A0A087Y6D4_POEFO Loading...

CAAX prenyl protease

Proteolytically removes the C-terminal three residues of farnesylated proteins.

AlphaFold DB , UniProt , Accession A0A087Y6D4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 471 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	55.7	Low	76.3	Confident	200 Å²	200	114.9 Å²	114.9	99%	0.985	59%	0.586	S	S	*	*				0	-54.4	0	-146.6	175	175.1	0	0	112.6	T4 L5	M1-T4 VanDerWaalsContact C-OG1 3.26Å; M1-T4 VanDerWaalsContact CA-OG1 3.3Å; M1-T4 WeakPolarHBondContact CA-OG1 3.43Å; M1-T4 PolarHBondContact O-N 2.99Å; M1-T4 PolarHBondContact O-OG1 2.76Å; M1-L5 PolarHBondContact O-N 3.37Å
2	L	57.3	Low	77.8	Confident	134 Å²	134	108.8 Å²	108.8	70%	0.702	56%	0.559	S	S	*	*	H	α-helix	trans	-65.6	-41.9	175.4	-90.3	137.9	0	0	0	114.2	T4 L5 F6	L2-T4 VanDerWaalsContact C-N 3.26Å; L2-T4 PolarHBondContact O-N 2.99Å; L2-L5 WeakPolarHBondContact O-CB 3.2Å; L2-L5 PolarHBondContact O-N 3.28Å; L2-L5 VanDerWaalsContact O-N 3.17Å; L2-F6 VanDerWaalsContact O-CD2 3.24Å; L2-F6 WeakPolarHBondContact O-CD2 3.45Å
3	K	60.7	Low	79.2	Confident	181 Å²	181	105 Å²	105	79%	0.787	54%	0.537	S	S	*	.	H	α-helix	trans	-62.5	-30.1	177.1	-72.3	-174.7	177.3	-177.7	0	114
4	T	68.1	Low	80.5	Confident	86 Å²	86	99.7 Å²	99.7	53%	0.528	51%	0.51	S	S	.	.	H	α-helix	trans	-74.4	-25.7	177.1	26.4	0	0	0	0	113	M1 L2 L7	M1-T4 VanDerWaalsContact C-OG1 3.26Å; M1-T4 VanDerWaalsContact CA-OG1 3.3Å; M1-T4 WeakPolarHBondContact CA-OG1 3.43Å; M1-T4 PolarHBondContact O-N 2.99Å; M1-T4 PolarHBondContact O-OG1 2.76Å; L2-T4 VanDerWaalsContact C-N 3.26Å; L2-T4 PolarHBondContact O-N 2.99Å; T4-L7 PolarHBondContact O-N 3.18Å
5	L	65.3	Low	81.6	Confident	91 Å²	91	95.1 Å²	95.1	48%	0.476	49%	0.485	S	S	.	.	H	α-helix	trans	-69.2	-39.9	174.4	-97.3	135.9	0	0	0	112	M1 L2 L7 L8 Q13	M1-L5 PolarHBondContact O-N 3.37Å; L2-L5 WeakPolarHBondContact O-CB 3.2Å; L2-L5 PolarHBondContact O-N 3.28Å; L2-L5 VanDerWaalsContact O-N 3.17Å; L5-L7 PolarHBondContact O-N 2.8Å; L5-L8 HydrophobicContact CD2-CD1 4.34Å; L5-L8 WeakPolarHBondContact O-CB 3.49Å; L5-L8 PolarHBondContact O-N 2.99Å; L5-Q13 PolarHBondContact O-NE2 3.1Å
6	F	73.6	Confident	82.5	Confident	155 Å²	155	96.7 Å²	96.7	68%	0.68	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-11	177	-70.1	-72.4	0	0	0	114.2	L2	L2-F6 VanDerWaalsContact O-CD2 3.24Å; L2-F6 WeakPolarHBondContact O-CD2 3.45Å
7	L	85.3	Confident	83.4	Confident	140 Å²	140	95.6 Å²	95.6	73%	0.733	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-7.7	176.7	-65.6	171.7	0	0	0	112.9	T4 L5	T4-L7 PolarHBondContact O-N 3.18Å; L5-L7 PolarHBondContact O-N 2.8Å
8	L	89.1	Confident	84.2	Confident	65 Å²	65	91.1 Å²	91.1	34%	0.34	47%	0.465	S	S	.	.	S	Bend	trans	-71.5	150.8	176.4	-67.3	172.4	0	0	0	110.8	L5 T12 Q13	L5-L8 HydrophobicContact CD2-CD1 4.34Å; L5-L8 WeakPolarHBondContact O-CB 3.49Å; L5-L8 PolarHBondContact O-N 2.99Å; L8-T12 HydrophobicContact CB-CG2 4.41Å; L8-T12 HydrophobicContact CD1-CG2 4.29Å; L8-T12 HydrophobicContact CD2-CG2 4.46Å; L8-Q13 HydrophobicContact CB-CG 3.95Å; L8-Q13 PolarHBondContact O-NE2 3.01Å
9	P	94.3	Very high	84.9	Confident	64 Å²	64	86.4 Å²	86.4	42%	0.416	44%	0.441	S	S	.	.			trans	-55	147.8	170.2	-22.6	33.2	0	0	0	111.9	E11 T12 Q13	P9-E11 VanDerWaalsContact C-N 3.3Å; P9-E11 HydrophobicContact CB-CG 4.15Å; P9-E11 VanDerWaalsContact CB-OE1 3.31Å; P9-E11 WeakPolarHBondContact CB-OE1 3.38Å; P9-E11 WeakPolarHBondContact CB-OE2 3.45Å; P9-E11 PolarHBondContact O-N 2.71Å; P9-T12 WeakPolarHBondContact O-CB 3.48Å; P9-T12 PolarHBondContact O-N 3.42Å; P9-Q13 PolarHBondContact O-N 3.15Å
10	V	95.1	Very high	85.5	Confident	80 Å²	80	85.9 Å²	85.9	49%	0.485	44%	0.443	S	S	.	.	H	α-helix	trans	-60.1	-41.8	-173.7	175.8	0	0	0	0	111.1	T12 Q13 I14 E367	V10-T12 VanDerWaalsContact C-N 3.26Å; V10-T12 PolarHBondContact O-N 3.13Å; V10-Q13 WeakPolarHBondContact O-CB 3.49Å; V10-Q13 PolarHBondContact O-N 2.89Å; V10-Q13 VanDerWaalsContact O-N 3.16Å; V10-I14 HydrophobicContact CG1-CD1 3.8Å; V10-I14 HydrophobicContact CG1-CG1 4.38Å; V10-I14 WeakPolarHBondContact O-CD1 3.43Å; V10-I14 VanDerWaalsContact O-CG1 3.3Å; V10-I14 WeakPolarHBondContact O-CG1 3.41Å; V10-I14 PolarHBondContact O-N 2.84Å; V10-E367 HydrophobicContact CG1-CB 4.34Å
11	E	94.8	Very high	86.1	Confident	68 Å²	68	84.4 Å²	84.4	32%	0.318	43%	0.433	S	S	.	.	H	α-helix	trans	-57.6	-37.9	175.1	61	-87	-155.6	0	0	112.6	P9 F15 V370 A371	P9-E11 VanDerWaalsContact C-N 3.3Å; P9-E11 HydrophobicContact CB-CG 4.15Å; P9-E11 VanDerWaalsContact CB-OE1 3.31Å; P9-E11 WeakPolarHBondContact CB-OE1 3.38Å; P9-E11 WeakPolarHBondContact CB-OE2 3.45Å; P9-E11 PolarHBondContact O-N 2.71Å; E11-F15 PolarHBondContact O-N 2.97Å; E11-F15 VanDerWaalsContact O-N 3.08Å; E11-V370 HydrophobicContact CB-CB 4.31Å; E11-V370 HydrophobicContact CB-CG1 3.93Å; E11-V370 HydrophobicContact CG-CG1 3.91Å; E11-A371 HydrophobicContact CB-CB 4.19Å; E11-A371 VanDerWaalsContact O-CB 3.28Å; E11-A371 WeakPolarHBondContact O-CB 3.48Å
12	T	94.8	Very high	88.2	Confident	42 Å²	42	76.9 Å²	76.9	26%	0.258	40%	0.4	S	S	.	.	H	α-helix	trans	-73.1	-39.7	178.3	-57.6	0	0	0	0	110.4	L8 P9 V10 Y16	L8-T12 HydrophobicContact CB-CG2 4.41Å; L8-T12 HydrophobicContact CD1-CG2 4.29Å; L8-T12 HydrophobicContact CD2-CG2 4.46Å; P9-T12 WeakPolarHBondContact O-CB 3.48Å; P9-T12 PolarHBondContact O-N 3.42Å; V10-T12 VanDerWaalsContact C-N 3.26Å; V10-T12 PolarHBondContact O-N 3.13Å; T12-Y16 HydrophobicContact CG2-CD2 3.58Å; T12-Y16 HydrophobicContact CG2-CE2 3.44Å; T12-Y16 VanDerWaalsContact CG2-CE2 3.44Å; T12-Y16 VanDerWaalsContact O-CD2 3.23Å; T12-Y16 WeakPolarHBondContact O-CD2 3.41Å; T12-Y16 PolarHBondContact O-N 3.35Å; T12-Y16 VanDerWaalsContact O-N 3.1Å
13	Q	95.6	Very high	90.1	Very high	59 Å²	59	75.4 Å²	75.4	28%	0.276	39%	0.385	S	S	.	.	H	α-helix	trans	-62.4	-44	174.2	-64	179.8	16.6	0	0	111.4	L5 L8 P9 V10 S17	L5-Q13 PolarHBondContact O-NE2 3.1Å; L8-Q13 HydrophobicContact CB-CG 3.95Å; L8-Q13 PolarHBondContact O-NE2 3.01Å; P9-Q13 PolarHBondContact O-N 3.15Å; V10-Q13 WeakPolarHBondContact O-CB 3.49Å; V10-Q13 PolarHBondContact O-N 2.89Å; V10-Q13 VanDerWaalsContact O-N 3.16Å; Q13-S17 WeakPolarHBondContact O-CB 3.25Å; Q13-S17 PolarHBondContact O-N 3.17Å; Q13-S17 PolarHBondContact O-OG 3.09Å
14	I	97.1	Very high	91.9	Very high	31 Å²	31	70.7 Å²	70.7	16%	0.159	37%	0.372	C	S	.	.	H	α-helix	trans	-59.5	-53.7	177.6	-69.1	157.6	0	0	0	110.3	V10 Y16 S17 V18 E367 L368 A371 F372 I391	V10-I14 HydrophobicContact CG1-CD1 3.8Å; V10-I14 HydrophobicContact CG1-CG1 4.38Å; V10-I14 WeakPolarHBondContact O-CD1 3.43Å; V10-I14 VanDerWaalsContact O-CG1 3.3Å; V10-I14 WeakPolarHBondContact O-CG1 3.41Å; V10-I14 PolarHBondContact O-N 2.84Å; I14-Y16 PolarHBondContact O-N 3.45Å; I14-S17 PolarHBondContact O-N 2.98Å; I14-V18 WeakPolarHBondContact O-CG2 3.29Å; I14-V18 PolarHBondContact O-N 2.96Å; I14-E367 HydrophobicContact CD1-CB 4.14Å; I14-L368 HydrophobicContact CD1-CD2 4.01Å; I14-L368 HydrophobicContact CG2-CD2 4.36Å; I14-A371 HydrophobicContact CB-CB 4.04Å; I14-A371 HydrophobicContact CG2-CB 3.86Å; I14-F372 HydrophobicContact CG2-CE2 4.38Å; I14-I391 HydrophobicContact CG2-CD1 3.88Å
15	F	97.4	Very high	93.4	Very high	30 Å²	30	67.9 Å²	67.9	13%	0.132	36%	0.355	C	S	.	.	H	α-helix	trans	-57.8	-50.5	-177.2	-179.4	-93.3	0	0	0	112	E11 S17 V18 L19 L88 L89 A371 F372	E11-F15 PolarHBondContact O-N 2.97Å; E11-F15 VanDerWaalsContact O-N 3.08Å; F15-S17 VanDerWaalsContact C-N 3.34Å; F15-S17 PolarHBondContact O-N 3.42Å; F15-V18 PolarHBondContact O-N 3.42Å; F15-L19 HydrophobicContact CE1-CD2 4.34Å; F15-L19 PolarHBondContact O-N 3.49Å; F15-L19 VanDerWaalsContact O-N 3.07Å; F15-L88 HydrophobicContact CE2-CB 4.08Å; F15-L88 HydrophobicContact CZ-CB 4.09Å; F15-L89 HydrophobicContact CE1-CD2 3.94Å; F15-L89 HydrophobicContact CZ-CD2 4.1Å; F15-A371 HydrophobicContact CB-CB 4.41Å; F15-A371 WeakPolarHBondContact CD2-O 3.35Å; F15-F372 HydrophobicContact CD2-CD1 4.18Å; F15-F372 HydrophobicContact CD2-CE1 4.13Å; F15-F372 HydrophobicContact CE2-CD1 4.42Å; F15-F372 HydrophobicContact CE2-CE1 4.49Å
16	Y	96.1	Very high	94.9	Very high	121 Å²	121	65.7 Å²	65.7	48%	0.475	34%	0.34	S	S	.	.	H	α-helix	trans	-69.5	-30.6	179.5	-73	-56.2	0	0	0	113.1	T12 I14 L19 V20	T12-Y16 HydrophobicContact CG2-CD2 3.58Å; T12-Y16 HydrophobicContact CG2-CE2 3.44Å; T12-Y16 VanDerWaalsContact CG2-CE2 3.44Å; T12-Y16 VanDerWaalsContact O-CD2 3.23Å; T12-Y16 WeakPolarHBondContact O-CD2 3.41Å; T12-Y16 PolarHBondContact O-N 3.35Å; T12-Y16 VanDerWaalsContact O-N 3.1Å; I14-Y16 PolarHBondContact O-N 3.45Å; Y16-L19 PolarHBondContact O-N 2.97Å; Y16-V20 VanDerWaalsContact O-CB 3.29Å; Y16-V20 WeakPolarHBondContact O-CB 3.27Å; Y16-V20 WeakPolarHBondContact O-CG2 3.49Å; Y16-V20 PolarHBondContact O-N 2.97Å
17	S	97.1	Very high	96.1	Very high	78 Å²	78	63.8 Å²	63.8	55%	0.545	34%	0.337	S	S	.	.	H	α-helix	trans	-64.2	-42.9	175.2	-62.2	0	0	0	0	111.3	Q13 I14 F15 F21	Q13-S17 WeakPolarHBondContact O-CB 3.25Å; Q13-S17 PolarHBondContact O-N 3.17Å; Q13-S17 PolarHBondContact O-OG 3.09Å; I14-S17 PolarHBondContact O-N 2.98Å; F15-S17 VanDerWaalsContact C-N 3.34Å; F15-S17 PolarHBondContact O-N 3.42Å; S17-F21 VanDerWaalsContact O-CB 3.25Å; S17-F21 WeakPolarHBondContact O-CB 3.38Å; S17-F21 PolarHBondContact O-N 3.1Å
18	V	97.9	Very high	96.7	Very high	14 Å²	14	61.4 Å²	61.4	9%	0.085	32%	0.318	C	S	.	.	H	α-helix	trans	-61.8	-47.5	175	168.1	0	0	0	0	110.7	I14 F15 F21 S22 F372 F390 I391	I14-V18 WeakPolarHBondContact O-CG2 3.29Å; I14-V18 PolarHBondContact O-N 2.96Å; F15-V18 PolarHBondContact O-N 3.42Å; V18-F21 PolarHBondContact O-N 2.96Å; V18-S22 PolarHBondContact O-N 2.91Å; V18-F372 HydrophobicContact CB-CZ 4.35Å; V18-F372 HydrophobicContact CG1-CZ 4.22Å; V18-F372 HydrophobicContact CG2-CZ 4.15Å; V18-F390 HydrophobicContact CG1-CB 3.74Å; V18-F390 HydrophobicContact CG1-CD1 4.2Å; V18-F390 HydrophobicContact CG1-CG 4.09Å; V18-F390 HydrophobicContact CG2-CB 3.99Å; V18-I391 HydrophobicContact CG2-CD1 4.44Å
19	L	97.5	Very high	97.1	Very high	2 Å²	2	60.3 Å²	60.3	1%	0.01	31%	0.311	C	S	.	.	H	α-helix	trans	-65.5	-45	-178	-171.6	63.6	0	0	0	112.4	F15 Y16 F21 S22 W23 T85 L88 L89	F15-L19 HydrophobicContact CE1-CD2 4.34Å; F15-L19 PolarHBondContact O-N 3.49Å; F15-L19 VanDerWaalsContact O-N 3.07Å; Y16-L19 PolarHBondContact O-N 2.97Å; L19-F21 VanDerWaalsContact C-N 3.31Å; L19-F21 PolarHBondContact O-N 3.35Å; L19-S22 WeakPolarHBondContact O-CB 3.47Å; L19-S22 PolarHBondContact O-N 3.28Å; L19-W23 HydrophobicContact CD1-CZ2 3.74Å; L19-W23 HydrophobicContact CD2-CH2 3.53Å; L19-W23 HydrophobicContact CD2-CZ2 3.5Å; L19-W23 VanDerWaalsContact CD2-CZ2 3.5Å; L19-W23 HydrophobicContact CD2-CZ3 4.27Å; L19-W23 HydrophobicContact CG-CD2 4.16Å; L19-W23 HydrophobicContact CG-CE3 4.41Å; L19-W23 HydrophobicContact CG-CH2 3.8Å; L19-W23 HydrophobicContact CG-CZ2 3.48Å; L19-W23 VanDerWaalsContact CG-CZ2 3.48Å; L19-W23 HydrophobicContact CG-CZ3 4.25Å; L19-W23 PolarHBondContact O-N 2.87Å; L19-T85 HydrophobicContact CD1-CG2 4.23Å; L19-L88 HydrophobicContact CD1-CD1 4.41Å; L19-L89 HydrophobicContact CD2-CD2 3.87Å; L19-L89 HydrophobicContact CD2-CG 4.4Å
20	V	97.8	Very high	97.3	Very high	77 Å²	77	58.1 Å²	58.1	47%	0.467	30%	0.299	S	S	.	.	H	α-helix	trans	-63.6	-39.1	176.4	169.1	0	0	0	0	110.9	Y16 W23 T24	Y16-V20 VanDerWaalsContact O-CB 3.29Å; Y16-V20 WeakPolarHBondContact O-CB 3.27Å; Y16-V20 WeakPolarHBondContact O-CG2 3.49Å; Y16-V20 PolarHBondContact O-N 2.97Å; V20-W23 PolarHBondContact O-N 3.08Å; V20-T24 WeakPolarHBondContact O-CB 3.28Å; V20-T24 PolarHBondContact O-N 2.92Å; V20-T24 PolarHBondContact O-OG1 3.1Å
21	F	98.4	Very high	97.4	Very high	55 Å²	55	59.7 Å²	59.7	24%	0.241	30%	0.297	C	S	.	.	H	α-helix	trans	-63.6	-46.8	175.6	-174.9	-100.4	0	0	0	111.4	S17 V18 L19 W23 T24 V25 S393 P394 E397	S17-F21 VanDerWaalsContact O-CB 3.25Å; S17-F21 WeakPolarHBondContact O-CB 3.38Å; S17-F21 PolarHBondContact O-N 3.1Å; V18-F21 PolarHBondContact O-N 2.96Å; L19-F21 VanDerWaalsContact C-N 3.31Å; L19-F21 PolarHBondContact O-N 3.35Å; F21-W23 PolarHBondContact O-N 3.02Å; F21-T24 WeakPolarHBondContact O-CB 3.34Å; F21-T24 PolarHBondContact O-N 3.14Å; F21-T24 VanDerWaalsContact O-N 3.1Å; F21-V25 HydrophobicContact CD1-CG2 4.1Å; F21-V25 HydrophobicContact CE1-CG2 3.55Å; F21-V25 HydrophobicContact CE2-CG2 4.12Å; F21-V25 HydrophobicContact CZ-CG2 3.54Å; F21-V25 WeakPolarHBondContact O-CG2 3.21Å; F21-V25 PolarHBondContact O-N 3.08Å; F21-S393 VanDerWaalsContact CD1-OG 3.25Å; F21-S393 WeakPolarHBondContact CD1-OG 3.44Å; F21-S393 VanDerWaalsContact CE1-C 3.49Å; F21-P394 HydrophobicContact CD1-CG 4.09Å; F21-P394 HydrophobicContact CD2-CB 4.43Å; F21-P394 HydrophobicContact CD2-CG 4.09Å; F21-P394 HydrophobicContact CE1-CB 4.22Å; F21-P394 HydrophobicContact CE1-CG 4.01Å; F21-P394 HydrophobicContact CE2-CB 3.87Å; F21-P394 HydrophobicContact CE2-CG 4.01Å; F21-P394 HydrophobicContact CG-CG 4.15Å; F21-P394 HydrophobicContact CZ-CB 3.77Å; F21-P394 HydrophobicContact CZ-CG 3.99Å; F21-E397 HydrophobicContact CE1-CG 3.97Å; F21-E397 HydrophobicContact CZ-CB 4.31Å; F21-E397 HydrophobicContact CZ-CG 3.95Å
22	S	98.3	Very high	97.6	Very high	42 Å²	42	56.5 Å²	56.5	29%	0.294	28%	0.281	S	S	.	.	H	α-helix	trans	-52.1	-53	174.2	-168.8	0	0	0	0	111.7	V18 L19 T24 V25 Y26 E81	V18-S22 PolarHBondContact O-N 2.91Å; L19-S22 WeakPolarHBondContact O-CB 3.47Å; L19-S22 PolarHBondContact O-N 3.28Å; S22-T24 VanDerWaalsContact C-N 3.29Å; S22-T24 PolarHBondContact O-N 2.85Å; S22-V25 PolarHBondContact O-N 3.29Å; S22-Y26 PolarHBondContact O-N 3.22Å; S22-E81 PolarHBondContact OG-OE1 2.89Å
23	W	98.5	Very high	97.7	Very high	103 Å²	103	55.9 Å²	55.9	39%	0.39	28%	0.279	S	S	.	.	H	α-helix	trans	-62.8	-35.7	178.5	-64.1	-20	0	0	0	113	L19 V20 F21 Y26 L27 E81 T85	L19-W23 HydrophobicContact CD1-CZ2 3.74Å; L19-W23 HydrophobicContact CD2-CH2 3.53Å; L19-W23 HydrophobicContact CD2-CZ2 3.5Å; L19-W23 VanDerWaalsContact CD2-CZ2 3.5Å; L19-W23 HydrophobicContact CD2-CZ3 4.27Å; L19-W23 HydrophobicContact CG-CD2 4.16Å; L19-W23 HydrophobicContact CG-CE3 4.41Å; L19-W23 HydrophobicContact CG-CH2 3.8Å; L19-W23 HydrophobicContact CG-CZ2 3.48Å; L19-W23 VanDerWaalsContact CG-CZ2 3.48Å; L19-W23 HydrophobicContact CG-CZ3 4.25Å; L19-W23 PolarHBondContact O-N 2.87Å; V20-W23 PolarHBondContact O-N 3.08Å; F21-W23 PolarHBondContact O-N 3.02Å; W23-Y26 PolarHBondContact O-N 3.32Å; W23-L27 WeakPolarHBondContact O-CB 3.49Å; W23-L27 WeakPolarHBondContact O-CG 3.26Å; W23-L27 PolarHBondContact O-N 3.45Å; W23-E81 VanDerWaalsContact CD1-OE1 3.24Å; W23-T85 HydrophobicContact CZ2-CG2 3.82Å; W23-T85 PolarHBondContact NE1-OG1 2.74Å
24	T	98.6	Very high	97.8	Very high	81 Å²	81	56.7 Å²	56.7	50%	0.497	29%	0.29	S	S	.	.	H	α-helix	trans	-65.2	-45	177.5	-59.6	0	0	0	0	110.9	V20 F21 S22 L27 W28	V20-T24 WeakPolarHBondContact O-CB 3.28Å; V20-T24 PolarHBondContact O-N 2.92Å; V20-T24 PolarHBondContact O-OG1 3.1Å; F21-T24 WeakPolarHBondContact O-CB 3.34Å; F21-T24 PolarHBondContact O-N 3.14Å; F21-T24 VanDerWaalsContact O-N 3.1Å; S22-T24 VanDerWaalsContact C-N 3.29Å; S22-T24 PolarHBondContact O-N 2.85Å; T24-L27 PolarHBondContact O-N 2.94Å; T24-W28 WeakPolarHBondContact O-CB 3.22Å; T24-W28 PolarHBondContact O-N 3.17Å
25	V	98.1	Very high	97.9	Very high	28 Å²	28	58.2 Å²	58.2	17%	0.17	29%	0.294	C	S	.	.	H	α-helix	trans	-61.8	-49.4	175	174.9	0	0	0	0	109.8	F21 S22 L27 W28 E29 E397	F21-V25 HydrophobicContact CD1-CG2 4.1Å; F21-V25 HydrophobicContact CE1-CG2 3.55Å; F21-V25 HydrophobicContact CE2-CG2 4.12Å; F21-V25 HydrophobicContact CZ-CG2 3.54Å; F21-V25 WeakPolarHBondContact O-CG2 3.21Å; F21-V25 PolarHBondContact O-N 3.08Å; S22-V25 PolarHBondContact O-N 3.29Å; V25-L27 PolarHBondContact O-N 3.11Å; V25-W28 WeakPolarHBondContact O-CB 3.48Å; V25-W28 PolarHBondContact O-N 2.96Å; V25-W28 VanDerWaalsContact O-N 3.14Å; V25-E29 HydrophobicContact CG1-CG 4.19Å; V25-E29 VanDerWaalsContact O-CG 3.29Å; V25-E29 WeakPolarHBondContact O-CG 3.38Å; V25-E29 PolarHBondContact O-N 2.95Å; V25-E397 HydrophobicContact CG1-CG 4.42Å; V25-E397 HydrophobicContact CG2-CG 3.99Å
26	Y	98.1	Very high	97.9	Very high	44 Å²	44	56.9 Å²	56.9	17%	0.173	29%	0.288	C	S	.	.	H	α-helix	trans	-56.7	-45.9	177.9	174.4	-99.3	0	0	0	112.8	S22 W23 W28 E29 A30 L78 E81	S22-Y26 PolarHBondContact O-N 3.22Å; W23-Y26 PolarHBondContact O-N 3.32Å; Y26-W28 VanDerWaalsContact C-N 3.33Å; Y26-W28 PolarHBondContact O-N 3.37Å; Y26-E29 PolarHBondContact O-N 3.37Å; Y26-A30 VanDerWaalsContact O-CB 3.29Å; Y26-A30 WeakPolarHBondContact O-CB 3.46Å; Y26-A30 PolarHBondContact O-N 2.91Å; Y26-L78 HydrophobicContact CE1-CD1 4.39Å; Y26-L78 WeakPolarHBondContact OH-CA 3.5Å; Y26-L78 WeakPolarHBondContact OH-CB 3.4Å; Y26-L78 WeakPolarHBondContact OH-CD1 3.19Å; Y26-E81 HydrophobicContact CD1-CG 4.11Å; Y26-E81 HydrophobicContact CD2-CB 3.8Å; Y26-E81 HydrophobicContact CD2-CG 3.97Å; Y26-E81 HydrophobicContact CE2-CB 4.07Å; Y26-E81 HydrophobicContact CG-CB 4.09Å; Y26-E81 HydrophobicContact CG-CG 3.72Å
27	L	98.4	Very high	98	Very high	116 Å²	116	54.1 Å²	54.1	61%	0.607	28%	0.277	S	S	*	.	H	α-helix	trans	-65.2	-37.4	178.6	-72.7	172.9	0	0	0	112.2	W23 T24 V25 Y31	W23-L27 WeakPolarHBondContact O-CB 3.49Å; W23-L27 WeakPolarHBondContact O-CG 3.26Å; W23-L27 PolarHBondContact O-N 3.45Å; T24-L27 PolarHBondContact O-N 2.94Å; V25-L27 PolarHBondContact O-N 3.11Å; L27-Y31 WeakPolarHBondContact O-CB 3.17Å; L27-Y31 PolarHBondContact O-N 3.32Å
28	W	98.3	Very high	98	Very high	89 Å²	89	57.2 Å²	57.2	34%	0.337	28%	0.281	S	S	.	.	H	α-helix	trans	-61.9	-49.6	172.9	173.5	-115.3	0	0	0	111.1	T24 V25 Y26 A30 Y31 L32 L447 W451	T24-W28 WeakPolarHBondContact O-CB 3.22Å; T24-W28 PolarHBondContact O-N 3.17Å; V25-W28 WeakPolarHBondContact O-CB 3.48Å; V25-W28 PolarHBondContact O-N 2.96Å; V25-W28 VanDerWaalsContact O-N 3.14Å; Y26-W28 VanDerWaalsContact C-N 3.33Å; Y26-W28 PolarHBondContact O-N 3.37Å; W28-A30 PolarHBondContact O-N 3.49Å; W28-Y31 AromaticContact CE3-CD1 3.95Å; W28-Y31 HydrophobicContact CE3-CD1 3.95Å; W28-Y31 AromaticContact CZ3-CD1 3.77Å; W28-Y31 HydrophobicContact CZ3-CD1 3.77Å; W28-Y31 AromaticContact CZ3-CE1 3.97Å; W28-Y31 HydrophobicContact CZ3-CE1 3.97Å; W28-Y31 WeakPolarHBondContact O-CB 3.39Å; W28-Y31 PolarHBondContact O-N 3.5Å; W28-Y31 VanDerWaalsContact O-N 3.13Å; W28-L32 HydrophobicContact CD2-CD1 4.43Å; W28-L32 HydrophobicContact CD2-CG 4.26Å; W28-L32 HydrophobicContact CH2-CD2 3.93Å; W28-L32 HydrophobicContact CZ2-CD1 4.05Å; W28-L32 HydrophobicContact CZ2-CD2 3.77Å; W28-L32 HydrophobicContact CZ2-CG 4.17Å; W28-L32 HydrophobicContact CZ3-CD2 4.34Å; W28-L32 WeakPolarHBondContact O-CG 3.48Å; W28-L32 PolarHBondContact O-N 2.94Å; W28-L447 HydrophobicContact CH2-CD1 4.22Å; W28-L447 HydrophobicContact CH2-CD2 3.82Å; W28-L447 HydrophobicContact CH2-CG 4.25Å; W28-L447 HydrophobicContact CZ2-CD1 4.38Å; W28-L447 HydrophobicContact CZ3-CD2 4.49Å; W28-W451 AromaticContact CD1-CE2 3.96Å; W28-W451 AromaticContact CD1-CZ2 3.94Å; W28-W451 HydrophobicContact CZ2-CE3 4.49Å; W28-W451 AromaticContact NE1-CD2 3.55Å; W28-W451 AromaticContact NE1-CE2 3.54Å; W28-W451 AromaticContact NE1-CE3 3.68Å; W28-W451 AromaticContact NE1-CH2 3.85Å; W28-W451 AromaticContact NE1-CZ2 3.71Å; W28-W451 AromaticContact NE1-CZ3 3.83Å
29	E	97.6	Very high	98	Very high	42 Å²	42	57.9 Å²	57.9	20%	0.196	28%	0.283	C	S	.	.	H	α-helix	trans	-64	-39.3	179.3	-65.3	-68.8	-162.5	0	0	112.8	V25 Y26 Y31 L32 S33 W451 H452	V25-E29 HydrophobicContact CG1-CG 4.19Å; V25-E29 VanDerWaalsContact O-CG 3.29Å; V25-E29 WeakPolarHBondContact O-CG 3.38Å; V25-E29 PolarHBondContact O-N 2.95Å; Y26-E29 PolarHBondContact O-N 3.37Å; E29-Y31 VanDerWaalsContact C-N 3.34Å; E29-L32 PolarHBondContact O-N 3.32Å; E29-S33 VanDerWaalsContact O-CB 3.29Å; E29-S33 WeakPolarHBondContact O-CB 3.41Å; E29-S33 PolarHBondContact O-N 2.76Å; E29-S33 PolarHBondContact O-OG 2.98Å; E29-W451 VanDerWaalsContact CD-NE1 3.34Å; E29-W451 PolarHBondContact OE1-NE1 3.1Å; E29-W451 PolarHBondContact OE2-NE1 3.47Å; E29-H452 VanDerWaalsContact CD-CE1 3.48Å; E29-H452 IonicContact OE1-CE1 3.39Å; E29-H452 IonicContact OE2-CE1 2.7Å; E29-H452 PolarHBondContact OE2-CE1 3.38Å; E29-H452 IonicContact OE2-ND1 3.74Å; E29-H452 IonicContact OE2-NE2 2.98Å; E29-H452 PolarHBondContact OE2-NE2 3.12Å
30	A	97.5	Very high	97.9	Very high	19 Å²	19	58.3 Å²	58.3	16%	0.157	29%	0.285	C	S	.	.	H	α-helix	trans	-63.2	-41.4	173.4	0	0	0	0	0	111.3	Y26 W28 S33 C34	Y26-A30 VanDerWaalsContact O-CB 3.29Å; Y26-A30 WeakPolarHBondContact O-CB 3.46Å; Y26-A30 PolarHBondContact O-N 2.91Å; W28-A30 PolarHBondContact O-N 3.49Å; A30-S33 PolarHBondContact O-N 2.72Å; A30-C34 WeakPolarHBondContact O-CB 3.25Å; A30-C34 PolarHBondContact O-N 2.98Å; A30-C34 PolarHBondContact O-SG 3.11Å
31	Y	98.4	Very high	97.8	Very high	113 Å²	113	61.5 Å²	61.5	44%	0.443	29%	0.288	S	S	.	.	H	α-helix	trans	-60.8	-48.5	174.5	168.3	-104.5	0	0	0	111.6	L27 W28 E29 S33 C34 R35 L447	L27-Y31 WeakPolarHBondContact O-CB 3.17Å; L27-Y31 PolarHBondContact O-N 3.32Å; W28-Y31 AromaticContact CE3-CD1 3.95Å; W28-Y31 HydrophobicContact CE3-CD1 3.95Å; W28-Y31 AromaticContact CZ3-CD1 3.77Å; W28-Y31 HydrophobicContact CZ3-CD1 3.77Å; W28-Y31 AromaticContact CZ3-CE1 3.97Å; W28-Y31 HydrophobicContact CZ3-CE1 3.97Å; W28-Y31 WeakPolarHBondContact O-CB 3.39Å; W28-Y31 PolarHBondContact O-N 3.5Å; W28-Y31 VanDerWaalsContact O-N 3.13Å; E29-Y31 VanDerWaalsContact C-N 3.34Å; Y31-S33 VanDerWaalsContact C-N 3.34Å; Y31-S33 PolarHBondContact O-N 3.28Å; Y31-C34 WeakPolarHBondContact O-CB 3.41Å; Y31-C34 PolarHBondContact O-N 3.41Å; Y31-R35 HydrophobicContact CE1-CG 4.42Å; Y31-R35 HydrophobicContact CE2-CG 4.29Å; Y31-R35 WeakPolarHBondContact O-CG 3.4Å; Y31-R35 PolarHBondContact O-N 2.81Å; Y31-R35 VanDerWaalsContact O-N 3.12Å; Y31-R35 PolarHBondContact OH-NH1 2.84Å; Y31-L447 HydrophobicContact CE1-CD2 3.98Å
32	L	98.3	Very high	97.7	Very high	0 Å²	0	63 Å²	63	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-58.5	-47.2	176.2	-64.1	-173	0	0	0	111.3	W28 E29 C34 R35 Q36 L447 F448 W451	W28-L32 HydrophobicContact CD2-CD1 4.43Å; W28-L32 HydrophobicContact CD2-CG 4.26Å; W28-L32 HydrophobicContact CH2-CD2 3.93Å; W28-L32 HydrophobicContact CZ2-CD1 4.05Å; W28-L32 HydrophobicContact CZ2-CD2 3.77Å; W28-L32 HydrophobicContact CZ2-CG 4.17Å; W28-L32 HydrophobicContact CZ3-CD2 4.34Å; W28-L32 WeakPolarHBondContact O-CG 3.48Å; W28-L32 PolarHBondContact O-N 2.94Å; E29-L32 PolarHBondContact O-N 3.32Å; L32-C34 VanDerWaalsContact C-N 3.32Å; L32-C34 PolarHBondContact O-N 3.08Å; L32-R35 WeakPolarHBondContact O-CB 3.15Å; L32-R35 PolarHBondContact O-N 3.26Å; L32-R35 VanDerWaalsContact O-N 3.12Å; L32-Q36 PolarHBondContact O-N 3.42Å; L32-L447 HydrophobicContact CD2-CB 4.31Å; L32-L447 HydrophobicContact CD2-CD2 3.64Å; L32-L447 HydrophobicContact CD2-CG 3.51Å; L32-F448 HydrophobicContact CB-CD2 3.92Å; L32-F448 WeakPolarHBondContact O-CD2 3.39Å; L32-W451 HydrophobicContact CD1-CB 3.54Å; L32-W451 HydrophobicContact CD1-CD2 4.21Å; L32-W451 HydrophobicContact CD1-CG 3.5Å
33	S	97.8	Very high	97.5	Very high	29 Å²	29	62.5 Å²	62.5	20%	0.203	30%	0.298	C	S	.	.	H	α-helix	trans	-61.2	-38.7	178.3	-65.2	0	0	0	0	112.4	E29 A30 Y31 R35 Q36 R37	E29-S33 VanDerWaalsContact O-CB 3.29Å; E29-S33 WeakPolarHBondContact O-CB 3.41Å; E29-S33 PolarHBondContact O-N 2.76Å; E29-S33 PolarHBondContact O-OG 2.98Å; A30-S33 PolarHBondContact O-N 2.72Å; Y31-S33 VanDerWaalsContact C-N 3.34Å; Y31-S33 PolarHBondContact O-N 3.28Å; S33-R35 PolarHBondContact O-N 2.93Å; S33-Q36 PolarHBondContact O-N 3.37Å; S33-R37 VanDerWaalsContact O-CB 3.27Å; S33-R37 WeakPolarHBondContact O-CB 3.46Å; S33-R37 PolarHBondContact O-N 2.86Å
34	C	97.9	Very high	97.1	Very high	76 Å²	76	61.8 Å²	61.8	51%	0.514	30%	0.301	S	S	.	.	H	α-helix	trans	-62.7	-40.2	174.2	-77.6	0	0	0	0	112.4	A30 Y31 L32 R37 K38	A30-C34 WeakPolarHBondContact O-CB 3.25Å; A30-C34 PolarHBondContact O-N 2.98Å; A30-C34 PolarHBondContact O-SG 3.11Å; Y31-C34 WeakPolarHBondContact O-CB 3.41Å; Y31-C34 PolarHBondContact O-N 3.41Å; L32-C34 VanDerWaalsContact C-N 3.32Å; L32-C34 PolarHBondContact O-N 3.08Å; C34-R37 PolarHBondContact O-N 3.16Å; C34-K38 PolarHBondContact O-N 3.4Å
35	R	98.3	Very high	96.7	Very high	63 Å²	63	64.7 Å²	64.7	24%	0.238	31%	0.308	C	S	.	.	H	α-helix	trans	-63.4	-47.9	176.1	-63.7	169.6	62	79.5	13.5	111.2	Y31 L32 S33 R37 K38 I39 D445	Y31-R35 HydrophobicContact CE1-CG 4.42Å; Y31-R35 HydrophobicContact CE2-CG 4.29Å; Y31-R35 WeakPolarHBondContact O-CG 3.4Å; Y31-R35 PolarHBondContact O-N 2.81Å; Y31-R35 VanDerWaalsContact O-N 3.12Å; Y31-R35 PolarHBondContact OH-NH1 2.84Å; L32-R35 WeakPolarHBondContact O-CB 3.15Å; L32-R35 PolarHBondContact O-N 3.26Å; L32-R35 VanDerWaalsContact O-N 3.12Å; S33-R35 PolarHBondContact O-N 2.93Å; R35-R37 VanDerWaalsContact C-N 3.34Å; R35-R37 PolarHBondContact O-N 3.41Å; R35-K38 WeakPolarHBondContact O-CB 3.35Å; R35-K38 PolarHBondContact O-N 3.32Å; R35-I39 PolarHBondContact O-N 3.47Å; R35-D445 HydrophobicContact CB-CB 4.36Å; R35-D445 IonicContact CZ-OD1 3.85Å; R35-D445 IonicContact CZ-OD2 3.51Å; R35-D445 IonicContact NE-OD1 2.87Å; R35-D445 PolarHBondContact NE-OD1 3.46Å; R35-D445 IonicContact NE-OD2 2.7Å; R35-D445 PolarHBondContact NE-OD2 3.29Å; R35-D445 IonicContact NH2-OD1 3.62Å; R35-D445 PolarHBondContact NH2-OD1 2.82Å; R35-D445 IonicContact NH2-OD2 3.56Å; R35-D445 PolarHBondContact NH2-OD2 3.42Å
36	Q	98.3	Very high	96.2	Very high	2 Å²	2	65 Å²	65	1%	0.009	31%	0.31	C	S	.	.	H	α-helix	trans	-62.7	-42.4	177.8	-176.1	63	10.3	0	0	111.7	L32 S33 K38 I39 Y40 F448	L32-Q36 PolarHBondContact O-N 3.42Å; S33-Q36 PolarHBondContact O-N 3.37Å; Q36-K38 VanDerWaalsContact C-N 3.27Å; Q36-K38 PolarHBondContact O-N 3.36Å; Q36-I39 WeakPolarHBondContact O-CB 3.36Å; Q36-I39 PolarHBondContact O-N 3.06Å; Q36-Y40 HydrophobicContact CG-CE1 4.2Å; Q36-Y40 HydrophobicContact CG-CE2 3.78Å; Q36-Y40 WeakPolarHBondContact CG-OH 3.39Å; Q36-Y40 PolarHBondContact NE2-OH 3.19Å; Q36-Y40 PolarHBondContact O-N 3.22Å; Q36-F448 HydrophobicContact CB-CB 4.04Å; Q36-F448 HydrophobicContact CB-CD1 3.82Å; Q36-F448 HydrophobicContact CB-CD2 3.69Å; Q36-F448 HydrophobicContact CB-CE1 4.17Å; Q36-F448 HydrophobicContact CB-CE2 4.07Å; Q36-F448 HydrophobicContact CB-CG 3.57Å; Q36-F448 HydrophobicContact CB-CZ 4.31Å; Q36-F448 HydrophobicContact CG-CD1 3.63Å; Q36-F448 HydrophobicContact CG-CD2 4.3Å; Q36-F448 HydrophobicContact CG-CE1 3.71Å; Q36-F448 HydrophobicContact CG-CE2 4.39Å; Q36-F448 HydrophobicContact CG-CG 3.96Å; Q36-F448 HydrophobicContact CG-CZ 4.11Å
37	R	97.4	Very high	95.5	Very high	64 Å²	64	64.3 Å²	64.3	24%	0.242	31%	0.311	C	S	.	.	H	α-helix	trans	-62.5	-34.5	176.3	-167.9	177.1	-174.5	-148.7	8.6	112.6	S33 C34 R35 I39 Y40 R41 L67 S70 N71	S33-R37 VanDerWaalsContact O-CB 3.27Å; S33-R37 WeakPolarHBondContact O-CB 3.46Å; S33-R37 PolarHBondContact O-N 2.86Å; C34-R37 PolarHBondContact O-N 3.16Å; R35-R37 VanDerWaalsContact C-N 3.34Å; R35-R37 PolarHBondContact O-N 3.41Å; R37-I39 VanDerWaalsContact C-N 3.29Å; R37-I39 PolarHBondContact O-N 2.63Å; R37-Y40 PolarHBondContact O-N 3.09Å; R37-R41 VanDerWaalsContact CZ-NH2 3.28Å; R37-R41 VanDerWaalsContact NH2-NH2 3.19Å; R37-R41 WeakPolarHBondContact O-CG 3.38Å; R37-R41 PolarHBondContact O-N 3.19Å; R37-R41 VanDerWaalsContact O-N 3.15Å; R37-L67 HydrophobicContact CG-CD1 3.95Å; R37-S70 WeakPolarHBondContact CG-OG 3.32Å; R37-N71 PolarHBondContact NH2-OD1 3.1Å
38	K	97.7	Very high	94.7	Very high	143 Å²	143	67.9 Å²	67.9	62%	0.622	33%	0.325	S	S	*	.	H	α-helix	trans	-59.3	-43.2	173.2	-174.2	179.8	177.6	-178.6	0	110.3	C34 R35 Q36 Y40 R41 T42	C34-K38 PolarHBondContact O-N 3.4Å; R35-K38 WeakPolarHBondContact O-CB 3.35Å; R35-K38 PolarHBondContact O-N 3.32Å; Q36-K38 VanDerWaalsContact C-N 3.27Å; Q36-K38 PolarHBondContact O-N 3.36Å; K38-Y40 PolarHBondContact O-N 3.24Å; K38-R41 PolarHBondContact O-N 2.94Å; K38-T42 HydrophobicContact CG-CG2 4.05Å; K38-T42 WeakPolarHBondContact O-CG2 3.17Å; K38-T42 PolarHBondContact O-N 3.26Å; K38-T42 PolarHBondContact O-OG1 3.34Å
39	I	96.7	Very high	93.6	Very high	28 Å²	28	68.7 Å²	68.7	14%	0.144	33%	0.332	C	S	.	.	H	α-helix	trans	-60.4	-44.7	176.9	-68.2	-174.4	0	0	0	111.8	R35 Q36 R37 R41 T42 T43 F441 V443 D445	R35-I39 PolarHBondContact O-N 3.47Å; Q36-I39 WeakPolarHBondContact O-CB 3.36Å; Q36-I39 PolarHBondContact O-N 3.06Å; R37-I39 VanDerWaalsContact C-N 3.29Å; R37-I39 PolarHBondContact O-N 2.63Å; I39-R41 PolarHBondContact O-N 3.19Å; I39-T42 PolarHBondContact O-N 2.7Å; I39-T43 VanDerWaalsContact O-CB 3.25Å; I39-T43 WeakPolarHBondContact O-CB 3.14Å; I39-T43 PolarHBondContact O-N 3.45Å; I39-T43 PolarHBondContact O-OG1 2.82Å; I39-F441 HydrophobicContact CG2-CE1 3.96Å; I39-V443 HydrophobicContact CG2-CB 4.29Å; I39-V443 HydrophobicContact CG2-CG1 3.9Å; I39-D445 HydrophobicContact CD1-CB 3.5Å; I39-D445 VanDerWaalsContact CD1-CB 3.5Å; I39-D445 HydrophobicContact CG1-CB 4.46Å
40	Y	96.4	Very high	92.6	Very high	11 Å²	11	66.9 Å²	66.9	4%	0.043	32%	0.324	C	S	.	.	H	α-helix	trans	-61.5	-27	175.5	-56.8	-32.9	0	0	0	113.3	Q36 R37 K38 R63 Q66 F441	Q36-Y40 HydrophobicContact CG-CE1 4.2Å; Q36-Y40 HydrophobicContact CG-CE2 3.78Å; Q36-Y40 WeakPolarHBondContact CG-OH 3.39Å; Q36-Y40 PolarHBondContact NE2-OH 3.19Å; Q36-Y40 PolarHBondContact O-N 3.22Å; R37-Y40 PolarHBondContact O-N 3.09Å; K38-Y40 PolarHBondContact O-N 3.24Å; Y40-R63 WeakPolarHBondContact O-CD 3.24Å; Y40-R63 WeakPolarHBondContact O-CG 3.44Å; Y40-R63 PolarHBondContact O-NH1 3.29Å; Y40-Q66 HydrophobicContact CD1-CB 4.23Å; Y40-Q66 HydrophobicContact CD2-CB 4.25Å; Y40-Q66 HydrophobicContact CE1-CB 3.87Å; Y40-Q66 HydrophobicContact CE1-CG 4.44Å; Y40-Q66 HydrophobicContact CE2-CB 3.89Å; Y40-Q66 HydrophobicContact CG-CB 4.42Å; Y40-F441 HydrophobicContact CD1-CB 4.46Å; Y40-F441 AromaticContact CD1-CD1 3.49Å; Y40-F441 HydrophobicContact CD1-CD1 3.49Å; Y40-F441 VanDerWaalsContact CD1-CD1 3.49Å; Y40-F441 AromaticContact CD1-CE1 3.82Å; Y40-F441 HydrophobicContact CD1-CE1 3.82Å; Y40-F441 AromaticContact CD1-CG 3.98Å; Y40-F441 HydrophobicContact CD1-CG 3.98Å; Y40-F441 HydrophobicContact CE1-CB 4.01Å; Y40-F441 AromaticContact CE1-CD1 3.5Å; Y40-F441 HydrophobicContact CE1-CD1 3.5Å; Y40-F441 HydrophobicContact CE1-CE1 4.24Å; Y40-F441 AromaticContact CE1-CG 3.95Å; Y40-F441 HydrophobicContact CE1-CG 3.95Å
41	R	96	Very high	91.4	Very high	143 Å²	143	68.3 Å²	68.3	54%	0.54	34%	0.34	S	S	.	.	H	α-helix	trans	-86.2	-36	178.2	-72.8	-178.8	170.7	-168	-4.4	113.2	R37 K38 I39 L67	R37-R41 VanDerWaalsContact CZ-NH2 3.28Å; R37-R41 VanDerWaalsContact NH2-NH2 3.19Å; R37-R41 WeakPolarHBondContact O-CG 3.38Å; R37-R41 PolarHBondContact O-N 3.19Å; R37-R41 VanDerWaalsContact O-N 3.15Å; K38-R41 PolarHBondContact O-N 2.94Å; I39-R41 PolarHBondContact O-N 3.19Å; R41-L67 HydrophobicContact CG-CD1 3.94Å
42	T	95.6	Very high	90.2	Very high	87 Å²	87	71 Å²	71	53%	0.534	35%	0.354	S	S	.	.	H	α-helix	trans	-88.9	-30.2	-174.6	55.6	0	0	0	0	113	K38 I39 I44	K38-T42 HydrophobicContact CG-CG2 4.05Å; K38-T42 WeakPolarHBondContact O-CG2 3.17Å; K38-T42 PolarHBondContact O-N 3.26Å; K38-T42 PolarHBondContact O-OG1 3.34Å; I39-T42 PolarHBondContact O-N 2.7Å; T42-I44 PolarHBondContact O-N 2.84Å; T42-I44 VanDerWaalsContact O-N 3.14Å
43	T	93.3	Very high	89	Confident	32 Å²	32	73.4 Å²	73.4	20%	0.196	37%	0.366	C	S	.	.			trans	-90.5	80	-175	-40.4	0	0	0	0	109.2	I39 F59 R63 F441	I39-T43 VanDerWaalsContact O-CB 3.25Å; I39-T43 WeakPolarHBondContact O-CB 3.14Å; I39-T43 PolarHBondContact O-N 3.45Å; I39-T43 PolarHBondContact O-OG1 2.82Å; T43-F59 HydrophobicContact CG2-CZ 3.97Å; T43-F59 VanDerWaalsContact O-CE1 3.31Å; T43-F59 WeakPolarHBondContact O-CE1 3.37Å; T43-R63 WeakPolarHBondContact O-CD 3.38Å; T43-F441 HydrophobicContact CG2-CZ 4.26Å
44	I	91.3	Very high	88.3	Confident	88 Å²	88	72.4 Å²	72.4	45%	0.451	36%	0.359	S	S	.	.			trans	-93.9	-5.1	-177.2	59.2	168.1	0	0	0	113.6	T42	T42-I44 PolarHBondContact O-N 2.84Å; T42-I44 VanDerWaalsContact O-N 3.14Å
45	H	88.7	Confident	87.8	Confident	142 Å²	142	70.7 Å²	70.7	66%	0.657	34%	0.344	S	S	*	.	S	Bend	trans	-122.8	148.9	178.2	-59.1	-49.7	0	0	0	110.1	F59	H45-F59 WeakPolarHBondContact O-CZ 3.3Å
46	V	87.6	Confident	87.4	Confident	33 Å²	33	72.2 Å²	72.2	20%	0.2	36%	0.362	C	S	.	.			trans	-62.7	128.9	176.9	-172	0	0	0	0	108.7	L50 M54 F59	V46-L50 HydrophobicContact CG1-CB 3.85Å; V46-M54 HydrophobicContact CG1-CB 4.28Å; V46-F59 HydrophobicContact CG2-CB 3.69Å; V46-F59 HydrophobicContact CG2-CD1 4.24Å; V46-F59 HydrophobicContact CG2-CD2 4.14Å; V46-F59 HydrophobicContact CG2-CG 3.77Å
47	P	83.8	Confident	87	Confident	30 Å²	30	76.3 Å²	76.3	20%	0.195	38%	0.384	C	S	.	.			trans	-57	145.6	172.9	-23.4	32.7	0	0	0	111.4	E49 L50 G51 V443	P47-E49 PolarHBondContact O-N 3.02Å; P47-E49 VanDerWaalsContact O-N 3.13Å; P47-L50 CarbonylContact O-C 3.55Å; P47-L50 PolarHBondContact O-N 3.46Å; P47-G51 PolarHBondContact O-N 3.03Å; P47-V443 HydrophobicContact CG-CG2 3.48Å; P47-V443 VanDerWaalsContact CG-CG2 3.48Å
48	E	82.6	Confident	86.7	Confident	192 Å²	192	74.3 Å²	74.3	90%	0.897	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-54.1	-37.8	-178.9	-67.5	-175.1	170.8	0	0	112.8	L50 G51	E48-L50 PolarHBondContact O-N 3.29Å; E48-L50 VanDerWaalsContact O-N 3.15Å; E48-G51 PolarHBondContact O-N 3.26Å; E48-G51 VanDerWaalsContact O-N 3.17Å
49	E	75.1	Confident	86.5	Confident	106 Å²	106	67.6 Å²	67.6	50%	0.495	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-59	-25.4	177.3	-60.9	178.1	-165.7	0	0	113.5	P47 L459 R463	P47-E49 PolarHBondContact O-N 3.02Å; P47-E49 VanDerWaalsContact O-N 3.13Å; E49-L459 HydrophobicContact CB-CD2 4.31Å; E49-R463 IonicContact OE1-CZ 3.83Å; E49-R463 IonicContact OE1-NH2 2.84Å; E49-R463 PolarHBondContact OE1-NH2 3.17Å; E49-R463 IonicContact OE2-CZ 3.45Å; E49-R463 IonicContact OE2-NE 3.42Å; E49-R463 PolarHBondContact OE2-NE 3.22Å; E49-R463 IonicContact OE2-NH2 2.71Å; E49-R463 PolarHBondContact OE2-NH2 3.25Å
50	L	75.7	Confident	86.4	Confident	4 Å²	4	69.3 Å²	69.3	2%	0.021	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-111.9	-3.5	-179.5	-63.8	173.2	0	0	0	113.1	V46 P47 E48 K52 I53 M54 P442 L459 L462	V46-L50 HydrophobicContact CG1-CB 3.85Å; P47-L50 CarbonylContact O-C 3.55Å; P47-L50 PolarHBondContact O-N 3.46Å; E48-L50 PolarHBondContact O-N 3.29Å; E48-L50 VanDerWaalsContact O-N 3.15Å; L50-K52 PolarHBondContact O-N 2.98Å; L50-K52 VanDerWaalsContact O-N 3.1Å; L50-I53 PolarHBondContact O-N 3.18Å; L50-M54 HydrophobicContact CB-CB 4.38Å; L50-M54 PolarHBondContact O-N 3.38Å; L50-P442 HydrophobicContact CD1-CB 3.41Å; L50-P442 VanDerWaalsContact CD1-CB 3.41Å; L50-P442 HydrophobicContact CD1-CG 3.39Å; L50-L459 HydrophobicContact CD1-CD1 4.45Å; L50-L459 HydrophobicContact CD1-CD2 3.89Å; L50-L459 HydrophobicContact CD1-CG 4.32Å; L50-L459 HydrophobicContact CD2-CD2 3.64Å; L50-L459 HydrophobicContact CG-CD2 3.71Å; L50-L462 HydrophobicContact CD2-CD1 4.37Å
51	G	73.8	Confident	86.3	Confident	48 Å²	48	74.7 Å²	74.7	50%	0.495	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-26.6	-171.7	0	0	0	0	0	114.1	P47 E48	P47-G51 PolarHBondContact O-N 3.03Å; E48-G51 PolarHBondContact O-N 3.26Å; E48-G51 VanDerWaalsContact O-N 3.17Å
52	K	72.2	Confident	86.2	Confident	171 Å²	171	67.9 Å²	67.9	74%	0.743	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-13	175.3	-66.5	-172.8	179.9	-177.4	0	114.1	L50	L50-K52 PolarHBondContact O-N 2.98Å; L50-K52 VanDerWaalsContact O-N 3.1Å
53	I	73.6	Confident	86.3	Confident	49 Å²	49	65.1 Å²	65.1	25%	0.251	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.6	-46.5	-162.9	-57.9	-177.6	0	0	0	110.7	L50 Y428 I432	L50-I53 PolarHBondContact O-N 3.18Å; I53-Y428 HydrophobicContact CD1-CE1 4.01Å; I53-I432 HydrophobicContact CD1-CD1 3.84Å; I53-I432 HydrophobicContact CG2-CB 4.15Å; I53-I432 HydrophobicContact CG2-CD1 3.53Å; I53-I432 HydrophobicContact CG2-CG1 3.92Å; I53-I432 HydrophobicContact CG2-CG2 3.21Å
54	M	82.1	Confident	86.5	Confident	9 Å²	9	67 Å²	67	4%	0.044	34%	0.343	C	S	.	.	S	Bend	trans	-102.9	119.8	-176.8	-167.4	175.3	-171.7	0	0	109.8	V46 L50 T58 F59 S62 P442	V46-M54 HydrophobicContact CG1-CB 4.28Å; L50-M54 HydrophobicContact CB-CB 4.38Å; L50-M54 PolarHBondContact O-N 3.38Å; M54-T58 HydrophobicContact CE-CG2 4.12Å; M54-F59 HydrophobicContact CE-CB 3.93Å; M54-F59 HydrophobicContact CE-CD2 4.07Å; M54-F59 HydrophobicContact CE-CG 4.45Å; M54-F59 HydrophobicContact CG-CB 4.3Å; M54-F59 HydrophobicContact SD-CB 4.08Å; M54-F59 HydrophobicContact SD-CD2 3.69Å; M54-F59 HydrophobicContact SD-CG 4.38Å; M54-S62 WeakPolarHBondContact CE-OG 3.17Å; M54-P442 HydrophobicContact SD-CG 3.96Å
55	D	87.4	Confident	86.8	Confident	40 Å²	40	62.9 Å²	62.9	21%	0.214	32%	0.322	C	S	.	.			trans	-69.4	146	176.4	61	86.9	0	0	0	111.5	D57 T58 F59 K316 M436	D55-D57 PolarHBondContact O-N 2.76Å; D55-T58 PolarHBondContact O-N 2.69Å; D55-T58 VanDerWaalsContact OD1-CB 3.24Å; D55-T58 WeakPolarHBondContact OD1-CB 3.31Å; D55-T58 PolarHBondContact OD1-N 2.8Å; D55-T58 PolarHBondContact OD1-OG1 3.19Å; D55-T58 PolarHBondContact OD2-OG1 3.23Å; D55-F59 PolarHBondContact O-N 2.98Å; D55-K316 IonicContact OD2-NZ 2.6Å; D55-K316 PolarHBondContact OD2-NZ 3.47Å; D55-M436 WeakPolarHBondContact OD2-CE 3.38Å
56	P	89.3	Confident	87.2	Confident	94 Å²	94	57.6 Å²	57.6	61%	0.61	30%	0.298	S	S	*	.	H	α-helix	trans	-56.7	-35.1	-178.6	-27.4	35.2	0	0	0	114.1	F59 E60	P56-F59 PolarHBondContact O-N 3.34Å; P56-E60 PolarHBondContact O-N 3.32Å
57	D	91	Very high	87.7	Confident	89 Å²	89	57.6 Å²	57.6	48%	0.476	30%	0.296	S	S	.	.	H	α-helix	trans	-64	-46.7	179.1	-66.2	-16.2	0	0	0	110.8	D55 F59 E60 K61 K313	D55-D57 PolarHBondContact O-N 2.76Å; D57-F59 VanDerWaalsContact C-N 3.34Å; D57-E60 PolarHBondContact O-N 2.73Å; D57-K61 WeakPolarHBondContact O-CG 3.42Å; D57-K61 PolarHBondContact O-N 3.28Å; D57-K313 IonicContact OD2-NZ 3.09Å; D57-K313 PolarHBondContact OD2-NZ 2.88Å
58	T	90.5	Very high	88.4	Confident	21 Å²	21	58.2 Å²	58.2	13%	0.129	30%	0.298	C	S	.	.	H	α-helix	trans	-67.8	-35.3	178	-58.3	0	0	0	0	111.5	M54 D55 K61 S62 M436 L439	M54-T58 HydrophobicContact CE-CG2 4.12Å; D55-T58 PolarHBondContact O-N 2.69Å; D55-T58 VanDerWaalsContact OD1-CB 3.24Å; D55-T58 WeakPolarHBondContact OD1-CB 3.31Å; D55-T58 PolarHBondContact OD1-N 2.8Å; D55-T58 PolarHBondContact OD1-OG1 3.19Å; D55-T58 PolarHBondContact OD2-OG1 3.23Å; T58-K61 PolarHBondContact O-N 3.06Å; T58-S62 WeakPolarHBondContact O-CB 3.35Å; T58-S62 PolarHBondContact O-N 3.46Å; T58-S62 PolarHBondContact O-OG 2.9Å; T58-M436 HydrophobicContact CG2-CB 4.21Å; T58-M436 HydrophobicContact CG2-CE 3.82Å; T58-M436 HydrophobicContact CG2-CG 4.26Å; T58-L439 HydrophobicContact CG2-CD2 4.23Å
59	F	92.9	Very high	89.1	Confident	3 Å²	3	52.6 Å²	52.6	1%	0.013	27%	0.271	C	S	.	.	H	α-helix	trans	-62.4	-47.5	174.3	-177	-91.7	0	0	0	111.9	T43 H45 V46 M54 D55 P56 D57 K61 S62 R63 F441 P442	T43-F59 HydrophobicContact CG2-CZ 3.97Å; T43-F59 VanDerWaalsContact O-CE1 3.31Å; T43-F59 WeakPolarHBondContact O-CE1 3.37Å; H45-F59 WeakPolarHBondContact O-CZ 3.3Å; V46-F59 HydrophobicContact CG2-CB 3.69Å; V46-F59 HydrophobicContact CG2-CD1 4.24Å; V46-F59 HydrophobicContact CG2-CD2 4.14Å; V46-F59 HydrophobicContact CG2-CG 3.77Å; M54-F59 HydrophobicContact CE-CB 3.93Å; M54-F59 HydrophobicContact CE-CD2 4.07Å; M54-F59 HydrophobicContact CE-CG 4.45Å; M54-F59 HydrophobicContact CG-CB 4.3Å; M54-F59 HydrophobicContact SD-CB 4.08Å; M54-F59 HydrophobicContact SD-CD2 3.69Å; M54-F59 HydrophobicContact SD-CG 4.38Å; D55-F59 PolarHBondContact O-N 2.98Å; P56-F59 PolarHBondContact O-N 3.34Å; D57-F59 VanDerWaalsContact C-N 3.34Å; F59-K61 PolarHBondContact O-N 3.24Å; F59-S62 PolarHBondContact O-N 3.15Å; F59-R63 WeakPolarHBondContact O-CB 3.36Å; F59-R63 PolarHBondContact O-N 2.96Å; F59-F441 HydrophobicContact CD2-CE2 4.24Å; F59-F441 AromaticContact CE1-CE2 3.92Å; F59-F441 HydrophobicContact CE1-CE2 3.92Å; F59-F441 HydrophobicContact CE1-CZ 4.31Å; F59-F441 HydrophobicContact CE2-CD2 4.33Å; F59-F441 AromaticContact CE2-CE2 3.53Å; F59-F441 HydrophobicContact CE2-CE2 3.53Å; F59-F441 AromaticContact CE2-CZ 3.91Å; F59-F441 HydrophobicContact CE2-CZ 3.91Å; F59-F441 HydrophobicContact CZ-CD2 4.5Å; F59-F441 AromaticContact CZ-CE2 3.35Å; F59-F441 HydrophobicContact CZ-CE2 3.35Å; F59-F441 AromaticContact CZ-CZ 3.52Å; F59-F441 HydrophobicContact CZ-CZ 3.52Å; F59-P442 HydrophobicContact CD2-CG 4.43Å; F59-P442 HydrophobicContact CE2-CG 4.21Å
