact OE2-NH2 3.28Å; W275-R528 HydrophobicContact CD2-CG 3.86Å; W275-R528 VanDerWaalsContact CE2-CG 3.45Å; W275-R528 HydrophobicContact CE3-CG 4.22Å; W275-R528 HydrophobicContact CH2-CG 3.88Å; W275-R528 HydrophobicContact CZ2-CG 3.49Å; W275-R528 VanDerWaalsContact CZ2-CG 3.49Å; W275-R528 VanDerWaalsContact CZ2-NE 3.28Å; W275-R528 HydrophobicContact CZ3-CG 4.22Å; L500-R528 PolarHBondContact O-NE 3.3Å; L500-R528 VanDerWaalsContact O-NE 3.08Å
529	L	86.8	Confident	86.9	Confident	89 Å²	89	52 Å²	52	47%	0.466	24%	0.242	S	C	.	.			trans	-80.7	127.5	165.1	-65.7	175.9	0	0	0	107.1	R274	R274-L529 HydrophobicContact CB-CB 4.1Å; R274-L529 HydrophobicContact CB-CD1 4.37Å; R274-L529 PolarHBondContact O-N 3.46Å
530	K	71.6	Confident	88.6	Confident	280 Å²	280	56.3 Å²	56.3	100%	1.217	26%	0.26	S	S	*	.			trans	-72.2	0	174.8	-74.2	-171.2	177.2	-174.5	0	111.2

Retrieved 530 of 530 residues in 155.2 ms (Link to these results)

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