60	E	94.8	Very high	90.2	Very high	64 Å²	64	48.5 Å²	48.5	30%	0.299	25%	0.254	S	S	.	.	H	α-helix	trans	-63.9	-41.7	177.3	-179.2	58.1	-163.6	0	0	111.6	P56 D57 S62 R63 L64	P56-E60 PolarHBondContact O-N 3.32Å; D57-E60 PolarHBondContact O-N 2.73Å; E60-S62 PolarHBondContact O-N 2.87Å; E60-R63 WeakPolarHBondContact O-CB 3.43Å; E60-R63 PolarHBondContact O-N 2.99Å; E60-R63 IonicContact OE1-CZ 3.62Å; E60-R63 IonicContact OE1-NE 2.81Å; E60-R63 IonicContact OE1-NH2 3.69Å; E60-R63 PolarHBondContact OE1-NH2 3.31Å; E60-R63 IonicContact OE2-CZ 2.76Å; E60-R63 VanDerWaalsContact OE2-CZ 3.28Å; E60-R63 IonicContact OE2-NE 3.32Å; E60-R63 PolarHBondContact OE2-NE 2.98Å; E60-R63 IonicContact OE2-NH2 2.72Å; E60-R63 PolarHBondContact OE2-NH2 3.03Å; E60-L64 HydrophobicContact CG-CD1 4.13Å; E60-L64 HydrophobicContact CG-CG 4.45Å; E60-L64 VanDerWaalsContact O-CG 3.32Å; E60-L64 WeakPolarHBondContact O-CG 3.29Å; E60-L64 PolarHBondContact O-N 3.02Å; E60-L64 WeakPolarHBondContact OE1-CG 3.42Å
61	K	94.9	Very high	91.2	Very high	124 Å²	124	51 Å²	51	54%	0.539	27%	0.267	S	S	.	.	H	α-helix	trans	-58.4	-46.9	173.3	-73.7	178.8	-178.5	-176.1	0	112.2	D57 T58 F59 R63 L64 Y65 L439	D57-K61 WeakPolarHBondContact O-CG 3.42Å; D57-K61 PolarHBondContact O-N 3.28Å; T58-K61 PolarHBondContact O-N 3.06Å; F59-K61 PolarHBondContact O-N 3.24Å; K61-R63 VanDerWaalsContact C-N 3.32Å; K61-R63 PolarHBondContact O-N 3Å; K61-L64 PolarHBondContact O-N 3.16Å; K61-Y65 WeakPolarHBondContact O-CB 3.47Å; K61-Y65 PolarHBondContact O-N 3.49Å; K61-L439 HydrophobicContact CB-CD1 4.28Å; K61-L439 HydrophobicContact CB-CD2 3.86Å
62	S	94.8	Very high	92.4	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61.4	-42.8	177.6	-55.6	0	0	0	0	111.3	M54 T58 F59 E60 Y65 Q66 L439	M54-S62 WeakPolarHBondContact CE-OG 3.17Å; T58-S62 WeakPolarHBondContact O-CB 3.35Å; T58-S62 PolarHBondContact O-N 3.46Å; T58-S62 PolarHBondContact O-OG 2.9Å; F59-S62 PolarHBondContact O-N 3.15Å; E60-S62 PolarHBondContact O-N 2.87Å; S62-Y65 PolarHBondContact O-N 2.99Å; S62-Q66 WeakPolarHBondContact O-CG 3.29Å; S62-Q66 PolarHBondContact O-N 3.42Å; S62-L439 WeakPolarHBondContact OG-CA 3.44Å
63	R	96.5	Very high	93.6	Very high	29 Å²	29	45.4 Å²	45.4	11%	0.109	24%	0.237	C	C	.	.	H	α-helix	trans	-61.9	-47.2	177.6	-165.1	-176.2	69.7	73.1	-1.2	111.8	Y40 T43 F59 E60 K61 L67 F441	Y40-R63 WeakPolarHBondContact O-CD 3.24Å; Y40-R63 WeakPolarHBondContact O-CG 3.44Å; Y40-R63 PolarHBondContact O-NH1 3.29Å; T43-R63 WeakPolarHBondContact O-CD 3.38Å; F59-R63 WeakPolarHBondContact O-CB 3.36Å; F59-R63 PolarHBondContact O-N 2.96Å; E60-R63 WeakPolarHBondContact O-CB 3.43Å; E60-R63 PolarHBondContact O-N 2.99Å; E60-R63 IonicContact OE1-CZ 3.62Å; E60-R63 IonicContact OE1-NE 2.81Å; E60-R63 IonicContact OE1-NH2 3.69Å; E60-R63 PolarHBondContact OE1-NH2 3.31Å; E60-R63 IonicContact OE2-CZ 2.76Å; E60-R63 VanDerWaalsContact OE2-CZ 3.28Å; E60-R63 IonicContact OE2-NE 3.32Å; E60-R63 PolarHBondContact OE2-NE 2.98Å; E60-R63 IonicContact OE2-NH2 2.72Å; E60-R63 PolarHBondContact OE2-NH2 3.03Å; K61-R63 VanDerWaalsContact C-N 3.32Å; K61-R63 PolarHBondContact O-N 3Å; R63-L67 VanDerWaalsContact O-CB 3.27Å; R63-L67 WeakPolarHBondContact O-CB 3.48Å; R63-L67 PolarHBondContact O-N 2.62Å; R63-F441 HydrophobicContact CB-CD2 3.98Å; R63-F441 HydrophobicContact CB-CE2 3.68Å; R63-F441 HydrophobicContact CG-CD2 4.35Å; R63-F441 HydrophobicContact CG-CE2 3.76Å; R63-F441 HydrophobicContact CG-CZ 4.26Å
64	L	97.4	Very high	94.7	Very high	71 Å²	71	46.4 Å²	46.4	37%	0.372	24%	0.24	S	C	.	.	H	α-helix	trans	-66.1	-41.5	178.8	-68.7	174.7	0	0	0	111.9	E60 K61 L67 D68	E60-L64 HydrophobicContact CG-CD1 4.13Å; E60-L64 HydrophobicContact CG-CG 4.45Å; E60-L64 VanDerWaalsContact O-CG 3.32Å; E60-L64 WeakPolarHBondContact O-CG 3.29Å; E60-L64 PolarHBondContact O-N 3.02Å; E60-L64 WeakPolarHBondContact OE1-CG 3.42Å; K61-L64 PolarHBondContact O-N 3.16Å; L64-L67 PolarHBondContact O-N 3.48Å; L64-D68 PolarHBondContact O-N 3.48Å
65	Y	97.9	Very high	95.4	Very high	1 Å²	1	52.3 Å²	52.3	0%	0.004	26%	0.262	C	S	.	.	H	α-helix	trans	-58.9	-51.3	175.1	177.3	-127.1	0	0	0	111.9	K61 S62 L67 D68 K69 I144 E145 H148 F150 L439	K61-Y65 WeakPolarHBondContact O-CB 3.47Å; K61-Y65 PolarHBondContact O-N 3.49Å; S62-Y65 PolarHBondContact O-N 2.99Å; Y65-L67 VanDerWaalsContact C-N 3.29Å; Y65-L67 PolarHBondContact O-N 2.91Å; Y65-D68 PolarHBondContact O-N 3.2Å; Y65-K69 HydrophobicContact CD1-CD 4.25Å; Y65-K69 HydrophobicContact CD2-CD 4.07Å; Y65-K69 HydrophobicContact CD2-CG 4.38Å; Y65-K69 HydrophobicContact CE1-CD 3.72Å; Y65-K69 HydrophobicContact CE2-CD 3.57Å; Y65-K69 HydrophobicContact CE2-CG 4.13Å; Y65-K69 HydrophobicContact CG-CD 4.42Å; Y65-K69 WeakPolarHBondContact O-CG 3.27Å; Y65-K69 PolarHBondContact O-N 2.86Å; Y65-K69 PolarHBondContact OH-NZ 3.27Å; Y65-I144 HydrophobicContact CE2-CG2 4.35Å; Y65-E145 VanDerWaalsContact OH-CD 3.29Å; Y65-E145 PolarHBondContact OH-OE1 2.88Å; Y65-E145 PolarHBondContact OH-OE2 3.17Å; Y65-H148 WeakPolarHBondContact CA-CE1 3.3Å; Y65-H148 HydrophobicContact CD2-CB 3.66Å; Y65-H148 AromaticContact CD2-CD2 3.5Å; Y65-H148 VanDerWaalsContact CD2-CD2 3.5Å; Y65-H148 WeakPolarHBondContact CD2-CD2 3.41Å; Y65-H148 AromaticContact CD2-CG 3.43Å; Y65-H148 VanDerWaalsContact CD2-CG 3.43Å; Y65-H148 HydrophobicContact CE2-CB 4.13Å; Y65-H148 HydrophobicContact CG-CB 4.37Å; Y65-H148 PolarHBondContact N-CE1 3.41Å; Y65-H148 VanDerWaalsContact N-CE1 3.34Å; Y65-F150 AromaticContact CD1-CE2 3.97Å; Y65-F150 HydrophobicContact CD1-CE2 3.97Å; Y65-F150 HydrophobicContact CD2-CD2 4.38Å; Y65-F150 HydrophobicContact CD2-CE2 4.13Å; Y65-F150 HydrophobicContact CE1-CD2 4.32Å; Y65-F150 AromaticContact CE1-CE2 3.64Å; Y65-F150 HydrophobicContact CE1-CE2 3.64Å; Y65-F150 HydrophobicContact CE1-CZ 4.35Å; Y65-F150 AromaticContact CE2-CD2 3.76Å; Y65-F150 HydrophobicContact CE2-CD2 3.76Å; Y65-F150 AromaticContact CE2-CE2 3.78Å; Y65-F150 HydrophobicContact CE2-CE2 3.78Å; Y65-F150 HydrophobicContact CG-CE2 4.2Å; Y65-F150 AromaticContact CZ-CD2 3.72Å; Y65-F150 AromaticContact CZ-CE2 3.52Å; Y65-L439 HydrophobicContact CD1-CB 3.66Å; Y65-L439 HydrophobicContact CE1-CB 4.32Å; Y65-L439 HydrophobicContact CG-CB 4.28Å; Y65-L439 HydrophobicContact CG-CD1 4.5Å
66	Q	97.4	Very high	95.9	Very high	32 Å²	32	51.4 Å²	51.4	15%	0.15	26%	0.259	C	S	.	.	H	α-helix	trans	-67.4	-29.3	178.2	-62.2	-52.5	-33.4	0	0	112.8	Y40 S62 S70 L439 F441	Y40-Q66 HydrophobicContact CD1-CB 4.23Å; Y40-Q66 HydrophobicContact CD2-CB 4.25Å; Y40-Q66 HydrophobicContact CE1-CB 3.87Å; Y40-Q66 HydrophobicContact CE1-CG 4.44Å; Y40-Q66 HydrophobicContact CE2-CB 3.89Å; Y40-Q66 HydrophobicContact CG-CB 4.42Å; S62-Q66 WeakPolarHBondContact O-CG 3.29Å; S62-Q66 PolarHBondContact O-N 3.42Å; Q66-S70 WeakPolarHBondContact O-CB 3.47Å; Q66-S70 PolarHBondContact O-N 3.38Å; Q66-L439 PolarHBondContact NE2-O 2.98Å; Q66-L439 VanDerWaalsContact NE2-O 3.08Å; Q66-F441 HydrophobicContact CB-CB 4.26Å; Q66-F441 HydrophobicContact CG-CB 3.57Å
67	L	97.8	Very high	96.3	Very high	32 Å²	32	48.2 Å²	48.2	17%	0.168	24%	0.243	C	C	.	.	H	α-helix	trans	-68.8	-40.6	175.4	-169.5	68.1	0	0	0	112.1	R37 R41 R63 L64 Y65 S70 N71	R37-L67 HydrophobicContact CG-CD1 3.95Å; R41-L67 HydrophobicContact CG-CD1 3.94Å; R63-L67 VanDerWaalsContact O-CB 3.27Å; R63-L67 WeakPolarHBondContact O-CB 3.48Å; R63-L67 PolarHBondContact O-N 2.62Å; L64-L67 PolarHBondContact O-N 3.48Å; Y65-L67 VanDerWaalsContact C-N 3.29Å; Y65-L67 PolarHBondContact O-N 2.91Å; L67-S70 PolarHBondContact O-N 3.35Å; L67-N71 WeakPolarHBondContact O-CB 3.23Å; L67-N71 PolarHBondContact O-N 3.3Å
68	D	98.3	Very high	96.7	Very high	43 Å²	43	46.4 Å²	46.4	23%	0.23	23%	0.233	C	C	.	.	H	α-helix	trans	-65.9	-44.8	174.3	-75.5	-23.7	0	0	0	111	L64 Y65 S70 N71 F72 I144 K147 H148	L64-D68 PolarHBondContact O-N 3.48Å; Y65-D68 PolarHBondContact O-N 3.2Å; D68-S70 VanDerWaalsContact C-N 3.35Å; D68-S70 PolarHBondContact O-N 2.66Å; D68-N71 PolarHBondContact O-N 2.89Å; D68-F72 PolarHBondContact O-N 3.17Å; D68-I144 HydrophobicContact CB-CG2 4.36Å; D68-K147 IonicContact OD1-NZ 2.83Å; D68-K147 WeakPolarHBondContact OD2-CE 3.31Å; D68-K147 IonicContact OD2-NZ 3.57Å; D68-K147 PolarHBondContact OD2-NZ 3.2Å; D68-H148 IonicContact OD2-CD2 2.76Å; D68-H148 IonicContact OD2-CE1 3.45Å; D68-H148 IonicContact OD2-NE2 3.34Å; D68-H148 PolarHBondContact OD2-NE2 3.47Å
69	K	97.9	Very high	97	Very high	75 Å²	75	49.4 Å²	49.4	33%	0.326	24%	0.243	S	C	.	.	H	α-helix	trans	-61.1	-41.9	174.4	-73.1	-179.4	72.6	155.4	0	112.5	Y65 N71 F72 S73 I144	Y65-K69 HydrophobicContact CD1-CD 4.25Å; Y65-K69 HydrophobicContact CD2-CD 4.07Å; Y65-K69 HydrophobicContact CD2-CG 4.38Å; Y65-K69 HydrophobicContact CE1-CD 3.72Å; Y65-K69 HydrophobicContact CE2-CD 3.57Å; Y65-K69 HydrophobicContact CE2-CG 4.13Å; Y65-K69 HydrophobicContact CG-CD 4.42Å; Y65-K69 WeakPolarHBondContact O-CG 3.27Å; Y65-K69 PolarHBondContact O-N 2.86Å; Y65-K69 PolarHBondContact OH-NZ 3.27Å; K69-N71 VanDerWaalsContact C-N 3.33Å; K69-N71 PolarHBondContact O-N 3.4Å; K69-F72 PolarHBondContact O-N 2.94Å; K69-S73 VanDerWaalsContact O-CB 3.27Å; K69-S73 WeakPolarHBondContact O-CB 3.43Å; K69-S73 PolarHBondContact O-N 3.33Å; K69-I144 HydrophobicContact CG-CG2 4.07Å
70	S	97.9	Very high	97.3	Very high	19 Å²	19	52.3 Å²	52.3	13%	0.133	26%	0.263	C	S	.	.	H	α-helix	trans	-61.7	-41.1	175	175.6	0	0	0	0	111.9	R37 Q66 L67 D68 F74	R37-S70 WeakPolarHBondContact CG-OG 3.32Å; Q66-S70 WeakPolarHBondContact O-CB 3.47Å; Q66-S70 PolarHBondContact O-N 3.38Å; L67-S70 PolarHBondContact O-N 3.35Å; D68-S70 VanDerWaalsContact C-N 3.35Å; D68-S70 PolarHBondContact O-N 2.66Å; S70-F74 PolarHBondContact O-N 3.05Å; S70-F74 VanDerWaalsContact O-N 3.11Å
71	N	97.3	Very high	97.5	Very high	57 Å²	57	50.9 Å²	50.9	31%	0.305	26%	0.257	S	S	.	.	H	α-helix	trans	-65.9	-44.7	176.5	-171.7	71.1	0	0	0	111.8	R37 L67 D68 K69 F74 W75	R37-N71 PolarHBondContact NH2-OD1 3.1Å; L67-N71 WeakPolarHBondContact O-CB 3.23Å; L67-N71 PolarHBondContact O-N 3.3Å; D68-N71 PolarHBondContact O-N 2.89Å; K69-N71 VanDerWaalsContact C-N 3.33Å; K69-N71 PolarHBondContact O-N 3.4Å; N71-F74 PolarHBondContact O-N 3.34Å; N71-W75 PolarHBondContact O-N 3.44Å
72	F	98.3	Very high	97.6	Very high	37 Å²	37	49 Å²	49	16%	0.162	25%	0.252	C	S	.	.	H	α-helix	trans	-62.5	-45	176.2	173.4	-97.4	0	0	0	112.7	D68 K69 F74 W75 S76 W136 Y139 I144	D68-F72 PolarHBondContact O-N 3.17Å; K69-F72 PolarHBondContact O-N 2.94Å; F72-F74 VanDerWaalsContact C-N 3.3Å; F72-F74 PolarHBondContact O-N 3.44Å; F72-W75 PolarHBondContact O-N 3.17Å; F72-S76 WeakPolarHBondContact O-CB 3.34Å; F72-S76 PolarHBondContact O-N 2.93Å; F72-S76 PolarHBondContact O-OG 2.83Å; F72-W136 HydrophobicContact CE2-CB 4.43Å; F72-W136 AromaticContact CE2-CE3 3.86Å; F72-W136 HydrophobicContact CE2-CE3 3.86Å; F72-W136 HydrophobicContact CZ-CB 4.07Å; F72-W136 HydrophobicContact CZ-CE3 4.3Å; F72-W136 VanDerWaalsContact CZ-O 3.31Å; F72-W136 WeakPolarHBondContact CZ-O 3.41Å; F72-Y139 AromaticContact CD2-CD1 3.62Å; F72-Y139 HydrophobicContact CD2-CD1 3.62Å; F72-Y139 HydrophobicContact CD2-CE1 4.14Å; F72-Y139 AromaticContact CE2-CD1 3.87Å; F72-Y139 HydrophobicContact CE2-CD1 3.87Å; F72-Y139 HydrophobicContact CE2-CG 4.46Å; F72-I144 HydrophobicContact CB-CD1 3.34Å; F72-I144 HydrophobicContact CD1-CD1 4.14Å; F72-I144 HydrophobicContact CD2-CD1 3.71Å; F72-I144 HydrophobicContact CG-CD1 3.45Å; F72-I144 VanDerWaalsContact CG-CD1 3.45Å
73	S	97.1	Very high	97.8	Very high	64 Å²	64	51 Å²	51	45%	0.448	26%	0.261	S	S	.	.	H	α-helix	trans	-59.6	-40.1	177.9	174.9	0	0	0	0	111.8	K69 S76 G77	K69-S73 VanDerWaalsContact O-CB 3.27Å; K69-S73 WeakPolarHBondContact O-CB 3.43Å; K69-S73 PolarHBondContact O-N 3.33Å; S73-S76 WeakPolarHBondContact CA-OG 3.42Å; S73-S76 PolarHBondContact O-OG 3.03Å; S73-G77 PolarHBondContact O-N 3.27Å
74	F	96.9	Very high	97.9	Very high	70 Å²	70	51.2 Å²	51.2	31%	0.307	27%	0.272	S	S	.	.	H	α-helix	trans	-60.7	-49.9	175.3	175.5	-97.2	0	0	0	112.4	S70 N71 F72 L78	S70-F74 PolarHBondContact O-N 3.05Å; S70-F74 VanDerWaalsContact O-N 3.11Å; N71-F74 PolarHBondContact O-N 3.34Å; F72-F74 VanDerWaalsContact C-N 3.3Å; F72-F74 PolarHBondContact O-N 3.44Å; F74-L78 WeakPolarHBondContact O-CB 3.45Å; F74-L78 PolarHBondContact O-N 3.35Å
75	W	98.2	Very high	97.9	Very high	133 Å²	133	48.7 Å²	48.7	50%	0.504	26%	0.259	S	S	.	.	H	α-helix	trans	-70.9	-41.6	-177.1	-70.5	115.8	0	0	0	113.2	N71 F72 L78 Y79 W136	N71-W75 PolarHBondContact O-N 3.44Å; F72-W75 PolarHBondContact O-N 3.17Å; W75-L78 HydrophobicContact CE3-CD2 4.11Å; W75-L78 HydrophobicContact CZ3-CD2 3.98Å; W75-L78 PolarHBondContact O-N 3.45Å; W75-Y79 WeakPolarHBondContact O-CB 3.1Å; W75-Y79 PolarHBondContact O-N 3.46Å; W75-W136 HydrophobicContact CB-CZ3 4.28Å
76	S	97.6	Very high	98	Very high	22 Å²	22	52.7 Å²	52.7	15%	0.154	28%	0.28	C	S	.	.	H	α-helix	trans	-65.6	-39.9	175.7	53.1	0	0	0	0	111.8	F72 S73 Y79 S80	F72-S76 WeakPolarHBondContact O-CB 3.34Å; F72-S76 PolarHBondContact O-N 2.93Å; F72-S76 PolarHBondContact O-OG 2.83Å; S73-S76 WeakPolarHBondContact CA-OG 3.42Å; S73-S76 PolarHBondContact O-OG 3.03Å; S76-Y79 PolarHBondContact O-N 3.05Å; S76-S80 WeakPolarHBondContact O-CB 3.41Å; S76-S80 PolarHBondContact O-N 3.04Å; S76-S80 PolarHBondContact O-OG 3.19Å
77	G	97.7	Very high	98	Very high	27 Å²	27	53.5 Å²	53.5	28%	0.278	29%	0.285	S	S	.	.	H	α-helix	trans	-63.1	-46.3	173.4	0	0	0	0	0	112.3	S73 Y79 S80 E81	S73-G77 PolarHBondContact O-N 3.27Å; G77-Y79 PolarHBondContact O-N 3.17Å; G77-S80 PolarHBondContact O-N 3.45Å; G77-E81 PolarHBondContact O-N 3.15Å
78	L	98.1	Very high	98	Very high	51 Å²	51	53.1 Å²	53.1	27%	0.267	28%	0.283	S	S	.	.	H	α-helix	trans	-60.6	-44	176.2	179.8	59.9	0	0	0	112	Y26 F74 W75 S80 E81 I82	Y26-L78 HydrophobicContact CE1-CD1 4.39Å; Y26-L78 WeakPolarHBondContact OH-CA 3.5Å; Y26-L78 WeakPolarHBondContact OH-CB 3.4Å; Y26-L78 WeakPolarHBondContact OH-CD1 3.19Å; F74-L78 WeakPolarHBondContact O-CB 3.45Å; F74-L78 PolarHBondContact O-N 3.35Å; W75-L78 HydrophobicContact CE3-CD2 4.11Å; W75-L78 HydrophobicContact CZ3-CD2 3.98Å; W75-L78 PolarHBondContact O-N 3.45Å; L78-S80 VanDerWaalsContact C-N 3.35Å; L78-E81 PolarHBondContact O-N 3.21Å; L78-I82 HydrophobicContact CD1-CD1 3.9Å; L78-I82 HydrophobicContact CD1-CG1 4.25Å; L78-I82 HydrophobicContact CG-CD1 3.89Å; L78-I82 WeakPolarHBondContact O-CB 3.45Å; L78-I82 VanDerWaalsContact O-CG1 3.25Å; L78-I82 WeakPolarHBondContact O-CG1 3.39Å; L78-I82 PolarHBondContact O-N 3.27Å
79	Y	98.5	Very high	98	Very high	84 Å²	84	55.2 Å²	55.2	33%	0.329	29%	0.294	S	S	.	.	H	α-helix	trans	-59.6	-46.6	175	171.5	-94.7	0	0	0	111.7	W75 S76 G77 E81 I82 E83 W136	W75-Y79 WeakPolarHBondContact O-CB 3.1Å; W75-Y79 PolarHBondContact O-N 3.46Å; S76-Y79 PolarHBondContact O-N 3.05Å; G77-Y79 PolarHBondContact O-N 3.17Å; Y79-E81 VanDerWaalsContact C-N 3.33Å; Y79-E81 PolarHBondContact O-N 3.41Å; Y79-I82 PolarHBondContact O-N 2.82Å; Y79-E83 HydrophobicContact CE1-CB 4.5Å; Y79-E83 WeakPolarHBondContact O-CB 3.44Å; Y79-E83 PolarHBondContact O-N 3.28Å; Y79-E83 PolarHBondContact OH-OE1 3.46Å; Y79-W136 AromaticContact CD1-CE2 3.63Å; Y79-W136 AromaticContact CD1-CZ2 3.63Å; Y79-W136 HydrophobicContact CD1-CZ2 3.63Å; Y79-W136 AromaticContact CD1-NE1 3.25Å; Y79-W136 VanDerWaalsContact CD1-NE1 3.25Å; Y79-W136 AromaticContact CD2-CZ2 3.73Å; Y79-W136 HydrophobicContact CD2-CZ2 3.73Å; Y79-W136 HydrophobicContact CE1-CZ2 4.34Å; Y79-W136 AromaticContact CE1-NE1 3.32Å; Y79-W136 VanDerWaalsContact CE1-NE1 3.32Å; Y79-W136 HydrophobicContact CE2-CZ2 4.43Å; Y79-W136 AromaticContact CG-CE2 3.8Å; Y79-W136 HydrophobicContact CG-CH2 4.23Å; Y79-W136 AromaticContact CG-CZ2 3.26Å; Y79-W136 HydrophobicContact CG-CZ2 3.26Å; Y79-W136 AromaticContact CG-NE1 3.86Å; Y79-W136 AromaticContact CZ-NE1 3.98Å
80	S	98	Very high	98	Very high	64 Å²	64	58.3 Å²	58.3	45%	0.448	31%	0.313	S	S	.	.	H	α-helix	trans	-62.4	-41.1	-178.9	-55.3	0	0	0	0	111.5	S76 G77 L78 E83 G84	S76-S80 WeakPolarHBondContact O-CB 3.41Å; S76-S80 PolarHBondContact O-N 3.04Å; S76-S80 PolarHBondContact O-OG 3.19Å; G77-S80 PolarHBondContact O-N 3.45Å; L78-S80 VanDerWaalsContact C-N 3.35Å; S80-E83 PolarHBondContact O-N 2.99Å; S80-G84 PolarHBondContact O-N 2.96Å
81	E	98.3	Very high	97.9	Very high	34 Å²	34	58.7 Å²	58.7	16%	0.159	32%	0.321	C	S	.	.	H	α-helix	trans	-66.9	-40.8	176.9	-169.1	62.6	-151.1	0	0	112	S22 W23 Y26 G77 L78 Y79 T85	S22-E81 PolarHBondContact OG-OE1 2.89Å; W23-E81 VanDerWaalsContact CD1-OE1 3.24Å; Y26-E81 HydrophobicContact CD1-CG 4.11Å; Y26-E81 HydrophobicContact CD2-CB 3.8Å; Y26-E81 HydrophobicContact CD2-CG 3.97Å; Y26-E81 HydrophobicContact CE2-CB 4.07Å; Y26-E81 HydrophobicContact CG-CB 4.09Å; Y26-E81 HydrophobicContact CG-CG 3.72Å; G77-E81 PolarHBondContact O-N 3.15Å; L78-E81 PolarHBondContact O-N 3.21Å; Y79-E81 VanDerWaalsContact C-N 3.33Å; Y79-E81 PolarHBondContact O-N 3.41Å; E81-T85 WeakPolarHBondContact O-CB 3.49Å; E81-T85 PolarHBondContact O-N 3.02Å; E81-T85 PolarHBondContact O-OG1 3.19Å
82	I	98.5	Very high	98	Very high	85 Å²	85	57.1 Å²	57.1	44%	0.436	32%	0.317	S	S	.	.	H	α-helix	trans	-64.8	-46.4	175.6	-69.7	168.7	0	0	0	110.3	L78 Y79 T85 L86	L78-I82 HydrophobicContact CD1-CD1 3.9Å; L78-I82 HydrophobicContact CD1-CG1 4.25Å; L78-I82 HydrophobicContact CG-CD1 3.89Å; L78-I82 WeakPolarHBondContact O-CB 3.45Å; L78-I82 VanDerWaalsContact O-CG1 3.25Å; L78-I82 WeakPolarHBondContact O-CG1 3.39Å; L78-I82 PolarHBondContact O-N 3.27Å; Y79-I82 PolarHBondContact O-N 2.82Å; I82-T85 PolarHBondContact O-N 2.96Å; I82-L86 HydrophobicContact CG2-CD1 3.8Å; I82-L86 HydrophobicContact CG2-CG 4.27Å; I82-L86 WeakPolarHBondContact O-CB 3.33Å; I82-L86 VanDerWaalsContact O-CG 3.24Å; I82-L86 WeakPolarHBondContact O-CG 3.27Å; I82-L86 PolarHBondContact O-N 3.19Å
83	E	98.4	Very high	98	Very high	42 Å²	42	56.3 Å²	56.3	20%	0.196	32%	0.315	C	S	.	.	H	α-helix	trans	-58.8	-51.6	177.6	179.6	178.8	-118.8	0	0	110.8	Y79 S80 T85 L86 I87 F128 T132	Y79-E83 HydrophobicContact CE1-CB 4.5Å; Y79-E83 WeakPolarHBondContact O-CB 3.44Å; Y79-E83 PolarHBondContact O-N 3.28Å; Y79-E83 PolarHBondContact OH-OE1 3.46Å; S80-E83 PolarHBondContact O-N 2.99Å; E83-T85 PolarHBondContact O-N 3.39Å; E83-L86 PolarHBondContact O-N 3.42Å; E83-I87 HydrophobicContact CG-CD1 3.78Å; E83-I87 HydrophobicContact CG-CG1 4.46Å; E83-I87 WeakPolarHBondContact O-CB 3.42Å; E83-I87 VanDerWaalsContact O-CG1 3.26Å; E83-I87 WeakPolarHBondContact O-CG1 3.49Å; E83-I87 PolarHBondContact O-N 3.32Å; E83-F128 WeakPolarHBondContact OE1-CZ 3.07Å; E83-T132 WeakPolarHBondContact OE1-CB 3.3Å; E83-T132 VanDerWaalsContact OE1-CG2 3.3Å; E83-T132 WeakPolarHBondContact OE1-CG2 3.37Å; E83-T132 PolarHBondContact OE1-OG1 2.99Å
84	G	98	Very high	98	Very high	32 Å²	32	54 Å²	54	33%	0.33	30%	0.298	S	S	.	.	H	α-helix	trans	-59.4	-44.9	177.4	0	0	0	0	0	112.7	S80 L86 I87 L88	S80-G84 PolarHBondContact O-N 2.96Å; G84-L86 PolarHBondContact O-N 2.98Å; G84-I87 PolarHBondContact O-N 3.47Å; G84-L88 WeakPolarHBondContact O-CG 3.36Å; G84-L88 PolarHBondContact O-N 2.99Å
85	T	98.6	Very high	98.1	Very high	19 Å²	19	57.4 Å²	57.4	12%	0.117	31%	0.313	C	S	.	.	H	α-helix	trans	-59.6	-46.5	176.3	-67.1	0	0	0	0	111.6	L19 W23 E81 I82 E83 L88 L89	L19-T85 HydrophobicContact CD1-CG2 4.23Å; W23-T85 HydrophobicContact CZ2-CG2 3.82Å; W23-T85 PolarHBondContact NE1-OG1 2.74Å; E81-T85 WeakPolarHBondContact O-CB 3.49Å; E81-T85 PolarHBondContact O-N 3.02Å; E81-T85 PolarHBondContact O-OG1 3.19Å; I82-T85 PolarHBondContact O-N 2.96Å; E83-T85 PolarHBondContact O-N 3.39Å; T85-L88 PolarHBondContact O-N 3.29Å; T85-L89 HydrophobicContact CG2-CD1 3.64Å; T85-L89 HydrophobicContact CG2-CG 4.28Å; T85-L89 WeakPolarHBondContact O-CB 3.29Å; T85-L89 VanDerWaalsContact O-CG 3.29Å; T85-L89 WeakPolarHBondContact O-CG 3.34Å; T85-L89 PolarHBondContact O-N 3.34Å
86	L	98.4	Very high	98.1	Very high	85 Å²	85	52.8 Å²	52.8	45%	0.445	30%	0.298	S	S	.	.	H	α-helix	trans	-68	-39.8	179.2	-70.4	176.1	0	0	0	112	I82 E83 G84 L88 L89 L90	I82-L86 HydrophobicContact CG2-CD1 3.8Å; I82-L86 HydrophobicContact CG2-CG 4.27Å; I82-L86 WeakPolarHBondContact O-CB 3.33Å; I82-L86 VanDerWaalsContact O-CG 3.24Å; I82-L86 WeakPolarHBondContact O-CG 3.27Å; I82-L86 PolarHBondContact O-N 3.19Å; E83-L86 PolarHBondContact O-N 3.42Å; G84-L86 PolarHBondContact O-N 2.98Å; L86-L88 VanDerWaalsContact C-N 3.29Å; L86-L88 PolarHBondContact O-N 3.48Å; L86-L89 PolarHBondContact O-N 3.1Å; L86-L90 HydrophobicContact CB-CD1 4.38Å; L86-L90 HydrophobicContact CD2-CD1 4.4Å; L86-L90 WeakPolarHBondContact O-CB 3.36Å; L86-L90 VanDerWaalsContact O-CG 3.27Å; L86-L90 WeakPolarHBondContact O-CG 3.45Å; L86-L90 PolarHBondContact O-N 3.35Å
87	I	98.3	Very high	98.1	Very high	48 Å²	48	52.2 Å²	52.2	25%	0.246	29%	0.292	C	S	.	.	H	α-helix	trans	-58.5	-43.3	174.8	-73.4	169.3	0	0	0	110.4	E83 G84 G91 G92 I93 F128	E83-I87 HydrophobicContact CG-CD1 3.78Å; E83-I87 HydrophobicContact CG-CG1 4.46Å; E83-I87 WeakPolarHBondContact O-CB 3.42Å; E83-I87 VanDerWaalsContact O-CG1 3.26Å; E83-I87 WeakPolarHBondContact O-CG1 3.49Å; E83-I87 PolarHBondContact O-N 3.32Å; G84-I87 PolarHBondContact O-N 3.47Å; I87-G91 PolarHBondContact O-N 3.44Å; I87-G92 PolarHBondContact O-N 3.29Å; I87-I93 HydrophobicContact CG2-CD1 4.41Å; I87-I93 HydrophobicContact CG2-CG1 4.01Å; I87-F128 HydrophobicContact CD1-CE1 3.91Å; I87-F128 HydrophobicContact CD1-CZ 4.32Å
88	L	97.7	Very high	98.1	Very high	25 Å²	25	56.2 Å²	56.2	13%	0.131	30%	0.304	C	S	.	.	H	α-helix	trans	-69.8	-49.6	178.3	-69	-178.5	0	0	0	112.1	F15 L19 G84 T85 L86 L90 G91 I93 F372 F390	F15-L88 HydrophobicContact CE2-CB 4.08Å; F15-L88 HydrophobicContact CZ-CB 4.09Å; L19-L88 HydrophobicContact CD1-CD1 4.41Å; G84-L88 WeakPolarHBondContact O-CG 3.36Å; G84-L88 PolarHBondContact O-N 2.99Å; T85-L88 PolarHBondContact O-N 3.29Å; L86-L88 VanDerWaalsContact C-N 3.29Å; L86-L88 PolarHBondContact O-N 3.48Å; L88-L90 VanDerWaalsContact C-N 3.35Å; L88-L90 PolarHBondContact O-N 3.11Å; L88-G91 PolarHBondContact O-N 3.43Å; L88-I93 HydrophobicContact CD2-CD1 3.99Å; L88-F372 HydrophobicContact CD2-CD1 3.97Å; L88-F372 HydrophobicContact CD2-CE1 3.9Å; L88-F390 HydrophobicContact CD2-CE1 4.46Å; L88-F390 HydrophobicContact CD2-CE2 4.14Å; L88-F390 HydrophobicContact CD2-CZ 3.91Å
89	L	97.9	Very high	98.1	Very high	87 Å²	87	58.1 Å²	58.1	46%	0.455	31%	0.31	S	S	.	.	H	α-helix	trans	-66.9	-33.4	-176.3	-70.8	175.8	0	0	0	113.4	F15 L19 T85 L86	F15-L89 HydrophobicContact CE1-CD2 3.94Å; F15-L89 HydrophobicContact CZ-CD2 4.1Å; L19-L89 HydrophobicContact CD2-CD2 3.87Å; L19-L89 HydrophobicContact CD2-CG 4.4Å; T85-L89 HydrophobicContact CG2-CD1 3.64Å; T85-L89 HydrophobicContact CG2-CG 4.28Å; T85-L89 WeakPolarHBondContact O-CB 3.29Å; T85-L89 VanDerWaalsContact O-CG 3.29Å; T85-L89 WeakPolarHBondContact O-CG 3.34Å; T85-L89 PolarHBondContact O-N 3.34Å; L86-L89 PolarHBondContact O-N 3.1Å
90	L	98	Very high	98.1	Very high	139 Å²	139	54.1 Å²	54.1	73%	0.728	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	3.5	-177.8	-56.4	177.7	0	0	0	113.2	L86 L88	L86-L90 HydrophobicContact CB-CD1 4.38Å; L86-L90 HydrophobicContact CD2-CD1 4.4Å; L86-L90 WeakPolarHBondContact O-CB 3.36Å; L86-L90 VanDerWaalsContact O-CG 3.27Å; L86-L90 WeakPolarHBondContact O-CG 3.45Å; L86-L90 PolarHBondContact O-N 3.35Å; L88-L90 VanDerWaalsContact C-N 3.35Å; L88-L90 PolarHBondContact O-N 3.11Å
91	G	97.2	Very high	98.1	Very high	28 Å²	28	51.8 Å²	51.8	29%	0.289	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.9	35.9	-180	0	0	0	0	0	113.6	I87 L88 I93 P94 F95	I87-G91 PolarHBondContact O-N 3.44Å; L88-G91 PolarHBondContact O-N 3.43Å; G91-I93 VanDerWaalsContact C-N 3.28Å; G91-I93 PolarHBondContact O-N 3.03Å; G91-P94 VanDerWaalsContact O-CD 3.29Å; G91-P94 WeakPolarHBondContact O-CD 2.81Å; G91-F95 WeakPolarHBondContact O-CB 3.21Å; G91-F95 PolarHBondContact O-N 3.49Å
92	G	98.1	Very high	98	Very high	23 Å²	23	53.2 Å²	53.2	24%	0.237	29%	0.294	C	S	.	.	H	α-helix	trans	-60.3	-34.1	-178.9	0	0	0	0	0	113.6	I87 L96	I87-G92 PolarHBondContact O-N 3.29Å; G92-L96 WeakPolarHBondContact O-CB 3.25Å; G92-L96 PolarHBondContact O-N 2.9Å
93	I	97.9	Very high	98	Very high	21 Å²	21	50.8 Å²	50.8	11%	0.108	28%	0.283	C	S	.	.	H	α-helix	trans	-65.8	-56.6	175.9	-67.7	159.6	0	0	0	111.2	I87 L88 G91 F95 L96 W97 F121 F374 I382 M385 F390	I87-I93 HydrophobicContact CG2-CD1 4.41Å; I87-I93 HydrophobicContact CG2-CG1 4.01Å; L88-I93 HydrophobicContact CD2-CD1 3.99Å; G91-I93 VanDerWaalsContact C-N 3.28Å; G91-I93 PolarHBondContact O-N 3.03Å; I93-F95 VanDerWaalsContact C-N 3.27Å; I93-F95 PolarHBondContact O-N 3.01Å; I93-L96 PolarHBondContact O-N 3.2Å; I93-W97 PolarHBondContact O-N 3.47Å; I93-F121 HydrophobicContact CG2-CE2 4.49Å; I93-F121 HydrophobicContact CG2-CZ 4.28Å; I93-F374 HydrophobicContact CG2-CE2 3.72Å; I93-F374 HydrophobicContact CG2-CZ 3.92Å; I93-I382 HydrophobicContact CG2-CD1 4.19Å; I93-M385 HydrophobicContact CB-CE 4.34Å; I93-M385 HydrophobicContact CD1-CE 3.66Å; I93-M385 HydrophobicContact CG1-CE 3.99Å; I93-M385 HydrophobicContact CG2-CE 3.44Å; I93-M385 VanDerWaalsContact CG2-CE 3.44Å; I93-F390 HydrophobicContact CD1-CE2 3.94Å; I93-F390 HydrophobicContact CD1-CZ 3.88Å
94	P	98.1	Very high	97.9	Very high	15 Å²	15	49 Å²	49	10%	0.097	28%	0.275	C	S	.	.	H	α-helix	trans	-52.9	-43.8	171.9	-29	32	0	0	0	113.3	G91 L96 W97 H98 F372 F374	G91-P94 VanDerWaalsContact O-CD 3.29Å; G91-P94 WeakPolarHBondContact O-CD 2.81Å; P94-L96 PolarHBondContact O-N 3.44Å; P94-W97 WeakPolarHBondContact O-CB 3.38Å; P94-W97 PolarHBondContact O-N 2.98Å; P94-H98 PolarHBondContact O-CD2 3.13Å; P94-H98 PolarHBondContact O-N 3.41Å; P94-F372 WeakPolarHBondContact CG-O 3.48Å; P94-F374 HydrophobicContact CB-CE2 4.38Å; P94-F374 HydrophobicContact CB-CZ 4.49Å; P94-F374 HydrophobicContact CG-CD2 4.19Å; P94-F374 HydrophobicContact CG-CE2 3.76Å; P94-F374 HydrophobicContact CG-CZ 4.32Å
95	F	98.3	Very high	97.8	Very high	142 Å²	142	50.3 Å²	50.3	62%	0.623	28%	0.283	S	S	*	.	H	α-helix	trans	-56.4	-50.2	177.8	171.3	-95.8	0	0	0	111.5	G91 I93 W97 H98 F99	G91-F95 WeakPolarHBondContact O-CB 3.21Å; G91-F95 PolarHBondContact O-N 3.49Å; I93-F95 VanDerWaalsContact C-N 3.27Å; I93-F95 PolarHBondContact O-N 3.01Å; F95-W97 VanDerWaalsContact C-N 3.31Å; F95-W97 PolarHBondContact O-N 3.24Å; F95-H98 PolarHBondContact O-N 3.47Å; F95-F99 WeakPolarHBondContact O-CB 3.22Å; F95-F99 PolarHBondContact O-N 2.88Å
96	L	98.4	Very high	97.7	Very high	36 Å²	36	59.2 Å²	59.2	19%	0.188	31%	0.314	C	S	.	.	H	α-helix	trans	-65.4	-35.9	179.5	-169.3	66.1	0	0	0	111.9	G92 I93 P94 F99 A100 F121 L124 A125	G92-L96 WeakPolarHBondContact O-CB 3.25Å; G92-L96 PolarHBondContact O-N 2.9Å; I93-L96 PolarHBondContact O-N 3.2Å; P94-L96 PolarHBondContact O-N 3.44Å; L96-F99 PolarHBondContact O-N 2.93Å; L96-A100 WeakPolarHBondContact O-CB 3.26Å; L96-A100 PolarHBondContact O-N 3.18Å; L96-F121 HydrophobicContact CB-CD2 4.26Å; L96-F121 HydrophobicContact CB-CE2 3.98Å; L96-F121 HydrophobicContact CD2-CD2 4.16Å; L96-F121 HydrophobicContact CD2-CE2 3.91Å; L96-F121 HydrophobicContact CG-CD2 4.02Å; L96-F121 HydrophobicContact CG-CE2 4.05Å; L96-L124 HydrophobicContact CD1-CB 3.97Å; L96-L124 HydrophobicContact CD1-CD1 4.4Å; L96-L124 HydrophobicContact CG-CB 4.42Å; L96-A125 HydrophobicContact CD2-CB 3.82Å
97	W	98.4	Very high	97.5	Very high	9 Å²	9	62.7 Å²	62.7	3%	0.034	33%	0.326	C	S	.	.	H	α-helix	trans	-62.7	-47	174.4	178.7	-98.5	0	0	0	112.4	I93 P94 F95 F99 A100 G101 E114 Q117 S118 F121 F374 P379 I382	I93-W97 PolarHBondContact O-N 3.47Å; P94-W97 WeakPolarHBondContact O-CB 3.38Å; P94-W97 PolarHBondContact O-N 2.98Å; F95-W97 VanDerWaalsContact C-N 3.31Å; F95-W97 PolarHBondContact O-N 3.24Å; W97-F99 VanDerWaalsContact C-N 3.34Å; W97-A100 WeakPolarHBondContact O-CB 3.42Å; W97-A100 PolarHBondContact O-N 3.19Å; W97-G101 PolarHBondContact O-N 3.42Å; W97-E114 HydrophobicContact CH2-CG 4.23Å; W97-E114 HydrophobicContact CZ2-CG 4.34Å; W97-Q117 HydrophobicContact CD2-CG 4.47Å; W97-Q117 VanDerWaalsContact CE2-NE2 3.26Å; W97-Q117 HydrophobicContact CH2-CB 4.33Å; W97-Q117 HydrophobicContact CH2-CG 4Å; W97-Q117 HydrophobicContact CZ2-CB 4.47Å; W97-Q117 HydrophobicContact CZ2-CG 3.91Å; W97-Q117 HydrophobicContact CZ3-CG 4.34Å; W97-Q117 VanDerWaalsContact NE1-NE2 3.19Å; W97-Q117 PolarHBondContact O-NE2 3.45Å; W97-S118 WeakPolarHBondContact CH2-OG 3.42Å; W97-F121 HydrophobicContact CB-CD2 4.15Å; W97-F121 HydrophobicContact CB-CE2 4.32Å; W97-F121 HydrophobicContact CE3-CB 3.96Å; W97-F121 HydrophobicContact CE3-CD1 4.5Å; W97-F121 HydrophobicContact CE3-CD2 4.01Å; W97-F121 AromaticContact CE3-CG 3.9Å; W97-F121 HydrophobicContact CE3-CG 3.9Å; W97-F121 HydrophobicContact CZ3-CB 4.19Å; W97-F121 HydrophobicContact CZ3-CG 4.4Å; W97-F374 HydrophobicContact CB-CE1 3.96Å; W97-F374 HydrophobicContact CB-CZ 3.93Å; W97-F374 AromaticContact CD1-CE1 3.66Å; W97-F374 HydrophobicContact CD2-CE1 4.16Å; W97-F374 AromaticContact CG-CE1 3.64Å; W97-F374 HydrophobicContact CG-CE1 3.64Å; W97-F374 HydrophobicContact CG-CZ 4.11Å; W97-P379 HydrophobicContact CD2-CG 4.33Å; W97-P379 HydrophobicContact CH2-CB 3.42Å; W97-P379 VanDerWaalsContact CH2-CB 3.42Å; W97-P379 HydrophobicContact CH2-CG 3.85Å; W97-P379 HydrophobicContact CZ2-CB 3.42Å; W97-P379 VanDerWaalsContact CZ2-CB 3.42Å; W97-P379 HydrophobicContact CZ2-CG 3.29Å; W97-P379 HydrophobicContact CZ3-CB 4.1Å; W97-I382 HydrophobicContact CD2-CD1 4.43Å; W97-I382 HydrophobicContact CD2-CG1 4.2Å; W97-I382 HydrophobicContact CE3-CD1 3.83Å; W97-I382 HydrophobicContact CE3-CG1 3.77Å; W97-I382 HydrophobicContact CZ3-CD1 4.36Å; W97-I382 HydrophobicContact CZ3-CG1 4.01Å
98	H	97.3	Very high	97.3	Very high	112 Å²	112	63.5 Å²	63.5	52%	0.519	35%	0.346	S	S	.	.	H	α-helix	trans	-65.6	-37.8	176.5	-70	-58.5	0	0	0	112.2	P94 F95 G101 S102	P94-H98 PolarHBondContact O-CD2 3.13Å; P94-H98 PolarHBondContact O-N 3.41Å; F95-H98 PolarHBondContact O-N 3.47Å; H98-G101 PolarHBondContact O-N 2.89Å; H98-S102 PolarHBondContact O-N 2.82Å; H98-S102 PolarHBondContact O-OG 2.81Å
99	F	98.1	Very high	97.2	Very high	91 Å²	91	66 Å²	66	40%	0.399	36%	0.356	S	S	.	.	H	α-helix	trans	-63.4	-44.1	173.7	-177.9	-105.3	0	0	0	111.4	F95 L96 W97 G101 S102 V103 L124	F95-F99 WeakPolarHBondContact O-CB 3.22Å; F95-F99 PolarHBondContact O-N 2.88Å; L96-F99 PolarHBondContact O-N 2.93Å; W97-F99 VanDerWaalsContact C-N 3.34Å; F99-G101 VanDerWaalsContact C-N 3.32Å; F99-G101 PolarHBondContact O-N 3.43Å; F99-S102 WeakPolarHBondContact O-CB 3.44Å; F99-S102 PolarHBondContact O-N 3.16Å; F99-S102 VanDerWaalsContact O-N 3.11Å; F99-V103 HydrophobicContact CD1-CG2 4.43Å; F99-V103 HydrophobicContact CE1-CG2 4.04Å; F99-V103 HydrophobicContact CZ-CG2 4.13Å; F99-V103 WeakPolarHBondContact O-CG2 3.4Å; F99-V103 PolarHBondContact O-N 3.14Å; F99-L124 HydrophobicContact CD1-CD1 3.76Å; F99-L124 HydrophobicContact CE1-CD1 4Å; F99-L124 HydrophobicContact CE1-CD2 4.41Å
100	A	98.1	Very high	96.9	Very high	0 Å²	0	63 Å²	63	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-57.6	-43.6	174.1	0	0	0	0	0	112	L96 W97 S102 V103 T104 Q117 V120 F121 L124	L96-A100 WeakPolarHBondContact O-CB 3.26Å; L96-A100 PolarHBondContact O-N 3.18Å; W97-A100 WeakPolarHBondContact O-CB 3.42Å; W97-A100 PolarHBondContact O-N 3.19Å; A100-S102 VanDerWaalsContact C-N 3.33Å; A100-S102 PolarHBondContact O-N 3Å; A100-V103 WeakPolarHBondContact O-CB 3.43Å; A100-V103 PolarHBondContact O-N 3.43Å; A100-T104 PolarHBondContact O-N 2.92Å; A100-T104 PolarHBondContact O-OG1 3.05Å; A100-Q117 HydrophobicContact CB-CG 4.25Å; A100-V120 HydrophobicContact CB-CB 4.26Å; A100-V120 HydrophobicContact CB-CG1 3.86Å; A100-F121 HydrophobicContact CB-CB 3.97Å; A100-L124 HydrophobicContact CB-CD1 4.12Å
101	G	97.4	Very high	96.5	Very high	15 Å²	15	61.5 Å²	61.5	16%	0.155	35%	0.345	C	S	.	.	H	α-helix	trans	-63.9	-36.7	175.3	0	0	0	0	0	113.2	W97 H98 F99 V103 T104 A105 Q117	W97-G101 PolarHBondContact O-N 3.42Å; H98-G101 PolarHBondContact O-N 2.89Å; F99-G101 VanDerWaalsContact C-N 3.32Å; F99-G101 PolarHBondContact O-N 3.43Å; G101-V103 VanDerWaalsContact C-N 3.3Å; G101-V103 PolarHBondContact O-N 2.85Å; G101-T104 WeakPolarHBondContact CA-OG1 3.45Å; G101-T104 PolarHBondContact O-N 2.67Å; G101-T104 PolarHBondContact O-OG1 2.76Å; G101-A105 VanDerWaalsContact O-CB 3.29Å; G101-A105 WeakPolarHBondContact O-CB 3.34Å; G101-A105 PolarHBondContact O-N 3.4Å; G101-Q117 VanDerWaalsContact CA-CD 3.5Å
102	S	97.4	Very high	96.3	Very high	63 Å²	63	67.5 Å²	67.5	44%	0.441	37%	0.37	S	S	.	.	H	α-helix	trans	-65.8	-35	174.9	-57.6	0	0	0	0	111.9	H98 F99 A100 R106	H98-S102 PolarHBondContact O-N 2.82Å; H98-S102 PolarHBondContact O-OG 2.81Å; F99-S102 WeakPolarHBondContact O-CB 3.44Å; F99-S102 PolarHBondContact O-N 3.16Å; F99-S102 VanDerWaalsContact O-N 3.11Å; A100-S102 VanDerWaalsContact C-N 3.33Å; A100-S102 PolarHBondContact O-N 3Å; S102-R106 WeakPolarHBondContact O-CG 3.48Å
103	V	97.1	Very high	96.2	Very high	34 Å²	34	72.2 Å²	72.2	21%	0.206	38%	0.382	C	S	.	.	H	α-helix	trans	-67.6	-50.3	173.8	172.7	0	0	0	0	110.4	F99 A100 G101 A105 R106 F107 V120	F99-V103 HydrophobicContact CD1-CG2 4.43Å; F99-V103 HydrophobicContact CE1-CG2 4.04Å; F99-V103 HydrophobicContact CZ-CG2 4.13Å; F99-V103 WeakPolarHBondContact O-CG2 3.4Å; F99-V103 PolarHBondContact O-N 3.14Å; A100-V103 WeakPolarHBondContact O-CB 3.43Å; A100-V103 PolarHBondContact O-N 3.43Å; G101-V103 VanDerWaalsContact C-N 3.3Å; G101-V103 PolarHBondContact O-N 2.85Å; V103-A105 VanDerWaalsContact C-N 3.31Å; V103-A105 PolarHBondContact O-N 2.83Å; V103-R106 WeakPolarHBondContact O-CB 3.36Å; V103-R106 PolarHBondContact O-N 3.07Å; V103-F107 HydrophobicContact CG1-CE2 4.32Å; V103-F107 VanDerWaalsContact O-CD2 3.3Å; V103-F107 WeakPolarHBondContact O-CD2 3.27Å; V103-V120 HydrophobicContact CB-CG1 4.28Å; V103-V120 HydrophobicContact CG1-CG1 4.19Å
104	T	97.3	Very high	96.1	Very high	5 Å²	5	73.3 Å²	73.3	3%	0.031	39%	0.386	C	S	.	.	H	α-helix	trans	-63	-37.7	-179.1	56.3	0	0	0	0	112.6	A100 G101 R106 F107 G108 F109 I116 Q117 V120	A100-T104 PolarHBondContact O-N 2.92Å; A100-T104 PolarHBondContact O-OG1 3.05Å; G101-T104 WeakPolarHBondContact CA-OG1 3.45Å; G101-T104 PolarHBondContact O-N 2.67Å; G101-T104 PolarHBondContact O-OG1 2.76Å; T104-R106 VanDerWaalsContact C-N 3.26Å; T104-R106 PolarHBondContact O-N 3.34Å; T104-F107 PolarHBondContact O-N 3.17Å; T104-G108 PolarHBondContact O-N 3.2Å; T104-F109 CarbonylContact C-O 3.56Å; T104-F109 VanDerWaalsContact C-O 3.22Å; T104-F109 PolarHBondContact O-N 3.12Å; T104-F109 VanDerWaalsContact O-N 3.12Å; T104-F109 PolarHBondContact OG1-O 3.26Å; T104-I116 HydrophobicContact CG2-CG2 3.94Å; T104-Q117 HydrophobicContact CG2-CB 4.48Å; T104-V120 HydrophobicContact CG2-CB 4.11Å; T104-V120 HydrophobicContact CG2-CG2 3.61Å
105	A	95.9	Very high	96.1	Very high	59 Å²	59	74.5 Å²	74.5	49%	0.488	39%	0.392	S	S	.	.	H	α-helix	trans	-60.3	-33.9	177.9	0	0	0	0	0	112.7	G101 V103 F107 G108 F109	G101-A105 VanDerWaalsContact O-CB 3.29Å; G101-A105 WeakPolarHBondContact O-CB 3.34Å; G101-A105 PolarHBondContact O-N 3.4Å; V103-A105 VanDerWaalsContact C-N 3.31Å; V103-A105 PolarHBondContact O-N 2.83Å; A105-F107 PolarHBondContact O-N 3.12Å; A105-G108 PolarHBondContact O-N 3.38Å; A105-G108 VanDerWaalsContact O-N 3.09Å; A105-F109 WeakPolarHBondContact CA-O 3.4Å; A105-F109 PolarHBondContact N-O 3.46Å
106	R	95.7	Very high	96.1	Very high	207 Å²	207	70.4 Å²	70.4	78%	0.781	38%	0.376	S	S	*	.	H	α-helix	trans	-64.3	-23.2	175.2	-69.2	173.6	-175.5	-173.9	1.7	113.2	S102 V103 T104	S102-R106 WeakPolarHBondContact O-CG 3.48Å; V103-R106 WeakPolarHBondContact O-CB 3.36Å; V103-R106 PolarHBondContact O-N 3.07Å; T104-R106 VanDerWaalsContact C-N 3.26Å; T104-R106 PolarHBondContact O-N 3.34Å
107	F	95	Very high	96.1	Very high	158 Å²	158	69.5 Å²	69.5	69%	0.693	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	13	176.9	-66.7	-82.5	0	0	0	112.8	V103 T104 A105 F109	V103-F107 HydrophobicContact CG1-CE2 4.32Å; V103-F107 VanDerWaalsContact O-CD2 3.3Å; V103-F107 WeakPolarHBondContact O-CD2 3.27Å; T104-F107 PolarHBondContact O-N 3.17Å; A105-F107 PolarHBondContact O-N 3.12Å; F107-F109 VanDerWaalsContact C-N 3.34Å; F107-F109 HydrophobicContact CB-CD2 3.93Å; F107-F109 HydrophobicContact CB-CE2 4.23Å; F107-F109 WeakPolarHBondContact O-CD2 3.47Å
108	G	94.8	Very high	96.1	Very high	64 Å²	64	69.1 Å²	69.1	66%	0.66	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.4	6.6	178.6	0	0	0	0	0	114.8	T104 A105	T104-G108 PolarHBondContact O-N 3.2Å; A105-G108 PolarHBondContact O-N 3.38Å; A105-G108 VanDerWaalsContact O-N 3.09Å
109	F	95.2	Very high	96.1	Very high	77 Å²	77	65.5 Å²	65.5	34%	0.338	35%	0.353	S	S	.	.			trans	-96.7	98.5	176.2	-61.8	-75.3	0	0	0	110.1	T104 A105 F107 Y113 I116	T104-F109 CarbonylContact C-O 3.56Å; T104-F109 VanDerWaalsContact C-O 3.22Å; T104-F109 PolarHBondContact O-N 3.12Å; T104-F109 VanDerWaalsContact O-N 3.12Å; T104-F109 PolarHBondContact OG1-O 3.26Å; A105-F109 WeakPolarHBondContact CA-O 3.4Å; A105-F109 PolarHBondContact N-O 3.46Å; F107-F109 VanDerWaalsContact C-N 3.34Å; F107-F109 HydrophobicContact CB-CD2 3.93Å; F107-F109 HydrophobicContact CB-CE2 4.23Å; F107-F109 WeakPolarHBondContact O-CD2 3.47Å; F109-Y113 HydrophobicContact CB-CD2 4.15Å; F109-Y113 HydrophobicContact CB-CG 4.24Å; F109-Y113 AromaticContact CD1-CD1 3.88Å; F109-Y113 HydrophobicContact CD1-CD1 3.88Å; F109-Y113 HydrophobicContact CD1-CD2 4.08Å; F109-Y113 HydrophobicContact CD1-CE1 4.1Å; F109-Y113 HydrophobicContact CD1-CE2 4.29Å; F109-Y113 AromaticContact CD1-CG 3.87Å; F109-Y113 HydrophobicContact CD1-CG 3.87Å; F109-Y113 HydrophobicContact CE1-CD1 4.49Å; F109-Y113 HydrophobicContact CE1-CE1 4.46Å; F109-I116 HydrophobicContact CD1-CD1 3.4Å; F109-I116 VanDerWaalsContact CD1-CD1 3.4Å; F109-I116 HydrophobicContact CE1-CD1 3.57Å; F109-I116 HydrophobicContact CG-CD1 3.96Å; F109-I116 HydrophobicContact CG-CG2 4.44Å; F109-I116 HydrophobicContact CZ-CD1 4.26Å
110	G	91.3	Very high	96.1	Very high	25 Å²	25	62.8 Å²	62.8	26%	0.258	34%	0.344	S	S	.	.			trans	-69.5	-176.8	175.6	0	0	0	0	0	114.1	D112 Y113	G110-D112 PolarHBondContact O-N 3.42Å; G110-Y113 PolarHBondContact O-N 3.05Å; G110-Y113 VanDerWaalsContact O-N 3.1Å
111	P	90.1	Very high	96.2	Very high	107 Å²	107	63.2 Å²	63.2	70%	0.695	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-21.6	-175.8	26.5	-34.9	0	0	0	114.1	Y113	P111-Y113 PolarHBondContact O-N 3.5Å
112	D	91.6	Very high	96.2	Very high	154 Å²	154	63.7 Å²	63.7	82%	0.824	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-23	175.9	-57.7	-34.2	0	0	0	112.4	G110 E114	G110-D112 PolarHBondContact O-N 3.42Å; D112-E114 PolarHBondContact O-N 3.38Å; D112-E114 VanDerWaalsContact O-N 3.1Å
113	Y	95.9	Very high	96.3	Very high	122 Å²	122	62.8 Å²	62.8	48%	0.478	34%	0.337	S	S	.	.			trans	-87.3	52.7	177.9	-63.4	-87.8	0	0	0	112.1	F109 G110 P111 I115 I116 Q117	F109-Y113 HydrophobicContact CB-CD2 4.15Å; F109-Y113 HydrophobicContact CB-CG 4.24Å; F109-Y113 AromaticContact CD1-CD1 3.88Å; F109-Y113 HydrophobicContact CD1-CD1 3.88Å; F109-Y113 HydrophobicContact CD1-CD2 4.08Å; F109-Y113 HydrophobicContact CD1-CE1 4.1Å; F109-Y113 HydrophobicContact CD1-CE2 4.29Å; F109-Y113 AromaticContact CD1-CG 3.87Å; F109-Y113 HydrophobicContact CD1-CG 3.87Å; F109-Y113 HydrophobicContact CE1-CD1 4.49Å; F109-Y113 HydrophobicContact CE1-CE1 4.46Å; G110-Y113 PolarHBondContact O-N 3.05Å; G110-Y113 VanDerWaalsContact O-N 3.1Å; P111-Y113 PolarHBondContact O-N 3.5Å; Y113-I115 VanDerWaalsContact C-N 3.27Å; Y113-I115 PolarHBondContact O-N 2.87Å; Y113-I116 HydrophobicContact CD1-CD1 3.82Å; Y113-I116 HydrophobicContact CG-CD1 4.2Å; Y113-I116 WeakPolarHBondContact O-CB 3.47Å; Y113-I116 PolarHBondContact O-N 3.39Å; Y113-Q117 PolarHBondContact O-N 3.12Å; Y113-Q117 VanDerWaalsContact O-N 3.12Å
114	E	96.9	Very high	96.3	Very high	45 Å²	45	63.1 Å²	63.1	21%	0.21	34%	0.337	C	S	.	.	H	α-helix	trans	-55.3	-38.1	-173.8	-169.6	-162.3	122.8	0	0	113.3	W97 D112 I116 Q117 S118 K185 P379 T380	W97-E114 HydrophobicContact CH2-CG 4.23Å; W97-E114 HydrophobicContact CZ2-CG 4.34Å; D112-E114 PolarHBondContact O-N 3.38Å; D112-E114 VanDerWaalsContact O-N 3.1Å; E114-I116 VanDerWaalsContact C-N 3.33Å; E114-I116 PolarHBondContact O-N 3.47Å; E114-Q117 PolarHBondContact O-N 2.88Å; E114-S118 WeakPolarHBondContact O-CB 3.32Å; E114-S118 PolarHBondContact O-N 3.33Å; E114-S118 PolarHBondContact O-OG 2.79Å; E114-K185 VanDerWaalsContact OE1-CE 3.23Å; E114-K185 WeakPolarHBondContact OE1-CE 3.35Å; E114-K185 IonicContact OE1-NZ 2.76Å; E114-K185 PolarHBondContact OE1-NZ 2.92Å; E114-K185 IonicContact OE2-NZ 2.8Å; E114-K185 PolarHBondContact OE2-NZ 2.87Å; E114-P379 HydrophobicContact CG-CB 4.24Å; E114-P379 WeakPolarHBondContact OE1-CA 3.48Å; E114-T380 PolarHBondContact OE1-N 2.92Å
115	I	97.9	Very high	96.4	Very high	40 Å²	40	64.4 Å²	64.4	21%	0.205	35%	0.349	C	S	.	.	H	α-helix	trans	-62.8	-42.5	177.6	-64.6	178.1	0	0	0	110.1	Y113 S118 L119 L181 Y182 K185	Y113-I115 VanDerWaalsContact C-N 3.27Å; Y113-I115 PolarHBondContact O-N 2.87Å; I115-S118 WeakPolarHBondContact O-CB 3.38Å; I115-S118 PolarHBondContact O-N 3.19Å; I115-L119 HydrophobicContact CG2-CG 4.46Å; I115-L119 WeakPolarHBondContact O-CG 3.4Å; I115-L119 PolarHBondContact O-N 2.9Å; I115-L181 HydrophobicContact CG1-CB 4.33Å; I115-Y182 HydrophobicContact CD1-CD2 4.2Å; I115-K185 HydrophobicContact CD1-CD 4.32Å; I115-K185 HydrophobicContact CG1-CD 4.3Å
116	I	97.8	Very high	96.5	Very high	56 Å²	56	63.8 Å²	63.8	29%	0.287	34%	0.339	S	S	.	.	H	α-helix	trans	-64.4	-45.5	179.2	-58.8	-177.6	0	0	0	110	T104 F109 Y113 E114 S118 L119 V120	T104-I116 HydrophobicContact CG2-CG2 3.94Å; F109-I116 HydrophobicContact CD1-CD1 3.4Å; F109-I116 VanDerWaalsContact CD1-CD1 3.4Å; F109-I116 HydrophobicContact CE1-CD1 3.57Å; F109-I116 HydrophobicContact CG-CD1 3.96Å; F109-I116 HydrophobicContact CG-CG2 4.44Å; F109-I116 HydrophobicContact CZ-CD1 4.26Å; Y113-I116 HydrophobicContact CD1-CD1 3.82Å; Y113-I116 HydrophobicContact CG-CD1 4.2Å; Y113-I116 WeakPolarHBondContact O-CB 3.47Å; Y113-I116 PolarHBondContact O-N 3.39Å; E114-I116 VanDerWaalsContact C-N 3.33Å; E114-I116 PolarHBondContact O-N 3.47Å; I116-S118 VanDerWaalsContact C-N 3.27Å; I116-S118 PolarHBondContact O-N 3.08Å; I116-L119 PolarHBondContact O-N 3.45Å; I116-V120 WeakPolarHBondContact O-CG2 3.27Å; I116-V120 PolarHBondContact O-N 3.35Å
117	Q	98.3	Very high	96.6	Very high	17 Å²	17	57.8 Å²	57.8	8%	0.079	32%	0.321	C	S	.	.	H	α-helix	trans	-59.4	-39.4	174.1	-176.2	173.3	-3.7	0	0	111.8	W97 A100 G101 T104 Y113 E114 V120 F121	W97-Q117 HydrophobicContact CD2-CG 4.47Å; W97-Q117 VanDerWaalsContact CE2-NE2 3.26Å; W97-Q117 HydrophobicContact CH2-CB 4.33Å; W97-Q117 HydrophobicContact CH2-CG 4Å; W97-Q117 HydrophobicContact CZ2-CB 4.47Å; W97-Q117 HydrophobicContact CZ2-CG 3.91Å; W97-Q117 HydrophobicContact CZ3-CG 4.34Å; W97-Q117 VanDerWaalsContact NE1-NE2 3.19Å; W97-Q117 PolarHBondContact O-NE2 3.45Å; A100-Q117 HydrophobicContact CB-CG 4.25Å; G101-Q117 VanDerWaalsContact CA-CD 3.5Å; T104-Q117 HydrophobicContact CG2-CB 4.48Å; Y113-Q117 PolarHBondContact O-N 3.12Å; Y113-Q117 VanDerWaalsContact O-N 3.12Å; E114-Q117 PolarHBondContact O-N 2.88Å; Q117-V120 PolarHBondContact O-N 2.95Å; Q117-F121 WeakPolarHBondContact O-CB 3.48Å; Q117-F121 PolarHBondContact O-N 3.05Å
118	S	98.5	Very high	96.8	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-62.2	-41.5	175.9	-59.4	0	0	0	0	112.5	W97 E114 I115 I116 F121 L122 L381	W97-S118 WeakPolarHBondContact CH2-OG 3.42Å; E114-S118 WeakPolarHBondContact O-CB 3.32Å; E114-S118 PolarHBondContact O-N 3.33Å; E114-S118 PolarHBondContact O-OG 2.79Å; I115-S118 WeakPolarHBondContact O-CB 3.38Å; I115-S118 PolarHBondContact O-N 3.19Å; I116-S118 VanDerWaalsContact C-N 3.27Å; I116-S118 PolarHBondContact O-N 3.08Å; S118-F121 PolarHBondContact O-N 2.98Å; S118-L122 WeakPolarHBondContact O-CG 3.33Å; S118-L122 PolarHBondContact O-N 3.45Å; S118-L381 WeakPolarHBondContact O-CD2 3.3Å
119	L	98.5	Very high	96.9	Very high	37 Å²	37	53.5 Å²	53.5	19%	0.194	30%	0.295	C	S	.	.	H	α-helix	trans	-68.1	-38.9	176.9	-63.5	-177.1	0	0	0	112.3	I115 I116 L122 T123 L174	I115-L119 HydrophobicContact CG2-CG 4.46Å; I115-L119 WeakPolarHBondContact O-CG 3.4Å; I115-L119 PolarHBondContact O-N 2.9Å; I116-L119 PolarHBondContact O-N 3.45Å; L119-L122 HydrophobicContact CD2-CD1 4.42Å; L119-L122 PolarHBondContact O-N 3Å; L119-T123 PolarHBondContact O-N 3.1Å; L119-T123 PolarHBondContact O-OG1 2.9Å; L119-L174 HydrophobicContact CB-CD2 4.3Å; L119-L174 HydrophobicContact CD2-CB 4.32Å; L119-L174 HydrophobicContact CD2-CD2 4.18Å; L119-L174 WeakPolarHBondContact CD2-O 3.48Å
120	V	98.5	Very high	97.1	Very high	34 Å²	34	52.1 Å²	52.1	21%	0.206	30%	0.298	C	S	.	.	H	α-helix	trans	-65.4	-44.2	173.7	174.4	0	0	0	0	110.3	A100 V103 T104 I116 Q117 L122 T123 L124	A100-V120 HydrophobicContact CB-CB 4.26Å; A100-V120 HydrophobicContact CB-CG1 3.86Å; V103-V120 HydrophobicContact CB-CG1 4.28Å; V103-V120 HydrophobicContact CG1-CG1 4.19Å; T104-V120 HydrophobicContact CG2-CB 4.11Å; T104-V120 HydrophobicContact CG2-CG2 3.61Å; I116-V120 WeakPolarHBondContact O-CG2 3.27Å; I116-V120 PolarHBondContact O-N 3.35Å; Q117-V120 PolarHBondContact O-N 2.95Å; V120-L122 PolarHBondContact O-N 3.46Å; V120-T123 PolarHBondContact O-N 3.02Å; V120-L124 HydrophobicContact CG1-CD1 3.8Å; V120-L124 HydrophobicContact CG1-CG 4.28Å; V120-L124 WeakPolarHBondContact O-CB 3.46Å; V120-L124 VanDerWaalsContact O-CG 3.27Å; V120-L124 WeakPolarHBondContact O-CG 3.4Å; V120-L124 PolarHBondContact O-N 3.48Å
121	F	98.6	Very high	97.4	Very high	8 Å²	8	55.2 Å²	55.2	4%	0.035	31%	0.312	C	S	.	.	H	α-helix	trans	-56.9	-47.7	173.6	173.1	-91.5	0	0	0	111.7	I93 L96 W97 A100 Q117 S118 T123 L124 A125 L381 I382 M385	I93-F121 HydrophobicContact CG2-CE2 4.49Å; I93-F121 HydrophobicContact CG2-CZ 4.28Å; L96-F121 HydrophobicContact CB-CD2 4.26Å; L96-F121 HydrophobicContact CB-CE2 3.98Å; L96-F121 HydrophobicContact CD2-CD2 4.16Å; L96-F121 HydrophobicContact CD2-CE2 3.91Å; L96-F121 HydrophobicContact CG-CD2 4.02Å; L96-F121 HydrophobicContact CG-CE2 4.05Å; W97-F121 HydrophobicContact CB-CD2 4.15Å; W97-F121 HydrophobicContact CB-CE2 4.32Å; W97-F121 HydrophobicContact CE3-CB 3.96Å; W97-F121 HydrophobicContact CE3-CD1 4.5Å; W97-F121 HydrophobicContact CE3-CD2 4.01Å; W97-F121 AromaticContact CE3-CG 3.9Å; W97-F121 HydrophobicContact CE3-CG 3.9Å; W97-F121 HydrophobicContact CZ3-CB 4.19Å; W97-F121 HydrophobicContact CZ3-CG 4.4Å; A100-F121 HydrophobicContact CB-CB 3.97Å; Q117-F121 WeakPolarHBondContact O-CB 3.48Å; Q117-F121 PolarHBondContact O-N 3.05Å; S118-F121 PolarHBondContact O-N 2.98Å; F121-T123 VanDerWaalsContact C-N 3.34Å; F121-T123 PolarHBondContact O-N 2.94Å; F121-L124 PolarHBondContact O-N 3.27Å; F121-A125 HydrophobicContact CE1-CB 4.47Å; F121-A125 VanDerWaalsContact O-CB 3.25Å; F121-A125 WeakPolarHBondContact O-CB 3.47Å; F121-A125 PolarHBondContact O-N 3.45Å; F121-L381 HydrophobicContact CD1-CD2 3.74Å; F121-L381 HydrophobicContact CE1-CD2 4.36Å; F121-I382 HydrophobicContact CD1-CD1 4.43Å; F121-I382 HydrophobicContact CE1-CD1 3.92Å; F121-I382 HydrophobicContact CE2-CD1 4.19Å; F121-I382 HydrophobicContact CZ-CD1 3.78Å; F121-M385 HydrophobicContact CE1-SD 4.37Å; F121-M385 HydrophobicContact CZ-SD 4.33Å
122	L	98.4	Very high	97.7	Very high	26 Å²	26	51.3 Å²	51.3	14%	0.136	29%	0.286	C	S	.	.	H	α-helix	trans	-58.7	-44.5	176.5	-78.6	173	0	0	0	112.4	S118 L119 V120 A125 T126 L174 L381	S118-L122 WeakPolarHBondContact O-CG 3.33Å; S118-L122 PolarHBondContact O-N 3.45Å; L119-L122 HydrophobicContact CD2-CD1 4.42Å; L119-L122 PolarHBondContact O-N 3Å; V120-L122 PolarHBondContact O-N 3.46Å; L122-A125 PolarHBondContact O-N 2.91Å; L122-T126 WeakPolarHBondContact O-CB 3.38Å; L122-T126 WeakPolarHBondContact O-CG2 3.41Å; L122-T126 PolarHBondContact O-N 2.83Å; L122-T126 PolarHBondContact O-OG1 3.01Å; L122-L174 HydrophobicContact CB-CD2 4.2Å; L122-L381 HydrophobicContact CD1-CD1 4.19Å; L122-L381 HydrophobicContact CD1-CD2 3.99Å; L122-L381 HydrophobicContact CD2-CD1 4.14Å; L122-L381 HydrophobicContact CD2-CD2 3.92Å; L122-L381 HydrophobicContact CG-CD1 4.33Å; L122-L381 HydrophobicContact CG-CD2 3.55Å
123	T	98.6	Very high	98	Very high	44 Å²	44	45.5 Å²	45.5	27%	0.27	26%	0.262	S	S	.	.	H	α-helix	trans	-62.2	-46	179.1	-54.9	0	0	0	0	110.6	L119 V120 F121 T126 L127	L119-T123 PolarHBondContact O-N 3.1Å; L119-T123 PolarHBondContact O-OG1 2.9Å; V120-T123 PolarHBondContact O-N 3.02Å; F121-T123 VanDerWaalsContact C-N 3.34Å; F121-T123 PolarHBondContact O-N 2.94Å; T123-T126 PolarHBondContact O-OG1 3.2Å; T123-T126 VanDerWaalsContact O-OG1 3.1Å; T123-L127 WeakPolarHBondContact O-CB 3.36Å; T123-L127 PolarHBondContact O-N 2.77Å
124	L	98.5	Very high	98.1	Very high	40 Å²	40	42.7 Å²	42.7	21%	0.209	26%	0.255	C	S	.	.	H	α-helix	trans	-69	-40.4	180	-67.1	171.9	0	0	0	112.4	L96 F99 A100 V120 F121 L127 F128	L96-L124 HydrophobicContact CD1-CB 3.97Å; L96-L124 HydrophobicContact CD1-CD1 4.4Å; L96-L124 HydrophobicContact CG-CB 4.42Å; F99-L124 HydrophobicContact CD1-CD1 3.76Å; F99-L124 HydrophobicContact CE1-CD1 4Å; F99-L124 HydrophobicContact CE1-CD2 4.41Å; A100-L124 HydrophobicContact CB-CD1 4.12Å; V120-L124 HydrophobicContact CG1-CD1 3.8Å; V120-L124 HydrophobicContact CG1-CG 4.28Å; V120-L124 WeakPolarHBondContact O-CB 3.46Å; V120-L124 VanDerWaalsContact O-CG 3.27Å; V120-L124 WeakPolarHBondContact O-CG 3.4Å; V120-L124 PolarHBondContact O-N 3.48Å; F121-L124 PolarHBondContact O-N 3.27Å; L124-L127 PolarHBondContact O-N 2.92Å; L124-F128 WeakPolarHBondContact O-CB 3.28Å; L124-F128 PolarHBondContact O-N 3.44Å
125	A	98.4	Very high	98.2	Very high	33 Å²	33	44.4 Å²	44.4	27%	0.273	27%	0.27	S	S	.	.	H	α-helix	trans	-65.3	-44.9	178.2	0	0	0	0	0	111.4	L96 F121 L122 F128 G129	L96-A125 HydrophobicContact CD2-CB 3.82Å; F121-A125 HydrophobicContact CE1-CB 4.47Å; F121-A125 VanDerWaalsContact O-CB 3.25Å; F121-A125 WeakPolarHBondContact O-CB 3.47Å; F121-A125 PolarHBondContact O-N 3.45Å; L122-A125 PolarHBondContact O-N 2.91Å; A125-F128 PolarHBondContact O-N 2.92Å; A125-G129 PolarHBondContact O-N 2.95Å
126	T	98.3	Very high	98.2	Very high	46 Å²	46	45.9 Å²	45.9	28%	0.282	27%	0.273	S	S	.	.	H	α-helix	trans	-69.4	-34.4	176.4	52.5	0	0	0	0	112.3	L122 T123 A130 Q170 L173	L122-T126 WeakPolarHBondContact O-CB 3.38Å; L122-T126 WeakPolarHBondContact O-CG2 3.41Å; L122-T126 PolarHBondContact O-N 2.83Å; L122-T126 PolarHBondContact O-OG1 3.01Å; T123-T126 PolarHBondContact O-OG1 3.2Å; T123-T126 VanDerWaalsContact O-OG1 3.1Å; T126-A130 WeakPolarHBondContact O-CB 3.49Å; T126-A130 PolarHBondContact O-N 3.29Å; T126-Q170 PolarHBondContact OG1-NE2 3.31Å; T126-L173 HydrophobicContact CG2-CD2 4.06Å
127	L	98.5	Very high	98.2	Very high	80 Å²	80	45.7 Å²	45.7	42%	0.419	28%	0.277	S	S	.	.	H	α-helix	trans	-65.3	-44.7	172.4	179.9	62.2	0	0	0	111.5	T123 L124 G129 A130 V131 F166	T123-L127 WeakPolarHBondContact O-CB 3.36Å; T123-L127 PolarHBondContact O-N 2.77Å; L124-L127 PolarHBondContact O-N 2.92Å; L127-G129 PolarHBondContact O-N 3.04Å; L127-A130 PolarHBondContact O-N 3.38Å; L127-V131 HydrophobicContact CD1-CG2 4.3Å; L127-V131 WeakPolarHBondContact O-CG2 3.16Å; L127-V131 PolarHBondContact O-N 3.38Å; L127-F166 HydrophobicContact CB-CE2 4.44Å; L127-F166 HydrophobicContact CB-CZ 4.04Å; L127-F166 HydrophobicContact CD1-CZ 4.18Å
128	F	98.4	Very high	98.2	Very high	96 Å²	96	47.2 Å²	47.2	42%	0.421	29%	0.285	S	S	.	.	H	α-helix	trans	-55.6	-52.3	175.3	173.3	-95.5	0	0	0	110.6	E83 I87 L124 A125 A130 V131 T132	E83-F128 WeakPolarHBondContact OE1-CZ 3.07Å; I87-F128 HydrophobicContact CD1-CE1 3.91Å; I87-F128 HydrophobicContact CD1-CZ 4.32Å; L124-F128 WeakPolarHBondContact O-CB 3.28Å; L124-F128 PolarHBondContact O-N 3.44Å; A125-F128 PolarHBondContact O-N 2.92Å; F128-A130 VanDerWaalsContact C-N 3.33Å; F128-A130 PolarHBondContact O-N 2.89Å; F128-V131 PolarHBondContact O-N 3.19Å; F128-V131 VanDerWaalsContact O-N 3.12Å; F128-T132 HydrophobicContact CD1-CG2 4.44Å; F128-T132 HydrophobicContact CD2-CG2 4.21Å; F128-T132 HydrophobicContact CE1-CG2 4.02Å; F128-T132 HydrophobicContact CE2-CG2 3.78Å; F128-T132 HydrophobicContact CZ-CG2 3.67Å; F128-T132 WeakPolarHBondContact O-CG2 3.45Å; F128-T132 PolarHBondContact O-N 3.35Å; F128-T132 PolarHBondContact O-OG1 2.94Å
129	G	97.4	Very high	98.2	Very high	36 Å²	36	53 Å²	53	37%	0.371	31%	0.308	S	S	.	.	H	α-helix	trans	-61.9	-36.4	177.6	0	0	0	0	0	113.8	A125 L127 V131 T132 G133	A125-G129 PolarHBondContact O-N 2.95Å; L127-G129 PolarHBondContact O-N 3.04Å; G129-V131 VanDerWaalsContact C-N 3.33Å; G129-V131 PolarHBondContact O-N 3.36Å; G129-T132 PolarHBondContact O-OG1 2.87Å; G129-G133 PolarHBondContact O-N 3.5Å
130	A	97.8	Very high	98.2	Very high	48 Å²	48	52.8 Å²	52.8	40%	0.397	31%	0.309	S	S	.	.	H	α-helix	trans	-64.7	-38.3	174.9	0	0	0	0	0	112.1	T126 L127 F128 L134 F166	T126-A130 WeakPolarHBondContact O-CB 3.49Å; T126-A130 PolarHBondContact O-N 3.29Å; L127-A130 PolarHBondContact O-N 3.38Å; F128-A130 VanDerWaalsContact C-N 3.33Å; F128-A130 PolarHBondContact O-N 2.89Å; A130-L134 WeakPolarHBondContact O-CB 3.23Å; A130-L134 PolarHBondContact O-N 2.95Å; A130-F166 HydrophobicContact CB-CD2 4.15Å; A130-F166 HydrophobicContact CB-CE2 4.27Å
131	V	98	Very high	98.2	Very high	91 Å²	91	52.2 Å²	52.2	55%	0.552	31%	0.306	S	S	*	.	H	α-helix	trans	-72.6	-45.5	178.9	171	0	0	0	0	111.4	L127 F128 G129 G133 L134 P135	L127-V131 HydrophobicContact CD1-CG2 4.3Å; L127-V131 WeakPolarHBondContact O-CG2 3.16Å; L127-V131 PolarHBondContact O-N 3.38Å; F128-V131 PolarHBondContact O-N 3.19Å; F128-V131 VanDerWaalsContact O-N 3.12Å; G129-V131 VanDerWaalsContact C-N 3.33Å; G129-V131 PolarHBondContact O-N 3.36Å; V131-G133 VanDerWaalsContact C-N 3.33Å; V131-G133 PolarHBondContact O-N 3.01Å; V131-L134 PolarHBondContact O-N 3.06Å; V131-P135 VanDerWaalsContact O-CD 3.31Å; V131-P135 WeakPolarHBondContact O-CD 3.34Å
132	T	97.8	Very high	98.2	Very high	24 Å²	24	54.4 Å²	54.4	15%	0.147	32%	0.315	C	S	.	.	H	α-helix	trans	-71.8	-29	-179.5	61.2	0	0	0	0	112.2	E83 F128 G129 P135 W136	E83-T132 WeakPolarHBondContact OE1-CB 3.3Å; E83-T132 VanDerWaalsContact OE1-CG2 3.3Å; E83-T132 WeakPolarHBondContact OE1-CG2 3.37Å; E83-T132 PolarHBondContact OE1-OG1 2.99Å; F128-T132 HydrophobicContact CD1-CG2 4.44Å; F128-T132 HydrophobicContact CD2-CG2 4.21Å; F128-T132 HydrophobicContact CE1-CG2 4.02Å; F128-T132 HydrophobicContact CE2-CG2 3.78Å; F128-T132 HydrophobicContact CZ-CG2 3.67Å; F128-T132 WeakPolarHBondContact O-CG2 3.45Å; F128-T132 PolarHBondContact O-N 3.35Å; F128-T132 PolarHBondContact O-OG1 2.94Å; G129-T132 PolarHBondContact O-OG1 2.87Å; T132-P135 WeakPolarHBondContact O-CD 3.48Å; T132-W136 VanDerWaalsContact O-CD1 3.23Å
133	G	97.8	Very high	98.1	Very high	32 Å²	32	56.2 Å²	56.2	33%	0.33	33%	0.328	S	S	.	.	H	α-helix	trans	-76.1	-23.4	173.1	0	0	0	0	0	115.1	G129 V131 W136 S137	G129-G133 PolarHBondContact O-N 3.5Å; V131-G133 VanDerWaalsContact C-N 3.33Å; V131-G133 PolarHBondContact O-N 3.01Å; G133-W136 PolarHBondContact O-N 3.2Å; G133-S137 PolarHBondContact O-N 3.37Å
134	L	97.8	Very high	98.1	Very high	63 Å²	63	54.5 Å²	54.5	33%	0.33	32%	0.317	S	S	.	.	H	α-helix	trans	-59.2	-45.5	-174	-178.7	65.3	0	0	0	113.8	A130 V131 W136 S137 L138 F158 L159	A130-L134 WeakPolarHBondContact O-CB 3.23Å; A130-L134 PolarHBondContact O-N 2.95Å; V131-L134 PolarHBondContact O-N 3.06Å; L134-W136 VanDerWaalsContact C-N 3.32Å; L134-W136 PolarHBondContact O-N 2.83Å; L134-S137 PolarHBondContact O-N 3.23Å; L134-L138 HydrophobicContact CD1-CD1 4.23Å; L134-L138 HydrophobicContact CD1-CG 4.17Å; L134-L138 HydrophobicContact CG-CD1 4Å; L134-L138 HydrophobicContact CG-CG 4.39Å; L134-L138 WeakPolarHBondContact O-CB 3.48Å; L134-L138 WeakPolarHBondContact O-CG 3.48Å; L134-L138 PolarHBondContact O-N 2.92Å; L134-F158 HydrophobicContact CD1-CE1 3.87Å; L134-L159 HydrophobicContact CD1-CD2 4.49Å
135	P	98.4	Very high	98.1	Very high	81 Å²	81	53.8 Å²	53.8	53%	0.526	31%	0.312	S	S	.	.	H	α-helix	trans	-58.7	-41.8	176.8	-24.9	34.9	0	0	0	113	V131 T132 L138 Y139	V131-P135 VanDerWaalsContact O-CD 3.31Å; V131-P135 WeakPolarHBondContact O-CD 3.34Å; T132-P135 WeakPolarHBondContact O-CD 3.48Å; P135-L138 PolarHBondContact O-N 3.44Å; P135-Y139 WeakPolarHBondContact O-CB 3.48Å; P135-Y139 PolarHBondContact O-N 3.45Å
136	W	98.4	Very high	98	Very high	71 Å²	71	57 Å²	57	27%	0.269	32%	0.321	S	S	.	.	H	α-helix	trans	-65.5	-43.5	178.4	-58	103.8	0	0	0	111.5	F72 W75 Y79 T132 G133 L134 Y139 S140	F72-W136 HydrophobicContact CE2-CB 4.43Å; F72-W136 AromaticContact CE2-CE3 3.86Å; F72-W136 HydrophobicContact CE2-CE3 3.86Å; F72-W136 HydrophobicContact CZ-CB 4.07Å; F72-W136 HydrophobicContact CZ-CE3 4.3Å; F72-W136 VanDerWaalsContact CZ-O 3.31Å; F72-W136 WeakPolarHBondContact CZ-O 3.41Å; W75-W136 HydrophobicContact CB-CZ3 4.28Å; Y79-W136 AromaticContact CD1-CE2 3.63Å; Y79-W136 AromaticContact CD1-CZ2 3.63Å; Y79-W136 HydrophobicContact CD1-CZ2 3.63Å; Y79-W136 AromaticContact CD1-NE1 3.25Å; Y79-W136 VanDerWaalsContact CD1-NE1 3.25Å; Y79-W136 AromaticContact CD2-CZ2 3.73Å; Y79-W136 HydrophobicContact CD2-CZ2 3.73Å; Y79-W136 HydrophobicContact CE1-CZ2 4.34Å; Y79-W136 AromaticContact CE1-NE1 3.32Å; Y79-W136 VanDerWaalsContact CE1-NE1 3.32Å; Y79-W136 HydrophobicContact CE2-CZ2 4.43Å; Y79-W136 AromaticContact CG-CE2 3.8Å; Y79-W136 HydrophobicContact CG-CH2 4.23Å; Y79-W136 AromaticContact CG-CZ2 3.26Å; Y79-W136 HydrophobicContact CG-CZ2 3.26Å; Y79-W136 AromaticContact CG-NE1 3.86Å; Y79-W136 AromaticContact CZ-NE1 3.98Å; T132-W136 VanDerWaalsContact O-CD1 3.23Å; G133-W136 PolarHBondContact O-N 3.2Å; L134-W136 VanDerWaalsContact C-N 3.32Å; L134-W136 PolarHBondContact O-N 2.83Å; W136-Y139 PolarHBondContact O-N 3.3Å; W136-S140 WeakPolarHBondContact O-CB 3.39Å; W136-S140 PolarHBondContact O-N 2.97Å
137	S	97.9	Very high	98	Very high	52 Å²	52	61.4 Å²	61.4	36%	0.364	34%	0.337	S	S	.	.	H	α-helix	trans	-65.6	-40.9	177.4	-169.1	0	0	0	0	112.1	G133 L134 S140 T141 F158	G133-S137 PolarHBondContact O-N 3.37Å; L134-S137 PolarHBondContact O-N 3.23Å; S137-S140 PolarHBondContact O-N 2.98Å; S137-T141 PolarHBondContact O-N 3.47Å; S137-T141 PolarHBondContact O-OG1 3.31Å; S137-F158 VanDerWaalsContact OG-CZ 3.31Å; S137-F158 WeakPolarHBondContact OG-CZ 3.47Å
138	L	98.4	Very high	97.8	Very high	50 Å²	50	59.2 Å²	59.2	26%	0.262	33%	0.325	S	S	.	.	H	α-helix	trans	-62.2	-44.8	175.6	-76	169.9	0	0	0	111.3	L134 P135 T141 F142 L155 F158	L134-L138 HydrophobicContact CD1-CD1 4.23Å; L134-L138 HydrophobicContact CD1-CG 4.17Å; L134-L138 HydrophobicContact CG-CD1 4Å; L134-L138 HydrophobicContact CG-CG 4.39Å; L134-L138 WeakPolarHBondContact O-CB 3.48Å; L134-L138 WeakPolarHBondContact O-CG 3.48Å; L134-L138 PolarHBondContact O-N 2.92Å; P135-L138 PolarHBondContact O-N 3.44Å; L138-T141 PolarHBondContact O-N 2.95Å; L138-F142 HydrophobicContact CD2-CD2 3.79Å; L138-F142 HydrophobicContact CD2-CE2 3.8Å; L138-F142 WeakPolarHBondContact O-CB 3.35Å; L138-F142 PolarHBondContact O-N 3.42Å; L138-L155 HydrophobicContact CD2-CD1 3.55Å; L138-F158 HydrophobicContact CD2-CD1 3.9Å; L138-F158 HydrophobicContact CD2-CE1 3.63Å; L138-F158 HydrophobicContact CD2-CZ 4.26Å; L138-F158 HydrophobicContact CG-CE1 4.14Å
139	Y	98.5	Very high	97.6	Very high	122 Å²	122	56.9 Å²	56.9	48%	0.478	33%	0.328	S	S	.	.	H	α-helix	trans	-64.1	-44.9	177.8	-169	-83.5	0	0	0	111.6	F72 P135 W136 T141 V143 I144	F72-Y139 AromaticContact CD2-CD1 3.62Å; F72-Y139 HydrophobicContact CD2-CD1 3.62Å; F72-Y139 HydrophobicContact CD2-CE1 4.14Å; F72-Y139 AromaticContact CE2-CD1 3.87Å; F72-Y139 HydrophobicContact CE2-CD1 3.87Å; F72-Y139 HydrophobicContact CE2-CG 4.46Å; P135-Y139 WeakPolarHBondContact O-CB 3.48Å; P135-Y139 PolarHBondContact O-N 3.45Å; W136-Y139 PolarHBondContact O-N 3.3Å; Y139-T141 PolarHBondContact O-N 3.17Å; Y139-V143 HydrophobicContact CD1-CB 4.3Å; Y139-V143 HydrophobicContact CD2-CB 4.21Å; Y139-V143 HydrophobicContact CD2-CG2 3.87Å; Y139-V143 HydrophobicContact CE1-CB 4.29Å; Y139-V143 HydrophobicContact CE1-CG1 4.22Å; Y139-V143 HydrophobicContact CE2-CB 4.2Å; Y139-V143 HydrophobicContact CE2-CG1 4.04Å; Y139-V143 HydrophobicContact CE2-CG2 4.08Å; Y139-V143 HydrophobicContact CG-CB 4.27Å; Y139-V143 HydrophobicContact CG-CG2 4.23Å; Y139-V143 WeakPolarHBondContact O-CA 3.44Å; Y139-V143 WeakPolarHBondContact O-CB 3.33Å; Y139-V143 PolarHBondContact O-N 3.49Å; Y139-I144 HydrophobicContact CD1-CD1 3.99Å; Y139-I144 HydrophobicContact CD1-CG1 4.01Å; Y139-I144 HydrophobicContact CE1-CD1 3.96Å; Y139-I144 HydrophobicContact CE1-CG1 3.84Å; Y139-I144 PolarHBondContact O-N 3.44Å; Y139-I144 VanDerWaalsContact O-N 3.14Å
140	S	98.2	Very high	97.5	Very high	31 Å²	31	55.5 Å²	55.5	22%	0.217	31%	0.311	C	S	.	.	I	π-helix	trans	-57.7	-49.7	176.9	-168.4	0	0	0	0	111.1	W136 S137 I144 E145	W136-S140 WeakPolarHBondContact O-CB 3.39Å; W136-S140 PolarHBondContact O-N 2.97Å; S137-S140 PolarHBondContact O-N 2.98Å; S140-I144 WeakPolarHBondContact O-CB 3.44Å; S140-I144 PolarHBondContact O-N 3.38Å; S140-E145 WeakPolarHBondContact O-CG 3.34Å; S140-E145 PolarHBondContact O-N 3.16Å
141	T	97.8	Very high	97.4	Very high	22 Å²	22	53.7 Å²	53.7	14%	0.135	30%	0.295	C	S	.	.	I	π-helix	trans	-75	-51.5	-175.5	-58.2	0	0	0	0	113.1	S137 L138 Y139 E145 E146 N151 F158	S137-T141 PolarHBondContact O-N 3.47Å; S137-T141 PolarHBondContact O-OG1 3.31Å; L138-T141 PolarHBondContact O-N 2.95Å; Y139-T141 PolarHBondContact O-N 3.17Å; T141-E145 WeakPolarHBondContact O-CB 3.29Å; T141-E146 PolarHBondContact O-N 2.88Å; T141-N151 WeakPolarHBondContact CG2-OD1 3.46Å; T141-N151 WeakPolarHBondContact O-CB 3.44Å; T141-F158 HydrophobicContact CG2-CD2 4.29Å
142	F	98.2	Very high	97.2	Very high	54 Å²	54	53.6 Å²	53.6	24%	0.237	29%	0.289	C	S	.	.	I	π-helix	trans	-94.9	-4.1	-169.4	-64.9	-76.6	0	0	0	114.3	L138 E146 Q153 L155 F158	L138-F142 HydrophobicContact CD2-CD2 3.79Å; L138-F142 HydrophobicContact CD2-CE2 3.8Å; L138-F142 WeakPolarHBondContact O-CB 3.35Å; L138-F142 PolarHBondContact O-N 3.42Å; F142-E146 WeakPolarHBondContact O-CB 3.36Å; F142-Q153 WeakPolarHBondContact CE1-O 3.18Å; F142-L155 HydrophobicContact CD2-CD1 4.39Å; F142-L155 HydrophobicContact CE1-CB 4.46Å; F142-L155 HydrophobicContact CE2-CD1 3.83Å; F142-L155 HydrophobicContact CZ-CB 4.21Å; F142-L155 HydrophobicContact CZ-CD1 4.12Å; F142-F158 HydrophobicContact CE2-CB 3.9Å; F142-F158 HydrophobicContact CE2-CD1 4.13Å; F142-F158 AromaticContact CE2-CD2 3.91Å; F142-F158 HydrophobicContact CE2-CD2 3.91Å; F142-F158 HydrophobicContact CE2-CE2 4.48Å; F142-F158 AromaticContact CE2-CG 3.71Å; F142-F158 HydrophobicContact CE2-CG 3.71Å; F142-F158 HydrophobicContact CZ-CB 3.73Å; F142-F158 HydrophobicContact CZ-CD2 4.36Å; F142-F158 HydrophobicContact CZ-CG 4.07Å
143	V	98.3	Very high	97.1	Very high	65 Å²	65	54 Å²	54	39%	0.394	29%	0.289	S	S	.	.	I	π-helix	trans	-116.7	-55.8	173.3	-174.5	0	0	0	0	110.7	Y139 K147	Y139-V143 HydrophobicContact CD1-CB 4.3Å; Y139-V143 HydrophobicContact CD2-CB 4.21Å; Y139-V143 HydrophobicContact CD2-CG2 3.87Å; Y139-V143 HydrophobicContact CE1-CB 4.29Å; Y139-V143 HydrophobicContact CE1-CG1 4.22Å; Y139-V143 HydrophobicContact CE2-CB 4.2Å; Y139-V143 HydrophobicContact CE2-CG1 4.04Å; Y139-V143 HydrophobicContact CE2-CG2 4.08Å; Y139-V143 HydrophobicContact CG-CB 4.27Å; Y139-V143 HydrophobicContact CG-CG2 4.23Å; Y139-V143 WeakPolarHBondContact O-CA 3.44Å; Y139-V143 WeakPolarHBondContact O-CB 3.33Å; Y139-V143 PolarHBondContact O-N 3.49Å; V143-K147 WeakPolarHBondContact O-CB 3.39Å; V143-K147 PolarHBondContact O-N 3.41Å
144	I	98.2	Very high	97	Very high	7 Å²	7	57 Å²	57	4%	0.036	30%	0.301	C	S	.	.	I	π-helix	trans	-75.4	-59.8	-175.5	-55.7	175.7	0	0	0	110.5	Y65 D68 K69 F72 Y139 S140 E146 K147 H148	Y65-I144 HydrophobicContact CE2-CG2 4.35Å; D68-I144 HydrophobicContact CB-CG2 4.36Å; K69-I144 HydrophobicContact CG-CG2 4.07Å; F72-I144 HydrophobicContact CB-CD1 3.34Å; F72-I144 HydrophobicContact CD1-CD1 4.14Å; F72-I144 HydrophobicContact CD2-CD1 3.71Å; F72-I144 HydrophobicContact CG-CD1 3.45Å; F72-I144 VanDerWaalsContact CG-CD1 3.45Å; Y139-I144 HydrophobicContact CD1-CD1 3.99Å; Y139-I144 HydrophobicContact CD1-CG1 4.01Å; Y139-I144 HydrophobicContact CE1-CD1 3.96Å; Y139-I144 HydrophobicContact CE1-CG1 3.84Å; Y139-I144 PolarHBondContact O-N 3.44Å; Y139-I144 VanDerWaalsContact O-N 3.14Å; S140-I144 WeakPolarHBondContact O-CB 3.44Å; S140-I144 PolarHBondContact O-N 3.38Å; I144-E146 VanDerWaalsContact C-N 3.29Å; I144-E146 PolarHBondContact O-N 3.01Å; I144-K147 PolarHBondContact O-N 2.89Å; I144-H148 PolarHBondContact O-CD2 3.25Å; I144-H148 VanDerWaalsContact O-CD2 3.24Å; I144-H148 PolarHBondContact O-N 3.25Å
145	E	97.5	Very high	97	Very high	25 Å²	25	58.4 Å²	58.4	12%	0.117	31%	0.308	C	S	.	.	I	π-helix	trans	-64	-36	-178.2	-60.4	-55.2	149.2	0	0	111.5	Y65 S140 T141 H148 G149 F150 N151 H258	Y65-E145 VanDerWaalsContact OH-CD 3.29Å; Y65-E145 PolarHBondContact OH-OE1 2.88Å; Y65-E145 PolarHBondContact OH-OE2 3.17Å; S140-E145 WeakPolarHBondContact O-CG 3.34Å; S140-E145 PolarHBondContact O-N 3.16Å; T141-E145 WeakPolarHBondContact O-CB 3.29Å; E145-H148 PolarHBondContact O-N 3.38Å; E145-G149 PolarHBondContact O-N 3.25Å; E145-G149 VanDerWaalsContact O-N 3.1Å; E145-F150 HydrophobicContact CB-CB 4.09Å; E145-F150 PolarHBondContact O-N 2.87Å; E145-F150 VanDerWaalsContact OE2-CB 3.24Å; E145-F150 WeakPolarHBondContact OE2-CB 3.4Å; E145-F150 VanDerWaalsContact OE2-CD2 3.31Å; E145-F150 WeakPolarHBondContact OE2-CD2 3.36Å; E145-N151 HydrophobicContact CB-CB 4.09Å; E145-N151 PolarHBondContact O-N 3.35Å; E145-H258 IonicContact OE2-NE2 2.82Å
146	E	97.1	Very high	96.9	Very high	100 Å²	100	56.5 Å²	56.5	47%	0.467	30%	0.303	S	S	.	.	H	α-helix	trans	-62.3	-48.6	173.2	-167.8	70	-147.4	0	0	112.5	T141 F142 I144 H148 G149 N151	T141-E146 PolarHBondContact O-N 2.88Å; F142-E146 WeakPolarHBondContact O-CB 3.36Å; I144-E146 VanDerWaalsContact C-N 3.29Å; I144-E146 PolarHBondContact O-N 3.01Å; E146-H148 PolarHBondContact O-N 3.48Å; E146-G149 PolarHBondContact O-N 3Å; E146-N151 HydrophobicContact CB-CB 4.36Å; E146-N151 WeakPolarHBondContact OE2-CB 3.29Å; E146-N151 PolarHBondContact OE2-ND2 3Å
147	K	97.2	Very high	96.8	Very high	139 Å²	139	55 Å²	55	60%	0.604	30%	0.299	S	S	*	.	H	α-helix	trans	-57.4	-35.4	178.7	175.1	-175.3	176.9	-169.5	0	112.3	D68 V143 I144	D68-K147 IonicContact OD1-NZ 2.83Å; D68-K147 WeakPolarHBondContact OD2-CE 3.31Å; D68-K147 IonicContact OD2-NZ 3.57Å; D68-K147 PolarHBondContact OD2-NZ 3.2Å; V143-K147 WeakPolarHBondContact O-CB 3.39Å; V143-K147 PolarHBondContact O-N 3.41Å; I144-K147 PolarHBondContact O-N 2.89Å
148	H	95.9	Very high	96.8	Very high	35 Å²	35	53.4 Å²	53.4	16%	0.162	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	5.3	-179	-68	-78.3	0	0	0	113.5	Y65 D68 I144 E145 E146 F150	Y65-H148 WeakPolarHBondContact CA-CE1 3.3Å; Y65-H148 HydrophobicContact CD2-CB 3.66Å; Y65-H148 AromaticContact CD2-CD2 3.5Å; Y65-H148 VanDerWaalsContact CD2-CD2 3.5Å; Y65-H148 WeakPolarHBondContact CD2-CD2 3.41Å; Y65-H148 AromaticContact CD2-CG 3.43Å; Y65-H148 VanDerWaalsContact CD2-CG 3.43Å; Y65-H148 HydrophobicContact CE2-CB 4.13Å; Y65-H148 HydrophobicContact CG-CB 4.37Å; Y65-H148 PolarHBondContact N-CE1 3.41Å; Y65-H148 VanDerWaalsContact N-CE1 3.34Å; D68-H148 IonicContact OD2-CD2 2.76Å; D68-H148 IonicContact OD2-CE1 3.45Å; D68-H148 IonicContact OD2-NE2 3.34Å; D68-H148 PolarHBondContact OD2-NE2 3.47Å; I144-H148 PolarHBondContact O-CD2 3.25Å; I144-H148 VanDerWaalsContact O-CD2 3.24Å; I144-H148 PolarHBondContact O-N 3.25Å; E145-H148 PolarHBondContact O-N 3.38Å; E146-H148 PolarHBondContact O-N 3.48Å; H148-F150 HydrophobicContact CB-CD2 3.92Å; H148-F150 HydrophobicContact CB-CE2 4.17Å
149	G	93.6	Very high	96.8	Very high	47 Å²	47	54.6 Å²	54.6	49%	0.485	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.1	16.5	173.2	0	0	0	0	0	115.1	E145 E146	E145-G149 PolarHBondContact O-N 3.25Å; E145-G149 VanDerWaalsContact O-N 3.1Å; E146-G149 PolarHBondContact O-N 3Å
150	F	94.5	Very high	96.7	Very high	6 Å²	6	56.7 Å²	56.7	3%	0.026	30%	0.303	C	S	.	.			trans	-89.4	-34.7	180	-73.6	-64.5	0	0	0	113.7	Y65 E145 H148 Q152 S256 S257 H258 D437 L439	Y65-F150 AromaticContact CD1-CE2 3.97Å; Y65-F150 HydrophobicContact CD1-CE2 3.97Å; Y65-F150 HydrophobicContact CD2-CD2 4.38Å; Y65-F150 HydrophobicContact CD2-CE2 4.13Å; Y65-F150 HydrophobicContact CE1-CD2 4.32Å; Y65-F150 AromaticContact CE1-CE2 3.64Å; Y65-F150 HydrophobicContact CE1-CE2 3.64Å; Y65-F150 HydrophobicContact CE1-CZ 4.35Å; Y65-F150 AromaticContact CE2-CD2 3.76Å; Y65-F150 HydrophobicContact CE2-CD2 3.76Å; Y65-F150 AromaticContact CE2-CE2 3.78Å; Y65-F150 HydrophobicContact CE2-CE2 3.78Å; Y65-F150 HydrophobicContact CG-CE2 4.2Å; Y65-F150 AromaticContact CZ-CD2 3.72Å; Y65-F150 AromaticContact CZ-CE2 3.52Å; E145-F150 HydrophobicContact CB-CB 4.09Å; E145-F150 PolarHBondContact O-N 2.87Å; E145-F150 VanDerWaalsContact OE2-CB 3.24Å; E145-F150 WeakPolarHBondContact OE2-CB 3.4Å; E145-F150 VanDerWaalsContact OE2-CD2 3.31Å; E145-F150 WeakPolarHBondContact OE2-CD2 3.36Å; H148-F150 HydrophobicContact CB-CD2 3.92Å; H148-F150 HydrophobicContact CB-CE2 4.17Å; F150-Q152 PolarHBondContact O-N 3.26Å; F150-S256 WeakPolarHBondContact O-CA 3.49Å; F150-S257 WeakPolarHBondContact CA-OG 3.2Å; F150-S257 WeakPolarHBondContact CD1-OG 3.36Å; F150-S257 PolarHBondContact O-N 3.27Å; F150-S257 VanDerWaalsContact O-N 3.16Å; F150-H258 AromaticContact CD1-CE1 3.45Å; F150-H258 VanDerWaalsContact CD1-CE1 3.45Å; F150-H258 WeakPolarHBondContact CD1-CE1 3.02Å; F150-H258 AromaticContact CD1-ND1 3.86Å; F150-H258 AromaticContact CD1-NE2 3.76Å; F150-H258 AromaticContact CE1-CE1 3.47Å; F150-H258 VanDerWaalsContact CE1-CE1 3.47Å; F150-H258 WeakPolarHBondContact CE1-CE1 3.43Å; F150-H258 AromaticContact CE1-ND1 3.78Å; F150-H258 AromaticContact CG-CE1 3.8Å; F150-H258 AromaticContact CG-NE2 3.78Å; F150-H258 AromaticContact CZ-CE1 3.77Å; F150-D437 WeakPolarHBondContact CE1-O 3.23Å; F150-L439 HydrophobicContact CE2-CB 4.05Å; F150-L439 HydrophobicContact CE2-CD1 3.68Å; F150-L439 HydrophobicContact CE2-CG 4.05Å; F150-L439 HydrophobicContact CZ-CB 3.77Å; F150-L439 HydrophobicContact CZ-CD1 3.76Å; F150-L439 HydrophobicContact CZ-CG 3.65Å
151	N	96.3	Very high	96.6	Very high	11 Å²	11	55.5 Å²	55.5	6%	0.059	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-68.3	132.8	-178	-179.2	45.9	0	0	0	111.1	T141 E145 E146 Q153	T141-N151 WeakPolarHBondContact CG2-OD1 3.46Å; T141-N151 WeakPolarHBondContact O-CB 3.44Å; E145-N151 HydrophobicContact CB-CB 4.09Å; E145-N151 PolarHBondContact O-N 3.35Å; E146-N151 HydrophobicContact CB-CB 4.36Å; E146-N151 WeakPolarHBondContact OE2-CB 3.29Å; E146-N151 PolarHBondContact OE2-ND2 3Å; N151-Q153 PolarHBondContact ND2-O 3.23Å; N151-Q153 VanDerWaalsContact ND2-O 3.07Å; N151-Q153 WeakPolarHBondContact OD1-CB 3.29Å; N151-Q153 PolarHBondContact OD1-N 3.18Å
152	Q	94.1	Very high	96.6	Very high	89 Å²	89	56.3 Å²	56.3	42%	0.416	30%	0.303	S	S	.	.			trans	-123.4	2.4	174.2	-59.1	-59.9	-36.4	0	0	111.6	F150 S253 R255	F150-Q152 PolarHBondContact O-N 3.26Å; Q152-S253 WeakPolarHBondContact CB-O 3.5Å; Q152-S253 WeakPolarHBondContact CG-O 3.47Å; Q152-R255 PolarHBondContact N-O 3.39Å
153	Q	94.3	Very high	96.6	Very high	32 Å²	32	58.7 Å²	58.7	15%	0.15	32%	0.322	C	S	.	.			trans	-92.8	146.3	-175	-62.9	173.3	54.7	0	0	111.3	F142 N151 F157 K254 R255	F142-Q153 WeakPolarHBondContact CE1-O 3.18Å; N151-Q153 PolarHBondContact ND2-O 3.23Å; N151-Q153 VanDerWaalsContact ND2-O 3.07Å; N151-Q153 WeakPolarHBondContact OD1-CB 3.29Å; N151-Q153 PolarHBondContact OD1-N 3.18Å; Q153-F157 HydrophobicContact CB-CD1 3.98Å; Q153-F157 HydrophobicContact CG-CD1 3.7Å; Q153-F157 HydrophobicContact CG-CE1 3.9Å; Q153-K254 WeakPolarHBondContact CG-O 3.5Å; Q153-R255 HydrophobicContact CG-CB 4.42Å; Q153-R255 WeakPolarHBondContact CG-O 3.25Å; Q153-R255 VanDerWaalsContact NE2-CA 3.33Å; Q153-R255 PolarHBondContact NE2-O 2.91Å
154	T	96.6	Very high	96.6	Very high	96 Å²	96	59 Å²	59	59%	0.589	32%	0.318	S	S	*	.			trans	-87	155.9	164.9	63.3	0	0	0	0	110.8	G156 F157 F158	T154-G156 PolarHBondContact O-N 3.16Å; T154-F157 WeakPolarHBondContact O-CB 3.37Å; T154-F157 PolarHBondContact O-N 2.77Å; T154-F157 VanDerWaalsContact O-N 3.08Å; T154-F157 WeakPolarHBondContact OG1-CB 3.31Å; T154-F157 PolarHBondContact OG1-N 3.45Å; T154-F158 PolarHBondContact O-N 2.85Å
155	L	97.2	Very high	96.5	Very high	92 Å²	92	63.2 Å²	63.2	48%	0.482	34%	0.336	S	S	.	.	H	α-helix	trans	-56.7	-38.5	176	-175.6	63.1	0	0	0	112.5	L138 F142 F158 L159	L138-L155 HydrophobicContact CD2-CD1 3.55Å; F142-L155 HydrophobicContact CD2-CD1 4.39Å; F142-L155 HydrophobicContact CE1-CB 4.46Å; F142-L155 HydrophobicContact CE2-CD1 3.83Å; F142-L155 HydrophobicContact CZ-CB 4.21Å; F142-L155 HydrophobicContact CZ-CD1 4.12Å; L155-F158 PolarHBondContact O-N 2.83Å; L155-L159 HydrophobicContact CD1-CD1 4.37Å; L155-L159 HydrophobicContact CD1-CG 4.3Å; L155-L159 HydrophobicContact CG-CD1 4.18Å; L155-L159 HydrophobicContact CG-CG 4.49Å; L155-L159 WeakPolarHBondContact O-CG 3.49Å; L155-L159 PolarHBondContact O-N 2.79Å
156	G	97.5	Very high	96.6	Very high	41 Å²	41	65 Å²	65	42%	0.423	34%	0.343	S	S	.	.	H	α-helix	trans	-65.1	-38.9	176.7	0	0	0	0	0	113.1	T154 K160	T154-G156 PolarHBondContact O-N 3.16Å; G156-K160 WeakPolarHBondContact O-CB 3.4Å; G156-K160 VanDerWaalsContact O-CG 3.25Å; G156-K160 WeakPolarHBondContact O-CG 3.39Å; G156-K160 PolarHBondContact O-N 2.98Å
157	F	96.1	Very high	96.6	Very high	40 Å²	40	62.4 Å²	62.4	18%	0.175	34%	0.339	C	S	.	.	H	α-helix	trans	-64.7	-47.9	172.7	177.3	-91.7	0	0	0	110.8	Q153 T154 L159 K160 D161 K254 R255	Q153-F157 HydrophobicContact CB-CD1 3.98Å; Q153-F157 HydrophobicContact CG-CD1 3.7Å; Q153-F157 HydrophobicContact CG-CE1 3.9Å; T154-F157 WeakPolarHBondContact O-CB 3.37Å; T154-F157 PolarHBondContact O-N 2.77Å; T154-F157 VanDerWaalsContact O-N 3.08Å; T154-F157 WeakPolarHBondContact OG1-CB 3.31Å; T154-F157 PolarHBondContact OG1-N 3.45Å; F157-L159 PolarHBondContact O-N 2.72Å; F157-K160 PolarHBondContact O-N 2.96Å; F157-D161 HydrophobicContact CE1-CB 4.49Å; F157-D161 VanDerWaalsContact O-CB 3.3Å; F157-D161 WeakPolarHBondContact O-CB 3.32Å; F157-D161 PolarHBondContact O-N 3.31Å; F157-K254 HydrophobicContact CE2-CD 4.15Å; F157-K254 VanDerWaalsContact CE2-CE 3.5Å; F157-K254 HydrophobicContact CE2-CG 4.41Å; F157-K254 HydrophobicContact CZ-CD 4.46Å; F157-K254 HydrophobicContact CZ-CG 4.42Å; F157-R255 HydrophobicContact CE1-CG 4.24Å; F157-R255 HydrophobicContact CZ-CG 4.48Å
158	F	97.5	Very high	96.7	Very high	18 Å²	18	57.3 Å²	57.3	8%	0.079	32%	0.319	C	S	.	.	H	α-helix	trans	-57	-49.3	-179.7	177.4	-84.7	0	0	0	112.5	L134 S137 L138 T141 F142 T154 L155 D161 A162	L134-F158 HydrophobicContact CD1-CE1 3.87Å; S137-F158 VanDerWaalsContact OG-CZ 3.31Å; S137-F158 WeakPolarHBondContact OG-CZ 3.47Å; L138-F158 HydrophobicContact CD2-CD1 3.9Å; L138-F158 HydrophobicContact CD2-CE1 3.63Å; L138-F158 HydrophobicContact CD2-CZ 4.26Å; L138-F158 HydrophobicContact CG-CE1 4.14Å; T141-F158 HydrophobicContact CG2-CD2 4.29Å; F142-F158 HydrophobicContact CE2-CB 3.9Å; F142-F158 HydrophobicContact CE2-CD1 4.13Å; F142-F158 AromaticContact CE2-CD2 3.91Å; F142-F158 HydrophobicContact CE2-CD2 3.91Å; F142-F158 HydrophobicContact CE2-CE2 4.48Å; F142-F158 AromaticContact CE2-CG 3.71Å; F142-F158 HydrophobicContact CE2-CG 3.71Å; F142-F158 HydrophobicContact CZ-CB 3.73Å; F142-F158 HydrophobicContact CZ-CD2 4.36Å; F142-F158 HydrophobicContact CZ-CG 4.07Å; T154-F158 PolarHBondContact O-N 2.85Å; L155-F158 PolarHBondContact O-N 2.83Å; F158-D161 PolarHBondContact O-N 3.23Å; F158-A162 WeakPolarHBondContact O-CB 3.49Å; F158-A162 PolarHBondContact O-N 3.45Å
159	L	97.6	Very high	96.8	Very high	75 Å²	75	59.1 Å²	59.1	39%	0.393	33%	0.333	S	S	.	.	H	α-helix	trans	-67	-41.1	-179.6	-69.6	175.3	0	0	0	112.2	L134 L155 F157 D161 A162 V163	L134-L159 HydrophobicContact CD1-CD2 4.49Å; L155-L159 HydrophobicContact CD1-CD1 4.37Å; L155-L159 HydrophobicContact CD1-CG 4.3Å; L155-L159 HydrophobicContact CG-CD1 4.18Å; L155-L159 HydrophobicContact CG-CG 4.49Å; L155-L159 WeakPolarHBondContact O-CG 3.49Å; L155-L159 PolarHBondContact O-N 2.79Å; F157-L159 PolarHBondContact O-N 2.72Å; L159-D161 VanDerWaalsContact C-N 3.28Å; L159-D161 PolarHBondContact O-N 2.71Å; L159-A162 PolarHBondContact O-N 2.88Å; L159-V163 WeakPolarHBondContact O-CG2 3.48Å; L159-V163 PolarHBondContact O-N 3.31Å
160	K	97.4	Very high	97	Very high	165 Å²	165	57.8 Å²	57.8	72%	0.717	31%	0.314	S	S	*	.	H	α-helix	trans	-60.7	-41.3	174	-76.1	177.7	-179	-178.9	0	111.3	G156 F157 K164	G156-K160 WeakPolarHBondContact O-CB 3.4Å; G156-K160 VanDerWaalsContact O-CG 3.25Å; G156-K160 WeakPolarHBondContact O-CG 3.39Å; G156-K160 PolarHBondContact O-N 2.98Å; F157-K160 PolarHBondContact O-N 2.96Å; K160-K164 VanDerWaalsContact O-CB 3.27Å; K160-K164 WeakPolarHBondContact O-CB 3.23Å; K160-K164 PolarHBondContact O-N 3.13Å
161	D	96.4	Very high	97.2	Very high	7 Å²	7	62.1 Å²	62.1	4%	0.037	35%	0.345	C	S	.	.	H	α-helix	trans	-66.4	-43	178	-167.4	64.3	0	0	0	111.8	F157 F158 L159 K164 K165 R255	F157-D161 HydrophobicContact CE1-CB 4.49Å; F157-D161 VanDerWaalsContact O-CB 3.3Å; F157-D161 WeakPolarHBondContact O-CB 3.32Å; F157-D161 PolarHBondContact O-N 3.31Å; F158-D161 PolarHBondContact O-N 3.23Å; L159-D161 VanDerWaalsContact C-N 3.28Å; L159-D161 PolarHBondContact O-N 2.71Å; D161-K164 PolarHBondContact O-N 3.47Å; D161-K164 IonicContact OD1-NZ 3.55Å; D161-K165 WeakPolarHBondContact O-CB 3.32Å; D161-K165 VanDerWaalsContact O-CG 3.3Å; D161-K165 WeakPolarHBondContact O-CG 3.21Å; D161-K165 PolarHBondContact O-N 3.14Å; D161-K165 WeakPolarHBondContact OD2-CE 3.36Å; D161-K165 IonicContact OD2-NZ 3.29Å; D161-K165 PolarHBondContact OD2-NZ 3.34Å; D161-R255 VanDerWaalsContact CG-NH1 3.29Å; D161-R255 IonicContact OD1-CZ 2.74Å; D161-R255 IonicContact OD1-NH1 2.7Å; D161-R255 IonicContact OD1-NH2 3.9Å; D161-R255 PolarHBondContact OD1-NH2 2.87Å; D161-R255 IonicContact OD2-CZ 3.92Å; D161-R255 IonicContact OD2-NH1 3.86Å; D161-R255 PolarHBondContact OD2-NH1 3.03Å; D161-R255 IonicContact OD2-NH2 3.44Å; D161-R255 PolarHBondContact OD2-NH2 2.89Å
162	A	96.9	Very high	97.2	Very high	38 Å²	38	64.3 Å²	64.3	31%	0.314	36%	0.355	S	S	.	.	H	α-helix	trans	-60.7	-47.4	176.2	0	0	0	0	0	112.3	F158 L159 K164 K165 F166	F158-A162 WeakPolarHBondContact O-CB 3.49Å; F158-A162 PolarHBondContact O-N 3.45Å; L159-A162 PolarHBondContact O-N 2.88Å; A162-K164 PolarHBondContact O-N 3.43Å; A162-K165 PolarHBondContact O-N 2.94Å; A162-F166 WeakPolarHBondContact O-CB 3.44Å; A162-F166 PolarHBondContact O-N 2.93Å
163	V	98.1	Very high	97.4	Very high	104 Å²	104	62.5 Å²	62.5	63%	0.63	35%	0.348	S	S	*	.	H	α-helix	trans	-62.6	-44.3	177.3	171.9	0	0	0	0	111.1	L159 F166 A167	L159-V163 WeakPolarHBondContact O-CG2 3.48Å; L159-V163 PolarHBondContact O-N 3.31Å; V163-F166 PolarHBondContact O-N 2.79Å; V163-A167 WeakPolarHBondContact O-CB 3.47Å; V163-A167 PolarHBondContact O-N 2.88Å
164	K	98.1	Very high	97.6	Very high	72 Å²	72	62.9 Å²	62.9	31%	0.313	35%	0.351	S	S	.	.	H	α-helix	trans	-62.7	-44.1	177.5	-176.1	177.6	56.8	-179.7	0	111.7	K160 D161 A162 A167 V168 L217 F218	K160-K164 VanDerWaalsContact O-CB 3.27Å; K160-K164 WeakPolarHBondContact O-CB 3.23Å; K160-K164 PolarHBondContact O-N 3.13Å; D161-K164 PolarHBondContact O-N 3.47Å; D161-K164 IonicContact OD1-NZ 3.55Å; A162-K164 PolarHBondContact O-N 3.43Å; K164-A167 PolarHBondContact O-N 3.08Å; K164-V168 WeakPolarHBondContact O-CB 3.33Å; K164-V168 VanDerWaalsContact O-CG2 3.32Å; K164-V168 WeakPolarHBondContact O-CG2 3.34Å; K164-V168 PolarHBondContact O-N 2.9Å; K164-L217 WeakPolarHBondContact CE-O 3.46Å; K164-L217 PolarHBondContact NZ-O 3.17Å; K164-F218 HydrophobicContact CB-CE1 4.32Å; K164-F218 HydrophobicContact CD-CD1 4.36Å; K164-F218 HydrophobicContact CD-CE1 4.14Å; K164-F218 VanDerWaalsContact CE-CD1 3.44Å; K164-F218 HydrophobicContact CG-CE1 3.83Å; K164-F218 HydrophobicContact CG-CZ 4.41Å
165	K	97.3	Very high	97.7	Very high	95 Å²	95	61.5 Å²	61.5	41%	0.413	34%	0.344	S	S	.	.	H	α-helix	trans	-59.7	-46.4	175.3	-78.9	174	173.5	161.2	0	111.2	D161 A162 T169 F218	D161-K165 WeakPolarHBondContact O-CB 3.32Å; D161-K165 VanDerWaalsContact O-CG 3.3Å; D161-K165 WeakPolarHBondContact O-CG 3.21Å; D161-K165 PolarHBondContact O-N 3.14Å; D161-K165 WeakPolarHBondContact OD2-CE 3.36Å; D161-K165 IonicContact OD2-NZ 3.29Å; D161-K165 PolarHBondContact OD2-NZ 3.34Å; A162-K165 PolarHBondContact O-N 2.94Å; K165-T169 VanDerWaalsContact O-CB 3.31Å; K165-T169 WeakPolarHBondContact O-CB 3.29Å; K165-T169 PolarHBondContact O-N 3.29Å; K165-T169 PolarHBondContact O-OG1 3.2Å; K165-F218 HydrophobicContact CB-CE1 4.16Å; K165-F218 HydrophobicContact CG-CD1 3.86Å; K165-F218 HydrophobicContact CG-CE1 3.34Å; K165-F218 HydrophobicContact CG-CZ 3.99Å
166	F	98.1	Very high	97.8	Very high	62 Å²	62	59 Å²	59	27%	0.272	33%	0.333	S	S	.	.	H	α-helix	trans	-60.7	-49.6	177.5	-174.5	-95.9	0	0	0	111.3	L127 A130 A162 V163 T169 Q170	L127-F166 HydrophobicContact CB-CE2 4.44Å; L127-F166 HydrophobicContact CB-CZ 4.04Å; L127-F166 HydrophobicContact CD1-CZ 4.18Å; A130-F166 HydrophobicContact CB-CD2 4.15Å; A130-F166 HydrophobicContact CB-CE2 4.27Å; A162-F166 WeakPolarHBondContact O-CB 3.44Å; A162-F166 PolarHBondContact O-N 2.93Å; V163-F166 PolarHBondContact O-N 2.79Å; F166-T169 WeakPolarHBondContact O-CB 3.17Å; F166-T169 PolarHBondContact O-N 2.83Å; F166-Q170 HydrophobicContact CD1-CG 4.11Å; F166-Q170 HydrophobicContact CE1-CG 3.72Å; F166-Q170 HydrophobicContact CZ-CG 3.95Å; F166-Q170 WeakPolarHBondContact O-CG 3.14Å; F166-Q170 PolarHBondContact O-N 2.99Å
167	A	98.4	Very high	97.8	Very high	46 Å²	46	57.8 Å²	57.8	38%	0.38	32%	0.318	S	S	.	.	H	α-helix	trans	-60.3	-49.3	-179.9	0	0	0	0	0	112.6	V163 K164 T169 Q170 C171	V163-A167 WeakPolarHBondContact O-CB 3.47Å; V163-A167 PolarHBondContact O-N 2.88Å; K164-A167 PolarHBondContact O-N 3.08Å; A167-T169 VanDerWaalsContact C-N 3.27Å; A167-T169 PolarHBondContact O-N 2.89Å; A167-Q170 PolarHBondContact O-N 3.11Å; A167-C171 PolarHBondContact O-N 3.48Å; A167-C171 PolarHBondContact O-SG 3.46Å
168	V	98.3	Very high	98	Very high	32 Å²	32	57.5 Å²	57.5	19%	0.194	32%	0.32	C	S	.	.	H	α-helix	trans	-60.2	-39.9	177	172.4	0	0	0	0	111	K164 C171 I172 I214 L217 F218	K164-V168 WeakPolarHBondContact O-CB 3.33Å; K164-V168 VanDerWaalsContact O-CG2 3.32Å; K164-V168 WeakPolarHBondContact O-CG2 3.34Å; K164-V168 PolarHBondContact O-N 2.9Å; V168-C171 PolarHBondContact O-N 2.95Å; V168-I172 HydrophobicContact CG1-CD1 4.15Å; V168-I172 PolarHBondContact O-N 3Å; V168-I214 HydrophobicContact CG1-CG2 4.4Å; V168-L217 HydrophobicContact CG2-CD1 4.11Å; V168-F218 HydrophobicContact CB-CZ 4.16Å; V168-F218 HydrophobicContact CG1-CZ 4.38Å; V168-F218 HydrophobicContact CG2-CZ 4.05Å
169	T	97.8	Very high	98	Very high	74 Å²	74	60.9 Å²	60.9	45%	0.454	34%	0.339	S	S	.	.	H	α-helix	trans	-60.8	-47.9	175.8	-59.2	0	0	0	0	111.1	K165 F166 A167 C171 I172 L173	K165-T169 VanDerWaalsContact O-CB 3.31Å; K165-T169 WeakPolarHBondContact O-CB 3.29Å; K165-T169 PolarHBondContact O-N 3.29Å; K165-T169 PolarHBondContact O-OG1 3.2Å; F166-T169 WeakPolarHBondContact O-CB 3.17Å; F166-T169 PolarHBondContact O-N 2.83Å; A167-T169 VanDerWaalsContact C-N 3.27Å; A167-T169 PolarHBondContact O-N 2.89Å; T169-C171 PolarHBondContact O-N 2.84Å; T169-I172 PolarHBondContact O-N 3.31Å; T169-L173 WeakPolarHBondContact O-CB 3.38Å; T169-L173 PolarHBondContact O-N 3.37Å
170	Q	98.4	Very high	98	Very high	18 Å²	18	58.5 Å²	58.5	8%	0.084	33%	0.326	C	S	.	.	H	α-helix	trans	-63.4	-40.5	178.5	-63.6	-54.4	-46.9	0	0	112.4	T126 F166 A167 I172 L173 L174	T126-Q170 PolarHBondContact OG1-NE2 3.31Å; F166-Q170 HydrophobicContact CD1-CG 4.11Å; F166-Q170 HydrophobicContact CE1-CG 3.72Å; F166-Q170 HydrophobicContact CZ-CG 3.95Å; F166-Q170 WeakPolarHBondContact O-CG 3.14Å; F166-Q170 PolarHBondContact O-N 2.99Å; A167-Q170 PolarHBondContact O-N 3.11Å; Q170-I172 PolarHBondContact O-N 2.98Å; Q170-L173 PolarHBondContact O-N 3.28Å; Q170-L174 HydrophobicContact CB-CD1 4.34Å; Q170-L174 WeakPolarHBondContact O-CG 3.32Å; Q170-L174 PolarHBondContact O-N 2.76Å
171	C	98.3	Very high	98.1	Very high	98 Å²	98	50.8 Å²	50.8	66%	0.662	29%	0.293	S	S	*	.	H	α-helix	trans	-60.5	-28.8	178.1	-71.7	0	0	0	0	113.2	A167 V168 T169 P175	A167-C171 PolarHBondContact O-N 3.48Å; A167-C171 PolarHBondContact O-SG 3.46Å; V168-C171 PolarHBondContact O-N 2.95Å; T169-C171 PolarHBondContact O-N 2.84Å; C171-P175 VanDerWaalsContact O-CD 3.23Å; C171-P175 WeakPolarHBondContact O-CD 3.45Å; C171-P175 VanDerWaalsContact O-CG 3.31Å; C171-P175 WeakPolarHBondContact O-CG 3.49Å
172	I	98	Very high	98.2	Very high	56 Å²	56	56.8 Å²	56.8	29%	0.287	32%	0.316	S	S	.	.	H	α-helix	trans	-92.1	-46.8	176.7	-63.1	170.2	0	0	0	110.5	V168 T169 Q170 P175 V176 L206 I214	V168-I172 HydrophobicContact CG1-CD1 4.15Å; V168-I172 PolarHBondContact O-N 3Å; T169-I172 PolarHBondContact O-N 3.31Å; Q170-I172 PolarHBondContact O-N 2.98Å; I172-P175 WeakPolarHBondContact O-CD 3.4Å; I172-V176 HydrophobicContact CG2-CG2 4.33Å; I172-V176 WeakPolarHBondContact O-CB 3.25Å; I172-V176 WeakPolarHBondContact O-CG2 3.14Å; I172-V176 PolarHBondContact O-N 3.28Å; I172-L206 HydrophobicContact CD1-CD2 4.3Å; I172-L206 HydrophobicContact CG2-CD1 4.14Å; I172-L206 HydrophobicContact CG2-CD2 3.85Å; I172-I214 HydrophobicContact CD1-CD1 3.88Å
173	L	98.1	Very high	98.3	Very high	51 Å²	51	56.7 Å²	56.7	27%	0.267	31%	0.31	S	S	.	.	H	α-helix	trans	-62.3	-47.6	-173	178.8	65	0	0	0	112.2	T126 T169 Q170 S177	T126-L173 HydrophobicContact CG2-CD2 4.06Å; T169-L173 WeakPolarHBondContact O-CB 3.38Å; T169-L173 PolarHBondContact O-N 3.37Å; Q170-L173 PolarHBondContact O-N 3.28Å; L173-S177 WeakPolarHBondContact O-CB 3.28Å; L173-S177 PolarHBondContact O-N 2.82Å; L173-S177 PolarHBondContact O-OG 2.9Å
174	L	98.4	Very high	98.2	Very high	41 Å²	41	52.3 Å²	52.3	22%	0.215	28%	0.283	C	S	.	.	H	α-helix	trans	-68.8	-46.3	-172	-57.6	176	0	0	0	112.5	L119 L122 Q170 S177 S178	L119-L174 HydrophobicContact CB-CD2 4.3Å; L119-L174 HydrophobicContact CD2-CB 4.32Å; L119-L174 HydrophobicContact CD2-CD2 4.18Å; L119-L174 WeakPolarHBondContact CD2-O 3.48Å; L122-L174 HydrophobicContact CB-CD2 4.2Å; Q170-L174 HydrophobicContact CB-CD1 4.34Å; Q170-L174 WeakPolarHBondContact O-CG 3.32Å; Q170-L174 PolarHBondContact O-N 2.76Å; L174-S177 PolarHBondContact O-N 3.46Å; L174-S178 WeakPolarHBondContact O-CB 3.3Å; L174-S178 PolarHBondContact O-N 2.92Å; L174-S178 PolarHBondContact O-OG 3.28Å
175	P	98.5	Very high	98.1	Very high	66 Å²	66	53.1 Å²	53.1	43%	0.429	29%	0.286	S	S	.	.	H	α-helix	trans	-66.5	-38.5	175.8	-22.8	35.9	0	0	0	113.4	C171 I172 S178 L179	C171-P175 VanDerWaalsContact O-CD 3.23Å; C171-P175 WeakPolarHBondContact O-CD 3.45Å; C171-P175 VanDerWaalsContact O-CG 3.31Å; C171-P175 WeakPolarHBondContact O-CG 3.49Å; I172-P175 WeakPolarHBondContact O-CD 3.4Å; P175-S178 PolarHBondContact O-OG 3.34Å; P175-L179 WeakPolarHBondContact O-CG 3.41Å; P175-L179 PolarHBondContact O-N 3.44Å
176	V	98.5	Very high	98.1	Very high	41 Å²	41	54 Å²	54	25%	0.248	29%	0.294	C	S	.	.	H	α-helix	trans	-65	-44.3	176.7	169.7	0	0	0	0	110.4	I172 L179 L180 F198 V202	I172-V176 HydrophobicContact CG2-CG2 4.33Å; I172-V176 WeakPolarHBondContact O-CB 3.25Å; I172-V176 WeakPolarHBondContact O-CG2 3.14Å; I172-V176 PolarHBondContact O-N 3.28Å; V176-L179 PolarHBondContact O-N 2.7Å; V176-L180 WeakPolarHBondContact O-CB 3.24Å; V176-L180 PolarHBondContact O-N 2.91Å; V176-F198 HydrophobicContact CG1-CE1 4.11Å; V176-F198 HydrophobicContact CG1-CZ 4.43Å; V176-V202 HydrophobicContact CG1-CG1 3.96Å; V176-V202 HydrophobicContact CG1-CG2 4.37Å; V176-V202 HydrophobicContact CG2-CG1 3.93Å; V176-V202 HydrophobicContact CG2-CG2 4.49Å
177	S	98.5	Very high	97.8	Very high	15 Å²	15	51.8 Å²	51.8	11%	0.105	29%	0.289	C	S	.	.	H	α-helix	trans	-66.8	-40.6	179.7	-58.4	0	0	0	0	111.7	L173 L174 L179 L180 L181	L173-S177 WeakPolarHBondContact O-CB 3.28Å; L173-S177 PolarHBondContact O-N 2.82Å; L173-S177 PolarHBondContact O-OG 2.9Å; L174-S177 PolarHBondContact O-N 3.46Å; S177-L179 PolarHBondContact O-N 3.28Å; S177-L180 PolarHBondContact O-N 3.46Å; S177-L181 WeakPolarHBondContact O-CB 3.49Å; S177-L181 WeakPolarHBondContact O-CG 3.25Å; S177-L181 PolarHBondContact O-N 3Å
178	S	98.5	Very high	97.5	Very high	33 Å²	33	52 Å²	52	23%	0.231	30%	0.295	C	S	.	.	H	α-helix	trans	-61.9	-44.3	178.7	69.9	0	0	0	0	111.8	L174 P175 Y182	L174-S178 WeakPolarHBondContact O-CB 3.3Å; L174-S178 PolarHBondContact O-N 2.92Å; L174-S178 PolarHBondContact O-OG 3.28Å; P175-S178 PolarHBondContact O-OG 3.34Å; S178-Y182 WeakPolarHBondContact O-CB 3.43Å; S178-Y182 PolarHBondContact O-N 3.45Å
179	L	98.5	Very high	97.3	Very high	90 Å²	90	57.5 Å²	57.5	47%	0.471	32%	0.324	S	S	.	.	H	α-helix	trans	-66.6	-43.4	176.2	-70.6	174.6	0	0	0	112	P175 V176 S177 L181 Y182 I183 F198	P175-L179 WeakPolarHBondContact O-CG 3.41Å; P175-L179 PolarHBondContact O-N 3.44Å; V176-L179 PolarHBondContact O-N 2.7Å; S177-L179 PolarHBondContact O-N 3.28Å; L179-L181 PolarHBondContact O-N 3.28Å; L179-Y182 PolarHBondContact O-N 3.39Å; L179-I183 WeakPolarHBondContact O-CB 3.25Å; L179-I183 VanDerWaalsContact O-CG1 3.25Å; L179-I183 WeakPolarHBondContact O-CG1 3.48Å; L179-I183 PolarHBondContact O-N 2.94Å; L179-F198 HydrophobicContact CB-CE1 4.3Å; L179-F198 HydrophobicContact CB-CE2 4Å; L179-F198 HydrophobicContact CB-CZ 3.58Å; L179-F198 HydrophobicContact CD1-CE2 4.16Å; L179-F198 HydrophobicContact CD1-CZ 4.15Å
180	L	98.6	Very high	97.2	Very high	25 Å²	25	60.8 Å²	60.8	13%	0.131	33%	0.329	C	S	.	.	H	α-helix	trans	-59.7	-48	176.6	177.2	60	0	0	0	111.4	V176 S177 Y182 I183 I184 A195 F198 T199 F356	V176-L180 WeakPolarHBondContact O-CB 3.24Å; V176-L180 PolarHBondContact O-N 2.91Å; S177-L180 PolarHBondContact O-N 3.46Å; L180-Y182 VanDerWaalsContact C-N 3.29Å; L180-Y182 PolarHBondContact O-N 3.22Å; L180-I183 PolarHBondContact O-N 2.93Å; L180-I184 HydrophobicContact CD1-CD1 3.99Å; L180-I184 HydrophobicContact CD1-CG1 4.31Å; L180-I184 HydrophobicContact CG-CD1 3.97Å; L180-I184 WeakPolarHBondContact O-CG1 3.45Å; L180-I184 PolarHBondContact O-N 3.36Å; L180-A195 HydrophobicContact CD1-CB 3.86Å; L180-F198 HydrophobicContact CB-CD1 4.14Å; L180-F198 HydrophobicContact CB-CE1 3.87Å; L180-F198 HydrophobicContact CD1-CD1 4.12Å; L180-T199 HydrophobicContact CD1-CG2 4.13Å; L180-T199 HydrophobicContact CD2-CG2 4.33Å; L180-F356 HydrophobicContact CD1-CZ 4.44Å
181	L	98.4	Very high	97.2	Very high	3 Å²	3	61 Å²	61	2%	0.016	33%	0.33	C	S	.	.	H	α-helix	trans	-62.3	-39.5	178.2	-68.5	173.9	0	0	0	111.3	I115 S177 L179 I184 K185 T380 L381 L384	I115-L181 HydrophobicContact CG1-CB 4.33Å; S177-L181 WeakPolarHBondContact O-CB 3.49Å; S177-L181 WeakPolarHBondContact O-CG 3.25Å; S177-L181 PolarHBondContact O-N 3Å; L179-L181 PolarHBondContact O-N 3.28Å; L181-I184 PolarHBondContact O-N 2.84Å; L181-K185 WeakPolarHBondContact O-CB 3.28Å; L181-K185 WeakPolarHBondContact O-CG 3.36Å; L181-K185 PolarHBondContact O-N 3Å; L181-T380 HydrophobicContact CD2-CG2 3.86Å; L181-L381 HydrophobicContact CD1-CB 4.18Å; L181-L381 HydrophobicContact CD2-CB 3.89Å; L181-L381 HydrophobicContact CD2-CD1 4.39Å; L181-L384 HydrophobicContact CD2-CD1 3.95Å
182	Y	98.4	Very high	97.1	Very high	133 Å²	133	58 Å²	58	52%	0.522	31%	0.305	S	S	.	.	H	α-helix	trans	-63.1	-45.6	175	-173.4	-101.9	0	0	0	112.1	I115 S178 L179 L180 I184 K185 I186	I115-Y182 HydrophobicContact CD1-CD2 4.2Å; S178-Y182 WeakPolarHBondContact O-CB 3.43Å; S178-Y182 PolarHBondContact O-N 3.45Å; L179-Y182 PolarHBondContact O-N 3.39Å; L180-Y182 VanDerWaalsContact C-N 3.29Å; L180-Y182 PolarHBondContact O-N 3.22Å; Y182-I184 VanDerWaalsContact C-N 3.35Å; Y182-I184 PolarHBondContact O-N 3.41Å; Y182-K185 PolarHBondContact O-N 2.75Å; Y182-I186 HydrophobicContact CD1-CG2 4.5Å; Y182-I186 HydrophobicContact CE1-CD1 4.24Å; Y182-I186 HydrophobicContact CE1-CG2 4.37Å; Y182-I186 WeakPolarHBondContact O-CG2 3.48Å; Y182-I186 PolarHBondContact O-N 3.29Å
183	I	98.3	Very high	97.1	Very high	35 Å²	35	58.2 Å²	58.2	18%	0.179	31%	0.306	C	S	.	.	H	α-helix	trans	-59.5	-44.8	176.7	-71.2	165.4	0	0	0	111.1	L179 L180 K185 I186 G187 A195 F198	L179-I183 WeakPolarHBondContact O-CB 3.25Å; L179-I183 VanDerWaalsContact O-CG1 3.25Å; L179-I183 WeakPolarHBondContact O-CG1 3.48Å; L179-I183 PolarHBondContact O-N 2.94Å; L180-I183 PolarHBondContact O-N 2.93Å; I183-K185 VanDerWaalsContact C-N 3.32Å; I183-K185 PolarHBondContact O-N 3Å; I183-I186 PolarHBondContact O-N 3.4Å; I183-G187 WeakPolarHBondContact O-CA 3.46Å; I183-G187 PolarHBondContact O-N 3.45Å; I183-A195 HydrophobicContact CG2-CB 4.45Å; I183-F198 HydrophobicContact CD1-CB 3.68Å; I183-F198 HydrophobicContact CD1-CD1 4.03Å; I183-F198 HydrophobicContact CD1-CD2 3.57Å; I183-F198 HydrophobicContact CD1-CE2 4.21Å; I183-F198 HydrophobicContact CD1-CG 3.46Å; I183-F198 VanDerWaalsContact CD1-CG 3.46Å
184	I	97.8	Very high	97.1	Very high	12 Å²	12	61.7 Å²	61.7	6%	0.062	32%	0.317	C	S	.	.	H	α-helix	trans	-62.4	-41.6	178.1	-68	165.6	0	0	0	110.8	L180 L181 Y182 F191 A195 F359 T380 L384	L180-I184 HydrophobicContact CD1-CD1 3.99Å; L180-I184 HydrophobicContact CD1-CG1 4.31Å; L180-I184 HydrophobicContact CG-CD1 3.97Å; L180-I184 WeakPolarHBondContact O-CG1 3.45Å; L180-I184 PolarHBondContact O-N 3.36Å; L181-I184 PolarHBondContact O-N 2.84Å; Y182-I184 VanDerWaalsContact C-N 3.35Å; Y182-I184 PolarHBondContact O-N 3.41Å; I184-F191 HydrophobicContact CB-CD2 4.08Å; I184-F191 HydrophobicContact CB-CE2 4.45Å; I184-F191 HydrophobicContact CG1-CD2 3.93Å; I184-F191 HydrophobicContact CG1-CE2 4.21Å; I184-F191 HydrophobicContact CG2-CD2 3.76Å; I184-F191 HydrophobicContact CG2-CE2 3.76Å; I184-F191 HydrophobicContact CG2-CG 4.36Å; I184-F191 HydrophobicContact CG2-CZ 4.31Å; I184-A195 HydrophobicContact CG1-CB 4.04Å; I184-F359 HydrophobicContact CD1-CE1 4.39Å; I184-F359 HydrophobicContact CG2-CE1 4.21Å; I184-T380 HydrophobicContact CB-CG2 3.99Å; I184-T380 HydrophobicContact CD1-CG2 4.29Å; I184-T380 HydrophobicContact CG2-CG2 3.42Å; I184-T380 VanDerWaalsContact CG2-CG2 3.42Å; I184-L384 HydrophobicContact CD1-CD1 3.81Å; I184-L384 HydrophobicContact CD1-CD2 4.14Å; I184-L384 HydrophobicContact CD1-CG 4.31Å
185	K	95.9	Very high	97.1	Very high	90 Å²	90	59.8 Å²	59.8	39%	0.391	31%	0.307	S	S	.	.	H	α-helix	trans	-69.6	-33.3	-179.1	-75.7	178.8	177.3	-64.3	0	113.7	E114 I115 L181 Y182 I183 T380	E114-K185 VanDerWaalsContact OE1-CE 3.23Å; E114-K185 WeakPolarHBondContact OE1-CE 3.35Å; E114-K185 IonicContact OE1-NZ 2.76Å; E114-K185 PolarHBondContact OE1-NZ 2.92Å; E114-K185 IonicContact OE2-NZ 2.8Å; E114-K185 PolarHBondContact OE2-NZ 2.87Å; I115-K185 HydrophobicContact CD1-CD 4.32Å; I115-K185 HydrophobicContact CG1-CD 4.3Å; L181-K185 WeakPolarHBondContact O-CB 3.28Å; L181-K185 WeakPolarHBondContact O-CG 3.36Å; L181-K185 PolarHBondContact O-N 3Å; Y182-K185 PolarHBondContact O-N 2.75Å; I183-K185 VanDerWaalsContact C-N 3.32Å; I183-K185 PolarHBondContact O-N 3Å; K185-T380 WeakPolarHBondContact CE-OG1 3.08Å; K185-T380 PolarHBondContact NZ-OG1 3.13Å
186	I	97.1	Very high	97.1	Very high	112 Å²	112	59.4 Å²	59.4	57%	0.574	30%	0.297	S	S	*	.	H	α-helix	trans	-96.6	-19.3	-176.1	-158.5	169	0	0	0	113.9	Y182 I183 G188	Y182-I186 HydrophobicContact CD1-CG2 4.5Å; Y182-I186 HydrophobicContact CE1-CD1 4.24Å; Y182-I186 HydrophobicContact CE1-CG2 4.37Å; Y182-I186 WeakPolarHBondContact O-CG2 3.48Å; Y182-I186 PolarHBondContact O-N 3.29Å; I183-I186 PolarHBondContact O-N 3.4Å; I186-G188 VanDerWaalsContact C-N 3.27Å; I186-G188 PolarHBondContact O-N 2.83Å; I186-G188 VanDerWaalsContact O-N 3.13Å
187	G	91.4	Very high	97.1	Very high	17 Å²	17	61.2 Å²	61.2	18%	0.175	31%	0.305	C	S	.	.	S	Bend	trans	-73.9	-0.9	-165.6	0	0	0	0	0	117.3	I183 F191	I183-G187 WeakPolarHBondContact O-CA 3.46Å; I183-G187 PolarHBondContact O-N 3.45Å; G187-F191 PolarHBondContact O-N 3.4Å
188	G	91.9	Very high	97.1	Very high	49 Å²	49	62.1 Å²	62.1	51%	0.505	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	60	-156	-179.4	0	0	0	0	0	113.6	I186 Y190 F191	I186-G188 VanDerWaalsContact C-N 3.27Å; I186-G188 PolarHBondContact O-N 2.83Å; I186-G188 VanDerWaalsContact O-N 3.13Å; G188-Y190 PolarHBondContact O-N 3.01Å; G188-F191 WeakPolarHBondContact O-CB 3.21Å; G188-F191 VanDerWaalsContact O-CD1 3.22Å; G188-F191 WeakPolarHBondContact O-CD1 3.45Å; G188-F191 PolarHBondContact O-N 3.01Å
189	D	93.4	Very high	97.1	Very high	148 Å²	148	61.8 Å²	61.8	79%	0.791	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-60.7	-23	-175.2	-60.7	-27.1	0	0	0	114.2	F192	D189-F192 WeakPolarHBondContact O-CE1 3.27Å
190	Y	96.4	Very high	97.1	Very high	144 Å²	144	59 Å²	59	57%	0.565	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-103	16.8	179.2	-63.7	-75.8	0	0	0	113.4	G188 F192 I193	G188-Y190 PolarHBondContact O-N 3.01Å; Y190-F192 HydrophobicContact CD1-CE1 4.03Å; Y190-F192 HydrophobicContact CD1-CZ 4.19Å; Y190-F192 PolarHBondContact O-N 3.07Å; Y190-I193 HydrophobicContact CD1-CD1 3.97Å; Y190-I193 PolarHBondContact O-N 2.84Å
191	F	97.4	Very high	97	Very high	23 Å²	23	62.3 Å²	62.3	10%	0.101	31%	0.306	C	S	.	.	H	α-helix	trans	-52	-32.6	-177.9	77.3	-102.5	0	0	0	112.9	I184 G187 G188 I193 Y194 A195 F359 A360 I363	I184-F191 HydrophobicContact CB-CD2 4.08Å; I184-F191 HydrophobicContact CB-CE2 4.45Å; I184-F191 HydrophobicContact CG1-CD2 3.93Å; I184-F191 HydrophobicContact CG1-CE2 4.21Å; I184-F191 HydrophobicContact CG2-CD2 3.76Å; I184-F191 HydrophobicContact CG2-CE2 3.76Å; I184-F191 HydrophobicContact CG2-CG 4.36Å; I184-F191 HydrophobicContact CG2-CZ 4.31Å; G187-F191 PolarHBondContact O-N 3.4Å; G188-F191 WeakPolarHBondContact O-CB 3.21Å; G188-F191 VanDerWaalsContact O-CD1 3.22Å; G188-F191 WeakPolarHBondContact O-CD1 3.45Å; G188-F191 PolarHBondContact O-N 3.01Å; F191-I193 VanDerWaalsContact C-N 3.28Å; F191-I193 PolarHBondContact O-N 3.08Å; F191-Y194 PolarHBondContact O-N 3.26Å; F191-A195 WeakPolarHBondContact O-CB 3.29Å; F191-A195 PolarHBondContact O-N 3.31Å; F191-F359 AromaticContact CE2-CD1 3.63Å; F191-F359 HydrophobicContact CE2-CD1 3.63Å; F191-F359 AromaticContact CE2-CE1 3.55Å; F191-F359 HydrophobicContact CE2-CE1 3.55Å; F191-F359 AromaticContact CZ-CD1 3.74Å; F191-F359 HydrophobicContact CZ-CD1 3.74Å; F191-F359 AromaticContact CZ-CE1 3.68Å; F191-F359 HydrophobicContact CZ-CE1 3.68Å; F191-A360 HydrophobicContact CE1-CB 3.92Å; F191-A360 HydrophobicContact CE2-CB 4.49Å; F191-A360 HydrophobicContact CZ-CB 3.74Å; F191-I363 HydrophobicContact CE1-CG2 4.3Å; F191-I363 HydrophobicContact CZ-CG2 4.11Å
192	F	97.7	Very high	97	Very high	33 Å²	33	63.5 Å²	63.5	15%	0.145	31%	0.313	C	S	.	.	H	α-helix	trans	-64	-30.2	-177.6	66.9	-86.6	0	0	0	113.4	D189 Y190 W196 F353 F356 S357 A360	D189-F192 WeakPolarHBondContact O-CE1 3.27Å; Y190-F192 HydrophobicContact CD1-CE1 4.03Å; Y190-F192 HydrophobicContact CD1-CZ 4.19Å; Y190-F192 PolarHBondContact O-N 3.07Å; F192-W196 WeakPolarHBondContact O-CB 3.24Å; F192-W196 PolarHBondContact O-N 3.1Å; F192-F353 HydrophobicContact CE2-CE2 4.42Å; F192-F353 HydrophobicContact CE2-CZ 4.23Å; F192-F356 HydrophobicContact CB-CB 4.12Å; F192-F356 VanDerWaalsContact CB-O 3.29Å; F192-F356 WeakPolarHBondContact CB-O 3.47Å; F192-S357 WeakPolarHBondContact CD2-OG 3.19Å; F192-A360 HydrophobicContact CB-CB 3.96Å; F192-A360 HydrophobicContact CD1-CB 3.7Å; F192-A360 HydrophobicContact CG-CB 4.05Å
193	I	98.3	Very high	96.8	Very high	61 Å²	61	59.7 Å²	59.7	31%	0.313	31%	0.307	S	S	.	.	H	α-helix	trans	-68.9	-45.2	175.6	-58.9	179.6	0	0	0	109.5	Y190 F191 W196 L197	Y190-I193 HydrophobicContact CD1-CD1 3.97Å; Y190-I193 PolarHBondContact O-N 2.84Å; F191-I193 VanDerWaalsContact C-N 3.28Å; F191-I193 PolarHBondContact O-N 3.08Å; I193-W196 PolarHBondContact O-N 3.04Å; I193-L197 WeakPolarHBondContact O-CB 3.39Å; I193-L197 PolarHBondContact O-N 3.29Å
194	Y	98.1	Very high	96.5	Very high	125 Å²	125	61.2 Å²	61.2	49%	0.49	32%	0.315	S	S	.	.	H	α-helix	trans	-68.9	-39.7	178.9	-48.9	-56.3	0	0	0	111.7	F191 L197 F198	F191-Y194 PolarHBondContact O-N 3.26Å; Y194-L197 PolarHBondContact O-N 2.66Å; Y194-F198 VanDerWaalsContact O-CB 3.23Å; Y194-F198 WeakPolarHBondContact O-CB 3.49Å; Y194-F198 PolarHBondContact O-N 3.28Å
195	A	98.4	Very high	96.3	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-62	-47.9	174.5	0	0	0	0	0	111.2	L180 I183 I184 F191 F198 T199 F356	L180-A195 HydrophobicContact CD1-CB 3.86Å; I183-A195 HydrophobicContact CG2-CB 4.45Å; I184-A195 HydrophobicContact CG1-CB 4.04Å; F191-A195 WeakPolarHBondContact O-CB 3.29Å; F191-A195 PolarHBondContact O-N 3.31Å; A195-F198 PolarHBondContact O-N 2.85Å; A195-T199 WeakPolarHBondContact O-CG2 3.31Å; A195-T199 PolarHBondContact O-N 3.13Å; A195-T199 PolarHBondContact O-OG1 2.97Å; A195-F356 HydrophobicContact CB-CD1 4.02Å; A195-F356 HydrophobicContact CB-CE1 3.97Å; A195-F356 HydrophobicContact CB-CZ 4.43Å
196	W	98.6	Very high	96.2	Very high	59 Å²	59	63 Å²	63	22%	0.223	33%	0.331	C	S	.	.	H	α-helix	trans	-57.4	-52.9	174.2	166.5	71.8	0	0	0	111.5	F192 I193 F198 T199 L200 Q349 F353 F356	F192-W196 WeakPolarHBondContact O-CB 3.24Å; F192-W196 PolarHBondContact O-N 3.1Å; I193-W196 PolarHBondContact O-N 3.04Å; W196-F198 VanDerWaalsContact C-N 3.29Å; W196-F198 PolarHBondContact O-N 3.29Å; W196-T199 PolarHBondContact O-N 3.46Å; W196-T199 VanDerWaalsContact O-N 3.13Å; W196-T199 PolarHBondContact O-OG1 3.17Å; W196-L200 HydrophobicContact CH2-CD1 4.18Å; W196-L200 HydrophobicContact CZ2-CD1 3.71Å; W196-L200 WeakPolarHBondContact O-CB 3.44Å; W196-L200 PolarHBondContact O-N 3.33Å; W196-Q349 PolarHBondContact NE1-O 2.85Å; W196-F353 HydrophobicContact CB-CD2 4.45Å; W196-F353 HydrophobicContact CD2-CB 4.39Å; W196-F353 AromaticContact CD2-CD2 3.74Å; W196-F353 HydrophobicContact CD2-CD2 3.74Å; W196-F353 AromaticContact CE3-CD2 3.99Å; W196-F353 HydrophobicContact CE3-CD2 3.99Å; W196-F353 HydrophobicContact CE3-CE2 4.49Å; W196-F353 HydrophobicContact CG-CB 4.19Å; W196-F353 AromaticContact CG-CD2 3.93Å; W196-F353 HydrophobicContact CG-CD2 3.93Å; W196-F356 HydrophobicContact CB-CB 4.47Å; W196-F356 HydrophobicContact CB-CD2 3.93Å; W196-F356 HydrophobicContact CB-CG 4.46Å
197	L	98.4	Very high	95.8	Very high	78 Å²	78	62 Å²	62	41%	0.408	33%	0.33	S	S	.	.	H	α-helix	trans	-59.9	-40.8	-179.7	-178.1	62.5	0	0	0	111.8	I193 Y194 L200 L201	I193-L197 WeakPolarHBondContact O-CB 3.39Å; I193-L197 PolarHBondContact O-N 3.29Å; Y194-L197 PolarHBondContact O-N 2.66Å; L197-L200 WeakPolarHBondContact O-CB 3.38Å; L197-L200 PolarHBondContact O-N 2.92Å; L197-L201 HydrophobicContact CD1-CG 4.49Å; L197-L201 HydrophobicContact CG-CD1 4.33Å; L197-L201 VanDerWaalsContact O-CG 3.3Å; L197-L201 WeakPolarHBondContact O-CG 3.39Å; L197-L201 PolarHBondContact O-N 3.48Å
198	F	98.6	Very high	95.6	Very high	35 Å²	35	64.8 Å²	64.8	15%	0.154	34%	0.344	C	S	.	.	H	α-helix	trans	-60.1	-49.4	174.5	174.5	-102	0	0	0	111.5	V176 L179 L180 I183 Y194 A195 W196 L200 L201 V202	V176-F198 HydrophobicContact CG1-CE1 4.11Å; V176-F198 HydrophobicContact CG1-CZ 4.43Å; L179-F198 HydrophobicContact CB-CE1 4.3Å; L179-F198 HydrophobicContact CB-CE2 4Å; L179-F198 HydrophobicContact CB-CZ 3.58Å; L179-F198 HydrophobicContact CD1-CE2 4.16Å; L179-F198 HydrophobicContact CD1-CZ 4.15Å; L180-F198 HydrophobicContact CB-CD1 4.14Å; L180-F198 HydrophobicContact CB-CE1 3.87Å; L180-F198 HydrophobicContact CD1-CD1 4.12Å; I183-F198 HydrophobicContact CD1-CB 3.68Å; I183-F198 HydrophobicContact CD1-CD1 4.03Å; I183-F198 HydrophobicContact CD1-CD2 3.57Å; I183-F198 HydrophobicContact CD1-CE2 4.21Å; I183-F198 HydrophobicContact CD1-CG 3.46Å; I183-F198 VanDerWaalsContact CD1-CG 3.46Å; Y194-F198 VanDerWaalsContact O-CB 3.23Å; Y194-F198 WeakPolarHBondContact O-CB 3.49Å; Y194-F198 PolarHBondContact O-N 3.28Å; A195-F198 PolarHBondContact O-N 2.85Å; W196-F198 VanDerWaalsContact C-N 3.29Å; W196-F198 PolarHBondContact O-N 3.29Å; F198-L200 VanDerWaalsContact C-N 3.31Å; F198-L200 PolarHBondContact O-N 3.5Å; F198-L201 PolarHBondContact O-N 3.45Å; F198-V202 HydrophobicContact CD1-CG2 4.28Å; F198-V202 HydrophobicContact CD2-CG2 4.27Å; F198-V202 HydrophobicContact CE1-CG2 3.85Å; F198-V202 HydrophobicContact CE2-CG2 3.84Å; F198-V202 HydrophobicContact CG-CG2 4.48Å; F198-V202 HydrophobicContact CZ-CG2 3.61Å; F198-V202 WeakPolarHBondContact O-CG2 3.21Å; F198-V202 PolarHBondContact O-N 2.68Å
199	T	98.1	Very high	95.5	Very high	26 Å²	26	65.2 Å²	65.2	16%	0.16	33%	0.334	C	S	.	.	H	α-helix	trans	-65.6	-32.5	178.2	59.4	0	0	0	0	113.3	L180 A195 W196 S203 F356	L180-T199 HydrophobicContact CD1-CG2 4.13Å; L180-T199 HydrophobicContact CD2-CG2 4.33Å; A195-T199 WeakPolarHBondContact O-CG2 3.31Å; A195-T199 PolarHBondContact O-N 3.13Å; A195-T199 PolarHBondContact O-OG1 2.97Å; W196-T199 PolarHBondContact O-N 3.46Å; W196-T199 VanDerWaalsContact O-N 3.13Å; W196-T199 PolarHBondContact O-OG1 3.17Å; T199-S203 VanDerWaalsContact O-CB 3.26Å; T199-S203 WeakPolarHBondContact O-CB 3.44Å; T199-S203 PolarHBondContact O-N 3.32Å; T199-S203 PolarHBondContact O-OG 3.41Å; T199-F356 HydrophobicContact CG2-CE2 3.89Å; T199-F356 HydrophobicContact CG2-CZ 3.77Å; T199-F356 WeakPolarHBondContact OG1-CE2 3.49Å
200	L	97.4	Very high	95.4	Very high	32 Å²	32	64.2 Å²	64.2	17%	0.168	32%	0.32	C	S	.	.	H	α-helix	trans	-61.3	-51.3	171.5	179.7	158.9	0	0	0	110.1	W196 L197 F198 S203 L204 Q349	W196-L200 HydrophobicContact CH2-CD1 4.18Å; W196-L200 HydrophobicContact CZ2-CD1 3.71Å; W196-L200 WeakPolarHBondContact O-CB 3.44Å; W196-L200 PolarHBondContact O-N 3.33Å; L197-L200 WeakPolarHBondContact O-CB 3.38Å; L197-L200 PolarHBondContact O-N 2.92Å; F198-L200 VanDerWaalsContact C-N 3.31Å; F198-L200 PolarHBondContact O-N 3.5Å; L200-S203 PolarHBondContact O-N 2.9Å; L200-L204 HydrophobicContact CD2-CD1 3.55Å; L200-L204 HydrophobicContact CD2-CG 4.2Å; L200-L204 WeakPolarHBondContact O-CG 3.33Å; L200-L204 PolarHBondContact O-N 3.02Å; L200-Q349 VanDerWaalsContact CB-OE1 3.32Å; L200-Q349 HydrophobicContact CD1-CG 4.21Å
201	L	97.6	Very high	94.9	Very high	94 Å²	94	57.7 Å²	57.7	49%	0.492	30%	0.296	S	S	.	.	H	α-helix	trans	-62.1	-45.3	179.9	-70.7	174	0	0	0	111.6	L197 F198 S203 L204 V205	L197-L201 HydrophobicContact CD1-CG 4.49Å; L197-L201 HydrophobicContact CG-CD1 4.33Å; L197-L201 VanDerWaalsContact O-CG 3.3Å; L197-L201 WeakPolarHBondContact O-CG 3.39Å; L197-L201 PolarHBondContact O-N 3.48Å; F198-L201 PolarHBondContact O-N 3.45Å; L201-S203 VanDerWaalsContact C-N 3.32Å; L201-S203 PolarHBondContact O-N 3.46Å; L201-L204 PolarHBondContact O-N 3.31Å; L201-V205 VanDerWaalsContact O-CG2 3.3Å; L201-V205 WeakPolarHBondContact O-CG2 3.36Å; L201-V205 PolarHBondContact O-N 3.23Å
202	V	97.3	Very high	94.3	Very high	27 Å²	27	59.7 Å²	59.7	16%	0.164	31%	0.308	C	S	.	.	H	α-helix	trans	-59.4	-45.2	175.5	170.6	0	0	0	0	110.5	V176 F198 L204 V205 L206	V176-V202 HydrophobicContact CG1-CG1 3.96Å; V176-V202 HydrophobicContact CG1-CG2 4.37Å; V176-V202 HydrophobicContact CG2-CG1 3.93Å; V176-V202 HydrophobicContact CG2-CG2 4.49Å; F198-V202 HydrophobicContact CD1-CG2 4.28Å; F198-V202 HydrophobicContact CD2-CG2 4.27Å; F198-V202 HydrophobicContact CE1-CG2 3.85Å; F198-V202 HydrophobicContact CE2-CG2 3.84Å; F198-V202 HydrophobicContact CG-CG2 4.48Å; F198-V202 HydrophobicContact CZ-CG2 3.61Å; F198-V202 WeakPolarHBondContact O-CG2 3.21Å; F198-V202 PolarHBondContact O-N 2.68Å; V202-L204 PolarHBondContact O-N 2.93Å; V202-V205 PolarHBondContact O-N 3.3Å; V202-L206 HydrophobicContact CG1-CD1 3.79Å; V202-L206 HydrophobicContact CG1-CG 4.16Å; V202-L206 WeakPolarHBondContact O-CB 3.41Å; V202-L206 WeakPolarHBondContact O-CG 3.44Å; V202-L206 PolarHBondContact O-N 2.93Å
203	S	94.3	Very high	94	Very high	54 Å²	54	66 Å²	66	38%	0.378	33%	0.332	S	S	.	.	H	α-helix	trans	-61.9	-44.8	178.9	-60.5	0	0	0	0	111.9	T199 L200 L201 L206 V207	T199-S203 VanDerWaalsContact O-CB 3.26Å; T199-S203 WeakPolarHBondContact O-CB 3.44Å; T199-S203 PolarHBondContact O-N 3.32Å; T199-S203 PolarHBondContact O-OG 3.41Å; L200-S203 PolarHBondContact O-N 2.9Å; L201-S203 VanDerWaalsContact C-N 3.32Å; L201-S203 PolarHBondContact O-N 3.46Å; S203-L206 PolarHBondContact O-N 3.1Å; S203-V207 WeakPolarHBondContact O-CB 3.35Å; S203-V207 VanDerWaalsContact O-CG2 3.27Å; S203-V207 WeakPolarHBondContact O-CG2 3.29Å; S203-V207 PolarHBondContact O-N 3.16Å
204	L	92.3	Very high	93.8	Very high	67 Å²	67	64.2 Å²	64.2	35%	0.351	32%	0.322	S	S	.	.	H	α-helix	trans	-62.5	-43.1	176.6	-71.2	179.7	0	0	0	112	L200 L201 V202 T208 F266	L200-L204 HydrophobicContact CD2-CD1 3.55Å; L200-L204 HydrophobicContact CD2-CG 4.2Å; L200-L204 WeakPolarHBondContact O-CG 3.33Å; L200-L204 PolarHBondContact O-N 3.02Å; L201-L204 PolarHBondContact O-N 3.31Å; V202-L204 PolarHBondContact O-N 2.93Å; L204-T208 VanDerWaalsContact O-CB 3.27Å; L204-T208 WeakPolarHBondContact O-CB 3.48Å; L204-T208 PolarHBondContact O-N 3Å; L204-T208 PolarHBondContact O-OG1 3.4Å; L204-F266 HydrophobicContact CD2-CE1 4.27Å; L204-F266 HydrophobicContact CD2-CZ 3.98Å
205	V	94.1	Very high	93.6	Very high	81 Å²	81	58.4 Å²	58.4	49%	0.491	30%	0.3	S	S	.	.	H	α-helix	trans	-62	-51.9	176.1	170.2	0	0	0	0	110.1	L201 V202 V207 T208 I209	L201-V205 VanDerWaalsContact O-CG2 3.3Å; L201-V205 WeakPolarHBondContact O-CG2 3.36Å; L201-V205 PolarHBondContact O-N 3.23Å; V202-V205 PolarHBondContact O-N 3.3Å; V205-V207 PolarHBondContact O-N 3.49Å; V205-T208 WeakPolarHBondContact O-CB 3.3Å; V205-T208 PolarHBondContact O-N 3.34Å; V205-T208 VanDerWaalsContact O-N 3.1Å; V205-I209 HydrophobicContact CG1-CD1 4.26Å; V205-I209 HydrophobicContact CG1-CG2 4.37Å; V205-I209 WeakPolarHBondContact O-CG1 3.45Å; V205-I209 WeakPolarHBondContact O-CG2 3.32Å; V205-I209 PolarHBondContact O-N 2.68Å
206	L	93.1	Very high	93.4	Very high	57 Å²	57	61.3 Å²	61.3	30%	0.298	32%	0.319	S	S	.	.	H	α-helix	trans	-59.4	-47.7	-178.4	-73	179.3	0	0	0	112	I172 V202 S203 T208 I209 Y210 I214	I172-L206 HydrophobicContact CD1-CD2 4.3Å; I172-L206 HydrophobicContact CG2-CD1 4.14Å; I172-L206 HydrophobicContact CG2-CD2 3.85Å; V202-L206 HydrophobicContact CG1-CD1 3.79Å; V202-L206 HydrophobicContact CG1-CG 4.16Å; V202-L206 WeakPolarHBondContact O-CB 3.41Å; V202-L206 WeakPolarHBondContact O-CG 3.44Å; V202-L206 PolarHBondContact O-N 2.93Å; S203-L206 PolarHBondContact O-N 3.1Å; L206-T208 VanDerWaalsContact C-N 3.26Å; L206-T208 PolarHBondContact O-N 3.42Å; L206-I209 HydrophobicContact CD2-CD1 4.29Å; L206-I209 PolarHBondContact O-N 3.36Å; L206-Y210 WeakPolarHBondContact O-CA 3.43Å; L206-Y210 WeakPolarHBondContact O-CB 3.48Å; L206-Y210 PolarHBondContact O-N 3.21Å; L206-I214 HydrophobicContact CD2-CD1 4.5Å
207	V	88.1	Confident	93.2	Very high	91 Å²	91	62.7 Å²	62.7	55%	0.552	33%	0.33	S	S	*	.	H	α-helix	trans	-62.1	-35.9	176.9	174.6	0	0	0	0	111.3	S203 V205 F266	S203-V207 WeakPolarHBondContact O-CB 3.35Å; S203-V207 VanDerWaalsContact O-CG2 3.27Å; S203-V207 WeakPolarHBondContact O-CG2 3.29Å; S203-V207 PolarHBondContact O-N 3.16Å; V205-V207 PolarHBondContact O-N 3.49Å; V207-F266 HydrophobicContact CB-CE2 4.17Å; V207-F266 HydrophobicContact CG1-CE2 3.66Å; V207-F266 HydrophobicContact CG1-CZ 4.01Å
208	T	87.6	Confident	93.1	Very high	77 Å²	77	60.5 Å²	60.5	47%	0.472	32%	0.317	S	S	.	.	H	α-helix	trans	-70.1	-44.5	178.8	-59.5	0	0	0	0	112.1	L204 V205 L206 F266	L204-T208 VanDerWaalsContact O-CB 3.27Å; L204-T208 WeakPolarHBondContact O-CB 3.48Å; L204-T208 PolarHBondContact O-N 3Å; L204-T208 PolarHBondContact O-OG1 3.4Å; V205-T208 WeakPolarHBondContact O-CB 3.3Å; V205-T208 PolarHBondContact O-N 3.34Å; V205-T208 VanDerWaalsContact O-N 3.1Å; L206-T208 VanDerWaalsContact C-N 3.26Å; L206-T208 PolarHBondContact O-N 3.42Å; T208-F266 WeakPolarHBondContact OG1-CD2 3.33Å; T208-F266 WeakPolarHBondContact OG1-CE2 3.22Å
209	I	90.9	Very high	92.8	Very high	58 Å²	58	60.9 Å²	60.9	30%	0.297	32%	0.321	S	S	.	.	H	α-helix	trans	-84.3	-17.5	-176.9	71.1	178	0	0	0	113.1	V205 L206 A211 D212 Y213 I214	V205-I209 HydrophobicContact CG1-CD1 4.26Å; V205-I209 HydrophobicContact CG1-CG2 4.37Å; V205-I209 WeakPolarHBondContact O-CG1 3.45Å; V205-I209 WeakPolarHBondContact O-CG2 3.32Å; V205-I209 PolarHBondContact O-N 2.68Å; L206-I209 HydrophobicContact CD2-CD1 4.29Å; L206-I209 PolarHBondContact O-N 3.36Å; I209-A211 PolarHBondContact O-N 3.47Å; I209-D212 PolarHBondContact O-N 3.14Å; I209-Y213 HydrophobicContact CB-CD2 3.81Å; I209-Y213 HydrophobicContact CG2-CD2 4.27Å; I209-Y213 WeakPolarHBondContact O-CB 3.27Å; I209-Y213 PolarHBondContact O-N 2.91Å; I209-I214 HydrophobicContact CG1-CD1 4.28Å
210	Y	90.6	Very high	92.6	Very high	126 Å²	126	66 Å²	66	49%	0.494	34%	0.341	S	S	.	.	I	π-helix	trans	-51.7	-53.9	-171.9	175.7	-97	0	0	0	112.2	L206 D212 I214 A215	L206-Y210 WeakPolarHBondContact O-CA 3.43Å; L206-Y210 WeakPolarHBondContact O-CB 3.48Å; L206-Y210 PolarHBondContact O-N 3.21Å; Y210-D212 PolarHBondContact O-N 2.89Å; Y210-I214 HydrophobicContact CD2-CB 3.97Å; Y210-I214 HydrophobicContact CD2-CD1 4.31Å; Y210-I214 HydrophobicContact CD2-CG2 4Å; Y210-I214 HydrophobicContact CE2-CB 4.46Å; Y210-I214 HydrophobicContact CE2-CG2 4.1Å; Y210-I214 CarbonylContact O-C 3.44Å; Y210-I214 WeakPolarHBondContact O-CA 3.36Å; Y210-I214 WeakPolarHBondContact O-CB 3.25Å; Y210-I214 PolarHBondContact O-N 2.84Å; Y210-A215 HydrophobicContact CD1-CB 4.36Å; Y210-A215 HydrophobicContact CE1-CB 3.95Å; Y210-A215 PolarHBondContact O-N 3.36Å
211	A	85.9	Confident	92.4	Very high	7 Å²	7	66.3 Å²	66.3	6%	0.058	34%	0.341	C	S	.	.	I	π-helix	trans	-75.2	-24.9	-171.7	0	0	0	0	0	114.3	I209 P216 Y264	I209-A211 PolarHBondContact O-N 3.47Å; A211-P216 VanDerWaalsContact O-CD 3.3Å; A211-P216 WeakPolarHBondContact O-CD 3.35Å; A211-P216 WeakPolarHBondContact O-CG 3.46Å; A211-Y264 HydrophobicContact CB-CD1 4.17Å; A211-Y264 HydrophobicContact CB-CD2 3.57Å; A211-Y264 HydrophobicContact CB-CE1 3.71Å; A211-Y264 HydrophobicContact CB-CE2 3.1Å; A211-Y264 HydrophobicContact CB-CG 4.1Å
212	D	85.6	Confident	92.2	Very high	66 Å²	66	64.7 Å²	64.7	35%	0.353	34%	0.335	S	S	.	.	I	π-helix	trans	-90.1	-31.8	-179.5	-83.2	-42.7	0	0	0	113.1	I209 Y210 R271	I209-D212 PolarHBondContact O-N 3.14Å; Y210-D212 PolarHBondContact O-N 2.89Å; D212-R271 VanDerWaalsContact CG-NH1 3.3Å; D212-R271 VanDerWaalsContact CG-NH2 3.33Å; D212-R271 IonicContact OD1-CZ 3.5Å; D212-R271 VanDerWaalsContact OD1-CZ 3.3Å; D212-R271 IonicContact OD1-NH1 2.62Å; D212-R271 PolarHBondContact OD1-NH1 3.17Å; D212-R271 IonicContact OD1-NH2 2.9Å; D212-R271 PolarHBondContact OD1-NH2 2.86Å; D212-R271 VanDerWaalsContact OD1-NH2 3.09Å; D212-R271 IonicContact OD2-CZ 3Å; D212-R271 IonicContact OD2-NH1 3.39Å; D212-R271 PolarHBondContact OD2-NH1 3.45Å; D212-R271 IonicContact OD2-NH2 3.28Å; D212-R271 PolarHBondContact OD2-NH2 3.4Å
213	Y	91.3	Very high	92.1	Very high	166 Å²	166	67.9 Å²	67.9	65%	0.651	36%	0.357	S	S	*	.	I	π-helix	trans	-124	-25.2	-168.3	-60.3	-80.7	0	0	0	114.1	I209 L217	I209-Y213 HydrophobicContact CB-CD2 3.81Å; I209-Y213 HydrophobicContact CG2-CD2 4.27Å; I209-Y213 WeakPolarHBondContact O-CB 3.27Å; I209-Y213 PolarHBondContact O-N 2.91Å; Y213-L217 WeakPolarHBondContact O-CG 3.5Å
214	I	94.3	Very high	92	Very high	22 Å²	22	65.5 Å²	65.5	11%	0.113	34%	0.34	C	S	.	.	I	π-helix	trans	-100.8	-56.7	-177.5	-55.7	179.8	0	0	0	110.4	V168 I172 L206 I209 Y210 L217 F218	V168-I214 HydrophobicContact CG1-CG2 4.4Å; I172-I214 HydrophobicContact CD1-CD1 3.88Å; L206-I214 HydrophobicContact CD2-CD1 4.5Å; I209-I214 HydrophobicContact CG1-CD1 4.28Å; Y210-I214 HydrophobicContact CD2-CB 3.97Å; Y210-I214 HydrophobicContact CD2-CD1 4.31Å; Y210-I214 HydrophobicContact CD2-CG2 4Å; Y210-I214 HydrophobicContact CE2-CB 4.46Å; Y210-I214 HydrophobicContact CE2-CG2 4.1Å; Y210-I214 CarbonylContact O-C 3.44Å; Y210-I214 WeakPolarHBondContact O-CA 3.36Å; Y210-I214 WeakPolarHBondContact O-CB 3.25Å; Y210-I214 PolarHBondContact O-N 2.84Å; I214-L217 VanDerWaalsContact O-CB 3.24Å; I214-L217 WeakPolarHBondContact O-CB 3.37Å; I214-L217 WeakPolarHBondContact O-CG 3.36Å; I214-L217 PolarHBondContact O-N 2.89Å; I214-F218 HydrophobicContact CG2-CE2 3.93Å; I214-F218 VanDerWaalsContact O-CD2 3.22Å; I214-F218 WeakPolarHBondContact O-CD2 3.22Å
215	A	92.4	Very high	92	Very high	3 Å²	3	65.2 Å²	65.2	3%	0.025	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-56.3	-41.5	-178.3	0	0	0	0	0	113.1	Y210 L217 F218 D219 F221	Y210-A215 HydrophobicContact CD1-CB 4.36Å; Y210-A215 HydrophobicContact CE1-CB 3.95Å; Y210-A215 PolarHBondContact O-N 3.36Å; A215-L217 PolarHBondContact O-N 2.82Å; A215-L217 VanDerWaalsContact O-N 3.13Å; A215-F218 PolarHBondContact O-N 2.94Å; A215-D219 PolarHBondContact O-N 3.28Å; A215-F221 HydrophobicContact CB-CE2 3.87Å; A215-F221 HydrophobicContact CB-CZ 3.82Å
216	P	94.3	Very high	91.9	Very high	61 Å²	61	68.3 Å²	68.3	40%	0.396	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-65.9	-14.5	177.9	-24.9	38.3	0	0	0	114.8	A211 F218 D219 F221	A211-P216 VanDerWaalsContact O-CD 3.3Å; A211-P216 WeakPolarHBondContact O-CD 3.35Å; A211-P216 WeakPolarHBondContact O-CG 3.46Å; P216-F218 PolarHBondContact O-N 3.26Å; P216-D219 WeakPolarHBondContact CA-O 3.47Å; P216-F221 HydrophobicContact CB-CD2 4.4Å; P216-F221 HydrophobicContact CG-CD2 4.16Å; P216-F221 HydrophobicContact CG-CE2 4.37Å
217	L	95.7	Very high	91.9	Very high	89 Å²	89	67 Å²	67	47%	0.466	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-69.9	-25.4	170.9	-59	174.6	0	0	0	111.5	K164 V168 Y213 I214 A215	K164-L217 WeakPolarHBondContact CE-O 3.46Å; K164-L217 PolarHBondContact NZ-O 3.17Å; V168-L217 HydrophobicContact CG2-CD1 4.11Å; Y213-L217 WeakPolarHBondContact O-CG 3.5Å; I214-L217 VanDerWaalsContact O-CB 3.24Å; I214-L217 WeakPolarHBondContact O-CB 3.37Å; I214-L217 WeakPolarHBondContact O-CG 3.36Å; I214-L217 PolarHBondContact O-N 2.89Å; A215-L217 PolarHBondContact O-N 2.82Å; A215-L217 VanDerWaalsContact O-N 3.13Å
218	F	94.9	Very high	92.1	Very high	31 Å²	31	70.5 Å²	70.5	14%	0.136	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-37.1	-173.3	-61.5	-73.6	0	0	0	112.7	K164 K165 V168 I214 A215 P216 R255	K164-F218 HydrophobicContact CB-CE1 4.32Å; K164-F218 HydrophobicContact CD-CD1 4.36Å; K164-F218 HydrophobicContact CD-CE1 4.14Å; K164-F218 VanDerWaalsContact CE-CD1 3.44Å; K164-F218 HydrophobicContact CG-CE1 3.83Å; K164-F218 HydrophobicContact CG-CZ 4.41Å; K165-F218 HydrophobicContact CB-CE1 4.16Å; K165-F218 HydrophobicContact CG-CD1 3.86Å; K165-F218 HydrophobicContact CG-CE1 3.34Å; K165-F218 HydrophobicContact CG-CZ 3.99Å; V168-F218 HydrophobicContact CB-CZ 4.16Å; V168-F218 HydrophobicContact CG1-CZ 4.38Å; V168-F218 HydrophobicContact CG2-CZ 4.05Å; I214-F218 HydrophobicContact CG2-CE2 3.93Å; I214-F218 VanDerWaalsContact O-CD2 3.22Å; I214-F218 WeakPolarHBondContact O-CD2 3.22Å; A215-F218 PolarHBondContact O-N 2.94Å; P216-F218 PolarHBondContact O-N 3.26Å; F218-R255 PolarHBondContact O-NH2 2.82Å
219	D	93.6	Very high	92.4	Very high	44 Å²	44	67 Å²	67	24%	0.235	34%	0.34	C	S	.	.	S	Bend	trans	-134.9	152	-171.3	-59	-56.5	0	0	0	111.5	A215 P216 F221 V250 R255	A215-D219 PolarHBondContact O-N 3.28Å; P216-D219 WeakPolarHBondContact CA-O 3.47Å; D219-F221 HydrophobicContact CB-CE2 3.96Å; D219-F221 HydrophobicContact CB-CZ 4.46Å; D219-F221 WeakPolarHBondContact O-CD2 3.42Å; D219-V250 HydrophobicContact CB-CG2 3.73Å; D219-R255 IonicContact OD1-CZ 3.34Å; D219-R255 IonicContact OD1-NE 3.88Å; D219-R255 PolarHBondContact OD1-NE 2.96Å; D219-R255 IonicContact OD1-NH2 3.85Å; D219-R255 PolarHBondContact OD1-NH2 2.94Å; D219-R255 IonicContact OD2-NE 3.49Å
220	K	93.4	Very high	92.6	Very high	132 Å²	132	65.8 Å²	65.8	57%	0.574	33%	0.332	S	S	*	.			trans	-89.2	126.5	178.1	-170.9	-177.4	178.4	-173	0	109.4	T222 V250 E251	K220-T222 HydrophobicContact CG-CG2 4.41Å; K220-V250 WeakPolarHBondContact O-CA 3.39Å; K220-E251 HydrophobicContact CB-CB 4.17Å; K220-E251 WeakPolarHBondContact CB-OE2 3.48Å; K220-E251 VanDerWaalsContact CD-OE2 3.31Å; K220-E251 WeakPolarHBondContact CD-OE2 3.46Å; K220-E251 PolarHBondContact O-N 2.87Å
221	F	93.4	Very high	92.8	Very high	39 Å²	39	63.1 Å²	63.1	17%	0.171	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	124.9	175.1	-65.9	-98	0	0	0	109.2	A215 P216 D219 Y248 V249 V250 V273	A215-F221 HydrophobicContact CB-CE2 3.87Å; A215-F221 HydrophobicContact CB-CZ 3.82Å; P216-F221 HydrophobicContact CB-CD2 4.4Å; P216-F221 HydrophobicContact CG-CD2 4.16Å; P216-F221 HydrophobicContact CG-CE2 4.37Å; D219-F221 HydrophobicContact CB-CE2 3.96Å; D219-F221 HydrophobicContact CB-CZ 4.46Å; D219-F221 WeakPolarHBondContact O-CD2 3.42Å; F221-Y248 HydrophobicContact CB-CD1 4.2Å; F221-V249 WeakPolarHBondContact CA-O 3.48Å; F221-V250 HydrophobicContact CD1-CB 4.02Å; F221-V250 HydrophobicContact CD1-CG2 4.17Å; F221-V250 HydrophobicContact CE1-CB 3.84Å; F221-V250 HydrophobicContact CE1-CG2 3.79Å; F221-V250 HydrophobicContact CE2-CG2 4.2Å; F221-V250 HydrophobicContact CZ-CB 4.36Å; F221-V250 HydrophobicContact CZ-CG2 3.79Å; F221-V273 HydrophobicContact CD1-CG1 4.3Å; F221-V273 HydrophobicContact CE1-CG1 3.94Å; F221-V273 HydrophobicContact CE1-CG2 4.24Å
222	T	93.4	Very high	93.3	Very high	60 Å²	60	64.3 Å²	64.3	37%	0.368	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	144.2	174.7	51.3	0	0	0	0	109.9	K220 Y248 V249	K220-T222 HydrophobicContact CG-CG2 4.41Å; T222-Y248 CarbonylContact O-C 3.44Å; T222-Y248 WeakPolarHBondContact O-CA 3.46Å; T222-V249 PolarHBondContact N-O 3.39Å; T222-V249 PolarHBondContact O-N 3.1Å
223	P	94.6	Very high	93.8	Very high	94 Å²	94	61.2 Å²	61.2	61%	0.61	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.4	143.2	173.5	-23.5	34.1	0	0	0	111.2	L247 Y248	P223-L247 WeakPolarHBondContact CA-O 3.41Å; P223-Y248 HydrophobicContact CG-CE1 4.39Å
224	L	93.5	Very high	94	Very high	5 Å²	5	57.4 Å²	57.4	3%	0.026	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-60.5	129.4	171.6	-175.6	69.5	0	0	0	108.9	K230 I233 L247 V249 L279	L224-K230 HydrophobicContact CD2-CB 3.8Å; L224-K230 HydrophobicContact CD2-CG 4.16Å; L224-K230 HydrophobicContact CG-CB 4.35Å; L224-I233 HydrophobicContact CD2-CD1 3.99Å; L224-L247 HydrophobicContact CB-CB 3.97Å; L224-L247 HydrophobicContact CD2-CB 4.46Å; L224-L247 HydrophobicContact CD2-CD2 4Å; L224-L247 PolarHBondContact N-O 2.91Å; L224-V249 HydrophobicContact CB-CG2 4.29Å; L224-V249 HydrophobicContact CD1-CG2 3.47Å; L224-V249 VanDerWaalsContact CD1-CG2 3.47Å; L224-V249 HydrophobicContact CG-CG2 4.5Å; L224-L279 HydrophobicContact CD1-CD1 4.22Å
225	P	90.6	Very high	94.1	Very high	60 Å²	60	61 Å²	61	39%	0.39	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-57.2	153	178.4	-26.3	36.7	0	0	0	112.5	Y282	P225-Y282 HydrophobicContact CB-CE1 4.09Å; P225-Y282 HydrophobicContact CG-CD1 4.18Å; P225-Y282 HydrophobicContact CG-CE1 3.76Å
226	E	92.8	Very high	94.2	Very high	146 Å²	146	61.6 Å²	61.6	68%	0.682	33%	0.333	S	S	*	.	S	Bend	trans	-62.5	138.7	171	-57.8	-57	154.2	0	0	110.2	K230	E226-K230 IonicContact OE1-NZ 2.73Å; E226-K230 PolarHBondContact OE1-NZ 3.24Å; E226-K230 WeakPolarHBondContact OE2-CD 3.27Å; E226-K230 IonicContact OE2-NZ 3.72Å; E226-K230 PolarHBondContact OE2-NZ 3.37Å
227	G	92.4	Very high	94.3	Very high	29 Å²	29	58.8 Å²	58.8	30%	0.299	31%	0.314	S	S	.	.	S	Bend	trans	165.8	-175.7	-179.4	0	0	0	0	0	113.5	L229 K230 T231	G227-L229 PolarHBondContact O-N 3.42Å; G227-K230 PolarHBondContact O-N 2.93Å; G227-T231 PolarHBondContact O-N 3.17Å; G227-T231 VanDerWaalsContact O-N 3.16Å; G227-T231 PolarHBondContact O-OG1 3.21Å
228	E	93.4	Very high	94.3	Very high	166 Å²	166	62.3 Å²	62.3	78%	0.776	33%	0.326	S	S	*	.	H	α-helix	trans	-60.3	-43.7	-179.4	-65.2	-172.7	168.1	0	0	112	K230 T231 A232	E228-K230 PolarHBondContact O-N 2.91Å; E228-T231 PolarHBondContact O-N 3.26Å; E228-A232 WeakPolarHBondContact O-CB 3.17Å; E228-A232 PolarHBondContact O-N 3.44Å
229	L	93.3	Very high	94.3	Very high	3 Å²	3	64.9 Å²	64.9	2%	0.016	35%	0.347	C	S	.	.	H	α-helix	trans	-59.3	-49.5	179.4	178.8	59.7	0	0	0	111.6	G227 T231 A232 I233 L279 Y282 N322 I325	G227-L229 PolarHBondContact O-N 3.42Å; L229-T231 PolarHBondContact O-N 3.03Å; L229-A232 PolarHBondContact O-N 3.05Å; L229-I233 HydrophobicContact CD1-CD1 3.9Å; L229-I233 HydrophobicContact CD1-CG1 4.18Å; L229-I233 HydrophobicContact CG-CD1 3.88Å; L229-I233 VanDerWaalsContact O-CG1 3.23Å; L229-I233 WeakPolarHBondContact O-CG1 3.44Å; L229-I233 PolarHBondContact O-N 3.36Å; L229-L279 HydrophobicContact CD2-CD2 3.92Å; L229-Y282 HydrophobicContact CD2-CE2 4.47Å; L229-N322 HydrophobicContact CD1-CB 4.09Å; L229-I325 HydrophobicContact CD1-CB 4.2Å; L229-I325 HydrophobicContact CD1-CD1 4.38Å; L229-I325 HydrophobicContact CD1-CG2 3.98Å; L229-I325 HydrophobicContact CD2-CD1 3.98Å
230	K	94.8	Very high	94.3	Very high	33 Å²	33	63.5 Å²	63.5	14%	0.143	34%	0.34	C	S	.	.	H	α-helix	trans	-59.7	-47.9	-179.6	-176.6	-179	168.9	-165.2	0	111.2	L224 E226 G227 E228 A232 I233 E234 L247	L224-K230 HydrophobicContact CD2-CB 3.8Å; L224-K230 HydrophobicContact CD2-CG 4.16Å; L224-K230 HydrophobicContact CG-CB 4.35Å; E226-K230 IonicContact OE1-NZ 2.73Å; E226-K230 PolarHBondContact OE1-NZ 3.24Å; E226-K230 WeakPolarHBondContact OE2-CD 3.27Å; E226-K230 IonicContact OE2-NZ 3.72Å; E226-K230 PolarHBondContact OE2-NZ 3.37Å; G227-K230 PolarHBondContact O-N 2.93Å; E228-K230 PolarHBondContact O-N 2.91Å; K230-A232 VanDerWaalsContact C-N 3.34Å; K230-A232 PolarHBondContact O-N 3.05Å; K230-I233 PolarHBondContact O-N 3.22Å; K230-E234 WeakPolarHBondContact CE-OE1 3.44Å; K230-E234 WeakPolarHBondContact O-CG 3.23Å; K230-E234 PolarHBondContact O-N 2.96Å; K230-L247 HydrophobicContact CG-CD1 4.31Å
231	T	96.3	Very high	94.3	Very high	69 Å²	69	61.7 Å²	61.7	42%	0.423	34%	0.344	S	S	.	.	H	α-helix	trans	-59	-46.4	178.5	-51.9	0	0	0	0	111	G227 E228 L229 I233 E234 D235	G227-T231 PolarHBondContact O-N 3.17Å; G227-T231 VanDerWaalsContact O-N 3.16Å; G227-T231 PolarHBondContact O-OG1 3.21Å; E228-T231 PolarHBondContact O-N 3.26Å; L229-T231 PolarHBondContact O-N 3.03Å; T231-I233 VanDerWaalsContact C-N 3.32Å; T231-I233 PolarHBondContact O-N 3.1Å; T231-E234 PolarHBondContact O-N 3.42Å; T231-D235 PolarHBondContact O-N 3.33Å
232	A	95.8	Very high	94.3	Very high	32 Å²	32	60.2 Å²	60.2	26%	0.264	34%	0.338	S	S	.	.	H	α-helix	trans	-64.6	-34.5	179.6	0	0	0	0	0	113	E228 L229 K230 M236 L326	E228-A232 WeakPolarHBondContact O-CB 3.17Å; E228-A232 PolarHBondContact O-N 3.44Å; L229-A232 PolarHBondContact O-N 3.05Å; K230-A232 VanDerWaalsContact C-N 3.34Å; K230-A232 PolarHBondContact O-N 3.05Å; A232-M236 WeakPolarHBondContact O-CB 3.18Å; A232-M236 PolarHBondContact O-N 3.35Å; A232-L326 HydrophobicContact CB-CD1 3.66Å; A232-L326 HydrophobicContact CB-CD2 3.83Å; A232-L326 HydrophobicContact CB-CG 4.34Å
233	I	95.8	Very high	94.2	Very high	1 Å²	1	59.3 Å²	59.3	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-68.8	-42.2	174.6	-62.7	165.6	0	0	0	110.8	L224 L229 K230 T231 M236 A237 L244 L247 I272 L274 L326 L329	L224-I233 HydrophobicContact CD2-CD1 3.99Å; L229-I233 HydrophobicContact CD1-CD1 3.9Å; L229-I233 HydrophobicContact CD1-CG1 4.18Å; L229-I233 HydrophobicContact CG-CD1 3.88Å; L229-I233 VanDerWaalsContact O-CG1 3.23Å; L229-I233 WeakPolarHBondContact O-CG1 3.44Å; L229-I233 PolarHBondContact O-N 3.36Å; K230-I233 PolarHBondContact O-N 3.22Å; T231-I233 VanDerWaalsContact C-N 3.32Å; T231-I233 PolarHBondContact O-N 3.1Å; I233-M236 PolarHBondContact O-N 2.99Å; I233-A237 WeakPolarHBondContact O-CB 3.42Å; I233-A237 PolarHBondContact O-N 3.17Å; I233-L244 HydrophobicContact CG2-CD2 4.28Å; I233-L247 HydrophobicContact CB-CD2 4.2Å; I233-L247 HydrophobicContact CD1-CD2 3.83Å; I233-L247 HydrophobicContact CG2-CD1 4.44Å; I233-L247 HydrophobicContact CG2-CD2 3.68Å; I233-I272 HydrophobicContact CG2-CD1 3.87Å; I233-L274 HydrophobicContact CD1-CD1 4.07Å; I233-L326 HydrophobicContact CB-CD2 4.44Å; I233-L326 HydrophobicContact CG1-CD2 3.68Å; I233-L329 HydrophobicContact CB-CD1 4.36Å; I233-L329 HydrophobicContact CD1-CD1 3.55Å; I233-L329 HydrophobicContact CG1-CD1 3.52Å; I233-L329 HydrophobicContact CG2-CD1 3.89Å
234	E	95.6	Very high	94.1	Very high	86 Å²	86	56.8 Å²	56.8	40%	0.402	31%	0.314	S	S	.	.	H	α-helix	trans	-61.8	-43.5	176.8	-72.4	177	174.9	0	0	111.6	K230 T231 A237 K238 L244 L247	K230-E234 WeakPolarHBondContact CE-OE1 3.44Å; K230-E234 WeakPolarHBondContact O-CG 3.23Å; K230-E234 PolarHBondContact O-N 2.96Å; T231-E234 PolarHBondContact O-N 3.42Å; E234-A237 PolarHBondContact O-N 3.43Å; E234-K238 WeakPolarHBondContact O-CB 3.13Å; E234-K238 PolarHBondContact O-N 3.37Å; E234-L244 HydrophobicContact CG-CD2 4.22Å; E234-L247 HydrophobicContact CG-CD1 4.03Å
235	D	96.4	Very high	93.8	Very high	97 Å²	97	60.1 Å²	60.1	52%	0.519	34%	0.335	S	S	.	.	H	α-helix	trans	-63.7	-43.1	175.6	-76.4	-25.4	0	0	0	112.1	T231 K238 S239	T231-D235 PolarHBondContact O-N 3.33Å; D235-K238 PolarHBondContact O-N 2.94Å; D235-S239 PolarHBondContact O-N 3.23Å
236	M	95.3	Very high	93.7	Very high	17 Å²	17	61.4 Å²	61.4	8%	0.084	33%	0.334	C	S	.	.	H	α-helix	trans	-60.8	-48.6	175.2	-177.5	179.1	-65.9	0	0	111.3	A232 I233 K238 S239 I240 L326 L329 L333 M421	A232-M236 WeakPolarHBondContact O-CB 3.18Å; A232-M236 PolarHBondContact O-N 3.35Å; I233-M236 PolarHBondContact O-N 2.99Å; M236-K238 VanDerWaalsContact C-N 3.29Å; M236-K238 PolarHBondContact O-N 3.38Å; M236-S239 PolarHBondContact O-N 3.43Å; M236-S239 PolarHBondContact O-OG 2.97Å; M236-I240 PolarHBondContact O-N 2.82Å; M236-L326 HydrophobicContact CE-CB 3.72Å; M236-L326 HydrophobicContact CE-CD2 3.94Å; M236-L326 HydrophobicContact CE-CG 4.36Å; M236-L326 VanDerWaalsContact CE-O 3.27Å; M236-L326 WeakPolarHBondContact CE-O 3.39Å; M236-L329 HydrophobicContact SD-CB 4.49Å; M236-L333 HydrophobicContact CG-CD1 4.03Å; M236-L333 HydrophobicContact SD-CD1 3.98Å; M236-M421 HydrophobicContact CG-CE 3.64Å; M236-M421 HydrophobicContact SD-CE 4.1Å
237	A	95.1	Very high	93.7	Very high	1 Å²	1	55.1 Å²	55.1	1%	0.008	31%	0.305	C	S	.	.	H	α-helix	trans	-58.2	-43.8	177.5	0	0	0	0	0	111.2	I233 E234 S239 I240 S241 F242 L244	I233-A237 WeakPolarHBondContact O-CB 3.42Å; I233-A237 PolarHBondContact O-N 3.17Å; E234-A237 PolarHBondContact O-N 3.43Å; A237-S239 PolarHBondContact O-N 3.45Å; A237-I240 WeakPolarHBondContact O-CG1 3.47Å; A237-I240 PolarHBondContact O-N 3.31Å; A237-S241 PolarHBondContact O-N 2.83Å; A237-F242 HydrophobicContact CB-CB 4.07Å; A237-F242 HydrophobicContact CB-CD1 4.02Å; A237-F242 WeakPolarHBondContact O-CB 3.33Å; A237-F242 PolarHBondContact O-N 2.87Å; A237-L244 HydrophobicContact CB-CB 3.92Å; A237-L244 HydrophobicContact CB-CD2 3.87Å
238	K	95.1	Very high	93.8	Very high	164 Å²	164	55.7 Å²	55.7	71%	0.713	30%	0.298	S	S	*	.	H	α-helix	trans	-62.2	-42	177.3	-170.3	178.1	-179.4	-177.9	0	112.1	E234 D235 M236 I240 S241	E234-K238 WeakPolarHBondContact O-CB 3.13Å; E234-K238 PolarHBondContact O-N 3.37Å; D235-K238 PolarHBondContact O-N 2.94Å; M236-K238 VanDerWaalsContact C-N 3.29Å; M236-K238 PolarHBondContact O-N 3.38Å; K238-I240 PolarHBondContact O-N 2.75Å; K238-I240 VanDerWaalsContact O-N 3.16Å; K238-S241 PolarHBondContact O-N 3.35Å
239	S	95.4	Very high	93.8	Very high	84 Å²	84	48.4 Å²	48.4	59%	0.587	27%	0.265	S	S	*	.	H	α-helix	trans	-57.9	-30.6	-179	77.9	0	0	0	0	113.6	D235 M236 A237	D235-S239 PolarHBondContact O-N 3.23Å; M236-S239 PolarHBondContact O-N 3.43Å; M236-S239 PolarHBondContact O-OG 2.97Å; A237-S239 PolarHBondContact O-N 3.45Å
240	I	94.1	Very high	93.9	Very high	16 Å²	16	48.5 Å²	48.5	8%	0.082	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	5.6	179.2	65.1	167.3	0	0	0	113.5	M236 A237 K238 F242 L333 W336 K337 F417 M421	M236-I240 PolarHBondContact O-N 2.82Å; A237-I240 WeakPolarHBondContact O-CG1 3.47Å; A237-I240 PolarHBondContact O-N 3.31Å; K238-I240 PolarHBondContact O-N 2.75Å; K238-I240 VanDerWaalsContact O-N 3.16Å; I240-F242 VanDerWaalsContact C-N 3.29Å; I240-F242 HydrophobicContact CD1-CB 4.06Å; I240-F242 HydrophobicContact CG1-CB 3.92Å; I240-F242 PolarHBondContact O-N 2.93Å; I240-L333 HydrophobicContact CD1-CB 3.57Å; I240-L333 HydrophobicContact CD1-CD1 3.75Å; I240-L333 HydrophobicContact CD1-CD2 4.11Å; I240-L333 HydrophobicContact CD1-CG 4Å; I240-W336 HydrophobicContact CD1-CE3 4.27Å; I240-W336 HydrophobicContact CD1-CZ3 4.17Å; I240-W336 HydrophobicContact CG1-CZ3 4.39Å; I240-K337 PolarHBondContact O-NZ 3.48Å; I240-F417 HydrophobicContact CG2-CZ 4.17Å; I240-M421 HydrophobicContact CG2-CE 3.99Å; I240-M421 HydrophobicContact CG2-SD 4.39Å
241	S	93.8	Very high	93.7	Very high	94 Å²	94	50 Å²	50	66%	0.657	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.3	34.3	-174.4	-51.8	0	0	0	0	113.9	A237 K238 W336	A237-S241 PolarHBondContact O-N 2.83Å; K238-S241 PolarHBondContact O-N 3.35Å; S241-W336 WeakPolarHBondContact O-CH2 3.39Å
242	F	92.6	Very high	93.4	Very high	8 Å²	8	46.9 Å²	46.9	4%	0.035	26%	0.255	C	S	.	.			trans	-72.4	123.9	171.2	-176	-107	0	0	0	109.4	A237 I240 L244 F263 K270 I272 L333 W336	A237-F242 HydrophobicContact CB-CB 4.07Å; A237-F242 HydrophobicContact CB-CD1 4.02Å; A237-F242 WeakPolarHBondContact O-CB 3.33Å; A237-F242 PolarHBondContact O-N 2.87Å; I240-F242 VanDerWaalsContact C-N 3.29Å; I240-F242 HydrophobicContact CD1-CB 4.06Å; I240-F242 HydrophobicContact CG1-CB 3.92Å; I240-F242 PolarHBondContact O-N 2.93Å; F242-L244 HydrophobicContact CD1-CB 3.91Å; F242-L244 HydrophobicContact CD1-CD1 4.41Å; F242-L244 HydrophobicContact CE1-CB 4.27Å; F242-L244 HydrophobicContact CE1-CD1 3.99Å; F242-L244 PolarHBondContact O-N 3.38Å; F242-F263 HydrophobicContact CE2-CD2 4.28Å; F242-F263 HydrophobicContact CZ-CB 4.34Å; F242-F263 HydrophobicContact CZ-CD2 4.17Å; F242-F263 HydrophobicContact CZ-CG 4.37Å; F242-K270 HydrophobicContact CD1-CB 4.49Å; F242-K270 HydrophobicContact CE1-CB 3.7Å; F242-K270 HydrophobicContact CE2-CB 3.92Å; F242-K270 HydrophobicContact CE2-CD 3.98Å; F242-K270 HydrophobicContact CE2-CG 3.84Å; F242-K270 HydrophobicContact CZ-CB 3.4Å; F242-K270 HydrophobicContact CZ-CD 4.06Å; F242-K270 HydrophobicContact CZ-CG 3.86Å; F242-I272 HydrophobicContact CE1-CD1 4.18Å; F242-I272 HydrophobicContact CE1-CG1 4.17Å; F242-L333 HydrophobicContact CB-CD2 4.2Å; F242-L333 HydrophobicContact CD1-CD2 3.76Å; F242-L333 HydrophobicContact CD2-CD2 3.65Å; F242-L333 HydrophobicContact CE1-CD2 3.91Å; F242-L333 HydrophobicContact CE2-CD2 3.78Å; F242-L333 HydrophobicContact CG-CD2 3.61Å; F242-L333 HydrophobicContact CZ-CD2 3.89Å; F242-W336 HydrophobicContact CB-CE3 4.36Å; F242-W336 HydrophobicContact CB-CH2 4.25Å; F242-W336 HydrophobicContact CB-CZ3 3.98Å; F242-W336 AromaticContact CD2-CD2 3.44Å; F242-W336 HydrophobicContact CD2-CD2 3.44Å; F242-W336 VanDerWaalsContact CD2-CD2 3.44Å; F242-W336 AromaticContact CD2-CE2 3.72Å; F242-W336 AromaticContact CD2-CE3 3.57Å; F242-W336 HydrophobicContact CD2-CE3 3.57Å; F242-W336 AromaticContact CD2-CG 3.86Å; F242-W336 HydrophobicContact CD2-CG 3.86Å; F242-W336 HydrophobicContact CD2-CH2 4.19Å; F242-W336 HydrophobicContact CD2-CZ2 4.1Å; F242-W336 AromaticContact CD2-CZ3 3.94Å; F242-W336 HydrophobicContact CD2-CZ3 3.94Å; F242-W336 HydrophobicContact CE2-CB 4.22Å; F242-W336 AromaticContact CE2-CD2 3.87Å; F242-W336 HydrophobicContact CE2-CD2 3.87Å; F242-W336 HydrophobicContact CE2-CE3 4.37Å; F242-W336 AromaticContact CE2-CG 3.75Å; F242-W336 HydrophobicContact CE2-CG 3.75Å; F242-W336 HydrophobicContact CG-CE3 4.45Å; F242-W336 HydrophobicContact CG-CZ3 4.49Å
243	P	91.4	Very high	93.2	Very high	41 Å²	41	45.9 Å²	45.9	27%	0.266	25%	0.246	S	C	.	.			trans	-80.2	64.9	-175.3	34.1	-36.1	0	0	0	111.2	T245 K270	P243-T245 PolarHBondContact O-N 2.88Å; P243-T245 PolarHBondContact O-OG1 2.89Å; P243-K270 HydrophobicContact CG-CB 4.33Å; P243-K270 HydrophobicContact CG-CG 3.78Å; P243-K270 WeakPolarHBondContact O-CB 3.18Å; P243-K270 PolarHBondContact O-N 3.5Å
244	L	92.2	Very high	93	Very high	40 Å²	40	50.8 Å²	50.8	21%	0.209	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	122.7	179.6	-173.8	57.7	0	0	0	110.3	I233 E234 A237 F242 L247 I272	I233-L244 HydrophobicContact CG2-CD2 4.28Å; E234-L244 HydrophobicContact CG-CD2 4.22Å; A237-L244 HydrophobicContact CB-CB 3.92Å; A237-L244 HydrophobicContact CB-CD2 3.87Å; F242-L244 HydrophobicContact CD1-CB 3.91Å; F242-L244 HydrophobicContact CD1-CD1 4.41Å; F242-L244 HydrophobicContact CE1-CB 4.27Å; F242-L244 HydrophobicContact CE1-CD1 3.99Å; F242-L244 PolarHBondContact O-N 3.38Å; L244-L247 HydrophobicContact CD1-CD1 4.49Å; L244-L247 HydrophobicContact CD1-CG 4.29Å; L244-L247 HydrophobicContact CD2-CD1 3.49Å; L244-L247 VanDerWaalsContact CD2-CD1 3.49Å; L244-L247 HydrophobicContact CD2-CG 4.07Å; L244-L247 HydrophobicContact CG-CD1 4.21Å; L244-I272 HydrophobicContact CD1-CB 4.31Å; L244-I272 HydrophobicContact CD1-CD1 3.75Å; L244-I272 HydrophobicContact CD1-CG1 3.8Å; L244-I272 HydrophobicContact CD2-CD1 4.3Å
245	T	88.6	Confident	92.8	Very high	76 Å²	76	48.3 Å²	48.3	47%	0.466	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	-39.4	178.8	-49.2	0	0	0	0	111.8	P243 K268 K270	P243-T245 PolarHBondContact O-N 2.88Å; P243-T245 PolarHBondContact O-OG1 2.89Å; T245-K268 PolarHBondContact OG1-O 2.93Å; T245-K270 PolarHBondContact N-O 2.86Å
246	K	87.6	Confident	92.6	Very high	87 Å²	87	45 Å²	45	38%	0.378	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	145.4	-178.4	-55.9	-170.4	-179.6	177.7	0	112	Y248 R271 I272	K246-Y248 HydrophobicContact CB-CD2 4.11Å; K246-Y248 HydrophobicContact CB-CE2 3.59Å; K246-Y248 HydrophobicContact CD-CE2 3.64Å; K246-Y248 WeakPolarHBondContact CD-OH 3.42Å; K246-Y248 HydrophobicContact CG-CE2 4.27Å; K246-Y248 PolarHBondContact NZ-OH 2.96Å; K246-R271 HydrophobicContact CB-CG 4.03Å; K246-R271 VanDerWaalsContact O-CA 3.27Å; K246-R271 WeakPolarHBondContact O-CA 3.27Å; K246-I272 PolarHBondContact O-N 3.1Å; K246-I272 VanDerWaalsContact O-N 3.1Å
247	L	92.9	Very high	92.3	Very high	13 Å²	13	44.7 Å²	44.7	7%	0.068	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	124.5	172.5	-84.6	131.5	0	0	0	109.4	P223 L224 K230 I233 E234 L244 I272	P223-L247 WeakPolarHBondContact CA-O 3.41Å; L224-L247 HydrophobicContact CB-CB 3.97Å; L224-L247 HydrophobicContact CD2-CB 4.46Å; L224-L247 HydrophobicContact CD2-CD2 4Å; L224-L247 PolarHBondContact N-O 2.91Å; K230-L247 HydrophobicContact CG-CD1 4.31Å; I233-L247 HydrophobicContact CB-CD2 4.2Å; I233-L247 HydrophobicContact CD1-CD2 3.83Å; I233-L247 HydrophobicContact CG2-CD1 4.44Å; I233-L247 HydrophobicContact CG2-CD2 3.68Å; E234-L247 HydrophobicContact CG-CD1 4.03Å; L244-L247 HydrophobicContact CD1-CD1 4.49Å; L244-L247 HydrophobicContact CD1-CG 4.29Å; L244-L247 HydrophobicContact CD2-CD1 3.49Å; L244-L247 VanDerWaalsContact CD2-CD1 3.49Å; L244-L247 HydrophobicContact CD2-CG 4.07Å; L244-L247 HydrophobicContact CG-CD1 4.21Å; L247-I272 HydrophobicContact CD2-CB 4.1Å; L247-I272 HydrophobicContact CD2-CG2 4.17Å; L247-I272 HydrophobicContact CG-CB 4.49Å
248	Y	94.2	Very high	92	Very high	41 Å²	41	47 Å²	47	16%	0.161	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	149.8	-179.9	-71.6	-74.7	0	0	0	111.5	F221 T222 P223 K246 I272 V273 L274	F221-Y248 HydrophobicContact CB-CD1 4.2Å; T222-Y248 CarbonylContact O-C 3.44Å; T222-Y248 WeakPolarHBondContact O-CA 3.46Å; P223-Y248 HydrophobicContact CG-CE1 4.39Å; K246-Y248 HydrophobicContact CB-CD2 4.11Å; K246-Y248 HydrophobicContact CB-CE2 3.59Å; K246-Y248 HydrophobicContact CD-CE2 3.64Å; K246-Y248 WeakPolarHBondContact CD-OH 3.42Å; K246-Y248 HydrophobicContact CG-CE2 4.27Å; K246-Y248 PolarHBondContact NZ-OH 2.96Å; Y248-I272 PolarHBondContact N-O 3.07Å; Y248-V273 WeakPolarHBondContact O-CA 3.42Å; Y248-L274 PolarHBondContact O-N 2.78Å
249	V	94.3	Very high	91.6	Very high	13 Å²	13	39.8 Å²	39.8	8%	0.079	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	131.1	162	-177.2	0	0	0	0	107.7	F221 T222 L224 L274 D276 L279	F221-V249 WeakPolarHBondContact CA-O 3.48Å; T222-V249 PolarHBondContact N-O 3.39Å; T222-V249 PolarHBondContact O-N 3.1Å; L224-V249 HydrophobicContact CB-CG2 4.29Å; L224-V249 HydrophobicContact CD1-CG2 3.47Å; L224-V249 VanDerWaalsContact CD1-CG2 3.47Å; L224-V249 HydrophobicContact CG-CG2 4.5Å; V249-L274 CarbonylContact C-O 3.58Å; V249-L274 VanDerWaalsContact CA-O 3.25Å; V249-L274 WeakPolarHBondContact CA-O 3.31Å; V249-D276 HydrophobicContact CG1-CB 3.82Å; V249-L279 HydrophobicContact CG1-CD1 4.11Å; V249-L279 HydrophobicContact CG2-CD1 3.78Å
250	V	94.6	Very high	91.3	Very high	5 Å²	5	40.2 Å²	40.2	3%	0.03	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	134.2	172.2	65.7	0	0	0	0	109.7	D219 K220 F221 G252 V273 L274 F275 D276	D219-V250 HydrophobicContact CB-CG2 3.73Å; K220-V250 WeakPolarHBondContact O-CA 3.39Å; F221-V250 HydrophobicContact CD1-CB 4.02Å; F221-V250 HydrophobicContact CD1-CG2 4.17Å; F221-V250 HydrophobicContact CE1-CB 3.84Å; F221-V250 HydrophobicContact CE1-CG2 3.79Å; F221-V250 HydrophobicContact CE2-CG2 4.2Å; F221-V250 HydrophobicContact CZ-CB 4.36Å; F221-V250 HydrophobicContact CZ-CG2 3.79Å; V250-G252 PolarHBondContact O-N 3.04Å; V250-V273 HydrophobicContact CB-CG1 3.8Å; V250-V273 HydrophobicContact CG1-CG1 3.63Å; V250-L274 PolarHBondContact N-O 2.96Å; V250-F275 HydrophobicContact CG1-CB 4.38Å; V250-F275 HydrophobicContact CG1-CD1 4.28Å; V250-F275 HydrophobicContact CG1-CD2 3.59Å; V250-F275 HydrophobicContact CG1-CE1 4.49Å; V250-F275 HydrophobicContact CG1-CE2 3.86Å; V250-F275 HydrophobicContact CG1-CG 3.82Å; V250-F275 HydrophobicContact CG1-CZ 4.3Å; V250-D276 PolarHBondContact O-N 2.81Å
251	E	91.8	Very high	91.1	Very high	65 Å²	65	39.6 Å²	39.6	30%	0.304	21%	0.212	S	C	.	.			trans	-75.1	71	177.4	-167.7	-172.4	160	0	0	110.5	K220 S253 K254	K220-E251 HydrophobicContact CB-CB 4.17Å; K220-E251 WeakPolarHBondContact CB-OE2 3.48Å; K220-E251 VanDerWaalsContact CD-OE2 3.31Å; K220-E251 WeakPolarHBondContact CD-OE2 3.46Å; K220-E251 PolarHBondContact O-N 2.87Å; E251-S253 VanDerWaalsContact C-N 3.35Å; E251-K254 HydrophobicContact CG-CB 4.25Å
252	G	89.8	Confident	90.9	Very high	4 Å²	4	38.4 Å²	38.4	4%	0.041	19%	0.194	C	C	.	.			trans	-73.6	-28.3	178.2	0	0	0	0	0	112.6	V250 K254 R255 S256 D276	V250-G252 PolarHBondContact O-N 3.04Å; G252-K254 PolarHBondContact O-N 2.6Å; G252-K254 VanDerWaalsContact O-N 3.14Å; G252-R255 WeakPolarHBondContact O-CA 3.42Å; G252-R255 WeakPolarHBondContact O-CB 3.38Å; G252-R255 PolarHBondContact O-N 2.78Å; G252-S256 PolarHBondContact O-N 3.44Å; G252-S256 VanDerWaalsContact O-O 3.11Å; G252-D276 PolarHBondContact N-OD1 2.96Å
253	S	91.4	Very high	90.7	Very high	10 Å²	10	39.5 Å²	39.5	7%	0.07	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-29.5	178.1	62.4	0	0	0	0	113.9	Q152 E251 R255 S256 D276	Q152-S253 WeakPolarHBondContact CB-O 3.5Å; Q152-S253 WeakPolarHBondContact CG-O 3.47Å; E251-S253 VanDerWaalsContact C-N 3.35Å; S253-R255 PolarHBondContact O-N 3.21Å; S253-S256 WeakPolarHBondContact CA-O 3.46Å; S253-D276 WeakPolarHBondContact CB-OD2 3.45Å; S253-D276 PolarHBondContact N-OD1 2.9Å; S253-D276 PolarHBondContact N-OD2 2.72Å; S253-D276 PolarHBondContact OG-OD2 3.26Å
254	K	90.7	Very high	90.4	Very high	104 Å²	104	39.6 Å²	39.6	45%	0.452	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-23.8	174	-172.4	170.3	-175.1	173	0	113.2	Q153 F157 E251 G252	Q153-K254 WeakPolarHBondContact CG-O 3.5Å; F157-K254 HydrophobicContact CE2-CD 4.15Å; F157-K254 VanDerWaalsContact CE2-CE 3.5Å; F157-K254 HydrophobicContact CE2-CG 4.41Å; F157-K254 HydrophobicContact CZ-CD 4.46Å; F157-K254 HydrophobicContact CZ-CG 4.42Å; E251-K254 HydrophobicContact CG-CB 4.25Å; G252-K254 PolarHBondContact O-N 2.6Å; G252-K254 VanDerWaalsContact O-N 3.14Å
255	R	91.1	Very high	89.7	Confident	35 Å²	35	39 Å²	39	13%	0.132	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-48.4	-179.5	-68.3	-174.9	179.1	-82.9	-1.1	112.5	Q152 Q153 F157 D161 F218 D219 G252 S253	Q152-R255 PolarHBondContact N-O 3.39Å; Q153-R255 HydrophobicContact CG-CB 4.42Å; Q153-R255 WeakPolarHBondContact CG-O 3.25Å; Q153-R255 VanDerWaalsContact NE2-CA 3.33Å; Q153-R255 PolarHBondContact NE2-O 2.91Å; F157-R255 HydrophobicContact CE1-CG 4.24Å; F157-R255 HydrophobicContact CZ-CG 4.48Å; D161-R255 VanDerWaalsContact CG-NH1 3.29Å; D161-R255 IonicContact OD1-CZ 2.74Å; D161-R255 IonicContact OD1-NH1 2.7Å; D161-R255 IonicContact OD1-NH2 3.9Å; D161-R255 PolarHBondContact OD1-NH2 2.87Å; D161-R255 IonicContact OD2-CZ 3.92Å; D161-R255 IonicContact OD2-NH1 3.86Å; D161-R255 PolarHBondContact OD2-NH1 3.03Å; D161-R255 IonicContact OD2-NH2 3.44Å; D161-R255 PolarHBondContact OD2-NH2 2.89Å; F218-R255 PolarHBondContact O-NH2 2.82Å; D219-R255 IonicContact OD1-CZ 3.34Å; D219-R255 IonicContact OD1-NE 3.88Å; D219-R255 PolarHBondContact OD1-NE 2.96Å; D219-R255 IonicContact OD1-NH2 3.85Å; D219-R255 PolarHBondContact OD1-NH2 2.94Å; D219-R255 IonicContact OD2-NE 3.49Å; G252-R255 WeakPolarHBondContact O-CA 3.42Å; G252-R255 WeakPolarHBondContact O-CB 3.38Å; G252-R255 PolarHBondContact O-N 2.78Å; S253-R255 PolarHBondContact O-N 3.21Å
256	S	91.8	Very high	89	Confident	27 Å²	27	38.3 Å²	38.3	19%	0.189	19%	0.188	C	C	.	.	B	Isolated β-bridge	trans	-162.3	160.6	-175.7	62.6	0	0	0	0	111	F150 G252 S253 H258	F150-S256 WeakPolarHBondContact O-CA 3.49Å; G252-S256 PolarHBondContact O-N 3.44Å; G252-S256 VanDerWaalsContact O-O 3.11Å; S253-S256 WeakPolarHBondContact CA-O 3.46Å; S256-H258 PolarHBondContact O-N 3.19Å; S256-H258 PolarHBondContact OG-N 3.42Å
257	S	89	Confident	88.4	Confident	10 Å²	10	42.8 Å²	42.8	7%	0.07	21%	0.208	C	C	.	.	S	Bend	trans	-79.2	13.1	167.6	50.9	0	0	0	0	114.1	F150 Q318	F150-S257 WeakPolarHBondContact CA-OG 3.2Å; F150-S257 WeakPolarHBondContact CD1-OG 3.36Å; F150-S257 PolarHBondContact O-N 3.27Å; F150-S257 VanDerWaalsContact O-N 3.16Å; S257-Q318 PolarHBondContact O-NE2 3.32Å
258	H	88.9	Confident	87.6	Confident	49 Å²	49	50.8 Å²	50.8	23%	0.227	24%	0.243	C	C	.	.			trans	-73.2	145.1	173.1	-70.9	-57.3	0	0	0	112.9	E145 F150 S256 T277 N438	E145-H258 IonicContact OE2-NE2 2.82Å; F150-H258 AromaticContact CD1-CE1 3.45Å; F150-H258 VanDerWaalsContact CD1-CE1 3.45Å; F150-H258 WeakPolarHBondContact CD1-CE1 3.02Å; F150-H258 AromaticContact CD1-ND1 3.86Å; F150-H258 AromaticContact CD1-NE2 3.76Å; F150-H258 AromaticContact CE1-CE1 3.47Å; F150-H258 VanDerWaalsContact CE1-CE1 3.47Å; F150-H258 WeakPolarHBondContact CE1-CE1 3.43Å; F150-H258 AromaticContact CE1-ND1 3.78Å; F150-H258 AromaticContact CG-CE1 3.8Å; F150-H258 AromaticContact CG-NE2 3.78Å; F150-H258 AromaticContact CZ-CE1 3.77Å; S256-H258 PolarHBondContact O-N 3.19Å; S256-H258 PolarHBondContact OG-N 3.42Å; H258-T277 WeakPolarHBondContact O-CB 3.29Å; H258-T277 PolarHBondContact O-OG1 2.95Å; H258-N438 WeakPolarHBondContact CA-OD1 3.31Å; H258-N438 PolarHBondContact ND1-OD1 2.83Å
259	S	88.1	Confident	86.9	Confident	13 Å²	13	52.4 Å²	52.4	9%	0.091	25%	0.254	C	S	.	.			trans	-113.3	138.1	-174.4	-54.5	0	0	0	0	112	T277 Q318 N438	S259-T277 WeakPolarHBondContact CA-OG1 3.26Å; S259-T277 PolarHBondContact OG-O 3.22Å; S259-Q318 PolarHBondContact OG-NE2 3.44Å; S259-N438 PolarHBondContact N-OD1 2.66Å
260	N	88.6	Confident	86.6	Confident	93 Å²	93	52.7 Å²	52.7	50%	0.497	25%	0.254	S	S	.	.			trans	-156.9	166.9	176.6	-156.4	-5.8	0	0	0	112.1	F275	N260-F275 HydrophobicContact CB-CD2 3.82Å; N260-F275 HydrophobicContact CB-CE2 3.78Å; N260-F275 HydrophobicContact CB-CG 4.25Å; N260-F275 HydrophobicContact CB-CZ 4.2Å; N260-F275 VanDerWaalsContact O-CB 3.3Å; N260-F275 WeakPolarHBondContact O-CB 3.28Å; N260-F275 WeakPolarHBondContact O-CD2 3.23Å; N260-F275 WeakPolarHBondContact O-CG 3.45Å; N260-F275 PolarHBondContact O-N 3.49Å; N260-F275 VanDerWaalsContact O-N 3.08Å
261	A	90.3	Very high	86.4	Confident	4 Å²	4	53 Å²	53	3%	0.033	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	150.9	169.1	0	0	0	0	0	109.6	V273 L274 L278 V328	A261-V273 WeakPolarHBondContact CA-O 3.19Å; A261-L274 HydrophobicContact CB-CD2 3.74Å; A261-L278 HydrophobicContact CB-CD2 3.64Å; A261-V328 HydrophobicContact CB-CG1 4.35Å
262	Y	89.3	Confident	86.5	Confident	68 Å²	68	50 Å²	50	27%	0.267	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156	163	174.3	62.9	-84.6	0	0	0	111.4	Y264 V273 F275	Y262-Y264 HydrophobicContact CD2-CD1 4.07Å; Y262-Y264 AromaticContact CE2-CD1 3.69Å; Y262-Y264 HydrophobicContact CE2-CD1 3.69Å; Y262-Y264 HydrophobicContact CE2-CE1 4.18Å; Y262-V273 HydrophobicContact CD1-CB 4.19Å; Y262-V273 HydrophobicContact CD1-CG1 4.48Å; Y262-V273 HydrophobicContact CD2-CB 4.34Å; Y262-V273 HydrophobicContact CE1-CB 3.74Å; Y262-V273 HydrophobicContact CE1-CG1 3.69Å; Y262-V273 HydrophobicContact CE1-CG2 4.47Å; Y262-V273 HydrophobicContact CE2-CB 3.91Å; Y262-V273 HydrophobicContact CE2-CG2 3.86Å; Y262-V273 HydrophobicContact CG-CB 4.47Å; Y262-V273 PolarHBondContact N-O 3.05Å; Y262-V273 PolarHBondContact O-N 2.92Å; Y262-F275 HydrophobicContact CD1-CE2 4.14Å; Y262-F275 AromaticContact CE1-CE2 3.84Å; Y262-F275 HydrophobicContact CE1-CE2 3.84Å
263	F	88.8	Confident	86.7	Confident	32 Å²	32	49.8 Å²	49.8	14%	0.14	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	156.3	168.4	72.6	-85.5	0	0	0	110.8	F242 K270 R271 I272 E332 H335 W336	F242-F263 HydrophobicContact CE2-CD2 4.28Å; F242-F263 HydrophobicContact CZ-CB 4.34Å; F242-F263 HydrophobicContact CZ-CD2 4.17Å; F242-F263 HydrophobicContact CZ-CG 4.37Å; F263-K270 HydrophobicContact CD2-CD 4.49Å; F263-R271 CarbonylContact C-O 3.52Å; F263-R271 WeakPolarHBondContact CA-O 3.21Å; F263-R271 VanDerWaalsContact CB-O 3.29Å; F263-R271 WeakPolarHBondContact CB-O 3.4Å; F263-I272 HydrophobicContact CB-CG1 4.22Å; F263-E332 HydrophobicContact CD1-CB 4.11Å; F263-E332 HydrophobicContact CE1-CB 4.46Å; F263-E332 WeakPolarHBondContact CE1-O 3.4Å; F263-H335 HydrophobicContact CE1-CB 4.3Å; F263-H335 HydrophobicContact CZ-CB 4.41Å; F263-W336 HydrophobicContact CE1-CB 4.37Å; F263-W336 HydrophobicContact CE2-CB 3.85Å; F263-W336 HydrophobicContact CE2-CG 4.43Å; F263-W336 HydrophobicContact CZ-CB 3.64Å
264	Y	83.6	Confident	86.8	Confident	42 Å²	42	49.3 Å²	49.3	17%	0.165	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	176.6	176.1	67.2	-93.9	0	0	0	111.7	A211 Y262 K270 R271 V273	A211-Y264 HydrophobicContact CB-CD1 4.17Å; A211-Y264 HydrophobicContact CB-CD2 3.57Å; A211-Y264 HydrophobicContact CB-CE1 3.71Å; A211-Y264 HydrophobicContact CB-CE2 3.1Å; A211-Y264 HydrophobicContact CB-CG 4.1Å; Y262-Y264 HydrophobicContact CD2-CD1 4.07Å; Y262-Y264 AromaticContact CE2-CD1 3.69Å; Y262-Y264 HydrophobicContact CE2-CD1 3.69Å; Y262-Y264 HydrophobicContact CE2-CE1 4.18Å; Y264-K270 WeakPolarHBondContact O-CA 3.47Å; Y264-R271 HydrophobicContact CE1-CB 4.13Å; Y264-R271 HydrophobicContact CE2-CB 4.04Å; Y264-R271 HydrophobicContact CE2-CG 4.21Å; Y264-R271 PolarHBondContact N-O 2.54Å; Y264-R271 PolarHBondContact O-N 3.06Å; Y264-R271 VanDerWaalsContact OH-CD 3.29Å; Y264-R271 WeakPolarHBondContact OH-CD 3.48Å; Y264-R271 PolarHBondContact OH-NH1 3.36Å; Y264-R271 VanDerWaalsContact OH-NH1 3.11Å; Y264-V273 HydrophobicContact CD1-CG2 4.1Å; Y264-V273 HydrophobicContact CE1-CG2 3.46Å; Y264-V273 VanDerWaalsContact CE1-CG2 3.46Å
265	G	78.9	Confident	87	Confident	29 Å²	29	46.6 Å²	46.6	30%	0.299	22%	0.224	S	C	.	.			trans	110.4	158.3	173.3	0	0	0	0	0	113.3	N269 K270	G265-N269 CarbonylContact C-O 3.55Å; G265-N269 WeakPolarHBondContact CA-O 3.48Å; G265-K270 WeakPolarHBondContact O-CD 3.39Å; G265-K270 WeakPolarHBondContact O-CE 3.48Å; G265-K270 PolarHBondContact O-NZ 3.14Å
266	F	74.1	Confident	87	Confident	60 Å²	60	45.2 Å²	45.2	26%	0.263	22%	0.219	S	C	.	.	S	Bend	trans	-103.9	150.3	-176.8	-78.6	-81.4	0	0	0	112	L204 V207 T208 K268 N269 I345	L204-F266 HydrophobicContact CD2-CE1 4.27Å; L204-F266 HydrophobicContact CD2-CZ 3.98Å; V207-F266 HydrophobicContact CB-CE2 4.17Å; V207-F266 HydrophobicContact CG1-CE2 3.66Å; V207-F266 HydrophobicContact CG1-CZ 4.01Å; T208-F266 WeakPolarHBondContact OG1-CD2 3.33Å; T208-F266 WeakPolarHBondContact OG1-CE2 3.22Å; F266-K268 PolarHBondContact O-N 2.95Å; F266-N269 PolarHBondContact O-N 3.47Å; F266-I345 HydrophobicContact CE1-CD1 4.28Å
267	F	74	Confident	87	Confident	182 Å²	182	44 Å²	44	80%	0.798	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.5	-123.3	177.4	-56	-77.2	0	0	0	112.7	N269 K270	F267-N269 VanDerWaalsContact C-N 3.35Å; F267-K270 PolarHBondContact O-NZ 2.95Å
268	K	76.6	Confident	87.2	Confident	181 Å²	181	43.6 Å²	43.6	79%	0.787	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-2.1	-175.9	-60.6	-174.9	179.7	-178.1	0	114.4	T245 F266	T245-K268 PolarHBondContact OG1-O 2.93Å; F266-K268 PolarHBondContact O-N 2.95Å
269	N	79.7	Confident	87.2	Confident	75 Å²	75	41.3 Å²	41.3	40%	0.401	20%	0.197	S	C	.	.			trans	-107.8	78.5	179.6	-168.8	0.2	0	0	0	108.9	G265 F266 F267	G265-N269 CarbonylContact C-O 3.55Å; G265-N269 WeakPolarHBondContact CA-O 3.48Å; F266-N269 PolarHBondContact O-N 3.47Å; F267-N269 VanDerWaalsContact C-N 3.35Å
270	K	87	Confident	87	Confident	18 Å²	18	42.9 Å²	42.9	8%	0.078	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	143.8	179	-68.1	-76.3	-174.6	-74.9	0	110.8	F242 P243 T245 F263 Y264 G265 F267	F242-K270 HydrophobicContact CD1-CB 4.49Å; F242-K270 HydrophobicContact CE1-CB 3.7Å; F242-K270 HydrophobicContact CE2-CB 3.92Å; F242-K270 HydrophobicContact CE2-CD 3.98Å; F242-K270 HydrophobicContact CE2-CG 3.84Å; F242-K270 HydrophobicContact CZ-CB 3.4Å; F242-K270 HydrophobicContact CZ-CD 4.06Å; F242-K270 HydrophobicContact CZ-CG 3.86Å; P243-K270 HydrophobicContact CG-CB 4.33Å; P243-K270 HydrophobicContact CG-CG 3.78Å; P243-K270 WeakPolarHBondContact O-CB 3.18Å; P243-K270 PolarHBondContact O-N 3.5Å; T245-K270 PolarHBondContact N-O 2.86Å; F263-K270 HydrophobicContact CD2-CD 4.49Å; Y264-K270 WeakPolarHBondContact O-CA 3.47Å; G265-K270 WeakPolarHBondContact O-CD 3.39Å; G265-K270 WeakPolarHBondContact O-CE 3.48Å; G265-K270 PolarHBondContact O-NZ 3.14Å; F267-K270 PolarHBondContact O-NZ 2.95Å
271	R	90.1	Very high	86.4	Confident	13 Å²	13	43.6 Å²	43.6	5%	0.049	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	147.3	-178	-54	-177.8	-167.9	169.2	3.4	110.7	D212 K246 F263 Y264	D212-R271 VanDerWaalsContact CG-NH1 3.3Å; D212-R271 VanDerWaalsContact CG-NH2 3.33Å; D212-R271 IonicContact OD1-CZ 3.5Å; D212-R271 VanDerWaalsContact OD1-CZ 3.3Å; D212-R271 IonicContact OD1-NH1 2.62Å; D212-R271 PolarHBondContact OD1-NH1 3.17Å; D212-R271 IonicContact OD1-NH2 2.9Å; D212-R271 PolarHBondContact OD1-NH2 2.86Å; D212-R271 VanDerWaalsContact OD1-NH2 3.09Å; D212-R271 IonicContact OD2-CZ 3Å; D212-R271 IonicContact OD2-NH1 3.39Å; D212-R271 PolarHBondContact OD2-NH1 3.45Å; D212-R271 IonicContact OD2-NH2 3.28Å; D212-R271 PolarHBondContact OD2-NH2 3.4Å; K246-R271 HydrophobicContact CB-CG 4.03Å; K246-R271 VanDerWaalsContact O-CA 3.27Å; K246-R271 WeakPolarHBondContact O-CA 3.27Å; F263-R271 CarbonylContact C-O 3.52Å; F263-R271 WeakPolarHBondContact CA-O 3.21Å; F263-R271 VanDerWaalsContact CB-O 3.29Å; F263-R271 WeakPolarHBondContact CB-O 3.4Å; Y264-R271 HydrophobicContact CE1-CB 4.13Å; Y264-R271 HydrophobicContact CE2-CB 4.04Å; Y264-R271 HydrophobicContact CE2-CG 4.21Å; Y264-R271 PolarHBondContact N-O 2.54Å; Y264-R271 PolarHBondContact O-N 3.06Å; Y264-R271 VanDerWaalsContact OH-CD 3.29Å; Y264-R271 WeakPolarHBondContact OH-CD 3.48Å; Y264-R271 PolarHBondContact OH-NH1 3.36Å; Y264-R271 VanDerWaalsContact OH-NH1 3.11Å
272	I	93.8	Very high	85.7	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	135.7	176.5	-66	172.3	0	0	0	108	I233 F242 L244 K246 L247 Y248 F263 L274 L329	I233-I272 HydrophobicContact CG2-CD1 3.87Å; F242-I272 HydrophobicContact CE1-CD1 4.18Å; F242-I272 HydrophobicContact CE1-CG1 4.17Å; L244-I272 HydrophobicContact CD1-CB 4.31Å; L244-I272 HydrophobicContact CD1-CD1 3.75Å; L244-I272 HydrophobicContact CD1-CG1 3.8Å; L244-I272 HydrophobicContact CD2-CD1 4.3Å; K246-I272 PolarHBondContact O-N 3.1Å; K246-I272 VanDerWaalsContact O-N 3.1Å; L247-I272 HydrophobicContact CD2-CB 4.1Å; L247-I272 HydrophobicContact CD2-CG2 4.17Å; L247-I272 HydrophobicContact CG-CB 4.49Å; Y248-I272 PolarHBondContact N-O 3.07Å; F263-I272 HydrophobicContact CB-CG1 4.22Å; I272-L274 HydrophobicContact CG2-CD2 4.02Å; I272-L274 HydrophobicContact CG2-CG 4.23Å; I272-L329 HydrophobicContact CD1-CD2 4.37Å; I272-L329 HydrophobicContact CG2-CD2 3.64Å
273	V	94	Very high	85.1	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	126.7	172.6	-177.7	0	0	0	0	109.1	F221 Y248 V250 A261 Y262 Y264	F221-V273 HydrophobicContact CD1-CG1 4.3Å; F221-V273 HydrophobicContact CE1-CG1 3.94Å; F221-V273 HydrophobicContact CE1-CG2 4.24Å; Y248-V273 WeakPolarHBondContact O-CA 3.42Å; V250-V273 HydrophobicContact CB-CG1 3.8Å; V250-V273 HydrophobicContact CG1-CG1 3.63Å; A261-V273 WeakPolarHBondContact CA-O 3.19Å; Y262-V273 HydrophobicContact CD1-CB 4.19Å; Y262-V273 HydrophobicContact CD1-CG1 4.48Å; Y262-V273 HydrophobicContact CD2-CB 4.34Å; Y262-V273 HydrophobicContact CE1-CB 3.74Å; Y262-V273 HydrophobicContact CE1-CG1 3.69Å; Y262-V273 HydrophobicContact CE1-CG2 4.47Å; Y262-V273 HydrophobicContact CE2-CB 3.91Å; Y262-V273 HydrophobicContact CE2-CG2 3.86Å; Y262-V273 HydrophobicContact CG-CB 4.47Å; Y262-V273 PolarHBondContact N-O 3.05Å; Y262-V273 PolarHBondContact O-N 2.92Å; Y264-V273 HydrophobicContact CD1-CG2 4.1Å; Y264-V273 HydrophobicContact CE1-CG2 3.46Å; Y264-V273 VanDerWaalsContact CE1-CG2 3.46Å
274	L	94.6	Very high	84.2	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	137.1	174	-56	177.8	0	0	0	108.5	I233 Y248 V249 V250 A261 I272 L278 L279 I325 L329	I233-L274 HydrophobicContact CD1-CD1 4.07Å; Y248-L274 PolarHBondContact O-N 2.78Å; V249-L274 CarbonylContact C-O 3.58Å; V249-L274 VanDerWaalsContact CA-O 3.25Å; V249-L274 WeakPolarHBondContact CA-O 3.31Å; V250-L274 PolarHBondContact N-O 2.96Å; A261-L274 HydrophobicContact CB-CD2 3.74Å; I272-L274 HydrophobicContact CG2-CD2 4.02Å; I272-L274 HydrophobicContact CG2-CG 4.23Å; L274-L278 HydrophobicContact CD2-CD2 4.31Å; L274-L279 HydrophobicContact CB-CD1 4.49Å; L274-L279 HydrophobicContact CB-CD2 4.37Å; L274-L279 HydrophobicContact CD1-CD2 4Å; L274-I325 HydrophobicContact CD1-CG2 4.28Å; L274-L329 HydrophobicContact CD2-CD1 4.29Å; L274-L329 HydrophobicContact CD2-CD2 3.95Å; L274-L329 HydrophobicContact CD2-CG 4.31Å
275	F	93.9	Very high	83.9	Confident	47 Å²	47	46 Å²	46	21%	0.206	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	140.8	168.3	-78.7	-125.6	0	0	0	109.1	V250 N260 Y262 T277 L278	V250-F275 HydrophobicContact CG1-CB 4.38Å; V250-F275 HydrophobicContact CG1-CD1 4.28Å; V250-F275 HydrophobicContact CG1-CD2 3.59Å; V250-F275 HydrophobicContact CG1-CE1 4.49Å; V250-F275 HydrophobicContact CG1-CE2 3.86Å; V250-F275 HydrophobicContact CG1-CG 3.82Å; V250-F275 HydrophobicContact CG1-CZ 4.3Å; N260-F275 HydrophobicContact CB-CD2 3.82Å; N260-F275 HydrophobicContact CB-CE2 3.78Å; N260-F275 HydrophobicContact CB-CG 4.25Å; N260-F275 HydrophobicContact CB-CZ 4.2Å; N260-F275 VanDerWaalsContact O-CB 3.3Å; N260-F275 WeakPolarHBondContact O-CB 3.28Å; N260-F275 WeakPolarHBondContact O-CD2 3.23Å; N260-F275 WeakPolarHBondContact O-CG 3.45Å; N260-F275 PolarHBondContact O-N 3.49Å; N260-F275 VanDerWaalsContact O-N 3.08Å; Y262-F275 HydrophobicContact CD1-CE2 4.14Å; Y262-F275 AromaticContact CE1-CE2 3.84Å; Y262-F275 HydrophobicContact CE1-CE2 3.84Å; F275-T277 WeakPolarHBondContact CB-OG1 3.45Å; F275-T277 PolarHBondContact O-N 3.21Å; F275-L278 HydrophobicContact CB-CB 4.42Å; F275-L278 VanDerWaalsContact O-CB 3.28Å; F275-L278 WeakPolarHBondContact O-CB 3.27Å; F275-L278 PolarHBondContact O-N 3.1Å
276	D	92.4	Very high	83.9	Confident	6 Å²	6	46 Å²	46	3%	0.032	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-57	-36.3	172.9	60.2	-16.7	0	0	0	112.6	V249 V250 G252 S253 L278 L279 S283 P284	V249-D276 HydrophobicContact CG1-CB 3.82Å; V250-D276 PolarHBondContact O-N 2.81Å; G252-D276 PolarHBondContact N-OD1 2.96Å; S253-D276 WeakPolarHBondContact CB-OD2 3.45Å; S253-D276 PolarHBondContact N-OD1 2.9Å; S253-D276 PolarHBondContact N-OD2 2.72Å; S253-D276 PolarHBondContact OG-OD2 3.26Å; D276-L278 PolarHBondContact O-N 3.44Å; D276-L279 PolarHBondContact O-N 3.46Å; D276-S283 WeakPolarHBondContact O-CA 3.44Å; D276-S283 WeakPolarHBondContact O-CB 3.29Å; D276-P284 WeakPolarHBondContact OD2-CD 3.35Å
277	T	91.9	Very high	83.3	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-62.8	-20.9	173.7	49.7	0	0	0	0	114.6	H258 S259 F275 L285 Q318 G319	H258-T277 WeakPolarHBondContact O-CB 3.29Å; H258-T277 PolarHBondContact O-OG1 2.95Å; S259-T277 WeakPolarHBondContact CA-OG1 3.26Å; S259-T277 PolarHBondContact OG-O 3.22Å; F275-T277 WeakPolarHBondContact CB-OG1 3.45Å; F275-T277 PolarHBondContact O-N 3.21Å; T277-L285 HydrophobicContact CG2-CD1 4.09Å; T277-Q318 VanDerWaalsContact CB-NE2 3.3Å; T277-Q318 PolarHBondContact O-NE2 3.02Å; T277-G319 WeakPolarHBondContact O-CA 3.27Å
278	L	91.5	Very high	82.4	Confident	2 Å²	2	42.3 Å²	42.3	1%	0.01	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-79.9	-21.1	173.8	179.3	62.7	0	0	0	112.1	A261 L274 F275 D276 G319 C320 L434	A261-L278 HydrophobicContact CB-CD2 3.64Å; L274-L278 HydrophobicContact CD2-CD2 4.31Å; F275-L278 HydrophobicContact CB-CB 4.42Å; F275-L278 VanDerWaalsContact O-CB 3.28Å; F275-L278 WeakPolarHBondContact O-CB 3.27Å; F275-L278 PolarHBondContact O-N 3.1Å; D276-L278 PolarHBondContact O-N 3.44Å; L278-G319 CarbonylContact O-C 3.55Å; L278-C320 HydrophobicContact CD1-CB 4.14Å; L278-C320 PolarHBondContact O-N 3.45Å; L278-L434 HydrophobicContact CD1-CD1 4.36Å; L278-L434 HydrophobicContact CD1-CD2 3.48Å; L278-L434 VanDerWaalsContact CD1-CD2 3.48Å; L278-L434 HydrophobicContact CD1-CG 4.39Å
279	L	89.6	Confident	80.7	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.005	22%	0.215	C	C	.	.	B	Isolated β-bridge	trans	-98.8	106.1	-171.4	-58.1	179.5	0	0	0	110.2	L224 L229 V249 L274 D276 D281 Y282 S283 I325	L224-L279 HydrophobicContact CD1-CD1 4.22Å; L229-L279 HydrophobicContact CD2-CD2 3.92Å; V249-L279 HydrophobicContact CG1-CD1 4.11Å; V249-L279 HydrophobicContact CG2-CD1 3.78Å; L274-L279 HydrophobicContact CB-CD1 4.49Å; L274-L279 HydrophobicContact CB-CD2 4.37Å; L274-L279 HydrophobicContact CD1-CD2 4Å; D276-L279 PolarHBondContact O-N 3.46Å; L279-D281 VanDerWaalsContact C-N 3.28Å; L279-D281 PolarHBondContact O-N 3.46Å; L279-Y282 HydrophobicContact CB-CD2 4.01Å; L279-Y282 HydrophobicContact CB-CG 4.36Å; L279-Y282 HydrophobicContact CD1-CD2 4.09Å; L279-Y282 HydrophobicContact CD1-CG 4.23Å; L279-Y282 PolarHBondContact O-N 3.24Å; L279-Y282 VanDerWaalsContact O-N 3.13Å; L279-S283 VanDerWaalsContact O-CB 3.28Å; L279-S283 WeakPolarHBondContact O-CB 3.46Å; L279-S283 PolarHBondContact O-N 2.74Å; L279-I325 HydrophobicContact CD2-CD1 3.4Å; L279-I325 HydrophobicContact CD2-CG1 4.19Å; L279-I325 HydrophobicContact CD2-CG2 4.5Å
280	E	84.3	Confident	78.5	Confident	46 Å²	46	38.9 Å²	38.9	22%	0.215	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-43.7	-176.2	-175.2	169.3	-177.1	0	0	112.7	N286 K317 Q318 C320 K433	E280-N286 PolarHBondContact O-ND2 2.95Å; E280-K317 HydrophobicContact CG-CB 4.08Å; E280-K317 HydrophobicContact CG-CD 4.47Å; E280-Q318 WeakPolarHBondContact CA-O 3.34Å; E280-C320 WeakPolarHBondContact CB-O 3.3Å; E280-C320 PolarHBondContact N-O 3.24Å; E280-C320 VanDerWaalsContact N-O 3.16Å; E280-K433 IonicContact OE2-NZ 3.91Å; E280-K433 PolarHBondContact OE2-NZ 2.92Å
281	D	75.9	Confident	75.7	Confident	108 Å²	108	43.8 Å²	43.8	58%	0.578	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-13.5	-177	-61.4	-36.7	0	0	0	114.2	L279	L279-D281 VanDerWaalsContact C-N 3.28Å; L279-D281 PolarHBondContact O-N 3.46Å
282	Y	75.4	Confident	72.8	Confident	85 Å²	85	52 Å²	52	33%	0.333	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.8	-6	-175.1	-60.1	-87	0	0	0	113.6	P225 L229 L279 P284	P225-Y282 HydrophobicContact CB-CE1 4.09Å; P225-Y282 HydrophobicContact CG-CD1 4.18Å; P225-Y282 HydrophobicContact CG-CE1 3.76Å; L229-Y282 HydrophobicContact CD2-CE2 4.47Å; L279-Y282 HydrophobicContact CB-CD2 4.01Å; L279-Y282 HydrophobicContact CB-CG 4.36Å; L279-Y282 HydrophobicContact CD1-CD2 4.09Å; L279-Y282 HydrophobicContact CD1-CG 4.23Å; L279-Y282 PolarHBondContact O-N 3.24Å; L279-Y282 VanDerWaalsContact O-N 3.13Å; Y282-P284 VanDerWaalsContact O-CD 3.27Å; Y282-P284 WeakPolarHBondContact O-CD 3.35Å
283	S	76.1	Confident	69.6	Low	0 Å²	0	57.5 Å²	57.5	0%	0	34%	0.337	C	S	.	.			trans	-67.2	118.8	179.5	178.2	0	0	0	0	110.5	D276 L279 L285 N286	D276-S283 WeakPolarHBondContact O-CA 3.44Å; D276-S283 WeakPolarHBondContact O-CB 3.29Å; L279-S283 VanDerWaalsContact O-CB 3.28Å; L279-S283 WeakPolarHBondContact O-CB 3.46Å; L279-S283 PolarHBondContact O-N 2.74Å; S283-L285 PolarHBondContact O-N 2.74Å; S283-L285 VanDerWaalsContact O-N 3.1Å; S283-L285 PolarHBondContact OG-N 3.44Å; S283-N286 WeakPolarHBondContact O-CB 3.44Å; S283-N286 PolarHBondContact O-N 3.45Å
284	P	71	Confident	66.5	Low	61 Å²	61	64.1 Å²	64.1	40%	0.396	37%	0.372	S	S	.	.	H	α-helix	trans	-58.6	-26.5	176.7	-24.5	34.7	0	0	0	112.8	D276 Y282 N286 S287 A288	D276-P284 WeakPolarHBondContact OD2-CD 3.35Å; Y282-P284 VanDerWaalsContact O-CD 3.27Å; Y282-P284 WeakPolarHBondContact O-CD 3.35Å; P284-N286 VanDerWaalsContact C-N 3.26Å; P284-N286 PolarHBondContact O-N 3.01Å; P284-S287 PolarHBondContact O-N 2.91Å; P284-A288 PolarHBondContact O-N 3.45Å; P284-A288 VanDerWaalsContact O-N 3.1Å
285	L	76.9	Confident	63.3	Low	52 Å²	52	70.7 Å²	70.7	27%	0.272	41%	0.413	S	S	.	.	H	α-helix	trans	-68.4	-25.8	178.3	-57.3	179.6	0	0	0	112.5	T277 S283	T277-L285 HydrophobicContact CG2-CD1 4.09Å; S283-L285 PolarHBondContact O-N 2.74Å; S283-L285 VanDerWaalsContact O-N 3.1Å; S283-L285 PolarHBondContact OG-N 3.44Å
286	N	79.4	Confident	60.2	Low	28 Å²	28	78.2 Å²	78.2	15%	0.15	45%	0.448	C	S	.	.	H	α-helix	trans	-80.8	-34.7	175.8	-68.5	-22.6	0	0	0	111.4	E280 S283 P284 Q318	E280-N286 PolarHBondContact O-ND2 2.95Å; S283-N286 WeakPolarHBondContact O-CB 3.44Å; S283-N286 PolarHBondContact O-N 3.45Å; P284-N286 VanDerWaalsContact C-N 3.26Å; P284-N286 PolarHBondContact O-N 3.01Å; N286-Q318 PolarHBondContact ND2-O 2.92Å; N286-Q318 PolarHBondContact OD1-N 3.46Å; N286-Q318 VanDerWaalsContact OD1-N 3.08Å
287	S	61.2	Low	57	Low	74 Å²	74	82.8 Å²	82.8	52%	0.517	48%	0.481	S	S	.	.	H	α-helix	trans	-77.2	-27.8	179.2	-51.3	0	0	0	0	113.9	P284 G289 E290	P284-S287 PolarHBondContact O-N 2.91Å; S287-G289 PolarHBondContact O-N 3.38Å; S287-G289 VanDerWaalsContact O-N 3.14Å; S287-E290 PolarHBondContact O-N 3.29Å
288	A	54.2	Low	54	Low	91 Å²	91	92 Å²	92	75%	0.752	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-5.8	178.1	0	0	0	0	0	114.2	P284	P284-A288 PolarHBondContact O-N 3.45Å; P284-A288 VanDerWaalsContact O-N 3.1Å
289	G	41.5	Very low	50.8	Low	50 Å²	50	98.6 Å²	98.6	52%	0.515	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.9	-5.4	177.9	0	0	0	0	0	115.3	S287	S287-G289 PolarHBondContact O-N 3.38Å; S287-G289 VanDerWaalsContact O-N 3.14Å
290	E	32.9	Very low	47.7	Very low	133 Å²	133	107.4 Å²	107.4	62%	0.621	61%	0.606	S	S	*	*	S	Bend	trans	-90	121.8	175.4	-68.8	-174.3	175.8	0	0	109.2	S287 Q292	S287-E290 PolarHBondContact O-N 3.29Å; E290-Q292 PolarHBondContact O-N 2.98Å
291	P	29.9	Very low	44.9	Very low	122 Å²	122	110.3 Å²	110.3	79%	0.792	63%	0.631	S	S	*	*			trans	-61	122.8	168.7	22.1	-26.5	0	0	0	108.2	S293	P291-S293 PolarHBondContact O-N 2.95Å
292	Q	28	Very low	42.5	Very low	186 Å²	186	112.7 Å²	112.7	87%	0.869	64%	0.644	S	S	*	*			trans	-54.1	106	169.8	-79.1	177	-32	0	0	108.7	E290 D294	E290-Q292 PolarHBondContact O-N 2.98Å; Q292-D294 PolarHBondContact O-N 3.43Å
293	S	27.5	Very low	40.4	Very low	115 Å²	115	113.9 Å²	113.9	80%	0.804	66%	0.662	S	S	*	*			trans	-77.7	71.8	168.7	61.1	0	0	0	0	109	P291	P291-S293 PolarHBondContact O-N 2.95Å
294	D	28.4	Very low	38	Very low	140 Å²	140	123.5 Å²	123.5	75%	0.749	71%	0.707	S	S	*	*			trans	-142.9	79.4	171.6	-86.3	-34	0	0	0	109.6	Q292	Q292-D294 PolarHBondContact O-N 3.43Å
295	T	26.4	Very low	35.9	Very low	138 Å²	138	129 Å²	129	85%	0.847	73%	0.727	S	S	*	*				-176.8	125.7	124.3	6.3	0	0	0	0	110.1	S297	T295-S297 PolarHBondContact O-N 3.14Å
296	Q	29.6	Very low	33.4	Very low	204 Å²	204	132.5 Å²	132.5	95%	0.953	75%	0.751	S	S	*	*			trans	-63.8	118.7	160.6	-73.3	170.9	-23.7	0	0	108.7
297	S	24.5	Very low	30.8	Very low	103 Å²	103	136.1 Å²	136.1	72%	0.72	78%	0.779	S	S	*	*			trans	-146.3	106.4	152.4	60.8	0	0	0	0	108.4	T295	T295-S297 PolarHBondContact O-N 3.14Å
298	E	29.2	Very low	28.9	Very low	193 Å²	193	137.7 Å²	137.7	90%	0.902	79%	0.789	S	S	*	*			trans	-59.4	128.4	166.5	-65.6	173	157.7	0	0	109.5
299	T	24.4	Very low	27.6	Very low	141 Å²	141	142.7 Å²	142.7	87%	0.865	80%	0.798	S	S	*	*			trans	-163.3	136.1	144.8	5.8	0	0	0	0	109.6
300	E	25.8	Very low	26.8	Very low	185 Å²	185	146.8 Å²	146.8	86%	0.864	81%	0.813	S	S	*	*			trans	-79.6	166.3	-167.3	-69.2	174.8	136	0	0	114.6
301	S	25.1	Very low	26.7	Very low	108 Å²	108	149.6 Å²	149.6	76%	0.755	82%	0.823	S	S	*	*			trans	72.6	110.4	152.5	67.7	0	0	0	0	119.8
302	D	25.7	Very low	26.6	Very low	157 Å²	157	153 Å²	153	84%	0.84	83%	0.828	S	S	*	*				-169.2	151.8	84.7	-104.9	-27.2	0	0	0	111.7
303	P	30.7	Very low	26.8	Very low	111 Å²	111	152.1 Å²	152.1	72%	0.721	82%	0.821	S	S	*	*			trans	-103.9	121.6	-176.3	34.5	-22.4	0	0	0	112.7
304	E	26.3	Very low	27.3	Very low	202 Å²	202	151.7 Å²	151.7	94%	0.944	82%	0.818	S	S	*	*			trans	-122.4	104.3	154.9	-82.9	-169.8	163.6	0	0	109.7
305	E	27.2	Very low	28.4	Very low	176 Å²	176	154 Å²	154	82%	0.822	82%	0.822	S	S	*	*			trans	-77.9	132.7	161.6	-68.9	-176.1	147.3	0	0	109.2
306	T	24.2	Very low	30.2	Very low	125 Å²	125	154.7 Å²	154.7	77%	0.767	81%	0.813	S	S	*	*				176.3	127.2	100.4	28.7	0	0	0	0	113.9
307	S	23.9	Very low	32.4	Very low	105 Å²	105	149.9 Å²	149.9	73%	0.734	79%	0.789	S	S	*	*			trans	60.8	107.2	142.1	65.8	0	0	0	0	120.7
308	S	22.1	Very low	35.3	Very low	106 Å²	106	146.3 Å²	146.3	74%	0.741	76%	0.761	S	S	*	*				172.2	113.6	95.7	44.4	0	0	0	0	111.4	T310	S308-T310 PolarHBondContact O-N 3.03Å
309	E	26.2	Very low	38.1	Very low	197 Å²	197	137.1 Å²	137.1	92%	0.921	72%	0.718	S	S	*	*			trans	17.4	70.3	152.1	-58.9	-175.6	162.6	0	0	119.3	K311	E309-K311 PolarHBondContact O-N 3.2Å
310	T	25.6	Very low	41.4	Very low	136 Å²	136	130.5 Å²	130.5	83%	0.834	68%	0.677	S	S	*	*			trans	-85.5	94.6	155.1	-38.9	0	0	0	0	107.8	S308 Q312	S308-T310 PolarHBondContact O-N 3.03Å; T310-Q312 PolarHBondContact O-N 3.36Å
311	K	30.2	Very low	44.6	Very low	192 Å²	192	124.7 Å²	124.7	84%	0.835	65%	0.652	S	S	*	*			trans	-45.2	115	164	-80.6	177.9	176.8	174	0	108.2	E309 K313	E309-K311 PolarHBondContact O-N 3.2Å; K311-K313 PolarHBondContact O-N 3.3Å
312	Q	27	Very low	47.9	Very low	193 Å²	193	121.6 Å²	121.6	90%	0.902	63%	0.627	S	S	*	*			trans	-55.9	90.8	164.1	-81.3	173.2	-24.1	0	0	108	T310 S314	T310-Q312 PolarHBondContact O-N 3.36Å; Q312-S314 VanDerWaalsContact C-N 3.28Å; Q312-S314 PolarHBondContact O-N 3.31Å
313	K	34	Very low	51.2	Low	167 Å²	167	116 Å²	116	73%	0.726	60%	0.603	S	S	*	*			trans	-64.8	98.4	157.6	-96.7	-175.9	173.3	-178.9	0	104.5	D57 K311 K315	D57-K313 IonicContact OD2-NZ 3.09Å; D57-K313 PolarHBondContact OD2-NZ 2.88Å; K311-K313 PolarHBondContact O-N 3.3Å; K313-K315 PolarHBondContact O-N 2.73Å; K313-K315 VanDerWaalsContact O-N 3.1Å
314	S	36.5	Very low	54.2	Low	106 Å²	106	111.2 Å²	111.2	74%	0.741	57%	0.571	S	S	*	*			trans	-47.9	121.4	167.4	60.1	0	0	0	0	107.5	Q312 K316	Q312-S314 VanDerWaalsContact C-N 3.28Å; Q312-S314 PolarHBondContact O-N 3.31Å; S314-K316 PolarHBondContact O-N 2.92Å
315	K	51.6	Low	57.5	Low	189 Å²	189	101.7 Å²	101.7	82%	0.822	53%	0.526	S	S	*	.			trans	-53.1	115.5	174.2	-111.4	177.5	173.7	-179.4	0	107.2	K313 K317	K313-K315 PolarHBondContact O-N 2.73Å; K313-K315 VanDerWaalsContact O-N 3.1Å; K315-K317 PolarHBondContact O-N 3.24Å; K315-K317 VanDerWaalsContact O-N 3.12Å
316	K	64.4	Low	60.8	Low	153 Å²	153	94.1 Å²	94.1	67%	0.665	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-57.2	118.8	171.1	-78.1	-177.6	177	-177.9	0	106.5	D55 S314	D55-K316 IonicContact OD2-NZ 2.6Å; D55-K316 PolarHBondContact OD2-NZ 3.47Å; S314-K316 PolarHBondContact O-N 2.92Å
317	K	76.1	Confident	64.2	Low	102 Å²	102	88.2 Å²	88.2	44%	0.443	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-67.4	141.6	176.2	-67.6	-173.7	176.6	-171.4	0	108.9	E280 K315	E280-K317 HydrophobicContact CG-CB 4.08Å; E280-K317 HydrophobicContact CG-CD 4.47Å; K315-K317 PolarHBondContact O-N 3.24Å; K315-K317 VanDerWaalsContact O-N 3.12Å
318	Q	85.4	Confident	67.7	Low	29 Å²	29	83.9 Å²	83.9	14%	0.136	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-80.9	152.9	176.8	177.2	-176.9	-25.2	0	0	110.3	S257 S259 T277 E280 N286 D437	S257-Q318 PolarHBondContact O-NE2 3.32Å; S259-Q318 PolarHBondContact OG-NE2 3.44Å; T277-Q318 VanDerWaalsContact CB-NE2 3.3Å; T277-Q318 PolarHBondContact O-NE2 3.02Å; E280-Q318 WeakPolarHBondContact CA-O 3.34Å; N286-Q318 PolarHBondContact ND2-O 2.92Å; N286-Q318 PolarHBondContact OD1-N 3.46Å; N286-Q318 VanDerWaalsContact OD1-N 3.08Å; Q318-D437 HydrophobicContact CG-CB 4.38Å
319	G	88.9	Confident	71.2	Confident	0 Å²	0	79 Å²	79	0%	0	39%	0.39	C	S	.	.	S	Bend	trans	98.1	168.8	169.8	0	0	0	0	0	112	T277 L278 K433 D437	T277-G319 WeakPolarHBondContact O-CA 3.27Å; L278-G319 CarbonylContact O-C 3.55Å; G319-K433 WeakPolarHBondContact O-CD 3.4Å; G319-K433 WeakPolarHBondContact O-CE 3.42Å; G319-K433 PolarHBondContact O-NZ 3.06Å; G319-D437 PolarHBondContact N-OD2 3.48Å
320	C	91.9	Very high	74.5	Confident	1 Å²	1	69.6 Å²	69.6	1%	0.007	35%	0.346	C	S	.	.	B	Isolated β-bridge	trans	-92.3	149.9	-177.5	-71.8	0	0	0	0	111.5	L278 E280 E324 I325	L278-C320 HydrophobicContact CD1-CB 4.14Å; L278-C320 PolarHBondContact O-N 3.45Å; E280-C320 WeakPolarHBondContact CB-O 3.3Å; E280-C320 PolarHBondContact N-O 3.24Å; E280-C320 VanDerWaalsContact N-O 3.16Å; C320-E324 WeakPolarHBondContact CA-OE2 3.26Å; C320-E324 HydrophobicContact CB-CB 3.65Å; C320-I325 HydrophobicContact CB-CG1 3.72Å; C320-I325 WeakPolarHBondContact O-CD1 3.5Å
321	N	93.6	Very high	77.9	Confident	63 Å²	63	63.5 Å²	63.5	34%	0.337	31%	0.308	S	S	.	.			trans	-74.6	170.4	168.4	70.5	42.8	0	0	0	110.9	A323 E324 I325	N321-A323 VanDerWaalsContact C-N 3.28Å; N321-A323 PolarHBondContact O-N 2.68Å; N321-A323 WeakPolarHBondContact OD1-CB 3.46Å; N321-A323 PolarHBondContact OD1-N 3.09Å; N321-E324 PolarHBondContact N-OE2 3.11Å; N321-E324 PolarHBondContact ND2-OE2 3.03Å; N321-E324 WeakPolarHBondContact O-CB 3.48Å; N321-E324 PolarHBondContact O-N 2.74Å; N321-E324 WeakPolarHBondContact OD1-CG 3.2Å; N321-E324 PolarHBondContact OD1-N 3.42Å; N321-I325 WeakPolarHBondContact O-CD1 3.36Å; N321-I325 VanDerWaalsContact O-CG1 3.27Å; N321-I325 WeakPolarHBondContact O-CG1 3.38Å; N321-I325 PolarHBondContact O-N 3.33Å
322	N	93.9	Very high	81	Confident	44 Å²	44	56.1 Å²	56.1	24%	0.235	28%	0.276	C	S	.	.	H	α-helix	trans	-56.3	-38.6	-176.4	-68.8	-15.7	0	0	0	113.8	L229 I325 L326	L229-N322 HydrophobicContact CD1-CB 4.09Å; N322-I325 PolarHBondContact O-N 3.48Å; N322-L326 VanDerWaalsContact O-CG 3.23Å; N322-L326 WeakPolarHBondContact O-CG 3.31Å; N322-L326 PolarHBondContact O-N 3.01Å
323	A	94.8	Very high	84.2	Confident	39 Å²	39	47 Å²	47	32%	0.322	23%	0.234	S	C	.	.	H	α-helix	trans	-70.6	-40.2	-179.1	0	0	0	0	0	112	N321 L326 A327 E426	N321-A323 VanDerWaalsContact C-N 3.28Å; N321-A323 PolarHBondContact O-N 2.68Å; N321-A323 WeakPolarHBondContact OD1-CB 3.46Å; N321-A323 PolarHBondContact OD1-N 3.09Å; A323-L326 PolarHBondContact O-N 3.38Å; A323-A327 PolarHBondContact O-N 3.44Å; A323-A327 VanDerWaalsContact O-N 3.11Å; A323-E426 HydrophobicContact CB-CG 4.05Å
324	E	95.2	Very high	87.2	Confident	10 Å²	10	39.1 Å²	39.1	5%	0.047	20%	0.199	C	C	.	.	H	α-helix	trans	-63.3	-44.1	173.2	-71.8	172.8	150.3	0	0	111.4	C320 N321 L326 A327 V328 S429 A430 K433	C320-E324 WeakPolarHBondContact CA-OE2 3.26Å; C320-E324 HydrophobicContact CB-CB 3.65Å; N321-E324 PolarHBondContact N-OE2 3.11Å; N321-E324 PolarHBondContact ND2-OE2 3.03Å; N321-E324 WeakPolarHBondContact O-CB 3.48Å; N321-E324 PolarHBondContact O-N 2.74Å; N321-E324 WeakPolarHBondContact OD1-CG 3.2Å; N321-E324 PolarHBondContact OD1-N 3.42Å; E324-L326 VanDerWaalsContact C-N 3.34Å; E324-L326 PolarHBondContact O-N 3.03Å; E324-A327 WeakPolarHBondContact O-CB 3.35Å; E324-A327 PolarHBondContact O-N 2.96Å; E324-A327 VanDerWaalsContact O-N 3.1Å; E324-V328 WeakPolarHBondContact O-CG2 3.3Å; E324-V328 PolarHBondContact O-N 3.45Å; E324-S429 WeakPolarHBondContact OE1-CB 3.39Å; E324-S429 PolarHBondContact OE1-OG 3.05Å; E324-A430 HydrophobicContact CB-CB 3.85Å; E324-A430 HydrophobicContact CG-CB 4.21Å; E324-K433 WeakPolarHBondContact OE2-CD 3.41Å; E324-K433 IonicContact OE2-NZ 3.64Å; E324-K433 PolarHBondContact OE2-NZ 3.18Å
325	I	95.2	Very high	90	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.01	17%	0.169	C	C	.	.	H	α-helix	trans	-60.5	-44.5	176.3	-65.8	158	0	0	0	110.7	L229 L274 L279 C320 N321 N322 A327 V328 L329	L229-I325 HydrophobicContact CD1-CB 4.2Å; L229-I325 HydrophobicContact CD1-CD1 4.38Å; L229-I325 HydrophobicContact CD1-CG2 3.98Å; L229-I325 HydrophobicContact CD2-CD1 3.98Å; L274-I325 HydrophobicContact CD1-CG2 4.28Å; L279-I325 HydrophobicContact CD2-CD1 3.4Å; L279-I325 HydrophobicContact CD2-CG1 4.19Å; L279-I325 HydrophobicContact CD2-CG2 4.5Å; C320-I325 HydrophobicContact CB-CG1 3.72Å; C320-I325 WeakPolarHBondContact O-CD1 3.5Å; N321-I325 WeakPolarHBondContact O-CD1 3.36Å; N321-I325 VanDerWaalsContact O-CG1 3.27Å; N321-I325 WeakPolarHBondContact O-CG1 3.38Å; N321-I325 PolarHBondContact O-N 3.33Å; N322-I325 PolarHBondContact O-N 3.48Å; I325-A327 PolarHBondContact O-N 2.7Å; I325-V328 PolarHBondContact O-N 3.42Å; I325-L329 HydrophobicContact CG2-CD1 4.12Å; I325-L329 WeakPolarHBondContact O-CB 3.28Å; I325-L329 WeakPolarHBondContact O-CG 3.19Å; I325-L329 PolarHBondContact O-N 3.35Å
326	L	95.9	Very high	92	Very high	18 Å²	18	29.1 Å²	29.1	9%	0.094	14%	0.141	C	C	.	.	H	α-helix	trans	-61	-35.4	176.4	-72.5	169.5	0	0	0	111.7	A232 I233 M236 N322 A323 E324 L329 G330	A232-L326 HydrophobicContact CB-CD1 3.66Å; A232-L326 HydrophobicContact CB-CD2 3.83Å; A232-L326 HydrophobicContact CB-CG 4.34Å; I233-L326 HydrophobicContact CB-CD2 4.44Å; I233-L326 HydrophobicContact CG1-CD2 3.68Å; M236-L326 HydrophobicContact CE-CB 3.72Å; M236-L326 HydrophobicContact CE-CD2 3.94Å; M236-L326 HydrophobicContact CE-CG 4.36Å; M236-L326 VanDerWaalsContact CE-O 3.27Å; M236-L326 WeakPolarHBondContact CE-O 3.39Å; N322-L326 VanDerWaalsContact O-CG 3.23Å; N322-L326 WeakPolarHBondContact O-CG 3.31Å; N322-L326 PolarHBondContact O-N 3.01Å; A323-L326 PolarHBondContact O-N 3.38Å; E324-L326 VanDerWaalsContact C-N 3.34Å; E324-L326 PolarHBondContact O-N 3.03Å; L326-L329 PolarHBondContact O-N 2.83Å; L326-G330 PolarHBondContact O-N 3.1Å
327	A	96.4	Very high	93.5	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-70.2	-42.2	177.3	0	0	0	0	0	112.5	A323 E324 I325 L329 G330 H331 K423 E426 L427	A323-A327 PolarHBondContact O-N 3.44Å; A323-A327 VanDerWaalsContact O-N 3.11Å; E324-A327 WeakPolarHBondContact O-CB 3.35Å; E324-A327 PolarHBondContact O-N 2.96Å; E324-A327 VanDerWaalsContact O-N 3.1Å; I325-A327 PolarHBondContact O-N 2.7Å; A327-L329 VanDerWaalsContact C-N 3.31Å; A327-L329 PolarHBondContact O-N 2.94Å; A327-G330 PolarHBondContact O-N 3.11Å; A327-H331 PolarHBondContact O-N 2.62Å; A327-K423 HydrophobicContact CB-CB 4Å; A327-E426 HydrophobicContact CB-CB 3.59Å; A327-L427 HydrophobicContact CB-CB 3.9Å; A327-L427 VanDerWaalsContact CB-N 3.32Å
328	V	96.2	Very high	94.4	Very high	15 Å²	15	25 Å²	25	9%	0.091	13%	0.126	C	C	.	.	H	α-helix	trans	-59.2	-44.5	171.5	174.4	0	0	0	0	110.2	A261 E324 I325 G330 H331 E332 A430 L434	A261-V328 HydrophobicContact CB-CG1 4.35Å; E324-V328 WeakPolarHBondContact O-CG2 3.3Å; E324-V328 PolarHBondContact O-N 3.45Å; I325-V328 PolarHBondContact O-N 3.42Å; V328-G330 VanDerWaalsContact C-N 3.34Å; V328-G330 PolarHBondContact O-N 3.3Å; V328-H331 WeakPolarHBondContact O-CB 3.41Å; V328-H331 PolarHBondContact O-N 3.36Å; V328-H331 VanDerWaalsContact O-N 3.17Å; V328-E332 WeakPolarHBondContact O-CG 3.29Å; V328-E332 PolarHBondContact O-N 3.04Å; V328-A430 HydrophobicContact CG2-CB 3.72Å; V328-L434 HydrophobicContact CG2-CD1 4.04Å
329	L	96	Very high	94.9	Very high	3 Å²	3	24.6 Å²	24.6	2%	0.016	13%	0.13	C	C	.	.	H	α-helix	trans	-66.1	-34.6	175.4	-74.9	174.7	0	0	0	113	I233 M236 I272 L274 I325 L326 A327 H331 E332 L333	I233-L329 HydrophobicContact CB-CD1 4.36Å; I233-L329 HydrophobicContact CD1-CD1 3.55Å; I233-L329 HydrophobicContact CG1-CD1 3.52Å; I233-L329 HydrophobicContact CG2-CD1 3.89Å; M236-L329 HydrophobicContact SD-CB 4.49Å; I272-L329 HydrophobicContact CD1-CD2 4.37Å; I272-L329 HydrophobicContact CG2-CD2 3.64Å; L274-L329 HydrophobicContact CD2-CD1 4.29Å; L274-L329 HydrophobicContact CD2-CD2 3.95Å; L274-L329 HydrophobicContact CD2-CG 4.31Å; I325-L329 HydrophobicContact CG2-CD1 4.12Å; I325-L329 WeakPolarHBondContact O-CB 3.28Å; I325-L329 WeakPolarHBondContact O-CG 3.19Å; I325-L329 PolarHBondContact O-N 3.35Å; L326-L329 PolarHBondContact O-N 2.83Å; A327-L329 VanDerWaalsContact C-N 3.31Å; A327-L329 PolarHBondContact O-N 2.94Å; L329-H331 VanDerWaalsContact C-N 3.28Å; L329-H331 PolarHBondContact O-N 2.94Å; L329-E332 PolarHBondContact O-N 3.16Å; L329-L333 VanDerWaalsContact O-CB 3.28Å; L329-L333 WeakPolarHBondContact O-CB 3.4Å; L329-L333 WeakPolarHBondContact O-CG 3.26Å; L329-L333 PolarHBondContact O-N 3Å
330	G	96.2	Very high	95.3	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-58.3	-42	171.3	0	0	0	0	0	112	L326 A327 V328 G334 F417	L326-G330 PolarHBondContact O-N 3.1Å; A327-G330 PolarHBondContact O-N 3.11Å; V328-G330 VanDerWaalsContact C-N 3.34Å; V328-G330 PolarHBondContact O-N 3.3Å; G330-G334 PolarHBondContact O-N 3.32Å; G330-F417 WeakPolarHBondContact O-CD1 3.34Å
331	H	96.8	Very high	95.2	Very high	8 Å²	8	27.9 Å²	27.9	4%	0.037	15%	0.15	C	C	.	.	H	α-helix	trans	-62.6	-51.4	173	168.1	101.2	0	0	0	111.4	A327 V328 L329 L333 G334 H335 E411 A414 D415 A418 L427 R461	A327-H331 PolarHBondContact O-N 2.62Å; V328-H331 WeakPolarHBondContact O-CB 3.41Å; V328-H331 PolarHBondContact O-N 3.36Å; V328-H331 VanDerWaalsContact O-N 3.17Å; L329-H331 VanDerWaalsContact C-N 3.28Å; L329-H331 PolarHBondContact O-N 2.94Å; H331-L333 VanDerWaalsContact C-N 3.33Å; H331-L333 PolarHBondContact O-N 3.41Å; H331-G334 VanDerWaalsContact O-CA 3.31Å; H331-G334 WeakPolarHBondContact O-CA 3.46Å; H331-G334 PolarHBondContact O-N 3.01Å; H331-H335 AromaticContact CD2-NE2 3.81Å; H331-H335 AromaticContact CE1-NE2 3.66Å; H331-H335 AromaticContact NE2-CD2 3.89Å; H331-H335 AromaticContact NE2-NE2 3.19Å; H331-H335 PolarHBondContact NE2-NE2 3.42Å; H331-H335 VanDerWaalsContact NE2-NE2 3.19Å; H331-H335 PolarHBondContact O-CD2 2.97Å; H331-H335 PolarHBondContact O-N 3Å; H331-E411 IonicContact CE1-OE2 3.3Å; H331-E411 PolarHBondContact CE1-OE2 3.06Å; H331-E411 VanDerWaalsContact CE1-OE2 3.29Å; H331-E411 IonicContact NE2-OE2 2.74Å; H331-E411 PolarHBondContact NE2-OE2 3.46Å; H331-A414 WeakPolarHBondContact ND1-CB 3.49Å; H331-D415 IonicContact CE1-OD1 3.25Å; H331-D415 PolarHBondContact CE1-OD1 2.85Å; H331-D415 IonicContact CG-OD1 2.76Å; H331-D415 IonicContact ND1-OD1 3.98Å; H331-D415 PolarHBondContact ND1-OD1 3.1Å; H331-A418 HydrophobicContact CB-CB 4.34Å; H331-L427 HydrophobicContact CB-CD1 4.39Å; H331-L427 HydrophobicContact CB-CD2 4.32Å; H331-R461 PolarHBondContact CE1-NH2 2.91Å; H331-R461 PolarHBondContact ND1-NH2 2.93Å
332	E	94.8	Very high	95.2	Very high	37 Å²	37	29.3 Å²	29.3	17%	0.173	16%	0.161	C	C	.	.	H	α-helix	trans	-55.9	-46.4	177.6	-70.2	-54.7	136	0	0	112.2	F263 V328 L329 G334 H335 W336	F263-E332 HydrophobicContact CD1-CB 4.11Å; F263-E332 HydrophobicContact CE1-CB 4.46Å; F263-E332 WeakPolarHBondContact CE1-O 3.4Å; V328-E332 WeakPolarHBondContact O-CG 3.29Å; V328-E332 PolarHBondContact O-N 3.04Å; L329-E332 PolarHBondContact O-N 3.16Å; E332-G334 PolarHBondContact O-N 3.33Å; E332-H335 WeakPolarHBondContact O-CB 3.36Å; E332-H335 PolarHBondContact O-N 2.7Å; E332-W336 PolarHBondContact O-N 2.7Å
333	L	94.4	Very high	95.4	Very high	2 Å²	2	31.5 Å²	31.5	1%	0.01	17%	0.168	C	C	.	.	H	α-helix	trans	-65.4	-25.2	176.6	-69.3	173.9	0	0	0	112.7	M236 I240 F242 L329 H331 W336 K337	M236-L333 HydrophobicContact CG-CD1 4.03Å; M236-L333 HydrophobicContact SD-CD1 3.98Å; I240-L333 HydrophobicContact CD1-CB 3.57Å; I240-L333 HydrophobicContact CD1-CD1 3.75Å; I240-L333 HydrophobicContact CD1-CD2 4.11Å; I240-L333 HydrophobicContact CD1-CG 4Å; F242-L333 HydrophobicContact CB-CD2 4.2Å; F242-L333 HydrophobicContact CD1-CD2 3.76Å; F242-L333 HydrophobicContact CD2-CD2 3.65Å; F242-L333 HydrophobicContact CE1-CD2 3.91Å; F242-L333 HydrophobicContact CE2-CD2 3.78Å; F242-L333 HydrophobicContact CG-CD2 3.61Å; F242-L333 HydrophobicContact CZ-CD2 3.89Å; L329-L333 VanDerWaalsContact O-CB 3.28Å; L329-L333 WeakPolarHBondContact O-CB 3.4Å; L329-L333 WeakPolarHBondContact O-CG 3.26Å; L329-L333 PolarHBondContact O-N 3Å; H331-L333 VanDerWaalsContact C-N 3.33Å; H331-L333 PolarHBondContact O-N 3.41Å; L333-W336 PolarHBondContact O-N 3.38Å; L333-K337 WeakPolarHBondContact O-CB 3.4Å; L333-K337 PolarHBondContact O-N 2.76Å
334	G	96.1	Very high	95.4	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-59.7	-42.8	169.2	0	0	0	0	0	112.5	G330 H331 E332 W336 K337 L338	G330-G334 PolarHBondContact O-N 3.32Å; H331-G334 VanDerWaalsContact O-CA 3.31Å; H331-G334 WeakPolarHBondContact O-CA 3.46Å; H331-G334 PolarHBondContact O-N 3.01Å; E332-G334 PolarHBondContact O-N 3.33Å; G334-W336 VanDerWaalsContact C-N 3.27Å; G334-W336 PolarHBondContact O-N 2.89Å; G334-K337 PolarHBondContact O-N 3.08Å; G334-L338 VanDerWaalsContact O-CB 3.3Å; G334-L338 WeakPolarHBondContact O-CB 3.45Å; G334-L338 VanDerWaalsContact O-CG 3.29Å; G334-L338 WeakPolarHBondContact O-CG 3.39Å; G334-L338 PolarHBondContact O-N 2.88Å
335	H	95.8	Very high	95.3	Very high	23 Å²	23	35.7 Å²	35.7	11%	0.106	19%	0.185	C	C	.	.	H	α-helix	trans	-59.9	-39.7	175.2	-70.1	-85.8	0	0	0	112.4	F263 H331 E332 G339 H340 E411 A414	F263-H335 HydrophobicContact CE1-CB 4.3Å; F263-H335 HydrophobicContact CZ-CB 4.41Å; H331-H335 AromaticContact CD2-NE2 3.81Å; H331-H335 AromaticContact CE1-NE2 3.66Å; H331-H335 AromaticContact NE2-CD2 3.89Å; H331-H335 AromaticContact NE2-NE2 3.19Å; H331-H335 PolarHBondContact NE2-NE2 3.42Å; H331-H335 VanDerWaalsContact NE2-NE2 3.19Å; H331-H335 PolarHBondContact O-CD2 2.97Å; H331-H335 PolarHBondContact O-N 3Å; E332-H335 WeakPolarHBondContact O-CB 3.36Å; E332-H335 PolarHBondContact O-N 2.7Å; H335-G339 PolarHBondContact O-N 2.92Å; H335-H340 HydrophobicContact CB-CB 4.2Å; H335-H340 AromaticContact CE1-ND1 3.9Å; H335-H340 AromaticContact CG-ND1 3.72Å; H335-H340 AromaticContact ND1-CG 3.89Å; H335-H340 AromaticContact ND1-ND1 3.1Å; H335-H340 PolarHBondContact ND1-ND1 2.87Å; H335-H340 WeakPolarHBondContact O-CB 3.31Å; H335-H340 PolarHBondContact O-N 3.36Å; H335-E411 IonicContact CE1-OE1 2.76Å; H335-E411 PolarHBondContact CE1-OE1 3.25Å; H335-E411 VanDerWaalsContact CE1-OE1 3.25Å; H335-E411 IonicContact NE2-OE1 3.38Å; H335-E411 PolarHBondContact NE2-OE1 3.23Å; H335-A414 VanDerWaalsContact NE2-CB 3.29Å; H335-A414 WeakPolarHBondContact NE2-CB 3.33Å
336	W	94.3	Very high	95.4	Very high	63 Å²	63	39.2 Å²	39.2	24%	0.239	21%	0.206	C	C	.	.	H	α-helix	trans	-67	-51.6	174.6	173.6	75.9	0	0	0	111.7	I240 S241 F242 F263 E332 L333 G334 L338 G339	I240-W336 HydrophobicContact CD1-CE3 4.27Å; I240-W336 HydrophobicContact CD1-CZ3 4.17Å; I240-W336 HydrophobicContact CG1-CZ3 4.39Å; S241-W336 WeakPolarHBondContact O-CH2 3.39Å; F242-W336 HydrophobicContact CB-CE3 4.36Å; F242-W336 HydrophobicContact CB-CH2 4.25Å; F242-W336 HydrophobicContact CB-CZ3 3.98Å; F242-W336 AromaticContact CD2-CD2 3.44Å; F242-W336 HydrophobicContact CD2-CD2 3.44Å; F242-W336 VanDerWaalsContact CD2-CD2 3.44Å; F242-W336 AromaticContact CD2-CE2 3.72Å; F242-W336 AromaticContact CD2-CE3 3.57Å; F242-W336 HydrophobicContact CD2-CE3 3.57Å; F242-W336 AromaticContact CD2-CG 3.86Å; F242-W336 HydrophobicContact CD2-CG 3.86Å; F242-W336 HydrophobicContact CD2-CH2 4.19Å; F242-W336 HydrophobicContact CD2-CZ2 4.1Å; F242-W336 AromaticContact CD2-CZ3 3.94Å; F242-W336 HydrophobicContact CD2-CZ3 3.94Å; F242-W336 HydrophobicContact CE2-CB 4.22Å; F242-W336 AromaticContact CE2-CD2 3.87Å; F242-W336 HydrophobicContact CE2-CD2 3.87Å; F242-W336 HydrophobicContact CE2-CE3 4.37Å; F242-W336 AromaticContact CE2-CG 3.75Å; F242-W336 HydrophobicContact CE2-CG 3.75Å; F242-W336 HydrophobicContact CG-CE3 4.45Å; F242-W336 HydrophobicContact CG-CZ3 4.49Å; F263-W336 HydrophobicContact CE1-CB 4.37Å; F263-W336 HydrophobicContact CE2-CB 3.85Å; F263-W336 HydrophobicContact CE2-CG 4.43Å; F263-W336 HydrophobicContact CZ-CB 3.64Å; E332-W336 PolarHBondContact O-N 2.7Å; L333-W336 PolarHBondContact O-N 3.38Å; G334-W336 VanDerWaalsContact C-N 3.27Å; G334-W336 PolarHBondContact O-N 2.89Å; W336-L338 VanDerWaalsContact C-N 3.29Å; W336-L338 PolarHBondContact O-N 3.27Å; W336-G339 PolarHBondContact O-N 3.39Å
337	K	94.9	Very high	95.5	Very high	105 Å²	105	41 Å²	41	46%	0.457	22%	0.215	S	C	.	.	H	α-helix	trans	-63.4	-36.1	-173.7	-168.9	66.2	169.8	-169.9	0	112.4	I240 L333 G334 G339 F417	I240-K337 PolarHBondContact O-NZ 3.48Å; L333-K337 WeakPolarHBondContact O-CB 3.4Å; L333-K337 PolarHBondContact O-N 2.76Å; G334-K337 PolarHBondContact O-N 3.08Å; K337-G339 VanDerWaalsContact C-N 3.28Å; K337-F417 HydrophobicContact CB-CE2 3.93Å; K337-F417 HydrophobicContact CB-CZ 3.88Å; K337-F417 HydrophobicContact CG-CE2 3.65Å; K337-F417 HydrophobicContact CG-CZ 3.86Å
338	L	96.6	Very high	95.5	Very high	63 Å²	63	43.5 Å²	43.5	33%	0.33	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	1.9	178.6	-60.6	173	0	0	0	113.4	G334 W336 H340 K343 Q413 F417	G334-L338 VanDerWaalsContact O-CB 3.3Å; G334-L338 WeakPolarHBondContact O-CB 3.45Å; G334-L338 VanDerWaalsContact O-CG 3.29Å; G334-L338 WeakPolarHBondContact O-CG 3.39Å; G334-L338 PolarHBondContact O-N 2.88Å; W336-L338 VanDerWaalsContact C-N 3.29Å; W336-L338 PolarHBondContact O-N 3.27Å; L338-H340 VanDerWaalsContact C-N 3.33Å; L338-H340 WeakPolarHBondContact CB-NE2 3.24Å; L338-H340 PolarHBondContact O-N 3.37Å; L338-K343 PolarHBondContact O-NZ 3.44Å; L338-Q413 HydrophobicContact CD1-CB 3.78Å; L338-F417 HydrophobicContact CD1-CB 4.39Å
339	G	95.6	Very high	95.6	Very high	21 Å²	21	44.5 Å²	44.5	22%	0.216	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	68	26.2	175.5	0	0	0	0	0	114.2	H335 W336 K337 T341 V342 K343	H335-G339 PolarHBondContact O-N 2.92Å; W336-G339 PolarHBondContact O-N 3.39Å; K337-G339 VanDerWaalsContact C-N 3.28Å; G339-T341 VanDerWaalsContact C-N 3.33Å; G339-T341 PolarHBondContact O-N 3.46Å; G339-V342 PolarHBondContact O-N 3.45Å; G339-K343 WeakPolarHBondContact O-CG 3.49Å; G339-K343 PolarHBondContact O-N 3.03Å
340	H	96.2	Very high	95.7	Very high	2 Å²	2	50.5 Å²	50.5	1%	0.009	27%	0.266	C	S	.	.	H	α-helix	trans	-59.7	-43.4	-179.5	-63.2	163.8	0	0	0	111.6	H335 L338 V342 K343 N344 F410 Q413	H335-H340 HydrophobicContact CB-CB 4.2Å; H335-H340 AromaticContact CE1-ND1 3.9Å; H335-H340 AromaticContact CG-ND1 3.72Å; H335-H340 AromaticContact ND1-CG 3.89Å; H335-H340 AromaticContact ND1-ND1 3.1Å; H335-H340 PolarHBondContact ND1-ND1 2.87Å; H335-H340 WeakPolarHBondContact O-CB 3.31Å; H335-H340 PolarHBondContact O-N 3.36Å; L338-H340 VanDerWaalsContact C-N 3.33Å; L338-H340 WeakPolarHBondContact CB-NE2 3.24Å; L338-H340 PolarHBondContact O-N 3.37Å; H340-V342 VanDerWaalsContact C-N 3.33Å; H340-V342 PolarHBondContact O-N 3.24Å; H340-K343 PolarHBondContact O-N 2.91Å; H340-N344 PolarHBondContact O-N 2.91Å; H340-F410 HydrophobicContact CB-CD2 3.75Å; H340-F410 HydrophobicContact CB-CE2 4.03Å; H340-F410 HydrophobicContact CB-CG 4.09Å; H340-F410 AromaticContact CD2-CD1 3.42Å; H340-F410 VanDerWaalsContact CD2-CD1 3.42Å; H340-F410 WeakPolarHBondContact CD2-CD1 3.42Å; H340-F410 AromaticContact CD2-CE1 3.69Å; H340-F410 AromaticContact CD2-CG 3.64Å; H340-F410 AromaticContact CE1-CD1 3.98Å; H340-F410 AromaticContact CE1-CG 3.94Å; H340-F410 PolarHBondContact CE1-O 3.44Å; H340-F410 VanDerWaalsContact CE1-O 3.3Å; H340-F410 AromaticContact CG-CD1 3.89Å; H340-F410 AromaticContact CG-CD2 3.78Å; H340-F410 AromaticContact CG-CG 3.58Å; H340-F410 AromaticContact ND1-CG 3.76Å; H340-F410 AromaticContact NE2-CD1 3.52Å; H340-F410 AromaticContact NE2-CG 3.9Å; H340-Q413 PolarHBondContact NE2-OE1 2.97Å
341	T	91.3	Very high	95.8	Very high	67 Å²	67	52.5 Å²	52.5	41%	0.411	28%	0.276	S	S	.	.	H	α-helix	trans	-59.3	-42.8	175.5	-44.8	0	0	0	0	112	G339 N344 I345	G339-T341 VanDerWaalsContact C-N 3.33Å; G339-T341 PolarHBondContact O-N 3.46Å; T341-N344 PolarHBondContact O-N 2.82Å; T341-I345 HydrophobicContact CG2-CD1 4.23Å; T341-I345 VanDerWaalsContact O-CG1 3.32Å; T341-I345 WeakPolarHBondContact O-CG1 3.46Å; T341-I345 PolarHBondContact O-N 3.19Å
342	V	92.9	Very high	95.8	Very high	94 Å²	94	53.2 Å²	53.2	57%	0.57	28%	0.283	S	S	*	.	H	α-helix	trans	-67.5	-42.9	179.2	178.8	0	0	0	0	110.8	G339 H340 N344 I345 V346	G339-V342 PolarHBondContact O-N 3.45Å; H340-V342 VanDerWaalsContact C-N 3.33Å; H340-V342 PolarHBondContact O-N 3.24Å; V342-N344 VanDerWaalsContact C-N 3.34Å; V342-N344 PolarHBondContact O-N 3.01Å; V342-I345 PolarHBondContact O-N 3.29Å; V342-V346 HydrophobicContact CG1-CG2 4.43Å; V342-V346 WeakPolarHBondContact O-CG2 3.42Å; V342-V346 PolarHBondContact O-N 3.02Å
343	K	97	Very high	96	Very high	89 Å²	89	55.4 Å²	55.4	39%	0.387	29%	0.292	S	S	.	.	H	α-helix	trans	-57.7	-46.1	174.7	-70	165.9	-177	155.7	0	111.2	L338 G339 H340 I345 V346 I347 F410	L338-K343 PolarHBondContact O-NZ 3.44Å; G339-K343 WeakPolarHBondContact O-CG 3.49Å; G339-K343 PolarHBondContact O-N 3.03Å; H340-K343 PolarHBondContact O-N 2.91Å; K343-I345 PolarHBondContact O-N 3.39Å; K343-V346 PolarHBondContact O-N 2.71Å; K343-I347 WeakPolarHBondContact O-CB 3.43Å; K343-I347 WeakPolarHBondContact O-CD1 3.3Å; K343-I347 VanDerWaalsContact O-CG1 3.23Å; K343-I347 WeakPolarHBondContact O-CG1 3.37Å; K343-I347 PolarHBondContact O-N 3.02Å; K343-F410 HydrophobicContact CB-CE2 4.45Å; K343-F410 HydrophobicContact CB-CZ 4.03Å; K343-F410 HydrophobicContact CD-CE1 4Å; K343-F410 HydrophobicContact CD-CZ 3.69Å
344	N	95.4	Very high	96.2	Very high	77 Å²	77	58.8 Å²	58.8	41%	0.412	31%	0.309	S	S	.	.	H	α-helix	trans	-62.9	-39.5	176.9	-75.1	-13.2	0	0	0	112.6	H340 T341 V342 S348	H340-N344 PolarHBondContact O-N 2.91Å; T341-N344 PolarHBondContact O-N 2.82Å; V342-N344 VanDerWaalsContact C-N 3.34Å; V342-N344 PolarHBondContact O-N 3.01Å; N344-S348 WeakPolarHBondContact O-CB 3.29Å; N344-S348 PolarHBondContact O-N 3.5Å; N344-S348 PolarHBondContact O-OG 3.44Å
345	I	93.8	Very high	96.3	Very high	60 Å²	60	59 Å²	59	31%	0.308	31%	0.311	S	S	.	.	H	α-helix	trans	-63.1	-48.6	174.5	-69	165.9	0	0	0	110.1	F266 T341 V342 K343 I347 S348 Q349	F266-I345 HydrophobicContact CE1-CD1 4.28Å; T341-I345 HydrophobicContact CG2-CD1 4.23Å; T341-I345 VanDerWaalsContact O-CG1 3.32Å; T341-I345 WeakPolarHBondContact O-CG1 3.46Å; T341-I345 PolarHBondContact O-N 3.19Å; V342-I345 PolarHBondContact O-N 3.29Å; K343-I345 PolarHBondContact O-N 3.39Å; I345-I347 PolarHBondContact O-N 2.99Å; I345-S348 WeakPolarHBondContact CA-OG 3.39Å; I345-S348 PolarHBondContact O-N 2.91Å; I345-S348 PolarHBondContact O-OG 3.07Å; I345-Q349 HydrophobicContact CG2-CG 4.36Å; I345-Q349 WeakPolarHBondContact O-CG 3.3Å; I345-Q349 PolarHBondContact O-N 2.92Å
346	V	96.6	Very high	96.4	Very high	76 Å²	76	58.5 Å²	58.5	46%	0.461	31%	0.308	S	S	.	.	H	α-helix	trans	-60.9	-47.4	179.6	172.7	0	0	0	0	111.4	V342 K343 S348 Q349 M350	V342-V346 HydrophobicContact CG1-CG2 4.43Å; V342-V346 WeakPolarHBondContact O-CG2 3.42Å; V342-V346 PolarHBondContact O-N 3.02Å; K343-V346 PolarHBondContact O-N 2.71Å; V346-S348 VanDerWaalsContact C-N 3.35Å; V346-S348 PolarHBondContact O-N 2.98Å; V346-Q349 PolarHBondContact O-N 2.84Å; V346-M350 HydrophobicContact CG1-CG 4.32Å; V346-M350 HydrophobicContact CG1-SD 3.87Å; V346-M350 VanDerWaalsContact O-CG 3.32Å; V346-M350 WeakPolarHBondContact O-CG 3.46Å; V346-M350 PolarHBondContact O-N 3.06Å
347	I	97.9	Very high	96.6	Very high	56 Å²	56	56.8 Å²	56.8	29%	0.287	31%	0.306	S	S	.	.	H	α-helix	trans	-59.9	-45.8	178.3	-67.1	163.8	0	0	0	110.8	K343 I345 Q349 M350 N351 L403 L406	K343-I347 WeakPolarHBondContact O-CB 3.43Å; K343-I347 WeakPolarHBondContact O-CD1 3.3Å; K343-I347 VanDerWaalsContact O-CG1 3.23Å; K343-I347 WeakPolarHBondContact O-CG1 3.37Å; K343-I347 PolarHBondContact O-N 3.02Å; I345-I347 PolarHBondContact O-N 2.99Å; I347-Q349 PolarHBondContact O-N 3.34Å; I347-M350 PolarHBondContact O-N 2.92Å; I347-N351 WeakPolarHBondContact O-CB 3.23Å; I347-N351 PolarHBondContact O-N 3.2Å; I347-L403 HydrophobicContact CG2-CD2 3.9Å; I347-L406 HydrophobicContact CD1-CD2 3.48Å; I347-L406 VanDerWaalsContact CD1-CD2 3.48Å
348	S	96.8	Very high	96.8	Very high	52 Å²	52	55.1 Å²	55.1	36%	0.364	30%	0.302	S	S	.	.	H	α-helix	trans	-64.4	-37.9	179.4	62.4	0	0	0	0	112.7	N344 I345 V346 S352	N344-S348 WeakPolarHBondContact O-CB 3.29Å; N344-S348 PolarHBondContact O-N 3.5Å; N344-S348 PolarHBondContact O-OG 3.44Å; I345-S348 WeakPolarHBondContact CA-OG 3.39Å; I345-S348 PolarHBondContact O-N 2.91Å; I345-S348 PolarHBondContact O-OG 3.07Å; V346-S348 VanDerWaalsContact C-N 3.35Å; V346-S348 PolarHBondContact O-N 2.98Å; S348-S352 VanDerWaalsContact O-CB 3.3Å; S348-S352 WeakPolarHBondContact O-CB 3.34Å; S348-S352 PolarHBondContact O-N 3.3Å
349	Q	97.5	Very high	96.8	Very high	36 Å²	36	52.1 Å²	52.1	17%	0.168	29%	0.286	C	S	.	.	H	α-helix	trans	-72.4	-37.4	176.9	-64.6	-47.3	-58.1	0	0	112.9	W196 L200 I345 V346 I347 S352 F353	W196-Q349 PolarHBondContact NE1-O 2.85Å; L200-Q349 VanDerWaalsContact CB-OE1 3.32Å; L200-Q349 HydrophobicContact CD1-CG 4.21Å; I345-Q349 HydrophobicContact CG2-CG 4.36Å; I345-Q349 WeakPolarHBondContact O-CG 3.3Å; I345-Q349 PolarHBondContact O-N 2.92Å; V346-Q349 PolarHBondContact O-N 2.84Å; I347-Q349 PolarHBondContact O-N 3.34Å; Q349-S352 PolarHBondContact O-N 3.01Å; Q349-F353 WeakPolarHBondContact O-CB 3.4Å; Q349-F353 PolarHBondContact O-N 2.94Å
350	M	98.1	Very high	96.9	Very high	129 Å²	129	52.4 Å²	52.4	64%	0.635	29%	0.286	S	S	*	.	H	α-helix	trans	-64.1	-44.8	173.4	-71.8	179.1	71.1	0	0	111.5	V346 I347 F353 L354	V346-M350 HydrophobicContact CG1-CG 4.32Å; V346-M350 HydrophobicContact CG1-SD 3.87Å; V346-M350 VanDerWaalsContact O-CG 3.32Å; V346-M350 WeakPolarHBondContact O-CG 3.46Å; V346-M350 PolarHBondContact O-N 3.06Å; I347-M350 PolarHBondContact O-N 2.92Å; M350-F353 PolarHBondContact O-N 3.36Å; M350-L354 WeakPolarHBondContact O-CB 3.47Å; M350-L354 PolarHBondContact O-N 3.4Å
351	N	98.3	Very high	97	Very high	42 Å²	42	56.9 Å²	56.9	23%	0.225	31%	0.314	C	S	.	.	H	α-helix	trans	-58.9	-49.7	173	170.6	55.5	0	0	0	111.4	I347 F353 L354 C355 Y395 L399	I347-N351 WeakPolarHBondContact O-CB 3.23Å; I347-N351 PolarHBondContact O-N 3.2Å; N351-F353 VanDerWaalsContact C-N 3.33Å; N351-F353 PolarHBondContact O-N 2.87Å; N351-L354 WeakPolarHBondContact O-CB 3.5Å; N351-L354 PolarHBondContact O-N 3.37Å; N351-L354 VanDerWaalsContact O-N 3.17Å; N351-C355 PolarHBondContact O-N 2.88Å; N351-C355 PolarHBondContact O-SG 3.33Å; N351-C355 VanDerWaalsContact O-SG 3.38Å; N351-Y395 VanDerWaalsContact OD1-CE1 3.29Å; N351-Y395 WeakPolarHBondContact OD1-CE1 3.32Å; N351-Y395 PolarHBondContact OD1-OH 3.34Å; N351-L399 HydrophobicContact CB-CD2 4.32Å; N351-L399 WeakPolarHBondContact OD1-CD2 3.33Å
352	S	98.1	Very high	97.3	Very high	24 Å²	24	55.8 Å²	55.8	17%	0.168	31%	0.305	C	S	.	.	H	α-helix	trans	-57.9	-44.6	178.7	179.9	0	0	0	0	112	S348 Q349 C355 F356	S348-S352 VanDerWaalsContact O-CB 3.3Å; S348-S352 WeakPolarHBondContact O-CB 3.34Å; S348-S352 PolarHBondContact O-N 3.3Å; Q349-S352 PolarHBondContact O-N 3.01Å; S352-C355 PolarHBondContact O-N 3.22Å; S352-F356 VanDerWaalsContact O-CD2 3.29Å; S352-F356 WeakPolarHBondContact O-CD2 3.39Å; S352-F356 PolarHBondContact O-N 2.95Å
353	F	98.5	Very high	97.4	Very high	82 Å²	82	52.9 Å²	52.9	36%	0.36	29%	0.286	S	S	.	.	H	α-helix	trans	-61.1	-45.3	176	-177.5	-94.1	0	0	0	112	F192 W196 Q349 M350 N351 F356 S357	F192-F353 HydrophobicContact CE2-CE2 4.42Å; F192-F353 HydrophobicContact CE2-CZ 4.23Å; W196-F353 HydrophobicContact CB-CD2 4.45Å; W196-F353 HydrophobicContact CD2-CB 4.39Å; W196-F353 AromaticContact CD2-CD2 3.74Å; W196-F353 HydrophobicContact CD2-CD2 3.74Å; W196-F353 AromaticContact CE3-CD2 3.99Å; W196-F353 HydrophobicContact CE3-CD2 3.99Å; W196-F353 HydrophobicContact CE3-CE2 4.49Å; W196-F353 HydrophobicContact CG-CB 4.19Å; W196-F353 AromaticContact CG-CD2 3.93Å; W196-F353 HydrophobicContact CG-CD2 3.93Å; Q349-F353 WeakPolarHBondContact O-CB 3.4Å; Q349-F353 PolarHBondContact O-N 2.94Å; M350-F353 PolarHBondContact O-N 3.36Å; N351-F353 VanDerWaalsContact C-N 3.33Å; N351-F353 PolarHBondContact O-N 2.87Å; F353-F356 PolarHBondContact O-N 3.47Å; F353-S357 WeakPolarHBondContact O-CB 3.45Å; F353-S357 PolarHBondContact O-N 2.81Å; F353-S357 PolarHBondContact O-OG 3.09Å
354	L	98.3	Very high	97.3	Very high	74 Å²	74	51.5 Å²	51.5	39%	0.387	30%	0.297	S	S	.	.	H	α-helix	trans	-59.6	-48	176.3	176.2	63.2	0	0	0	111.2	M350 N351 F356 S357 L358 Y395	M350-L354 WeakPolarHBondContact O-CB 3.47Å; M350-L354 PolarHBondContact O-N 3.4Å; N351-L354 WeakPolarHBondContact O-CB 3.5Å; N351-L354 PolarHBondContact O-N 3.37Å; N351-L354 VanDerWaalsContact O-N 3.17Å; L354-F356 PolarHBondContact O-N 2.86Å; L354-S357 PolarHBondContact O-N 3.44Å; L354-L358 HydrophobicContact CD1-CD1 4.01Å; L354-L358 HydrophobicContact CD1-CG 4.12Å; L354-L358 HydrophobicContact CG-CD1 4.08Å; L354-L358 WeakPolarHBondContact O-CG 3.46Å; L354-L358 PolarHBondContact O-N 3.13Å; L354-Y395 HydrophobicContact CD2-CE2 4.37Å
355	C	98.4	Very high	97.4	Very high	5 Å²	5	54.7 Å²	54.7	3%	0.034	30%	0.303	C	S	.	.	H	α-helix	trans	-61.8	-44.7	179.6	-71	0	0	0	0	112.2	N351 S352 S357 L358 F359 F388 F392	N351-C355 PolarHBondContact O-N 2.88Å; N351-C355 PolarHBondContact O-SG 3.33Å; N351-C355 VanDerWaalsContact O-SG 3.38Å; S352-C355 PolarHBondContact O-N 3.22Å; C355-S357 VanDerWaalsContact C-N 3.34Å; C355-L358 PolarHBondContact O-N 2.84Å; C355-F359 VanDerWaalsContact O-CB 3.23Å; C355-F359 WeakPolarHBondContact O-CB 3.32Å; C355-F359 PolarHBondContact O-N 2.89Å; C355-F388 HydrophobicContact CB-CD1 4.44Å; C355-F388 HydrophobicContact CB-CE1 3.71Å; C355-F388 HydrophobicContact CB-CZ 4Å; C355-F392 HydrophobicContact CB-CD2 4.42Å; C355-F392 HydrophobicContact CB-CE2 3.96Å
356	F	98.5	Very high	97.5	Very high	11 Å²	11	55.2 Å²	55.2	5%	0.048	31%	0.309	C	S	.	.	H	α-helix	trans	-66	-36.7	175.8	-83.3	-62	0	0	0	112.6	L180 F192 A195 W196 T199 S352 F353 L354 F359 A360 L384 F388	L180-F356 HydrophobicContact CD1-CZ 4.44Å; F192-F356 HydrophobicContact CB-CB 4.12Å; F192-F356 VanDerWaalsContact CB-O 3.29Å; F192-F356 WeakPolarHBondContact CB-O 3.47Å; A195-F356 HydrophobicContact CB-CD1 4.02Å; A195-F356 HydrophobicContact CB-CE1 3.97Å; A195-F356 HydrophobicContact CB-CZ 4.43Å; W196-F356 HydrophobicContact CB-CB 4.47Å; W196-F356 HydrophobicContact CB-CD2 3.93Å; W196-F356 HydrophobicContact CB-CG 4.46Å; T199-F356 HydrophobicContact CG2-CE2 3.89Å; T199-F356 HydrophobicContact CG2-CZ 3.77Å; T199-F356 WeakPolarHBondContact OG1-CE2 3.49Å; S352-F356 VanDerWaalsContact O-CD2 3.29Å; S352-F356 WeakPolarHBondContact O-CD2 3.39Å; S352-F356 PolarHBondContact O-N 2.95Å; F353-F356 PolarHBondContact O-N 3.47Å; L354-F356 PolarHBondContact O-N 2.86Å; F356-F359 WeakPolarHBondContact O-CB 3.44Å; F356-F359 PolarHBondContact O-N 2.84Å; F356-A360 PolarHBondContact O-N 2.86Å; F356-L384 HydrophobicContact CE1-CD2 4.4Å; F356-F388 HydrophobicContact CD1-CZ 4.03Å; F356-F388 HydrophobicContact CE1-CZ 4.06Å; F356-F388 HydrophobicContact CG-CZ 4.41Å; F356-F388 HydrophobicContact CZ-CZ 4.49Å
357	S	98.1	Very high	97.6	Very high	27 Å²	27	55 Å²	55	19%	0.189	30%	0.303	C	S	.	.	H	α-helix	trans	-64.7	-46.1	175.7	-57.8	0	0	0	0	111.4	F192 F353 L354 C355 F359 A360 V361	F192-S357 WeakPolarHBondContact CD2-OG 3.19Å; F353-S357 WeakPolarHBondContact O-CB 3.45Å; F353-S357 PolarHBondContact O-N 2.81Å; F353-S357 PolarHBondContact O-OG 3.09Å; L354-S357 PolarHBondContact O-N 3.44Å; C355-S357 VanDerWaalsContact C-N 3.34Å; S357-F359 VanDerWaalsContact C-N 3.33Å; S357-A360 PolarHBondContact O-N 2.92Å; S357-V361 PolarHBondContact O-N 3.3Å
358	L	98.1	Very high	97.6	Very high	70 Å²	70	53 Å²	53	37%	0.366	29%	0.293	S	S	.	.	H	α-helix	trans	-67	-35.4	175.7	-71.5	175.8	0	0	0	111.9	L354 C355 A360 V361 L362 F392	L354-L358 HydrophobicContact CD1-CD1 4.01Å; L354-L358 HydrophobicContact CD1-CG 4.12Å; L354-L358 HydrophobicContact CG-CD1 4.08Å; L354-L358 WeakPolarHBondContact O-CG 3.46Å; L354-L358 PolarHBondContact O-N 3.13Å; C355-L358 PolarHBondContact O-N 2.84Å; L358-A360 VanDerWaalsContact C-N 3.34Å; L358-A360 PolarHBondContact O-N 2.93Å; L358-V361 PolarHBondContact O-N 3.29Å; L358-L362 WeakPolarHBondContact O-CB 3.4Å; L358-L362 VanDerWaalsContact O-CG 3.28Å; L358-L362 WeakPolarHBondContact O-CG 3.43Å; L358-L362 PolarHBondContact O-N 3.43Å; L358-F392 HydrophobicContact CB-CE1 4.07Å; L358-F392 HydrophobicContact CB-CE2 4.38Å; L358-F392 HydrophobicContact CB-CZ 3.47Å; L358-F392 VanDerWaalsContact CB-CZ 3.47Å; L358-F392 HydrophobicContact CD1-CE1 4.3Å; L358-F392 HydrophobicContact CD1-CZ 4.18Å; L358-F392 HydrophobicContact CG-CZ 4.49Å
359	F	98.1	Very high	97.6	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-59.1	-44	172.6	173	-101.3	0	0	0	111.9	I184 F191 C355 F356 S357 V361 L362 I363 L384 I387 F388	I184-F359 HydrophobicContact CD1-CE1 4.39Å; I184-F359 HydrophobicContact CG2-CE1 4.21Å; F191-F359 AromaticContact CE2-CD1 3.63Å; F191-F359 HydrophobicContact CE2-CD1 3.63Å; F191-F359 AromaticContact CE2-CE1 3.55Å; F191-F359 HydrophobicContact CE2-CE1 3.55Å; F191-F359 AromaticContact CZ-CD1 3.74Å; F191-F359 HydrophobicContact CZ-CD1 3.74Å; F191-F359 AromaticContact CZ-CE1 3.68Å; F191-F359 HydrophobicContact CZ-CE1 3.68Å; C355-F359 VanDerWaalsContact O-CB 3.23Å; C355-F359 WeakPolarHBondContact O-CB 3.32Å; C355-F359 PolarHBondContact O-N 2.89Å; F356-F359 WeakPolarHBondContact O-CB 3.44Å; F356-F359 PolarHBondContact O-N 2.84Å; S357-F359 VanDerWaalsContact C-N 3.33Å; F359-V361 VanDerWaalsContact C-N 3.26Å; F359-V361 PolarHBondContact O-N 3.37Å; F359-L362 PolarHBondContact O-N 3.31Å; F359-L362 VanDerWaalsContact O-N 3.11Å; F359-I363 HydrophobicContact CE1-CB 4.3Å; F359-I363 HydrophobicContact CE1-CG1 4.25Å; F359-I363 HydrophobicContact CE2-CB 4.12Å; F359-I363 HydrophobicContact CE2-CD1 3.6Å; F359-I363 HydrophobicContact CE2-CG1 4.05Å; F359-I363 HydrophobicContact CZ-CB 4.01Å; F359-I363 HydrophobicContact CZ-CD1 3.57Å; F359-I363 HydrophobicContact CZ-CG1 3.68Å; F359-I363 WeakPolarHBondContact O-CB 3.36Å; F359-I363 WeakPolarHBondContact O-CG2 3.37Å; F359-I363 PolarHBondContact O-N 2.88Å; F359-L384 HydrophobicContact CD1-CD2 4.21Å; F359-L384 HydrophobicContact CD2-CD2 3.99Å; F359-L384 HydrophobicContact CE1-CD2 3.86Å; F359-L384 HydrophobicContact CE1-CG 4.43Å; F359-L384 HydrophobicContact CE2-CB 4.35Å; F359-L384 HydrophobicContact CE2-CD2 3.62Å; F359-L384 HydrophobicContact CE2-CG 3.89Å; F359-L384 HydrophobicContact CG-CD2 4.28Å; F359-L384 HydrophobicContact CZ-CD2 3.55Å; F359-L384 HydrophobicContact CZ-CG 3.74Å; F359-I387 HydrophobicContact CB-CG2 4.49Å; F359-I387 HydrophobicContact CD2-CB 4.03Å; F359-I387 HydrophobicContact CD2-CD1 3.51Å; F359-I387 HydrophobicContact CD2-CG1 4.35Å; F359-I387 HydrophobicContact CD2-CG2 4.08Å; F359-I387 HydrophobicContact CE2-CD1 3.75Å; F359-F388 HydrophobicContact CB-CE2 3.69Å; F359-F388 HydrophobicContact CB-CZ 4.31Å; F359-F388 HydrophobicContact CD2-CD2 4.22Å; F359-F388 AromaticContact CD2-CE2 3.77Å; F359-F388 HydrophobicContact CD2-CE2 3.77Å; F359-F388 AromaticContact CG-CE2 3.81Å; F359-F388 HydrophobicContact CG-CE2 3.81Å
360	A	97.6	Very high	97.6	Very high	27 Å²	27	51.4 Å²	51.4	22%	0.223	28%	0.283	C	S	.	.	H	α-helix	trans	-60.2	-35.6	175.2	0	0	0	0	0	113.2	F191 F192 F356 S357 L358	F191-A360 HydrophobicContact CE1-CB 3.92Å; F191-A360 HydrophobicContact CE2-CB 4.49Å; F191-A360 HydrophobicContact CZ-CB 3.74Å; F192-A360 HydrophobicContact CB-CB 3.96Å; F192-A360 HydrophobicContact CD1-CB 3.7Å; F192-A360 HydrophobicContact CG-CB 4.05Å; F356-A360 PolarHBondContact O-N 2.86Å; S357-A360 PolarHBondContact O-N 2.92Å; L358-A360 VanDerWaalsContact C-N 3.34Å; L358-A360 PolarHBondContact O-N 2.93Å
361	V	97.4	Very high	97.6	Very high	97 Å²	97	45.8 Å²	45.8	59%	0.588	26%	0.257	S	S	*	.	H	α-helix	trans	-69.7	-34.6	175.7	175.9	0	0	0	0	112	S357 L358 F359	S357-V361 PolarHBondContact O-N 3.3Å; L358-V361 PolarHBondContact O-N 3.29Å; F359-V361 VanDerWaalsContact C-N 3.26Å; F359-V361 PolarHBondContact O-N 3.37Å
362	L	97.5	Very high	97.6	Very high	43 Å²	43	44.4 Å²	44.4	23%	0.225	25%	0.249	C	C	.	.	H	α-helix	trans	-94.8	-28	-170.3	-68.2	173.5	0	0	0	114.1	L358 F359 G364 R365 L368 I387 I391 F392	L358-L362 WeakPolarHBondContact O-CB 3.4Å; L358-L362 VanDerWaalsContact O-CG 3.28Å; L358-L362 WeakPolarHBondContact O-CG 3.43Å; L358-L362 PolarHBondContact O-N 3.43Å; F359-L362 PolarHBondContact O-N 3.31Å; F359-L362 VanDerWaalsContact O-N 3.11Å; L362-G364 PolarHBondContact O-N 3.21Å; L362-G364 VanDerWaalsContact O-N 3.09Å; L362-R365 WeakPolarHBondContact O-CB 3.32Å; L362-R365 WeakPolarHBondContact O-CG 3.38Å; L362-R365 PolarHBondContact O-N 3.25Å; L362-L368 HydrophobicContact CB-CD1 4.01Å; L362-L368 WeakPolarHBondContact O-CD1 3.24Å; L362-I387 HydrophobicContact CB-CD1 3.76Å; L362-I387 HydrophobicContact CB-CG1 4.28Å; L362-I387 HydrophobicContact CD1-CG2 4.03Å; L362-I391 HydrophobicContact CD1-CG2 4.25Å; L362-F392 HydrophobicContact CD1-CE1 3.69Å; L362-F392 HydrophobicContact CD1-CZ 4.19Å
363	I	96.1	Very high	97.5	Very high	34 Å²	34	45.2 Å²	45.2	17%	0.174	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-25.3	-171.5	-169.6	56.1	0	0	0	113.9	F191 F359 R365 F369 I387	F191-I363 HydrophobicContact CE1-CG2 4.3Å; F191-I363 HydrophobicContact CZ-CG2 4.11Å; F359-I363 HydrophobicContact CE1-CB 4.3Å; F359-I363 HydrophobicContact CE1-CG1 4.25Å; F359-I363 HydrophobicContact CE2-CB 4.12Å; F359-I363 HydrophobicContact CE2-CD1 3.6Å; F359-I363 HydrophobicContact CE2-CG1 4.05Å; F359-I363 HydrophobicContact CZ-CB 4.01Å; F359-I363 HydrophobicContact CZ-CD1 3.57Å; F359-I363 HydrophobicContact CZ-CG1 3.68Å; F359-I363 WeakPolarHBondContact O-CB 3.36Å; F359-I363 WeakPolarHBondContact O-CG2 3.37Å; F359-I363 PolarHBondContact O-N 2.88Å; I363-R365 VanDerWaalsContact C-N 3.3Å; I363-R365 PolarHBondContact O-N 3.46Å; I363-F369 HydrophobicContact CD1-CE2 4Å; I363-F369 HydrophobicContact CD1-CZ 3.63Å; I363-I387 HydrophobicContact CB-CD1 4.33Å; I363-I387 HydrophobicContact CD1-CD1 4.23Å
364	G	94.9	Very high	97.5	Very high	59 Å²	59	41.7 Å²	41.7	61%	0.608	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-7.2	176.1	0	0	0	0	0	115.1	L362 T366	L362-G364 PolarHBondContact O-N 3.21Å; L362-G364 VanDerWaalsContact O-N 3.09Å; G364-T366 PolarHBondContact O-N 3.28Å
365	R	96.9	Very high	97.2	Very high	144 Å²	144	42.9 Å²	42.9	54%	0.543	26%	0.256	S	S	.	.			trans	-82.3	102.9	-178	-60.3	-60.3	179.2	-159.1	-2.7	110.7	L362 I363 E367 L368	L362-R365 WeakPolarHBondContact O-CB 3.32Å; L362-R365 WeakPolarHBondContact O-CG 3.38Å; L362-R365 PolarHBondContact O-N 3.25Å; I363-R365 VanDerWaalsContact C-N 3.3Å; I363-R365 PolarHBondContact O-N 3.46Å; R365-E367 WeakPolarHBondContact CA-OE2 3.22Å; R365-E367 WeakPolarHBondContact CB-OE2 3.4Å; R365-E367 PolarHBondContact O-N 2.96Å; R365-L368 HydrophobicContact CB-CD1 3.93Å; R365-L368 HydrophobicContact CB-CG 3.91Å; R365-L368 WeakPolarHBondContact O-CB 3.35Å; R365-L368 PolarHBondContact O-N 3.01Å
366	T	96.7	Very high	96.9	Very high	71 Å²	71	51.5 Å²	51.5	44%	0.436	30%	0.296	S	S	.	.	H	α-helix	trans	-59.6	-31	179.7	48.1	0	0	0	0	112.4	G364 L368 F369 V370 Q378	G364-T366 PolarHBondContact O-N 3.28Å; T366-L368 PolarHBondContact O-N 2.79Å; T366-F369 PolarHBondContact O-N 2.93Å; T366-V370 WeakPolarHBondContact O-CG2 3.33Å; T366-V370 PolarHBondContact O-N 3.46Å; T366-Q378 VanDerWaalsContact CG2-NE2 3.28Å
367	E	97.1	Very high	96.6	Very high	71 Å²	71	53.3 Å²	53.3	33%	0.332	31%	0.31	S	S	.	.	H	α-helix	trans	-61	-32.5	-179.1	-50.7	84.3	173.9	0	0	111.8	V10 I14 R365 F369 A371	V10-E367 HydrophobicContact CG1-CB 4.34Å; I14-E367 HydrophobicContact CD1-CB 4.14Å; R365-E367 WeakPolarHBondContact CA-OE2 3.22Å; R365-E367 WeakPolarHBondContact CB-OE2 3.4Å; R365-E367 PolarHBondContact O-N 2.96Å; E367-F369 VanDerWaalsContact C-N 3.34Å; E367-F369 PolarHBondContact O-N 3.5Å; E367-A371 WeakPolarHBondContact O-CB 3.49Å; E367-A371 PolarHBondContact O-N 2.97Å
368	L	97.7	Very high	96.5	Very high	15 Å²	15	56.5 Å²	56.5	8%	0.079	32%	0.322	C	S	.	.	H	α-helix	trans	-65.4	-37	176.1	-63.2	179.6	0	0	0	111.8	I14 L362 R365 T366 F372 I386 I387 I391	I14-L368 HydrophobicContact CD1-CD2 4.01Å; I14-L368 HydrophobicContact CG2-CD2 4.36Å; L362-L368 HydrophobicContact CB-CD1 4.01Å; L362-L368 WeakPolarHBondContact O-CD1 3.24Å; R365-L368 HydrophobicContact CB-CD1 3.93Å; R365-L368 HydrophobicContact CB-CG 3.91Å; R365-L368 WeakPolarHBondContact O-CB 3.35Å; R365-L368 PolarHBondContact O-N 3.01Å; T366-L368 PolarHBondContact O-N 2.79Å; L368-F372 WeakPolarHBondContact O-CD2 3.49Å; L368-I386 HydrophobicContact CB-CG2 4.46Å; L368-I387 HydrophobicContact CD1-CD1 4.27Å; L368-I387 HydrophobicContact CD1-CG1 4.08Å; L368-I391 HydrophobicContact CD2-CD1 3.71Å; L368-I391 HydrophobicContact CD2-CG1 4.02Å
369	F	98.4	Very high	96.5	Very high	3 Å²	3	53.2 Å²	53.2	1%	0.013	31%	0.305	C	S	.	.	H	α-helix	trans	-77	-43.9	179	-73.2	-94.2	0	0	0	111.5	I363 T366 E367 A371 F372 G373 F374 Q378 I382 G383 I386	I363-F369 HydrophobicContact CD1-CE2 4Å; I363-F369 HydrophobicContact CD1-CZ 3.63Å; T366-F369 PolarHBondContact O-N 2.93Å; E367-F369 VanDerWaalsContact C-N 3.34Å; E367-F369 PolarHBondContact O-N 3.5Å; F369-A371 VanDerWaalsContact C-N 3.26Å; F369-A371 PolarHBondContact O-N 2.87Å; F369-F372 CarbonylContact O-C 3.58Å; F369-F372 PolarHBondContact O-N 3.26Å; F369-G373 PolarHBondContact O-N 3.06Å; F369-F374 CarbonylContact C-O 3.22Å; F369-F374 HydrophobicContact CB-CB 3.92Å; F369-F374 HydrophobicContact CD1-CB 4.24Å; F369-F374 WeakPolarHBondContact O-CB 3.31Å; F369-F374 PolarHBondContact O-N 3.26Å; F369-Q378 HydrophobicContact CB-CG 4.42Å; F369-Q378 HydrophobicContact CD1-CB 4.08Å; F369-Q378 HydrophobicContact CD1-CG 4.28Å; F369-Q378 HydrophobicContact CD2-CB 4.25Å; F369-Q378 HydrophobicContact CD2-CG 3.99Å; F369-Q378 HydrophobicContact CE1-CB 3.9Å; F369-Q378 HydrophobicContact CE2-CB 4.07Å; F369-Q378 HydrophobicContact CE2-CG 4.26Å; F369-Q378 HydrophobicContact CG-CB 4.23Å; F369-Q378 HydrophobicContact CG-CG 3.98Å; F369-Q378 HydrophobicContact CZ-CB 3.87Å; F369-I382 HydrophobicContact CD1-CG2 4.35Å; F369-I382 HydrophobicContact CE1-CB 4.5Å; F369-I382 HydrophobicContact CE1-CG2 4.38Å; F369-G383 VanDerWaalsContact CZ-CA 3.45Å; F369-I386 HydrophobicContact CD1-CD1 4.35Å
370	V	97.8	Very high	96.4	Very high	51 Å²	51	54 Å²	54	31%	0.309	31%	0.31	S	S	.	.	H	α-helix	trans	-59.3	-39.4	178.4	173.8	0	0	0	0	110.9	E11 T366 F372 G373 F374 T375	E11-V370 HydrophobicContact CB-CB 4.31Å; E11-V370 HydrophobicContact CB-CG1 3.93Å; E11-V370 HydrophobicContact CG-CG1 3.91Å; T366-V370 WeakPolarHBondContact O-CG2 3.33Å; T366-V370 PolarHBondContact O-N 3.46Å; V370-F372 PolarHBondContact O-N 2.97Å; V370-F372 VanDerWaalsContact O-N 3.09Å; V370-G373 PolarHBondContact O-N 3.03Å; V370-F374 PolarHBondContact N-O 3.03Å; V370-T375 HydrophobicContact CG1-CG2 4.28Å; V370-T375 HydrophobicContact CG2-CG2 4.48Å
371	A	97.4	Very high	96.5	Very high	12 Å²	12	53.5 Å²	53.5	10%	0.099	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-30	176.2	0	0	0	0	0	113.5	E11 I14 F15 E367 F369	E11-A371 HydrophobicContact CB-CB 4.19Å; E11-A371 VanDerWaalsContact O-CB 3.28Å; E11-A371 WeakPolarHBondContact O-CB 3.48Å; I14-A371 HydrophobicContact CB-CB 4.04Å; I14-A371 HydrophobicContact CG2-CB 3.86Å; F15-A371 HydrophobicContact CB-CB 4.41Å; F15-A371 WeakPolarHBondContact CD2-O 3.35Å; E367-A371 WeakPolarHBondContact O-CB 3.49Å; E367-A371 PolarHBondContact O-N 2.97Å; F369-A371 VanDerWaalsContact C-N 3.26Å; F369-A371 PolarHBondContact O-N 2.87Å
372	F	97.6	Very high	96.5	Very high	13 Å²	13	48.9 Å²	48.9	6%	0.057	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.7	21.3	-179.4	-65.1	-83.5	0	0	0	113.2	I14 F15 V18 L88 P94 L368 F369 V370 F374 I386 F390	I14-F372 HydrophobicContact CG2-CE2 4.38Å; F15-F372 HydrophobicContact CD2-CD1 4.18Å; F15-F372 HydrophobicContact CD2-CE1 4.13Å; F15-F372 HydrophobicContact CE2-CD1 4.42Å; F15-F372 HydrophobicContact CE2-CE1 4.49Å; V18-F372 HydrophobicContact CB-CZ 4.35Å; V18-F372 HydrophobicContact CG1-CZ 4.22Å; V18-F372 HydrophobicContact CG2-CZ 4.15Å; L88-F372 HydrophobicContact CD2-CD1 3.97Å; L88-F372 HydrophobicContact CD2-CE1 3.9Å; P94-F372 WeakPolarHBondContact CG-O 3.48Å; L368-F372 WeakPolarHBondContact O-CD2 3.49Å; F369-F372 CarbonylContact O-C 3.58Å; F369-F372 PolarHBondContact O-N 3.26Å; V370-F372 PolarHBondContact O-N 2.97Å; V370-F372 VanDerWaalsContact O-N 3.09Å; F372-F374 WeakPolarHBondContact O-CD2 3.49Å; F372-I386 HydrophobicContact CB-CD1 3.93Å; F372-I386 HydrophobicContact CB-CG1 4.35Å; F372-I386 HydrophobicContact CD2-CB 4.41Å; F372-I386 HydrophobicContact CD2-CD1 3.83Å; F372-I386 HydrophobicContact CD2-CG1 3.83Å; F372-I386 HydrophobicContact CD2-CG2 3.7Å; F372-I386 HydrophobicContact CE2-CG1 4.41Å; F372-I386 HydrophobicContact CE2-CG2 3.62Å; F372-I386 HydrophobicContact CG-CD1 4.14Å; F372-I386 HydrophobicContact CG-CG1 4.14Å; F372-F390 AromaticContact CD1-CD2 3.98Å; F372-F390 HydrophobicContact CD1-CD2 3.98Å; F372-F390 HydrophobicContact CD1-CE2 4.01Å; F372-F390 HydrophobicContact CD2-CD2 4.47Å; F372-F390 AromaticContact CE1-CD2 3.41Å; F372-F390 HydrophobicContact CE1-CD2 3.41Å; F372-F390 VanDerWaalsContact CE1-CD2 3.41Å; F372-F390 AromaticContact CE1-CE2 3.79Å; F372-F390 HydrophobicContact CE1-CE2 3.79Å; F372-F390 HydrophobicContact CE1-CG 4.06Å; F372-F390 HydrophobicContact CE2-CB 4.46Å; F372-F390 AromaticContact CE2-CD2 3.99Å; F372-F390 HydrophobicContact CE2-CD2 3.99Å; F372-F390 HydrophobicContact CG-CD2 4.47Å; F372-F390 HydrophobicContact CZ-CB 3.85Å; F372-F390 AromaticContact CZ-CD2 3.42Å; F372-F390 HydrophobicContact CZ-CD2 3.42Å; F372-F390 VanDerWaalsContact CZ-CD2 3.42Å; F372-F390 HydrophobicContact CZ-CE2 4.26Å; F372-F390 AromaticContact CZ-CG 3.88Å; F372-F390 HydrophobicContact CZ-CG 3.88Å
373	G	96.7	Very high	96.5	Very high	40 Å²	40	46.9 Å²	46.9	41%	0.412	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.1	9.3	172.5	0	0	0	0	0	115.5	F369 V370 T375	F369-G373 PolarHBondContact O-N 3.06Å; V370-G373 PolarHBondContact O-N 3.03Å; G373-T375 PolarHBondContact O-N 2.72Å
374	F	97.4	Very high	96.6	Very high	8 Å²	8	46.2 Å²	46.2	4%	0.035	26%	0.261	C	S	.	.			trans	-96.8	83.5	176	-70.9	-96.5	0	0	0	110.3	I93 P94 W97 F369 V370 F372 P379 I382	I93-F374 HydrophobicContact CG2-CE2 3.72Å; I93-F374 HydrophobicContact CG2-CZ 3.92Å; P94-F374 HydrophobicContact CB-CE2 4.38Å; P94-F374 HydrophobicContact CB-CZ 4.49Å; P94-F374 HydrophobicContact CG-CD2 4.19Å; P94-F374 HydrophobicContact CG-CE2 3.76Å; P94-F374 HydrophobicContact CG-CZ 4.32Å; W97-F374 HydrophobicContact CB-CE1 3.96Å; W97-F374 HydrophobicContact CB-CZ 3.93Å; W97-F374 AromaticContact CD1-CE1 3.66Å; W97-F374 HydrophobicContact CD2-CE1 4.16Å; W97-F374 AromaticContact CG-CE1 3.64Å; W97-F374 HydrophobicContact CG-CE1 3.64Å; W97-F374 HydrophobicContact CG-CZ 4.11Å; F369-F374 CarbonylContact C-O 3.22Å; F369-F374 HydrophobicContact CB-CB 3.92Å; F369-F374 HydrophobicContact CD1-CB 4.24Å; F369-F374 WeakPolarHBondContact O-CB 3.31Å; F369-F374 PolarHBondContact O-N 3.26Å; V370-F374 PolarHBondContact N-O 3.03Å; F372-F374 WeakPolarHBondContact O-CD2 3.49Å; F374-P379 HydrophobicContact CD1-CG 4.28Å; F374-P379 HydrophobicContact CE1-CG 4.34Å; F374-I382 HydrophobicContact CD1-CG2 4.14Å; F374-I382 HydrophobicContact CD2-CG2 3.75Å; F374-I382 HydrophobicContact CE1-CB 4.34Å; F374-I382 HydrophobicContact CE1-CD1 4.22Å; F374-I382 HydrophobicContact CE1-CG1 3.81Å; F374-I382 HydrophobicContact CE1-CG2 3.92Å; F374-I382 HydrophobicContact CE2-CD1 4.46Å; F374-I382 HydrophobicContact CE2-CG2 3.53Å; F374-I382 HydrophobicContact CG-CG2 4.06Å; F374-I382 HydrophobicContact CZ-CB 4.32Å; F374-I382 HydrophobicContact CZ-CD1 3.74Å; F374-I382 HydrophobicContact CZ-CG1 3.8Å; F374-I382 HydrophobicContact CZ-CG2 3.63Å
375	T	93.7	Very high	96.8	Very high	99 Å²	99	45 Å²	45	61%	0.607	24%	0.24	S	C	*	.	S	Bend	trans	-92.9	-24.5	-175.7	55.1	0	0	0	0	114.3	V370 G373	V370-T375 HydrophobicContact CG1-CG2 4.28Å; V370-T375 HydrophobicContact CG2-CG2 4.48Å; G373-T375 PolarHBondContact O-N 2.72Å
376	Q	90.4	Very high	96.9	Very high	186 Å²	186	38.1 Å²	38.1	87%	0.869	21%	0.214	S	C	*	.	S	Bend	trans	-106.5	-15.2	-173	-61.5	179	21.6	0	0	113.4
377	S	92.9	Very high	97	Very high	50 Å²	50	34.8 Å²	34.8	35%	0.35	19%	0.194	S	C	.	.			trans	-148.9	158.2	-176	61.8	0	0	0	0	111.3
378	Q	95.9	Very high	97	Very high	93 Å²	93	34.2 Å²	34.2	44%	0.435	19%	0.19	S	C	.	.			trans	-126.8	66.9	178.1	-61.4	174.2	-75.8	0	0	110.6	T366 F369 T380	T366-Q378 VanDerWaalsContact CG2-NE2 3.28Å; F369-Q378 HydrophobicContact CB-CG 4.42Å; F369-Q378 HydrophobicContact CD1-CB 4.08Å; F369-Q378 HydrophobicContact CD1-CG 4.28Å; F369-Q378 HydrophobicContact CD2-CB 4.25Å; F369-Q378 HydrophobicContact CD2-CG 3.99Å; F369-Q378 HydrophobicContact CE1-CB 3.9Å; F369-Q378 HydrophobicContact CE2-CB 4.07Å; F369-Q378 HydrophobicContact CE2-CG 4.26Å; F369-Q378 HydrophobicContact CG-CB 4.23Å; F369-Q378 HydrophobicContact CG-CG 3.98Å; F369-Q378 HydrophobicContact CZ-CB 3.87Å; Q378-T380 PolarHBondContact O-N 3.03Å
379	P	97.3	Very high	97	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.013	21%	0.212	C	C	.	.			trans	-62.3	135.4	-175.3	-18.2	31.1	0	0	0	111.2	W97 E114 F374 L381 I382 G383	W97-P379 HydrophobicContact CD2-CG 4.33Å; W97-P379 HydrophobicContact CH2-CB 3.42Å; W97-P379 VanDerWaalsContact CH2-CB 3.42Å; W97-P379 HydrophobicContact CH2-CG 3.85Å; W97-P379 HydrophobicContact CZ2-CB 3.42Å; W97-P379 VanDerWaalsContact CZ2-CB 3.42Å; W97-P379 HydrophobicContact CZ2-CG 3.29Å; W97-P379 HydrophobicContact CZ3-CB 4.1Å; E114-P379 HydrophobicContact CG-CB 4.24Å; E114-P379 WeakPolarHBondContact OE1-CA 3.48Å; F374-P379 HydrophobicContact CD1-CG 4.28Å; F374-P379 HydrophobicContact CE1-CG 4.34Å; P379-L381 VanDerWaalsContact C-N 3.29Å; P379-L381 PolarHBondContact O-N 3.03Å; P379-I382 HydrophobicContact CB-CB 4.19Å; P379-I382 HydrophobicContact CB-CG1 3.94Å; P379-I382 HydrophobicContact CG-CB 4.42Å; P379-I382 HydrophobicContact CG-CG1 4.11Å; P379-I382 PolarHBondContact O-N 3.09Å; P379-G383 PolarHBondContact O-N 3.05Å
380	T	97.5	Very high	97	Very high	15 Å²	15	40.3 Å²	40.3	9%	0.092	22%	0.218	C	C	.	.	H	α-helix	trans	-59.6	-40.6	-172.4	-57.3	0	0	0	0	111.8	E114 L181 I184 K185 Q378 G383 L384	E114-T380 PolarHBondContact OE1-N 2.92Å; L181-T380 HydrophobicContact CD2-CG2 3.86Å; I184-T380 HydrophobicContact CB-CG2 3.99Å; I184-T380 HydrophobicContact CD1-CG2 4.29Å; I184-T380 HydrophobicContact CG2-CG2 3.42Å; I184-T380 VanDerWaalsContact CG2-CG2 3.42Å; K185-T380 WeakPolarHBondContact CE-OG1 3.08Å; K185-T380 PolarHBondContact NZ-OG1 3.13Å; Q378-T380 PolarHBondContact O-N 3.03Å; T380-G383 PolarHBondContact O-N 3.49Å; T380-L384 PolarHBondContact O-N 3.48Å
381	L	98.3	Very high	97	Very high	18 Å²	18	40.1 Å²	40.1	9%	0.094	22%	0.215	C	C	.	.	H	α-helix	trans	-63.6	-41.4	177.3	179.4	67.2	0	0	0	112.5	S118 F121 L122 L181 P379 G383 L384 M385	S118-L381 WeakPolarHBondContact O-CD2 3.3Å; F121-L381 HydrophobicContact CD1-CD2 3.74Å; F121-L381 HydrophobicContact CE1-CD2 4.36Å; L122-L381 HydrophobicContact CD1-CD1 4.19Å; L122-L381 HydrophobicContact CD1-CD2 3.99Å; L122-L381 HydrophobicContact CD2-CD1 4.14Å; L122-L381 HydrophobicContact CD2-CD2 3.92Å; L122-L381 HydrophobicContact CG-CD1 4.33Å; L122-L381 HydrophobicContact CG-CD2 3.55Å; L181-L381 HydrophobicContact CD1-CB 4.18Å; L181-L381 HydrophobicContact CD2-CB 3.89Å; L181-L381 HydrophobicContact CD2-CD1 4.39Å; P379-L381 VanDerWaalsContact C-N 3.29Å; P379-L381 PolarHBondContact O-N 3.03Å; L381-G383 VanDerWaalsContact C-N 3.31Å; L381-L384 WeakPolarHBondContact O-CB 3.38Å; L381-L384 PolarHBondContact O-N 3Å; L381-M385 PolarHBondContact O-N 3.37Å
382	I	98.3	Very high	97	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-67.3	-38.6	179.4	-62.8	-64.8	0	0	0	109.9	I93 W97 F121 F369 F374 P379 M385 I386	I93-I382 HydrophobicContact CG2-CD1 4.19Å; W97-I382 HydrophobicContact CD2-CD1 4.43Å; W97-I382 HydrophobicContact CD2-CG1 4.2Å; W97-I382 HydrophobicContact CE3-CD1 3.83Å; W97-I382 HydrophobicContact CE3-CG1 3.77Å; W97-I382 HydrophobicContact CZ3-CD1 4.36Å; W97-I382 HydrophobicContact CZ3-CG1 4.01Å; F121-I382 HydrophobicContact CD1-CD1 4.43Å; F121-I382 HydrophobicContact CE1-CD1 3.92Å; F121-I382 HydrophobicContact CE2-CD1 4.19Å; F121-I382 HydrophobicContact CZ-CD1 3.78Å; F369-I382 HydrophobicContact CD1-CG2 4.35Å; F369-I382 HydrophobicContact CE1-CB 4.5Å; F369-I382 HydrophobicContact CE1-CG2 4.38Å; F374-I382 HydrophobicContact CD1-CG2 4.14Å; F374-I382 HydrophobicContact CD2-CG2 3.75Å; F374-I382 HydrophobicContact CE1-CB 4.34Å; F374-I382 HydrophobicContact CE1-CD1 4.22Å; F374-I382 HydrophobicContact CE1-CG1 3.81Å; F374-I382 HydrophobicContact CE1-CG2 3.92Å; F374-I382 HydrophobicContact CE2-CD1 4.46Å; F374-I382 HydrophobicContact CE2-CG2 3.53Å; F374-I382 HydrophobicContact CG-CG2 4.06Å; F374-I382 HydrophobicContact CZ-CB 4.32Å; F374-I382 HydrophobicContact CZ-CD1 3.74Å; F374-I382 HydrophobicContact CZ-CG1 3.8Å; F374-I382 HydrophobicContact CZ-CG2 3.63Å; P379-I382 HydrophobicContact CB-CB 4.19Å; P379-I382 HydrophobicContact CB-CG1 3.94Å; P379-I382 HydrophobicContact CG-CB 4.42Å; P379-I382 HydrophobicContact CG-CG1 4.11Å; P379-I382 PolarHBondContact O-N 3.09Å; I382-M385 HydrophobicContact CD1-CE 4.28Å; I382-M385 PolarHBondContact O-N 2.85Å; I382-I386 HydrophobicContact CG2-CD1 3.68Å; I382-I386 HydrophobicContact CG2-CG1 4.28Å; I382-I386 WeakPolarHBondContact O-CB 3.3Å; I382-I386 WeakPolarHBondContact O-CG1 3.46Å; I382-I386 PolarHBondContact O-N 3.37Å
383	G	98.1	Very high	97	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-59.6	-45.3	171.7	0	0	0	0	0	112.7	F369 P379 T380 L381 M385 I387	F369-G383 VanDerWaalsContact CZ-CA 3.45Å; P379-G383 PolarHBondContact O-N 3.05Å; T380-G383 PolarHBondContact O-N 3.49Å; L381-G383 VanDerWaalsContact C-N 3.31Å; G383-M385 VanDerWaalsContact C-N 3.33Å; G383-M385 PolarHBondContact O-N 3.34Å; G383-I387 WeakPolarHBondContact O-CB 3.3Å; G383-I387 WeakPolarHBondContact O-CG1 3.48Å; G383-I387 PolarHBondContact O-N 3.03Å
384	L	98.4	Very high	97.1	Very high	20 Å²	20	41.8 Å²	41.8	11%	0.105	22%	0.218	C	C	.	.	H	α-helix	trans	-57.5	-47.9	174.4	-77	168.5	0	0	0	110.8	L181 I184 F356 F359 T380 L381 F388	L181-L384 HydrophobicContact CD2-CD1 3.95Å; I184-L384 HydrophobicContact CD1-CD1 3.81Å; I184-L384 HydrophobicContact CD1-CD2 4.14Å; I184-L384 HydrophobicContact CD1-CG 4.31Å; F356-L384 HydrophobicContact CE1-CD2 4.4Å; F359-L384 HydrophobicContact CD1-CD2 4.21Å; F359-L384 HydrophobicContact CD2-CD2 3.99Å; F359-L384 HydrophobicContact CE1-CD2 3.86Å; F359-L384 HydrophobicContact CE1-CG 4.43Å; F359-L384 HydrophobicContact CE2-CB 4.35Å; F359-L384 HydrophobicContact CE2-CD2 3.62Å; F359-L384 HydrophobicContact CE2-CG 3.89Å; F359-L384 HydrophobicContact CG-CD2 4.28Å; F359-L384 HydrophobicContact CZ-CD2 3.55Å; F359-L384 HydrophobicContact CZ-CG 3.74Å; T380-L384 PolarHBondContact O-N 3.48Å; L381-L384 WeakPolarHBondContact O-CB 3.38Å; L381-L384 PolarHBondContact O-N 3Å; L384-F388 HydrophobicContact CD2-CD2 4.2Å; L384-F388 HydrophobicContact CD2-CE2 3.75Å; L384-F388 HydrophobicContact CD2-CZ 4.4Å; L384-F388 VanDerWaalsContact O-CB 3.27Å; L384-F388 WeakPolarHBondContact O-CB 3.39Å; L384-F388 WeakPolarHBondContact O-CD2 3.46Å; L384-F388 PolarHBondContact O-N 2.83Å
385	M	98.3	Very high	97.2	Very high	33 Å²	33	45 Å²	45	16%	0.163	23%	0.23	C	C	.	.	H	α-helix	trans	-61.6	-52.3	-179.7	-170	-176.3	70.7	0	0	111.8	I93 F121 L381 I382 G383 I387 Q389 F390	I93-M385 HydrophobicContact CB-CE 4.34Å; I93-M385 HydrophobicContact CD1-CE 3.66Å; I93-M385 HydrophobicContact CG1-CE 3.99Å; I93-M385 HydrophobicContact CG2-CE 3.44Å; I93-M385 VanDerWaalsContact CG2-CE 3.44Å; F121-M385 HydrophobicContact CE1-SD 4.37Å; F121-M385 HydrophobicContact CZ-SD 4.33Å; L381-M385 PolarHBondContact O-N 3.37Å; I382-M385 HydrophobicContact CD1-CE 4.28Å; I382-M385 PolarHBondContact O-N 2.85Å; G383-M385 VanDerWaalsContact C-N 3.33Å; G383-M385 PolarHBondContact O-N 3.34Å; M385-I387 PolarHBondContact O-N 3.03Å; M385-Q389 HydrophobicContact CG-CG 4.44Å; M385-Q389 WeakPolarHBondContact O-CB 3.31Å; M385-Q389 WeakPolarHBondContact O-CG 3.46Å; M385-Q389 PolarHBondContact O-N 3.49Å; M385-F390 HydrophobicContact CE-CE2 4.47Å
386	I	98.4	Very high	97.3	Very high	1 Å²	1	43 Å²	43	1%	0.005	22%	0.216	C	C	.	.	I	π-helix	trans	-57.9	-49.7	179.8	-70.2	167.9	0	0	0	110.4	L368 F369 F372 I382 F390 I391	L368-I386 HydrophobicContact CB-CG2 4.46Å; F369-I386 HydrophobicContact CD1-CD1 4.35Å; F372-I386 HydrophobicContact CB-CD1 3.93Å; F372-I386 HydrophobicContact CB-CG1 4.35Å; F372-I386 HydrophobicContact CD2-CB 4.41Å; F372-I386 HydrophobicContact CD2-CD1 3.83Å; F372-I386 HydrophobicContact CD2-CG1 3.83Å; F372-I386 HydrophobicContact CD2-CG2 3.7Å; F372-I386 HydrophobicContact CE2-CG1 4.41Å; F372-I386 HydrophobicContact CE2-CG2 3.62Å; F372-I386 HydrophobicContact CG-CD1 4.14Å; F372-I386 HydrophobicContact CG-CG1 4.14Å; I382-I386 HydrophobicContact CG2-CD1 3.68Å; I382-I386 HydrophobicContact CG2-CG1 4.28Å; I382-I386 WeakPolarHBondContact O-CB 3.3Å; I382-I386 WeakPolarHBondContact O-CG1 3.46Å; I382-I386 PolarHBondContact O-N 3.37Å; I386-F390 HydrophobicContact CB-CD2 4.39Å; I386-F390 HydrophobicContact CG1-CD2 4.26Å; I386-F390 HydrophobicContact CG1-CE2 4.49Å; I386-F390 WeakPolarHBondContact O-CA 3.21Å; I386-F390 VanDerWaalsContact O-CB 3.26Å; I386-F390 WeakPolarHBondContact O-CB 3.27Å; I386-F390 PolarHBondContact O-N 3.04Å; I386-I391 HydrophobicContact CG2-CD1 4.47Å; I386-I391 HydrophobicContact CG2-CG1 4.1Å; I386-I391 PolarHBondContact O-N 2.96Å
387	I	98.5	Very high	97.7	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	19%	0.187	C	C	.	.	I	π-helix	trans	-69.9	-50.1	-174	-67.9	165.6	0	0	0	111	F359 L362 I363 L368 G383 M385 I391 F392	F359-I387 HydrophobicContact CB-CG2 4.49Å; F359-I387 HydrophobicContact CD2-CB 4.03Å; F359-I387 HydrophobicContact CD2-CD1 3.51Å; F359-I387 HydrophobicContact CD2-CG1 4.35Å; F359-I387 HydrophobicContact CD2-CG2 4.08Å; F359-I387 HydrophobicContact CE2-CD1 3.75Å; L362-I387 HydrophobicContact CB-CD1 3.76Å; L362-I387 HydrophobicContact CB-CG1 4.28Å; L362-I387 HydrophobicContact CD1-CG2 4.03Å; I363-I387 HydrophobicContact CB-CD1 4.33Å; I363-I387 HydrophobicContact CD1-CD1 4.23Å; L368-I387 HydrophobicContact CD1-CD1 4.27Å; L368-I387 HydrophobicContact CD1-CG1 4.08Å; G383-I387 WeakPolarHBondContact O-CB 3.3Å; G383-I387 WeakPolarHBondContact O-CG1 3.48Å; G383-I387 PolarHBondContact O-N 3.03Å; M385-I387 PolarHBondContact O-N 3.03Å; I387-I391 PolarHBondContact O-N 3.36Å; I387-F392 HydrophobicContact CG2-CD1 4.33Å; I387-F392 HydrophobicContact CG2-CD2 4.41Å; I387-F392 HydrophobicContact CG2-CE1 3.79Å; I387-F392 HydrophobicContact CG2-CE2 3.87Å; I387-F392 HydrophobicContact CG2-CZ 3.51Å; I387-F392 WeakPolarHBondContact O-CB 3.38Å; I387-F392 WeakPolarHBondContact O-CG 3.48Å; I387-F392 PolarHBondContact O-N 2.95Å
388	F	98.3	Very high	97.9	Very high	58 Å²	58	39.7 Å²	39.7	25%	0.254	20%	0.198	S	C	.	.	I	π-helix	trans	-74.4	-35.1	-174.4	-78.7	-117.6	0	0	0	113.1	C355 F356 F359 L384 N396	C355-F388 HydrophobicContact CB-CD1 4.44Å; C355-F388 HydrophobicContact CB-CE1 3.71Å; C355-F388 HydrophobicContact CB-CZ 4Å; F356-F388 HydrophobicContact CD1-CZ 4.03Å; F356-F388 HydrophobicContact CE1-CZ 4.06Å; F356-F388 HydrophobicContact CG-CZ 4.41Å; F356-F388 HydrophobicContact CZ-CZ 4.49Å; F359-F388 HydrophobicContact CB-CE2 3.69Å; F359-F388 HydrophobicContact CB-CZ 4.31Å; F359-F388 HydrophobicContact CD2-CD2 4.22Å; F359-F388 AromaticContact CD2-CE2 3.77Å; F359-F388 HydrophobicContact CD2-CE2 3.77Å; F359-F388 AromaticContact CG-CE2 3.81Å; F359-F388 HydrophobicContact CG-CE2 3.81Å; L384-F388 HydrophobicContact CD2-CD2 4.2Å; L384-F388 HydrophobicContact CD2-CE2 3.75Å; L384-F388 HydrophobicContact CD2-CZ 4.4Å; L384-F388 VanDerWaalsContact O-CB 3.27Å; L384-F388 WeakPolarHBondContact O-CB 3.39Å; L384-F388 WeakPolarHBondContact O-CD2 3.46Å; L384-F388 PolarHBondContact O-N 2.83Å; F388-N396 PolarHBondContact O-ND2 3.32Å
389	Q	96.9	Very high	98	Very high	114 Å²	114	37 Å²	37	53%	0.533	19%	0.186	S	C	.	.	I	π-helix	trans	-91.5	-42.8	-177	-60.1	-176.8	-17.2	0	0	112.4	M385	M385-Q389 HydrophobicContact CG-CG 4.44Å; M385-Q389 WeakPolarHBondContact O-CB 3.31Å; M385-Q389 WeakPolarHBondContact O-CG 3.46Å; M385-Q389 PolarHBondContact O-N 3.49Å
390	F	97.8	Very high	98	Very high	32 Å²	32	39.9 Å²	39.9	14%	0.14	21%	0.206	C	C	.	.	I	π-helix	trans	-98.2	-53.8	-172.4	-54	-36.1	0	0	0	112.4	V18 L88 I93 F372 M385 I386 S393	V18-F390 HydrophobicContact CG1-CB 3.74Å; V18-F390 HydrophobicContact CG1-CD1 4.2Å; V18-F390 HydrophobicContact CG1-CG 4.09Å; V18-F390 HydrophobicContact CG2-CB 3.99Å; L88-F390 HydrophobicContact CD2-CE1 4.46Å; L88-F390 HydrophobicContact CD2-CE2 4.14Å; L88-F390 HydrophobicContact CD2-CZ 3.91Å; I93-F390 HydrophobicContact CD1-CE2 3.94Å; I93-F390 HydrophobicContact CD1-CZ 3.88Å; F372-F390 AromaticContact CD1-CD2 3.98Å; F372-F390 HydrophobicContact CD1-CD2 3.98Å; F372-F390 HydrophobicContact CD1-CE2 4.01Å; F372-F390 HydrophobicContact CD2-CD2 4.47Å; F372-F390 AromaticContact CE1-CD2 3.41Å; F372-F390 HydrophobicContact CE1-CD2 3.41Å; F372-F390 VanDerWaalsContact CE1-CD2 3.41Å; F372-F390 AromaticContact CE1-CE2 3.79Å; F372-F390 HydrophobicContact CE1-CE2 3.79Å; F372-F390 HydrophobicContact CE1-CG 4.06Å; F372-F390 HydrophobicContact CE2-CB 4.46Å; F372-F390 AromaticContact CE2-CD2 3.99Å; F372-F390 HydrophobicContact CE2-CD2 3.99Å; F372-F390 HydrophobicContact CG-CD2 4.47Å; F372-F390 HydrophobicContact CZ-CB 3.85Å; F372-F390 AromaticContact CZ-CD2 3.42Å; F372-F390 HydrophobicContact CZ-CD2 3.42Å; F372-F390 VanDerWaalsContact CZ-CD2 3.42Å; F372-F390 HydrophobicContact CZ-CE2 4.26Å; F372-F390 AromaticContact CZ-CG 3.88Å; F372-F390 HydrophobicContact CZ-CG 3.88Å; M385-F390 HydrophobicContact CE-CE2 4.47Å; I386-F390 HydrophobicContact CB-CD2 4.39Å; I386-F390 HydrophobicContact CG1-CD2 4.26Å; I386-F390 HydrophobicContact CG1-CE2 4.49Å; I386-F390 WeakPolarHBondContact O-CA 3.21Å; I386-F390 VanDerWaalsContact O-CB 3.26Å; I386-F390 WeakPolarHBondContact O-CB 3.27Å; I386-F390 PolarHBondContact O-N 3.04Å; F390-S393 WeakPolarHBondContact O-CB 3.42Å; F390-S393 PolarHBondContact O-N 3.49Å; F390-S393 PolarHBondContact O-OG 3.25Å
391	I	98.3	Very high	98	Very high	47 Å²	47	41.4 Å²	41.4	24%	0.241	21%	0.212	C	C	.	.	I	π-helix	trans	-68.6	-40.1	-176	-54.2	-54.7	0	0	0	111.3	I14 V18 L362 L368 I386 I387 S393	I14-I391 HydrophobicContact CG2-CD1 3.88Å; V18-I391 HydrophobicContact CG2-CD1 4.44Å; L362-I391 HydrophobicContact CD1-CG2 4.25Å; L368-I391 HydrophobicContact CD2-CD1 3.71Å; L368-I391 HydrophobicContact CD2-CG1 4.02Å; I386-I391 HydrophobicContact CG2-CD1 4.47Å; I386-I391 HydrophobicContact CG2-CG1 4.1Å; I386-I391 PolarHBondContact O-N 2.96Å; I387-I391 PolarHBondContact O-N 3.36Å; I391-S393 VanDerWaalsContact C-N 3.28Å; I391-S393 PolarHBondContact O-N 3.49Å
392	F	98.5	Very high	98	Very high	15 Å²	15	43.6 Å²	43.6	7%	0.066	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	3.2	176.5	-65.6	-8.4	0	0	0	113.8	C355 L358 L362 I387 P394 Y395 N396	C355-F392 HydrophobicContact CB-CD2 4.42Å; C355-F392 HydrophobicContact CB-CE2 3.96Å; L358-F392 HydrophobicContact CB-CE1 4.07Å; L358-F392 HydrophobicContact CB-CE2 4.38Å; L358-F392 HydrophobicContact CB-CZ 3.47Å; L358-F392 VanDerWaalsContact CB-CZ 3.47Å; L358-F392 HydrophobicContact CD1-CE1 4.3Å; L358-F392 HydrophobicContact CD1-CZ 4.18Å; L358-F392 HydrophobicContact CG-CZ 4.49Å; L362-F392 HydrophobicContact CD1-CE1 3.69Å; L362-F392 HydrophobicContact CD1-CZ 4.19Å; I387-F392 HydrophobicContact CG2-CD1 4.33Å; I387-F392 HydrophobicContact CG2-CD2 4.41Å; I387-F392 HydrophobicContact CG2-CE1 3.79Å; I387-F392 HydrophobicContact CG2-CE2 3.87Å; I387-F392 HydrophobicContact CG2-CZ 3.51Å; I387-F392 WeakPolarHBondContact O-CB 3.38Å; I387-F392 WeakPolarHBondContact O-CG 3.48Å; I387-F392 PolarHBondContact O-N 2.95Å; F392-P394 VanDerWaalsContact C-CD 3.49Å; F392-Y395 WeakPolarHBondContact O-CA 3.49Å; F392-Y395 WeakPolarHBondContact O-CB 3.5Å; F392-Y395 PolarHBondContact O-N 3.35Å; F392-N396 PolarHBondContact O-N 3.45Å; F392-N396 PolarHBondContact O-ND2 3.48Å
393	S	97.8	Very high	98	Very high	21 Å²	21	46.9 Å²	46.9	15%	0.147	25%	0.245	C	C	.	.	H	α-helix	trans	-51.9	-43.5	-178.3	57.7	0	0	0	0	113.9	F21 F390 I391 Y395 N396 E397	F21-S393 VanDerWaalsContact CD1-OG 3.25Å; F21-S393 WeakPolarHBondContact CD1-OG 3.44Å; F21-S393 VanDerWaalsContact CE1-C 3.49Å; F390-S393 WeakPolarHBondContact O-CB 3.42Å; F390-S393 PolarHBondContact O-N 3.49Å; F390-S393 PolarHBondContact O-OG 3.25Å; I391-S393 VanDerWaalsContact C-N 3.28Å; I391-S393 PolarHBondContact O-N 3.49Å; S393-Y395 VanDerWaalsContact C-N 3.34Å; S393-Y395 PolarHBondContact O-N 3.27Å; S393-N396 PolarHBondContact O-N 3.38Å; S393-E397 WeakPolarHBondContact O-CG 3.44Å; S393-E397 PolarHBondContact O-N 2.88Å
394	P	98.3	Very high	97.9	Very high	64 Å²	64	47.8 Å²	47.8	42%	0.416	25%	0.251	S	S	.	.	H	α-helix	trans	-68.9	-33.8	178.5	-17.6	34	0	0	0	113.3	F21 F392 L398	F21-P394 HydrophobicContact CD1-CG 4.09Å; F21-P394 HydrophobicContact CD2-CB 4.43Å; F21-P394 HydrophobicContact CD2-CG 4.09Å; F21-P394 HydrophobicContact CE1-CB 4.22Å; F21-P394 HydrophobicContact CE1-CG 4.01Å; F21-P394 HydrophobicContact CE2-CB 3.87Å; F21-P394 HydrophobicContact CE2-CG 4.01Å; F21-P394 HydrophobicContact CG-CG 4.15Å; F21-P394 HydrophobicContact CZ-CB 3.77Å; F21-P394 HydrophobicContact CZ-CG 3.99Å; F392-P394 VanDerWaalsContact C-CD 3.49Å; P394-L398 PolarHBondContact O-N 3.44Å
395	Y	98.3	Very high	97.9	Very high	76 Å²	76	50 Å²	50	30%	0.298	27%	0.265	S	S	.	.	H	α-helix	trans	-66.8	-44.6	174.5	168.9	-102.4	0	0	0	111.2	N351 L354 F392 S393 L398 L399	N351-Y395 VanDerWaalsContact OD1-CE1 3.29Å; N351-Y395 WeakPolarHBondContact OD1-CE1 3.32Å; N351-Y395 PolarHBondContact OD1-OH 3.34Å; L354-Y395 HydrophobicContact CD2-CE2 4.37Å; F392-Y395 WeakPolarHBondContact O-CA 3.49Å; F392-Y395 WeakPolarHBondContact O-CB 3.5Å; F392-Y395 PolarHBondContact O-N 3.35Å; S393-Y395 VanDerWaalsContact C-N 3.34Å; S393-Y395 PolarHBondContact O-N 3.27Å; Y395-L398 PolarHBondContact O-N 2.88Å; Y395-L399 HydrophobicContact CE1-CD2 4.04Å; Y395-L399 WeakPolarHBondContact O-CB 3.47Å; Y395-L399 PolarHBondContact O-N 3.42Å
396	N	97.4	Very high	97.9	Very high	57 Å²	57	50.6 Å²	50.6	31%	0.305	27%	0.268	S	S	.	.	H	α-helix	trans	-62.4	-43.7	-179.4	-66.6	-21.7	0	0	0	111.4	F388 F392 S393 L399 S400	F388-N396 PolarHBondContact O-ND2 3.32Å; F392-N396 PolarHBondContact O-N 3.45Å; F392-N396 PolarHBondContact O-ND2 3.48Å; S393-N396 PolarHBondContact O-N 3.38Å; N396-L399 PolarHBondContact O-N 3.3Å; N396-S400 VanDerWaalsContact O-CB 3.25Å; N396-S400 WeakPolarHBondContact O-CB 3.22Å; N396-S400 PolarHBondContact O-N 3.18Å
397	E	97.6	Very high	97.9	Very high	57 Å²	57	52.2 Å²	52.2	27%	0.266	28%	0.28	S	S	.	.	H	α-helix	trans	-62	-46.4	176.6	-71.2	-54.5	142	0	0	112.2	F21 V25 S393 L399 S400 F401	F21-E397 HydrophobicContact CE1-CG 3.97Å; F21-E397 HydrophobicContact CZ-CB 4.31Å; F21-E397 HydrophobicContact CZ-CG 3.95Å; V25-E397 HydrophobicContact CG1-CG 4.42Å; V25-E397 HydrophobicContact CG2-CG 3.99Å; S393-E397 WeakPolarHBondContact O-CG 3.44Å; S393-E397 PolarHBondContact O-N 2.88Å; E397-L399 PolarHBondContact O-N 3.43Å; E397-S400 WeakPolarHBondContact O-CB 3.33Å; E397-S400 PolarHBondContact O-N 3.43Å; E397-F401 PolarHBondContact O-N 2.91Å
398	L	97.9	Very high	97.8	Very high	109 Å²	109	54.1 Å²	54.1	57%	0.571	29%	0.287	S	S	*	.	H	α-helix	trans	-64	-43.6	178	179.5	62.2	0	0	0	111.9	P394 Y395 F401 C402	P394-L398 PolarHBondContact O-N 3.44Å; Y395-L398 PolarHBondContact O-N 2.88Å; L398-F401 PolarHBondContact O-N 3.4Å; L398-C402 PolarHBondContact O-N 2.79Å; L398-C402 PolarHBondContact O-SG 3.39Å
399	L	97.6	Very high	97.8	Very high	37 Å²	37	59.1 Å²	59.1	19%	0.194	30%	0.304	C	S	.	.	H	α-helix	trans	-63.2	-44.1	177.4	-179.7	64.3	0	0	0	110.8	N351 Y395 N396 E397 F401 C402 L403	N351-L399 HydrophobicContact CB-CD2 4.32Å; N351-L399 WeakPolarHBondContact OD1-CD2 3.33Å; Y395-L399 HydrophobicContact CE1-CD2 4.04Å; Y395-L399 WeakPolarHBondContact O-CB 3.47Å; Y395-L399 PolarHBondContact O-N 3.42Å; N396-L399 PolarHBondContact O-N 3.3Å; E397-L399 PolarHBondContact O-N 3.43Å; L399-F401 PolarHBondContact O-N 3.35Å; L399-C402 PolarHBondContact O-N 3.5Å; L399-L403 HydrophobicContact CD1-CD1 4.33Å; L399-L403 HydrophobicContact CD1-CG 4.23Å; L399-L403 HydrophobicContact CG-CD1 4.02Å; L399-L403 HydrophobicContact CG-CG 4.33Å; L399-L403 WeakPolarHBondContact O-CB 3.25Å; L399-L403 VanDerWaalsContact O-CG 3.3Å; L399-L403 WeakPolarHBondContact O-CG 3.5Å; L399-L403 PolarHBondContact O-N 2.96Å
400	S	96.9	Very high	97.9	Very high	62 Å²	62	54.2 Å²	54.2	43%	0.434	28%	0.281	S	S	.	.	H	α-helix	trans	-55.3	-51.1	176	-175.8	0	0	0	0	110.9	N396 E397 C402 L403 T404	N396-S400 VanDerWaalsContact O-CB 3.25Å; N396-S400 WeakPolarHBondContact O-CB 3.22Å; N396-S400 PolarHBondContact O-N 3.18Å; E397-S400 WeakPolarHBondContact O-CB 3.33Å; E397-S400 PolarHBondContact O-N 3.43Å; S400-C402 PolarHBondContact O-N 2.93Å; S400-L403 PolarHBondContact O-N 3.34Å; S400-T404 PolarHBondContact O-N 3.08Å; S400-T404 PolarHBondContact O-OG1 3.25Å
401	F	97.8	Very high	97.9	Very high	47 Å²	47	53.2 Å²	53.2	21%	0.206	28%	0.277	C	S	.	.	H	α-helix	trans	-57.4	-46.1	175.6	176.7	-105.9	0	0	0	112.6	E397 L398 L399 L403 T404 V405 M450 W451	E397-F401 PolarHBondContact O-N 2.91Å; L398-F401 PolarHBondContact O-N 3.4Å; L399-F401 PolarHBondContact O-N 3.35Å; F401-L403 VanDerWaalsContact C-N 3.32Å; F401-L403 PolarHBondContact O-N 2.95Å; F401-T404 PolarHBondContact O-N 3.28Å; F401-V405 HydrophobicContact CE1-CG2 4.17Å; F401-V405 HydrophobicContact CE2-CG2 4.14Å; F401-V405 HydrophobicContact CZ-CG2 3.91Å; F401-V405 WeakPolarHBondContact O-CG2 3.34Å; F401-V405 PolarHBondContact O-N 3.21Å; F401-M450 HydrophobicContact CE2-CE 4.18Å; F401-M450 HydrophobicContact CE2-CG 4.1Å; F401-M450 HydrophobicContact CZ-CE 4.17Å; F401-M450 HydrophobicContact CZ-CG 4.31Å; F401-W451 HydrophobicContact CB-CH2 4.36Å; F401-W451 HydrophobicContact CB-CZ3 4.2Å; F401-W451 HydrophobicContact CD2-CD2 4.06Å; F401-W451 AromaticContact CD2-CE3 3.38Å; F401-W451 HydrophobicContact CD2-CE3 3.38Å; F401-W451 AromaticContact CD2-CZ3 3.69Å; F401-W451 HydrophobicContact CD2-CZ3 3.69Å; F401-W451 AromaticContact CE2-CE3 3.79Å; F401-W451 HydrophobicContact CE2-CE3 3.79Å; F401-W451 HydrophobicContact CE2-CZ3 4.26Å; F401-W451 HydrophobicContact CG-CE3 4.12Å; F401-W451 AromaticContact CG-CZ3 3.95Å; F401-W451 HydrophobicContact CG-CZ3 3.95Å
402	C	98.3	Very high	97.9	Very high	64 Å²	64	54 Å²	54	43%	0.432	28%	0.279	S	S	.	.	H	α-helix	trans	-61.4	-40.5	177.9	-67.6	0	0	0	0	112.3	L398 L399 S400 V405 L406	L398-C402 PolarHBondContact O-N 2.79Å; L398-C402 PolarHBondContact O-SG 3.39Å; L399-C402 PolarHBondContact O-N 3.5Å; S400-C402 PolarHBondContact O-N 2.93Å; C402-V405 PolarHBondContact O-N 2.94Å; C402-L406 WeakPolarHBondContact O-CB 3.37Å; C402-L406 PolarHBondContact O-N 3.43Å
403	L	97.7	Very high	97.9	Very high	69 Å²	69	56 Å²	56	36%	0.361	29%	0.288	S	S	.	.	H	α-helix	trans	-68.5	-37.1	177	-69.8	176.8	0	0	0	111.9	I347 L399 S400 F401 L406 S407	I347-L403 HydrophobicContact CG2-CD2 3.9Å; L399-L403 HydrophobicContact CD1-CD1 4.33Å; L399-L403 HydrophobicContact CD1-CG 4.23Å; L399-L403 HydrophobicContact CG-CD1 4.02Å; L399-L403 HydrophobicContact CG-CG 4.33Å; L399-L403 WeakPolarHBondContact O-CB 3.25Å; L399-L403 VanDerWaalsContact O-CG 3.3Å; L399-L403 WeakPolarHBondContact O-CG 3.5Å; L399-L403 PolarHBondContact O-N 2.96Å; S400-L403 PolarHBondContact O-N 3.34Å; F401-L403 VanDerWaalsContact C-N 3.32Å; F401-L403 PolarHBondContact O-N 2.95Å; L403-L406 PolarHBondContact O-N 3.45Å; L403-S407 WeakPolarHBondContact O-CB 3.2Å; L403-S407 PolarHBondContact O-N 3.49Å
404	T	97.9	Very high	97.9	Very high	20 Å²	20	55 Å²	55	12%	0.123	28%	0.281	C	S	.	.	H	α-helix	trans	-60.6	-47.1	172.8	-63.4	0	0	0	0	111.2	S400 F401 L406 S407 R408 Y453	S400-T404 PolarHBondContact O-N 3.08Å; S400-T404 PolarHBondContact O-OG1 3.25Å; F401-T404 PolarHBondContact O-N 3.28Å; T404-L406 VanDerWaalsContact C-N 3.35Å; T404-L406 PolarHBondContact O-N 3.46Å; T404-S407 WeakPolarHBondContact O-CB 3.18Å; T404-S407 PolarHBondContact O-N 2.89Å; T404-R408 WeakPolarHBondContact O-CG 3.17Å; T404-R408 PolarHBondContact O-N 2.94Å; T404-Y453 WeakPolarHBondContact CG2-O 3.48Å
405	V	97.6	Very high	97.9	Very high	66 Å²	66	52 Å²	52	40%	0.4	26%	0.262	S	S	.	.	H	α-helix	trans	-62.4	-42.3	176.4	173.9	0	0	0	0	111.4	F401 C402 R408 R409	F401-V405 HydrophobicContact CE1-CG2 4.17Å; F401-V405 HydrophobicContact CE2-CG2 4.14Å; F401-V405 HydrophobicContact CZ-CG2 3.91Å; F401-V405 WeakPolarHBondContact O-CG2 3.34Å; F401-V405 PolarHBondContact O-N 3.21Å; C402-V405 PolarHBondContact O-N 2.94Å; V405-R408 PolarHBondContact O-N 3.36Å; V405-R409 PolarHBondContact O-N 3.25Å; V405-R409 VanDerWaalsContact O-N 3.15Å
406	L	98.1	Very high	97.8	Very high	46 Å²	46	50.8 Å²	50.8	24%	0.241	27%	0.267	C	S	.	.	H	α-helix	trans	-63.4	-42.3	176.5	-178.1	62.7	0	0	0	111.8	I347 C402 L403 T404 R409 F410	I347-L406 HydrophobicContact CD1-CD2 3.48Å; I347-L406 VanDerWaalsContact CD1-CD2 3.48Å; C402-L406 WeakPolarHBondContact O-CB 3.37Å; C402-L406 PolarHBondContact O-N 3.43Å; L403-L406 PolarHBondContact O-N 3.45Å; T404-L406 VanDerWaalsContact C-N 3.35Å; T404-L406 PolarHBondContact O-N 3.46Å; L406-R409 WeakPolarHBondContact O-CB 3.35Å; L406-R409 PolarHBondContact O-N 3.35Å; L406-F410 HydrophobicContact CD1-CD1 4.27Å; L406-F410 HydrophobicContact CD1-CE1 3.61Å; L406-F410 HydrophobicContact CD1-CE2 4.33Å; L406-F410 HydrophobicContact CD1-CZ 3.64Å; L406-F410 HydrophobicContact CD2-CE2 4.14Å; L406-F410 HydrophobicContact CD2-CZ 3.95Å; L406-F410 HydrophobicContact CG-CD2 4.44Å; L406-F410 HydrophobicContact CG-CE1 4.1Å; L406-F410 HydrophobicContact CG-CE2 3.91Å; L406-F410 HydrophobicContact CG-CZ 3.71Å; L406-F410 PolarHBondContact O-N 2.96Å
407	S	97.9	Very high	97.8	Very high	35 Å²	35	50 Å²	50	25%	0.245	26%	0.261	C	S	.	.	H	α-helix	trans	-58	-49.2	175.7	-172.8	0	0	0	0	110.9	L403 T404 R409 F410 E411 S454	L403-S407 WeakPolarHBondContact O-CB 3.2Å; L403-S407 PolarHBondContact O-N 3.49Å; T404-S407 WeakPolarHBondContact O-CB 3.18Å; T404-S407 PolarHBondContact O-N 2.89Å; S407-R409 PolarHBondContact O-N 2.85Å; S407-F410 WeakPolarHBondContact O-CA 3.48Å; S407-F410 WeakPolarHBondContact O-CB 3.4Å; S407-F410 PolarHBondContact O-N 2.86Å; S407-E411 WeakPolarHBondContact O-CG 3.12Å; S407-E411 PolarHBondContact O-N 3.42Å; S407-S454 CarbonylContact C-O 3.53Å; S407-S454 WeakPolarHBondContact CB-O 3.37Å; S407-S454 PolarHBondContact OG-O 3.43Å
408	R	97.8	Very high	97.8	Very high	41 Å²	41	47.3 Å²	47.3	16%	0.155	25%	0.248	C	C	.	.	H	α-helix	trans	-56.1	-39.2	176.4	-72	178.2	67.4	-172.4	4.6	112.6	T404 V405 E411 F412 Y453 S454 P456 E460	T404-R408 WeakPolarHBondContact O-CG 3.17Å; T404-R408 PolarHBondContact O-N 2.94Å; V405-R408 PolarHBondContact O-N 3.36Å; R408-E411 PolarHBondContact O-N 2.79Å; R408-F412 WeakPolarHBondContact O-CD2 3.42Å; R408-F412 PolarHBondContact O-N 3.36Å; R408-Y453 WeakPolarHBondContact CD-O 3.46Å; R408-Y453 WeakPolarHBondContact CG-O 3.41Å; R408-S454 PolarHBondContact N-O 3.5Å; R408-P456 HydrophobicContact CB-CG 4.07Å; R408-P456 HydrophobicContact CG-CG 4.29Å; R408-E460 IonicContact NH2-OE1 3.53Å; R408-E460 IonicContact NH2-OE2 3.41Å; R408-E460 PolarHBondContact NH2-OE2 3.39Å
409	R	97.9	Very high	97.7	Very high	162 Å²	162	48.8 Å²	48.8	61%	0.611	25%	0.246	S	C	*	.	H	α-helix	trans	-65.5	-41.5	175.3	179.8	177	178	147	0.9	111.8	V405 L406 S407 E411 F412 Q413	V405-R409 PolarHBondContact O-N 3.25Å; V405-R409 VanDerWaalsContact O-N 3.15Å; L406-R409 WeakPolarHBondContact O-CB 3.35Å; L406-R409 PolarHBondContact O-N 3.35Å; S407-R409 PolarHBondContact O-N 2.85Å; R409-E411 VanDerWaalsContact C-N 3.32Å; R409-F412 PolarHBondContact O-N 2.68Å; R409-Q413 VanDerWaalsContact O-CG 3.27Å; R409-Q413 WeakPolarHBondContact O-CG 3.32Å; R409-Q413 PolarHBondContact O-N 3.22Å; R409-Q413 VanDerWaalsContact O-N 3.11Å
410	F	98.4	Very high	97.6	Very high	11 Å²	11	50.3 Å²	50.3	5%	0.048	27%	0.271	C	S	.	.	H	α-helix	trans	-63.1	-38.3	177.1	-72.1	-10.3	0	0	0	112.3	H340 K343 L406 S407 Q413 A414	H340-F410 HydrophobicContact CB-CD2 3.75Å; H340-F410 HydrophobicContact CB-CE2 4.03Å; H340-F410 HydrophobicContact CB-CG 4.09Å; H340-F410 AromaticContact CD2-CD1 3.42Å; H340-F410 VanDerWaalsContact CD2-CD1 3.42Å; H340-F410 WeakPolarHBondContact CD2-CD1 3.42Å; H340-F410 AromaticContact CD2-CE1 3.69Å; H340-F410 AromaticContact CD2-CG 3.64Å; H340-F410 AromaticContact CE1-CD1 3.98Å; H340-F410 AromaticContact CE1-CG 3.94Å; H340-F410 PolarHBondContact CE1-O 3.44Å; H340-F410 VanDerWaalsContact CE1-O 3.3Å; H340-F410 AromaticContact CG-CD1 3.89Å; H340-F410 AromaticContact CG-CD2 3.78Å; H340-F410 AromaticContact CG-CG 3.58Å; H340-F410 AromaticContact ND1-CG 3.76Å; H340-F410 AromaticContact NE2-CD1 3.52Å; H340-F410 AromaticContact NE2-CG 3.9Å; K343-F410 HydrophobicContact CB-CE2 4.45Å; K343-F410 HydrophobicContact CB-CZ 4.03Å; K343-F410 HydrophobicContact CD-CE1 4Å; K343-F410 HydrophobicContact CD-CZ 3.69Å; L406-F410 HydrophobicContact CD1-CD1 4.27Å; L406-F410 HydrophobicContact CD1-CE1 3.61Å; L406-F410 HydrophobicContact CD1-CE2 4.33Å; L406-F410 HydrophobicContact CD1-CZ 3.64Å; L406-F410 HydrophobicContact CD2-CE2 4.14Å; L406-F410 HydrophobicContact CD2-CZ 3.95Å; L406-F410 HydrophobicContact CG-CD2 4.44Å; L406-F410 HydrophobicContact CG-CE1 4.1Å; L406-F410 HydrophobicContact CG-CE2 3.91Å; L406-F410 HydrophobicContact CG-CZ 3.71Å; L406-F410 PolarHBondContact O-N 2.96Å; S407-F410 WeakPolarHBondContact O-CA 3.48Å; S407-F410 WeakPolarHBondContact O-CB 3.4Å; S407-F410 PolarHBondContact O-N 2.86Å; F410-Q413 WeakPolarHBondContact O-CB 3.31Å; F410-Q413 PolarHBondContact O-N 2.97Å; F410-A414 WeakPolarHBondContact O-CB 3.41Å; F410-A414 PolarHBondContact O-N 3.24Å
411	E	97.9	Very high	97.4	Very high	11 Å²	11	49.9 Å²	49.9	5%	0.051	26%	0.263	C	S	.	.	H	α-helix	trans	-60.1	-49	175.1	-67.5	-65.9	131.5	0	0	112.3	H331 H335 S407 R408 R409 Q413 A414 D415 H455 P456 R461	H331-E411 IonicContact CE1-OE2 3.3Å; H331-E411 PolarHBondContact CE1-OE2 3.06Å; H331-E411 VanDerWaalsContact CE1-OE2 3.29Å; H331-E411 IonicContact NE2-OE2 2.74Å; H331-E411 PolarHBondContact NE2-OE2 3.46Å; H335-E411 IonicContact CE1-OE1 2.76Å; H335-E411 PolarHBondContact CE1-OE1 3.25Å; H335-E411 VanDerWaalsContact CE1-OE1 3.25Å; H335-E411 IonicContact NE2-OE1 3.38Å; H335-E411 PolarHBondContact NE2-OE1 3.23Å; S407-E411 WeakPolarHBondContact O-CG 3.12Å; S407-E411 PolarHBondContact O-N 3.42Å; R408-E411 PolarHBondContact O-N 2.79Å; R409-E411 VanDerWaalsContact C-N 3.32Å; E411-Q413 VanDerWaalsContact C-N 3.26Å; E411-Q413 PolarHBondContact O-N 3.38Å; E411-A414 PolarHBondContact O-N 2.71Å; E411-A414 VanDerWaalsContact O-N 3.17Å; E411-D415 PolarHBondContact O-N 2.72Å; E411-H455 IonicContact OE1-CE1 3.55Å; E411-H455 PolarHBondContact OE1-CE1 2.97Å; E411-H455 VanDerWaalsContact OE1-CE1 3.25Å; E411-H455 IonicContact OE1-ND1 2.7Å; E411-H455 PolarHBondContact OE1-ND1 3.26Å; E411-H455 IonicContact OE2-CE1 3.42Å; E411-H455 PolarHBondContact OE2-CE1 2.95Å; E411-H455 IonicContact OE2-CG 3.47Å; E411-H455 IonicContact OE2-ND1 2.62Å; E411-H455 PolarHBondContact OE2-ND1 3.2Å; E411-P456 VanDerWaalsContact CB-CD 3.5Å; E411-P456 HydrophobicContact CB-CG 4.09Å; E411-R461 IonicContact OE2-CZ 3.36Å; E411-R461 IonicContact OE2-NH1 2.7Å; E411-R461 IonicContact OE2-NH2 3.92Å
412	F	98.2	Very high	97.3	Very high	65 Å²	65	50.3 Å²	50.3	29%	0.285	28%	0.281	S	S	.	.	H	α-helix	trans	-62.6	-34	175.9	-74.8	-60	0	0	0	112.8	R408 R409 A416 P456 E460 R461 A464	R408-F412 WeakPolarHBondContact O-CD2 3.42Å; R408-F412 PolarHBondContact O-N 3.36Å; R409-F412 PolarHBondContact O-N 2.68Å; F412-A416 VanDerWaalsContact O-CB 3.28Å; F412-A416 WeakPolarHBondContact O-CB 3.42Å; F412-A416 PolarHBondContact O-N 2.91Å; F412-P456 HydrophobicContact CD1-CG 4.45Å; F412-P456 HydrophobicContact CD2-CG 3.77Å; F412-P456 HydrophobicContact CE1-CB 4.07Å; F412-P456 HydrophobicContact CE1-CG 4.09Å; F412-P456 HydrophobicContact CE2-CB 3.66Å; F412-P456 HydrophobicContact CE2-CG 3.34Å; F412-P456 HydrophobicContact CG-CG 4.31Å; F412-P456 HydrophobicContact CZ-CB 3.38Å; F412-P456 HydrophobicContact CZ-CG 3.53Å; F412-E460 HydrophobicContact CE1-CB 4.34Å; F412-E460 HydrophobicContact CZ-CB 3.94Å; F412-R461 HydrophobicContact CE1-CG 4.34Å; F412-A464 HydrophobicContact CD1-CB 3.88Å; F412-A464 HydrophobicContact CE1-CB 3.93Å
413	Q	98.4	Very high	97.1	Very high	56 Å²	56	49.6 Å²	49.6	26%	0.262	27%	0.27	S	S	.	.	H	α-helix	trans	-69.4	-37.7	176.2	-71.7	177.3	-12.7	0	0	111.8	L338 H340 R409 F410 E411 A416 F417	L338-Q413 HydrophobicContact CD1-CB 3.78Å; H340-Q413 PolarHBondContact NE2-OE1 2.97Å; R409-Q413 VanDerWaalsContact O-CG 3.27Å; R409-Q413 WeakPolarHBondContact O-CG 3.32Å; R409-Q413 PolarHBondContact O-N 3.22Å; R409-Q413 VanDerWaalsContact O-N 3.11Å; F410-Q413 WeakPolarHBondContact O-CB 3.31Å; F410-Q413 PolarHBondContact O-N 2.97Å; E411-Q413 VanDerWaalsContact C-N 3.26Å; E411-Q413 PolarHBondContact O-N 3.38Å; Q413-A416 PolarHBondContact O-N 2.93Å; Q413-F417 WeakPolarHBondContact O-CB 3.04Å; Q413-F417 PolarHBondContact O-N 3.35Å
414	A	97.9	Very high	97	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-69.2	-41.2	174.5	0	0	0	0	0	112.1	H331 H335 F410 E411 A416 F417 A418	H331-A414 WeakPolarHBondContact ND1-CB 3.49Å; H335-A414 VanDerWaalsContact NE2-CB 3.29Å; H335-A414 WeakPolarHBondContact NE2-CB 3.33Å; F410-A414 WeakPolarHBondContact O-CB 3.41Å; F410-A414 PolarHBondContact O-N 3.24Å; E411-A414 PolarHBondContact O-N 2.71Å; E411-A414 VanDerWaalsContact O-N 3.17Å; A414-A416 PolarHBondContact O-N 3.35Å; A414-F417 WeakPolarHBondContact O-CB 3.25Å; A414-F417 PolarHBondContact O-N 3.03Å; A414-F417 VanDerWaalsContact O-N 3.17Å; A414-A418 PolarHBondContact O-N 3.44Å
415	D	97.8	Very high	96.8	Very high	2 Å²	2	49 Å²	49	1%	0.011	27%	0.274	C	S	.	.	H	α-helix	trans	-59.4	-45.9	171.3	-73.5	-12	0	0	0	111.6	H331 E411 F417 A418 R419 R461 L465	H331-D415 IonicContact CE1-OD1 3.25Å; H331-D415 PolarHBondContact CE1-OD1 2.85Å; H331-D415 IonicContact CG-OD1 2.76Å; H331-D415 IonicContact ND1-OD1 3.98Å; H331-D415 PolarHBondContact ND1-OD1 3.1Å; E411-D415 PolarHBondContact O-N 2.72Å; D415-F417 VanDerWaalsContact C-N 3.27Å; D415-F417 PolarHBondContact O-N 3.49Å; D415-A418 PolarHBondContact O-N 2.97Å; D415-R419 WeakPolarHBondContact O-CB 3.41Å; D415-R419 PolarHBondContact O-N 2.95Å; D415-R461 IonicContact OD1-CZ 2.93Å; D415-R461 IonicContact OD1-NE 3.62Å; D415-R461 IonicContact OD1-NH2 2.79Å; D415-R461 PolarHBondContact OD1-NH2 2.94Å; D415-R461 IonicContact OD2-CZ 3.25Å; D415-R461 IonicContact OD2-NE 3.47Å; D415-R461 PolarHBondContact OD2-NE 3.47Å; D415-R461 IonicContact OD2-NH2 3.41Å; D415-R461 PolarHBondContact OD2-NH2 3.39Å; D415-L465 HydrophobicContact CB-CD2 4.04Å
416	A	97.5	Very high	96.7	Very high	49 Å²	49	48 Å²	48	41%	0.405	27%	0.265	S	S	.	.	H	α-helix	trans	-64	-32.6	176.4	0	0	0	0	0	112.5	F412 Q413 A414 G420	F412-A416 VanDerWaalsContact O-CB 3.28Å; F412-A416 WeakPolarHBondContact O-CB 3.42Å; F412-A416 PolarHBondContact O-N 2.91Å; Q413-A416 PolarHBondContact O-N 2.93Å; A414-A416 PolarHBondContact O-N 3.35Å; A416-G420 PolarHBondContact O-N 2.94Å
417	F	97.4	Very high	96.6	Very high	42 Å²	42	46 Å²	46	18%	0.184	25%	0.254	C	S	.	.	H	α-helix	trans	-67.3	-48.8	174.2	-178.9	-94.1	0	0	0	111.5	I240 G330 K337 L338 Q413 A414 D415 R419 G420 M421	I240-F417 HydrophobicContact CG2-CZ 4.17Å; G330-F417 WeakPolarHBondContact O-CD1 3.34Å; K337-F417 HydrophobicContact CB-CE2 3.93Å; K337-F417 HydrophobicContact CB-CZ 3.88Å; K337-F417 HydrophobicContact CG-CE2 3.65Å; K337-F417 HydrophobicContact CG-CZ 3.86Å; L338-F417 HydrophobicContact CD1-CB 4.39Å; Q413-F417 WeakPolarHBondContact O-CB 3.04Å; Q413-F417 PolarHBondContact O-N 3.35Å; A414-F417 WeakPolarHBondContact O-CB 3.25Å; A414-F417 PolarHBondContact O-N 3.03Å; A414-F417 VanDerWaalsContact O-N 3.17Å; D415-F417 VanDerWaalsContact C-N 3.27Å; D415-F417 PolarHBondContact O-N 3.49Å; F417-R419 VanDerWaalsContact C-N 3.28Å; F417-R419 PolarHBondContact O-N 3.23Å; F417-G420 CarbonylContact O-C 3.56Å; F417-G420 WeakPolarHBondContact O-CA 3.45Å; F417-G420 PolarHBondContact O-N 3.39Å; F417-M421 HydrophobicContact CD1-CG 4.5Å; F417-M421 HydrophobicContact CD1-SD 3.96Å; F417-M421 HydrophobicContact CE1-CG 4.17Å; F417-M421 HydrophobicContact CE1-SD 3.35Å; F417-M421 WeakPolarHBondContact CE1-SD 3.39Å; F417-M421 HydrophobicContact CZ-CG 4.48Å; F417-M421 HydrophobicContact CZ-SD 3.97Å; F417-M421 PolarHBondContact O-N 3.42Å; F417-M421 VanDerWaalsContact O-N 3.08Å
418	A	96.6	Very high	96.4	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-59.3	-39.8	174.9	0	0	0	0	0	111.9	H331 A414 D415 G420 M421 G422 K423 L427	H331-A418 HydrophobicContact CB-CB 4.34Å; A414-A418 PolarHBondContact O-N 3.44Å; D415-A418 PolarHBondContact O-N 2.97Å; A418-G420 VanDerWaalsContact C-N 3.33Å; A418-G420 PolarHBondContact O-N 2.84Å; A418-M421 WeakPolarHBondContact O-CB 3.27Å; A418-M421 PolarHBondContact O-N 2.97Å; A418-M421 VanDerWaalsContact O-N 3.1Å; A418-G422 PolarHBondContact O-N 3.44Å; A418-K423 PolarHBondContact O-N 3.32Å; A418-K423 VanDerWaalsContact O-N 3.11Å; A418-L427 HydrophobicContact CB-CD2 3.66Å
419	R	95.6	Very high	96.2	Very high	139 Å²	139	47 Å²	47	53%	0.525	26%	0.261	S	S	.	.	H	α-helix	trans	-58.6	-43.5	170.7	-172.3	-174.9	80.1	154.4	5	111.9	D415 F417 M421 G422 A424 L465	D415-R419 WeakPolarHBondContact O-CB 3.41Å; D415-R419 PolarHBondContact O-N 2.95Å; F417-R419 VanDerWaalsContact C-N 3.28Å; F417-R419 PolarHBondContact O-N 3.23Å; R419-M421 PolarHBondContact O-N 3.01Å; R419-G422 PolarHBondContact O-N 3.35Å; R419-A424 HydrophobicContact CB-CB 4.3Å; R419-A424 HydrophobicContact CG-CB 3.84Å; R419-L465 HydrophobicContact CB-CD2 4.33Å
420	G	95.2	Very high	96	Very high	69 Å²	69	39.3 Å²	39.3	71%	0.711	23%	0.232	S	C	*	.	H	α-helix	trans	-63	-22.7	175.7	0	0	0	0	0	114.1	A416 F417 A418 G422	A416-G420 PolarHBondContact O-N 2.94Å; F417-G420 CarbonylContact O-C 3.56Å; F417-G420 WeakPolarHBondContact O-CA 3.45Å; F417-G420 PolarHBondContact O-N 3.39Å; A418-G420 VanDerWaalsContact C-N 3.33Å; A418-G420 PolarHBondContact O-N 2.84Å; G420-G422 VanDerWaalsContact C-N 3.28Å
421	M	94.3	Very high	95.8	Very high	53 Å²	53	39.6 Å²	39.6	26%	0.261	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	4.7	171.9	-62.2	-177.8	68.8	0	0	113.5	M236 I240 F417 A418 R419 K423	M236-M421 HydrophobicContact CG-CE 3.64Å; M236-M421 HydrophobicContact SD-CE 4.1Å; I240-M421 HydrophobicContact CG2-CE 3.99Å; I240-M421 HydrophobicContact CG2-SD 4.39Å; F417-M421 HydrophobicContact CD1-CG 4.5Å; F417-M421 HydrophobicContact CD1-SD 3.96Å; F417-M421 HydrophobicContact CE1-CG 4.17Å; F417-M421 HydrophobicContact CE1-SD 3.35Å; F417-M421 WeakPolarHBondContact CE1-SD 3.39Å; F417-M421 HydrophobicContact CZ-CG 4.48Å; F417-M421 HydrophobicContact CZ-SD 3.97Å; F417-M421 PolarHBondContact O-N 3.42Å; F417-M421 VanDerWaalsContact O-N 3.08Å; A418-M421 WeakPolarHBondContact O-CB 3.27Å; A418-M421 PolarHBondContact O-N 2.97Å; A418-M421 VanDerWaalsContact O-N 3.1Å; R419-M421 PolarHBondContact O-N 3.01Å; M421-K423 VanDerWaalsContact C-N 3.34Å; M421-K423 HydrophobicContact CB-CG 4.44Å
422	G	94.8	Very high	95.4	Very high	57 Å²	57	40 Å²	40	59%	0.588	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.8	19.8	-177.7	0	0	0	0	0	114.2	A418 R419 G420	A418-G422 PolarHBondContact O-N 3.44Å; R419-G422 PolarHBondContact O-N 3.35Å; G420-G422 VanDerWaalsContact C-N 3.28Å
423	K	95.3	Very high	95	Very high	48 Å²	48	38.9 Å²	38.9	21%	0.209	23%	0.231	C	C	.	.			trans	-103.5	25.1	-177.6	-64.6	-67.1	178.5	-173.3	0	113.9	A327 A418 M421 E426 L427	A327-K423 HydrophobicContact CB-CB 4Å; A418-K423 PolarHBondContact O-N 3.32Å; A418-K423 VanDerWaalsContact O-N 3.11Å; M421-K423 VanDerWaalsContact C-N 3.34Å; M421-K423 HydrophobicContact CB-CG 4.44Å; K423-E426 WeakPolarHBondContact CA-OE2 3.42Å; K423-L427 WeakPolarHBondContact O-CB 3.38Å; K423-L427 PolarHBondContact O-N 3.02Å
424	A	95	Very high	94.7	Very high	20 Å²	20	37.6 Å²	37.6	17%	0.165	23%	0.226	C	C	.	.	H	α-helix	trans	-68.1	-42.7	-171.5	0	0	0	0	0	112.7	R419 Y428	R419-A424 HydrophobicContact CB-CB 4.3Å; R419-A424 HydrophobicContact CG-CB 3.84Å; A424-Y428 VanDerWaalsContact O-CB 3.29Å; A424-Y428 WeakPolarHBondContact O-CB 3.29Å; A424-Y428 PolarHBondContact O-N 3.2Å
425	S	93.6	Very high	94.4	Very high	56 Å²	56	39 Å²	39	39%	0.392	23%	0.234	S	C	.	.	H	α-helix	trans	-72.4	-40.1	-178.2	72.3	0	0	0	0	111.9	Y428 S429	S425-Y428 WeakPolarHBondContact O-CB 3.34Å; S425-Y428 PolarHBondContact O-N 3.12Å; S425-S429 PolarHBondContact O-N 3.13Å
426	E	95.5	Very high	94	Very high	47 Å²	47	40.3 Å²	40.3	22%	0.22	24%	0.24	C	C	.	.	H	α-helix	trans	-68.8	-38.3	177.6	-59.7	92	155.9	0	0	111	A323 A327 K423 S429 A430	A323-E426 HydrophobicContact CB-CG 4.05Å; A327-E426 HydrophobicContact CB-CB 3.59Å; K423-E426 WeakPolarHBondContact CA-OE2 3.42Å; E426-S429 PolarHBondContact O-N 3.45Å; E426-A430 VanDerWaalsContact O-CB 3.25Å; E426-A430 WeakPolarHBondContact O-CB 3.4Å; E426-A430 PolarHBondContact O-N 3.27Å
427	L	96	Very high	93.7	Very high	2 Å²	2	39.7 Å²	39.7	1%	0.01	23%	0.23	C	C	.	.	H	α-helix	trans	-67.5	-40.3	174.2	-175.2	57.7	0	0	0	111.2	A327 H331 A418 K423 S429 A430 L431 L465	A327-L427 HydrophobicContact CB-CB 3.9Å; A327-L427 VanDerWaalsContact CB-N 3.32Å; H331-L427 HydrophobicContact CB-CD1 4.39Å; H331-L427 HydrophobicContact CB-CD2 4.32Å; A418-L427 HydrophobicContact CB-CD2 3.66Å; K423-L427 WeakPolarHBondContact O-CB 3.38Å; K423-L427 PolarHBondContact O-N 3.02Å; L427-S429 VanDerWaalsContact C-N 3.34Å; L427-S429 PolarHBondContact O-N 2.87Å; L427-A430 PolarHBondContact O-N 3.26Å; L427-L431 HydrophobicContact CD1-CD1 4.42Å; L427-L431 HydrophobicContact CD1-CD2 4.37Å; L427-L431 HydrophobicContact CD1-CG 4.06Å; L427-L431 HydrophobicContact CG-CD1 4.21Å; L427-L431 HydrophobicContact CG-CG 4.3Å; L427-L431 WeakPolarHBondContact O-CB 3.25Å; L427-L431 VanDerWaalsContact O-CG 3.26Å; L427-L431 WeakPolarHBondContact O-CG 3.36Å; L427-L431 PolarHBondContact O-N 2.97Å; L427-L465 HydrophobicContact CB-CD1 4.29Å; L427-L465 HydrophobicContact CD2-CD1 4.08Å; L427-L465 HydrophobicContact CD2-CD2 3.93Å; L427-L465 HydrophobicContact CG-CD1 3.93Å
428	Y	93.8	Very high	93.4	Very high	47 Å²	47	39.5 Å²	39.5	18%	0.184	23%	0.231	C	C	.	.	H	α-helix	trans	-56.2	-49.9	174.2	-172.4	-76.3	0	0	0	110.6	I53 A424 S425 I432 L462 V468	I53-Y428 HydrophobicContact CD1-CE1 4.01Å; A424-Y428 VanDerWaalsContact O-CB 3.29Å; A424-Y428 WeakPolarHBondContact O-CB 3.29Å; A424-Y428 PolarHBondContact O-N 3.2Å; S425-Y428 WeakPolarHBondContact O-CB 3.34Å; S425-Y428 PolarHBondContact O-N 3.12Å; Y428-I432 HydrophobicContact CD1-CD1 3.53Å; Y428-I432 HydrophobicContact CE1-CD1 3.27Å; Y428-I432 WeakPolarHBondContact O-CD1 3.34Å; Y428-I432 WeakPolarHBondContact O-CG1 3.36Å; Y428-I432 PolarHBondContact O-N 3.21Å; Y428-L462 HydrophobicContact CD1-CD2 4.15Å; Y428-L462 HydrophobicContact CD2-CB 4.12Å; Y428-L462 HydrophobicContact CD2-CD2 3.58Å; Y428-L462 HydrophobicContact CD2-CG 4.36Å; Y428-L462 HydrophobicContact CE1-CD2 4.27Å; Y428-L462 HydrophobicContact CE2-CB 3.59Å; Y428-L462 HydrophobicContact CE2-CD1 4.32Å; Y428-L462 HydrophobicContact CE2-CD2 3.72Å; Y428-L462 HydrophobicContact CE2-CG 4.04Å; Y428-L462 HydrophobicContact CG-CD2 3.78Å; Y428-V468 HydrophobicContact CD2-CG2 4.5Å
429	S	92.4	Very high	93.3	Very high	51 Å²	51	40.4 Å²	40.4	36%	0.357	24%	0.235	S	C	.	.	H	α-helix	trans	-61.3	-47.3	176	-168.1	0	0	0	0	112.3	E324 S425 E426 L427 L431 I432 K433	E324-S429 WeakPolarHBondContact OE1-CB 3.39Å; E324-S429 PolarHBondContact OE1-OG 3.05Å; S425-S429 PolarHBondContact O-N 3.13Å; E426-S429 PolarHBondContact O-N 3.45Å; L427-S429 VanDerWaalsContact C-N 3.34Å; L427-S429 PolarHBondContact O-N 2.87Å; S429-L431 PolarHBondContact O-N 3.2Å; S429-I432 WeakPolarHBondContact O-CB 3.34Å; S429-I432 PolarHBondContact O-N 3.47Å; S429-K433 PolarHBondContact O-N 2.8Å
430	A	93.8	Very high	93.1	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-60.7	-44	-178.5	0	0	0	0	0	112.4	E324 V328 E426 L427 I432 K433 L434	E324-A430 HydrophobicContact CB-CB 3.85Å; E324-A430 HydrophobicContact CG-CB 4.21Å; V328-A430 HydrophobicContact CG2-CB 3.72Å; E426-A430 VanDerWaalsContact O-CB 3.25Å; E426-A430 WeakPolarHBondContact O-CB 3.4Å; E426-A430 PolarHBondContact O-N 3.27Å; L427-A430 PolarHBondContact O-N 3.26Å; A430-I432 VanDerWaalsContact C-N 3.3Å; A430-I432 PolarHBondContact O-N 2.93Å; A430-K433 PolarHBondContact O-N 3.4Å; A430-L434 WeakPolarHBondContact O-CB 3.23Å; A430-L434 VanDerWaalsContact O-CG 3.25Å; A430-L434 WeakPolarHBondContact O-CG 3.41Å; A430-L434 PolarHBondContact O-N 2.75Å
431	L	94.1	Very high	93	Very high	18 Å²	18	32 Å²	32	9%	0.094	19%	0.187	C	C	.	.	H	α-helix	trans	-62.7	-38.4	179.2	-71	177.1	0	0	0	112.2	L427 S429 N435 L458 R461 L462 L465	L427-L431 HydrophobicContact CD1-CD1 4.42Å; L427-L431 HydrophobicContact CD1-CD2 4.37Å; L427-L431 HydrophobicContact CD1-CG 4.06Å; L427-L431 HydrophobicContact CG-CD1 4.21Å; L427-L431 HydrophobicContact CG-CG 4.3Å; L427-L431 WeakPolarHBondContact O-CB 3.25Å; L427-L431 VanDerWaalsContact O-CG 3.26Å; L427-L431 WeakPolarHBondContact O-CG 3.36Å; L427-L431 PolarHBondContact O-N 2.97Å; S429-L431 PolarHBondContact O-N 3.2Å; L431-N435 WeakPolarHBondContact O-CB 3.39Å; L431-N435 PolarHBondContact O-N 2.89Å; L431-L458 HydrophobicContact CB-CD1 3.74Å; L431-R461 HydrophobicContact CD1-CB 4.16Å; L431-L462 HydrophobicContact CB-CD2 4.32Å; L431-L462 HydrophobicContact CD1-CD2 4.44Å; L431-L465 HydrophobicContact CD1-CD1 3.89Å
432	I	90.6	Very high	92.7	Very high	18 Å²	18	29.7 Å²	29.7	9%	0.092	18%	0.176	C	C	.	.	H	α-helix	trans	-65.2	-51.5	174.5	-71	159.3	0	0	0	110	I53 Y428 S429 A430 L434 N435 M436 L462	I53-I432 HydrophobicContact CD1-CD1 3.84Å; I53-I432 HydrophobicContact CG2-CB 4.15Å; I53-I432 HydrophobicContact CG2-CD1 3.53Å; I53-I432 HydrophobicContact CG2-CG1 3.92Å; I53-I432 HydrophobicContact CG2-CG2 3.21Å; Y428-I432 HydrophobicContact CD1-CD1 3.53Å; Y428-I432 HydrophobicContact CE1-CD1 3.27Å; Y428-I432 WeakPolarHBondContact O-CD1 3.34Å; Y428-I432 WeakPolarHBondContact O-CG1 3.36Å; Y428-I432 PolarHBondContact O-N 3.21Å; S429-I432 WeakPolarHBondContact O-CB 3.34Å; S429-I432 PolarHBondContact O-N 3.47Å; A430-I432 VanDerWaalsContact C-N 3.3Å; A430-I432 PolarHBondContact O-N 2.93Å; I432-L434 VanDerWaalsContact C-N 3.34Å; I432-L434 PolarHBondContact O-N 2.7Å; I432-N435 PolarHBondContact O-N 3.41Å; I432-N435 VanDerWaalsContact O-N 3.14Å; I432-M436 HydrophobicContact CG2-CG 4.47Å; I432-M436 HydrophobicContact CG2-SD 4Å; I432-M436 WeakPolarHBondContact O-CG 3.49Å; I432-M436 PolarHBondContact O-N 3.06Å; I432-L462 HydrophobicContact CD1-CD1 4.17Å; I432-L462 HydrophobicContact CD1-CD2 4.33Å; I432-L462 HydrophobicContact CG1-CD1 3.96Å; I432-L462 HydrophobicContact CG1-CD2 4.22Å
433	K	90.4	Very high	92.5	Very high	43 Å²	43	28.5 Å²	28.5	19%	0.187	16%	0.158	C	C	.	.	H	α-helix	trans	-59.7	-46	-177	-159.8	175.3	-166.2	-169.9	0	110.9	E280 G319 E324 S429 A430 N435 M436 D437	E280-K433 IonicContact OE2-NZ 3.91Å; E280-K433 PolarHBondContact OE2-NZ 2.92Å; G319-K433 WeakPolarHBondContact O-CD 3.4Å; G319-K433 WeakPolarHBondContact O-CE 3.42Å; G319-K433 PolarHBondContact O-NZ 3.06Å; E324-K433 WeakPolarHBondContact OE2-CD 3.41Å; E324-K433 IonicContact OE2-NZ 3.64Å; E324-K433 PolarHBondContact OE2-NZ 3.18Å; S429-K433 PolarHBondContact O-N 2.8Å; A430-K433 PolarHBondContact O-N 3.4Å; K433-N435 PolarHBondContact O-N 3.37Å; K433-M436 PolarHBondContact O-N 2.84Å; K433-D437 WeakPolarHBondContact O-CB 3.34Å; K433-D437 VanDerWaalsContact O-CG 3.31Å; K433-D437 PolarHBondContact O-N 3.03Å
434	L	91.9	Very high	92.5	Very high	28 Å²	28	27.4 Å²	27.4	15%	0.147	16%	0.157	C	C	.	.	H	α-helix	trans	-64.1	-37.3	175.6	-70.1	170.4	0	0	0	113.2	L278 V328 A430 I432 M436 N438	L278-L434 HydrophobicContact CD1-CD1 4.36Å; L278-L434 HydrophobicContact CD1-CD2 3.48Å; L278-L434 VanDerWaalsContact CD1-CD2 3.48Å; L278-L434 HydrophobicContact CD1-CG 4.39Å; V328-L434 HydrophobicContact CG2-CD1 4.04Å; A430-L434 WeakPolarHBondContact O-CB 3.23Å; A430-L434 VanDerWaalsContact O-CG 3.25Å; A430-L434 WeakPolarHBondContact O-CG 3.41Å; A430-L434 PolarHBondContact O-N 2.75Å; I432-L434 VanDerWaalsContact C-N 3.34Å; I432-L434 PolarHBondContact O-N 2.7Å; L434-M436 VanDerWaalsContact C-N 3.34Å; L434-N438 VanDerWaalsContact O-CB 3.29Å; L434-N438 WeakPolarHBondContact O-CB 3.34Å; L434-N438 PolarHBondContact O-N 3.19Å; L434-N438 PolarHBondContact O-ND2 2.94Å
435	N	91.5	Very high	92.6	Very high	31 Å²	31	27.1 Å²	27.1	17%	0.166	15%	0.153	C	C	.	.	H	α-helix	trans	-66	-39.5	174.7	-176.9	86.9	0	0	0	111.2	L431 I432 K433 L439 G440 L458	L431-N435 WeakPolarHBondContact O-CB 3.39Å; L431-N435 PolarHBondContact O-N 2.89Å; I432-N435 PolarHBondContact O-N 3.41Å; I432-N435 VanDerWaalsContact O-N 3.14Å; K433-N435 PolarHBondContact O-N 3.37Å; N435-L439 PolarHBondContact O-N 3.17Å; N435-G440 PolarHBondContact ND2-O 2.97Å; N435-G440 PolarHBondContact O-N 3.42Å; N435-G440 WeakPolarHBondContact OD1-CA 3.33Å; N435-G440 PolarHBondContact OD1-O 2.88Å; N435-L458 HydrophobicContact CB-CD2 3.8Å
436	M	89.1	Confident	92.7	Very high	29 Å²	29	32.1 Å²	32.1	14%	0.143	16%	0.163	C	C	.	.	H	α-helix	trans	-68.1	-47.2	176.6	-68.9	-178.9	72.4	0	0	111.9	D55 T58 I432 K433 L434 N438 L439	D55-M436 WeakPolarHBondContact OD2-CE 3.38Å; T58-M436 HydrophobicContact CG2-CB 4.21Å; T58-M436 HydrophobicContact CG2-CE 3.82Å; T58-M436 HydrophobicContact CG2-CG 4.26Å; I432-M436 HydrophobicContact CG2-CG 4.47Å; I432-M436 HydrophobicContact CG2-SD 4Å; I432-M436 WeakPolarHBondContact O-CG 3.49Å; I432-M436 PolarHBondContact O-N 3.06Å; K433-M436 PolarHBondContact O-N 2.84Å; L434-M436 VanDerWaalsContact C-N 3.34Å; M436-N438 VanDerWaalsContact C-N 3.26Å; M436-N438 PolarHBondContact O-N 2.84Å; M436-L439 PolarHBondContact O-N 3.35Å; M436-L439 VanDerWaalsContact O-N 3.07Å
437	D	90.2	Very high	92.8	Very high	36 Å²	36	30.8 Å²	30.8	19%	0.193	16%	0.158	C	C	.	.	H	α-helix	trans	-60.8	-36.9	179.5	-73.2	-5.8	0	0	0	111.6	F150 Q318 G319 K433	F150-D437 WeakPolarHBondContact CE1-O 3.23Å; Q318-D437 HydrophobicContact CG-CB 4.38Å; G319-D437 PolarHBondContact N-OD2 3.48Å; K433-D437 WeakPolarHBondContact O-CB 3.34Å; K433-D437 VanDerWaalsContact O-CG 3.31Å; K433-D437 PolarHBondContact O-N 3.03Å
438	N	92.6	Very high	92.9	Very high	38 Å²	38	32 Å²	32	20%	0.203	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	6.3	178.2	-67.7	-53.4	0	0	0	114.1	H258 S259 L434 M436 G440	H258-N438 WeakPolarHBondContact CA-OD1 3.31Å; H258-N438 PolarHBondContact ND1-OD1 2.83Å; S259-N438 PolarHBondContact N-OD1 2.66Å; L434-N438 VanDerWaalsContact O-CB 3.29Å; L434-N438 WeakPolarHBondContact O-CB 3.34Å; L434-N438 PolarHBondContact O-N 3.19Å; L434-N438 PolarHBondContact O-ND2 2.94Å; M436-N438 VanDerWaalsContact C-N 3.26Å; M436-N438 PolarHBondContact O-N 2.84Å; N438-G440 PolarHBondContact O-N 3.31Å; N438-G440 VanDerWaalsContact O-N 3.16Å
439	L	93.3	Very high	93.1	Very high	19 Å²	19	29.8 Å²	29.8	10%	0.099	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.9	39.7	-175.1	-66.6	-176.5	0	0	0	113.1	T58 K61 S62 Y65 Q66 F150 N435 M436	T58-L439 HydrophobicContact CG2-CD2 4.23Å; K61-L439 HydrophobicContact CB-CD1 4.28Å; K61-L439 HydrophobicContact CB-CD2 3.86Å; S62-L439 WeakPolarHBondContact OG-CA 3.44Å; Y65-L439 HydrophobicContact CD1-CB 3.66Å; Y65-L439 HydrophobicContact CE1-CB 4.32Å; Y65-L439 HydrophobicContact CG-CB 4.28Å; Y65-L439 HydrophobicContact CG-CD1 4.5Å; Q66-L439 PolarHBondContact NE2-O 2.98Å; Q66-L439 VanDerWaalsContact NE2-O 3.08Å; F150-L439 HydrophobicContact CE2-CB 4.05Å; F150-L439 HydrophobicContact CE2-CD1 3.68Å; F150-L439 HydrophobicContact CE2-CG 4.05Å; F150-L439 HydrophobicContact CZ-CB 3.77Å; F150-L439 HydrophobicContact CZ-CD1 3.76Å; F150-L439 HydrophobicContact CZ-CG 3.65Å; N435-L439 PolarHBondContact O-N 3.17Å; M436-L439 PolarHBondContact O-N 3.35Å; M436-L439 VanDerWaalsContact O-N 3.07Å
440	G	92.4	Very high	93.2	Very high	15 Å²	15	30.1 Å²	30.1	16%	0.155	15%	0.151	C	C	.	.			trans	-68.1	129.8	174.2	0	0	0	0	0	110.6	N435 N438	N435-G440 PolarHBondContact ND2-O 2.97Å; N435-G440 PolarHBondContact O-N 3.42Å; N435-G440 WeakPolarHBondContact OD1-CA 3.33Å; N435-G440 PolarHBondContact OD1-O 2.88Å; N438-G440 PolarHBondContact O-N 3.31Å; N438-G440 VanDerWaalsContact O-N 3.16Å
441	F	93.1	Very high	93.4	Very high	16 Å²	16	32.6 Å²	32.6	7%	0.07	16%	0.16	C	C	.	.			trans	-86.1	120.1	177.3	-167.5	-103.3	0	0	0	110	I39 Y40 T43 F59 R63 Q66 V443	I39-F441 HydrophobicContact CG2-CE1 3.96Å; Y40-F441 HydrophobicContact CD1-CB 4.46Å; Y40-F441 AromaticContact CD1-CD1 3.49Å; Y40-F441 HydrophobicContact CD1-CD1 3.49Å; Y40-F441 VanDerWaalsContact CD1-CD1 3.49Å; Y40-F441 AromaticContact CD1-CE1 3.82Å; Y40-F441 HydrophobicContact CD1-CE1 3.82Å; Y40-F441 AromaticContact CD1-CG 3.98Å; Y40-F441 HydrophobicContact CD1-CG 3.98Å; Y40-F441 HydrophobicContact CE1-CB 4.01Å; Y40-F441 AromaticContact CE1-CD1 3.5Å; Y40-F441 HydrophobicContact CE1-CD1 3.5Å; Y40-F441 HydrophobicContact CE1-CE1 4.24Å; Y40-F441 AromaticContact CE1-CG 3.95Å; Y40-F441 HydrophobicContact CE1-CG 3.95Å; T43-F441 HydrophobicContact CG2-CZ 4.26Å; F59-F441 HydrophobicContact CD2-CE2 4.24Å; F59-F441 AromaticContact CE1-CE2 3.92Å; F59-F441 HydrophobicContact CE1-CE2 3.92Å; F59-F441 HydrophobicContact CE1-CZ 4.31Å; F59-F441 HydrophobicContact CE2-CD2 4.33Å; F59-F441 AromaticContact CE2-CE2 3.53Å; F59-F441 HydrophobicContact CE2-CE2 3.53Å; F59-F441 AromaticContact CE2-CZ 3.91Å; F59-F441 HydrophobicContact CE2-CZ 3.91Å; F59-F441 HydrophobicContact CZ-CD2 4.5Å; F59-F441 AromaticContact CZ-CE2 3.35Å; F59-F441 HydrophobicContact CZ-CE2 3.35Å; F59-F441 AromaticContact CZ-CZ 3.52Å; F59-F441 HydrophobicContact CZ-CZ 3.52Å; R63-F441 HydrophobicContact CB-CD2 3.98Å; R63-F441 HydrophobicContact CB-CE2 3.68Å; R63-F441 HydrophobicContact CG-CD2 4.35Å; R63-F441 HydrophobicContact CG-CE2 3.76Å; R63-F441 HydrophobicContact CG-CZ 4.26Å; Q66-F441 HydrophobicContact CB-CB 4.26Å; Q66-F441 HydrophobicContact CG-CB 3.57Å; F441-V443 VanDerWaalsContact C-N 3.28Å; F441-V443 HydrophobicContact CD1-CB 4.34Å; F441-V443 WeakPolarHBondContact CD1-O 3.36Å; F441-V443 HydrophobicContact CE1-CB 3.84Å; F441-V443 WeakPolarHBondContact CE1-O 3.37Å; F441-V443 PolarHBondContact O-N 3.03Å
442	P	88.6	Confident	93.5	Very high	4 Å²	4	35 Å²	35	3%	0.026	17%	0.171	C	C	.	.	S	Bend	trans	-81.4	-5.4	-163.1	32.6	-38	0	0	0	114.4	L50 M54 F59 L458	L50-P442 HydrophobicContact CD1-CB 3.41Å; L50-P442 VanDerWaalsContact CD1-CB 3.41Å; L50-P442 HydrophobicContact CD1-CG 3.39Å; M54-P442 HydrophobicContact SD-CG 3.96Å; F59-P442 HydrophobicContact CD2-CG 4.43Å; F59-P442 HydrophobicContact CE2-CG 4.21Å; P442-L458 HydrophobicContact CB-CD2 4.22Å
443	V	90.6	Very high	93.8	Very high	33 Å²	33	37 Å²	37	20%	0.2	18%	0.178	C	C	.	.			trans	-113.2	126.7	179.6	-175.1	0	0	0	0	109.4	I39 P47 F441	I39-V443 HydrophobicContact CG2-CB 4.29Å; I39-V443 HydrophobicContact CG2-CG1 3.9Å; P47-V443 HydrophobicContact CG-CG2 3.48Å; P47-V443 VanDerWaalsContact CG-CG2 3.48Å; F441-V443 VanDerWaalsContact C-N 3.28Å; F441-V443 HydrophobicContact CD1-CB 4.34Å; F441-V443 WeakPolarHBondContact CD1-O 3.36Å; F441-V443 HydrophobicContact CE1-CB 3.84Å; F441-V443 WeakPolarHBondContact CE1-O 3.37Å; F441-V443 PolarHBondContact O-N 3.03Å
444	A	94.1	Very high	93.9	Very high	24 Å²	24	37.5 Å²	37.5	20%	0.198	19%	0.187	C	C	.	.			trans	-129.1	152.9	177.8	0	0	0	0	0	111.5	Y453	A444-Y453 HydrophobicContact CB-CD2 4.45Å; A444-Y453 HydrophobicContact CB-CE2 3.58Å
445	D	97.3	Very high	93.9	Very high	14 Å²	14	40.7 Å²	40.7	8%	0.075	20%	0.201	C	C	.	.			trans	-69.5	130	172.1	176.3	-106.5	0	0	0	107.2	R35 I39 L447 F448 S449	R35-D445 HydrophobicContact CB-CB 4.36Å; R35-D445 IonicContact CZ-OD1 3.85Å; R35-D445 IonicContact CZ-OD2 3.51Å; R35-D445 IonicContact NE-OD1 2.87Å; R35-D445 PolarHBondContact NE-OD1 3.46Å; R35-D445 IonicContact NE-OD2 2.7Å; R35-D445 PolarHBondContact NE-OD2 3.29Å; R35-D445 IonicContact NH2-OD1 3.62Å; R35-D445 PolarHBondContact NH2-OD1 2.82Å; R35-D445 IonicContact NH2-OD2 3.56Å; R35-D445 PolarHBondContact NH2-OD2 3.42Å; I39-D445 HydrophobicContact CD1-CB 3.5Å; I39-D445 VanDerWaalsContact CD1-CB 3.5Å; I39-D445 HydrophobicContact CG1-CB 4.46Å; D445-L447 PolarHBondContact O-N 3.25Å; D445-L447 WeakPolarHBondContact OD1-CB 3.34Å; D445-L447 PolarHBondContact OD1-N 2.99Å; D445-F448 HydrophobicContact CB-CB 3.96Å; D445-F448 PolarHBondContact O-N 3.32Å; D445-F448 PolarHBondContact OD1-N 2.9Å; D445-F448 VanDerWaalsContact OD1-N 3.09Å; D445-S449 WeakPolarHBondContact O-CB 3.39Å; D445-S449 PolarHBondContact O-N 3.3Å; D445-S449 PolarHBondContact O-OG 3.2Å
446	W	96.6	Very high	94.1	Very high	161 Å²	161	39.4 Å²	39.4	61%	0.61	19%	0.194	S	C	*	.	H	α-helix	trans	-59.8	-32.8	-173.4	68.5	-90.7	0	0	0	112.7	S449 M450	W446-S449 PolarHBondContact O-OG 2.93Å; W446-M450 WeakPolarHBondContact O-CB 3.18Å; W446-M450 PolarHBondContact O-N 2.92Å
447	L	97.8	Very high	94.3	Very high	19 Å²	19	38.9 Å²	38.9	10%	0.099	19%	0.193	C	C	.	.	H	α-helix	trans	-81.2	-42.1	-177.4	-174.3	63.3	0	0	0	110.5	W28 Y31 L32 D445 M450 W451	W28-L447 HydrophobicContact CH2-CD1 4.22Å; W28-L447 HydrophobicContact CH2-CD2 3.82Å; W28-L447 HydrophobicContact CH2-CG 4.25Å; W28-L447 HydrophobicContact CZ2-CD1 4.38Å; W28-L447 HydrophobicContact CZ3-CD2 4.49Å; Y31-L447 HydrophobicContact CE1-CD2 3.98Å; L32-L447 HydrophobicContact CD2-CB 4.31Å; L32-L447 HydrophobicContact CD2-CD2 3.64Å; L32-L447 HydrophobicContact CD2-CG 3.51Å; D445-L447 PolarHBondContact O-N 3.25Å; D445-L447 WeakPolarHBondContact OD1-CB 3.34Å; D445-L447 PolarHBondContact OD1-N 2.99Å; L447-M450 HydrophobicContact CD1-CE 3.67Å; L447-M450 PolarHBondContact O-N 3.44Å; L447-W451 PolarHBondContact O-N 3.43Å
448	F	97.7	Very high	94.4	Very high	27 Å²	27	38.2 Å²	38.2	12%	0.118	19%	0.189	C	C	.	.	H	α-helix	trans	-59.9	-48	171.8	-178.8	-92.5	0	0	0	111.9	L32 Q36 D445 M450 W451 H452 Y453	L32-F448 HydrophobicContact CB-CD2 3.92Å; L32-F448 WeakPolarHBondContact O-CD2 3.39Å; Q36-F448 HydrophobicContact CB-CB 4.04Å; Q36-F448 HydrophobicContact CB-CD1 3.82Å; Q36-F448 HydrophobicContact CB-CD2 3.69Å; Q36-F448 HydrophobicContact CB-CE1 4.17Å; Q36-F448 HydrophobicContact CB-CE2 4.07Å; Q36-F448 HydrophobicContact CB-CG 3.57Å; Q36-F448 HydrophobicContact CB-CZ 4.31Å; Q36-F448 HydrophobicContact CG-CD1 3.63Å; Q36-F448 HydrophobicContact CG-CD2 4.3Å; Q36-F448 HydrophobicContact CG-CE1 3.71Å; Q36-F448 HydrophobicContact CG-CE2 4.39Å; Q36-F448 HydrophobicContact CG-CG 3.96Å; Q36-F448 HydrophobicContact CG-CZ 4.11Å; D445-F448 HydrophobicContact CB-CB 3.96Å; D445-F448 PolarHBondContact O-N 3.32Å; D445-F448 PolarHBondContact OD1-N 2.9Å; D445-F448 VanDerWaalsContact OD1-N 3.09Å; F448-M450 VanDerWaalsContact C-N 3.32Å; F448-M450 PolarHBondContact O-N 2.87Å; F448-W451 PolarHBondContact O-N 2.92Å; F448-H452 AromaticContact CD2-CD2 3.42Å; F448-H452 VanDerWaalsContact CD2-CD2 3.42Å; F448-H452 WeakPolarHBondContact CD2-CD2 3.47Å; F448-H452 AromaticContact CD2-NE2 3.85Å; F448-H452 HydrophobicContact CE1-CB 4.48Å; F448-H452 AromaticContact CE2-CD2 3.26Å; F448-H452 WeakPolarHBondContact CE2-CD2 3.45Å; F448-H452 AromaticContact CE2-NE2 3.55Å; F448-H452 AromaticContact CG-CD2 3.93Å; F448-H452 HydrophobicContact CZ-CB 4.5Å; F448-H452 AromaticContact CZ-CD2 3.65Å; F448-H452 PolarHBondContact O-CD2 3.42Å; F448-H452 PolarHBondContact O-N 2.96Å; F448-Y453 HydrophobicContact CD1-CE1 4.06Å; F448-Y453 HydrophobicContact CE1-CD1 4.29Å; F448-Y453 AromaticContact CE1-CE1 3.51Å; F448-Y453 HydrophobicContact CE1-CE1 3.51Å; F448-Y453 AromaticContact CE1-CZ 3.91Å
449	S	96.8	Very high	94.3	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.014	19%	0.185	C	C	.	.	H	α-helix	trans	-67	-34.2	179.7	70.9	0	0	0	0	112	D445 W446 W451 Y453	D445-S449 WeakPolarHBondContact O-CB 3.39Å; D445-S449 PolarHBondContact O-N 3.3Å; D445-S449 PolarHBondContact O-OG 3.2Å; W446-S449 PolarHBondContact O-OG 2.93Å; S449-W451 VanDerWaalsContact C-N 3.29Å; S449-W451 PolarHBondContact O-N 3.17Å; S449-Y453 WeakPolarHBondContact O-CB 3.27Å; S449-Y453 PolarHBondContact O-N 3.34Å; S449-Y453 VanDerWaalsContact O-N 3.13Å
450	M	96.1	Very high	94.3	Very high	58 Å²	58	39.7 Å²	39.7	29%	0.286	20%	0.195	S	C	.	.	H	α-helix	trans	-61.6	-37.8	174.4	-174.8	-176.6	79.9	0	0	112.6	F401 W446 L447 F448	F401-M450 HydrophobicContact CE2-CE 4.18Å; F401-M450 HydrophobicContact CE2-CG 4.1Å; F401-M450 HydrophobicContact CZ-CE 4.17Å; F401-M450 HydrophobicContact CZ-CG 4.31Å; W446-M450 WeakPolarHBondContact O-CB 3.18Å; W446-M450 PolarHBondContact O-N 2.92Å; L447-M450 HydrophobicContact CD1-CE 3.67Å; L447-M450 PolarHBondContact O-N 3.44Å; F448-M450 VanDerWaalsContact C-N 3.32Å; F448-M450 PolarHBondContact O-N 2.87Å
451	W	96.8	Very high	94.4	Very high	51 Å²	51	40.1 Å²	40.1	19%	0.193	19%	0.192	C	C	.	.	H	α-helix	trans	-83.2	-42.4	-176.8	-167.5	-99.2	0	0	0	113.3	W28 E29 L32 F401 L447 F448 S449	W28-W451 AromaticContact CD1-CE2 3.96Å; W28-W451 AromaticContact CD1-CZ2 3.94Å; W28-W451 HydrophobicContact CZ2-CE3 4.49Å; W28-W451 AromaticContact NE1-CD2 3.55Å; W28-W451 AromaticContact NE1-CE2 3.54Å; W28-W451 AromaticContact NE1-CE3 3.68Å; W28-W451 AromaticContact NE1-CH2 3.85Å; W28-W451 AromaticContact NE1-CZ2 3.71Å; W28-W451 AromaticContact NE1-CZ3 3.83Å; E29-W451 VanDerWaalsContact CD-NE1 3.34Å; E29-W451 PolarHBondContact OE1-NE1 3.1Å; E29-W451 PolarHBondContact OE2-NE1 3.47Å; L32-W451 HydrophobicContact CD1-CB 3.54Å; L32-W451 HydrophobicContact CD1-CD2 4.21Å; L32-W451 HydrophobicContact CD1-CG 3.5Å; F401-W451 HydrophobicContact CB-CH2 4.36Å; F401-W451 HydrophobicContact CB-CZ3 4.2Å; F401-W451 HydrophobicContact CD2-CD2 4.06Å; F401-W451 AromaticContact CD2-CE3 3.38Å; F401-W451 HydrophobicContact CD2-CE3 3.38Å; F401-W451 AromaticContact CD2-CZ3 3.69Å; F401-W451 HydrophobicContact CD2-CZ3 3.69Å; F401-W451 AromaticContact CE2-CE3 3.79Å; F401-W451 HydrophobicContact CE2-CE3 3.79Å; F401-W451 HydrophobicContact CE2-CZ3 4.26Å; F401-W451 HydrophobicContact CG-CE3 4.12Å; F401-W451 AromaticContact CG-CZ3 3.95Å; F401-W451 HydrophobicContact CG-CZ3 3.95Å; L447-W451 PolarHBondContact O-N 3.43Å; F448-W451 PolarHBondContact O-N 2.92Å; S449-W451 VanDerWaalsContact C-N 3.29Å; S449-W451 PolarHBondContact O-N 3.17Å
452	H	96.1	Very high	94.3	Very high	70 Å²	70	39.5 Å²	39.5	32%	0.324	19%	0.189	S	C	.	.	H	α-helix	trans	-104.8	-29.5	-169	-68.1	-68.8	0	0	0	116.1	E29 F448 S454	E29-H452 VanDerWaalsContact CD-CE1 3.48Å; E29-H452 IonicContact OE1-CE1 3.39Å; E29-H452 IonicContact OE2-CE1 2.7Å; E29-H452 PolarHBondContact OE2-CE1 3.38Å; E29-H452 IonicContact OE2-ND1 3.74Å; E29-H452 IonicContact OE2-NE2 2.98Å; E29-H452 PolarHBondContact OE2-NE2 3.12Å; F448-H452 AromaticContact CD2-CD2 3.42Å; F448-H452 VanDerWaalsContact CD2-CD2 3.42Å; F448-H452 WeakPolarHBondContact CD2-CD2 3.47Å; F448-H452 AromaticContact CD2-NE2 3.85Å; F448-H452 HydrophobicContact CE1-CB 4.48Å; F448-H452 AromaticContact CE2-CD2 3.26Å; F448-H452 WeakPolarHBondContact CE2-CD2 3.45Å; F448-H452 AromaticContact CE2-NE2 3.55Å; F448-H452 AromaticContact CG-CD2 3.93Å; F448-H452 HydrophobicContact CZ-CB 4.5Å; F448-H452 AromaticContact CZ-CD2 3.65Å; F448-H452 PolarHBondContact O-CD2 3.42Å; F448-H452 PolarHBondContact O-N 2.96Å; H452-S454 PolarHBondContact O-N 3.47Å
453	Y	96.6	Very high	94.4	Very high	60 Å²	60	46 Å²	46	24%	0.235	21%	0.213	C	C	.	.			trans	-84.9	108.1	-167	-72.2	-0.8	0	0	0	110.8	T404 R408 A444 F448 S449 H455 P457	T404-Y453 WeakPolarHBondContact CG2-O 3.48Å; R408-Y453 WeakPolarHBondContact CD-O 3.46Å; R408-Y453 WeakPolarHBondContact CG-O 3.41Å; A444-Y453 HydrophobicContact CB-CD2 4.45Å; A444-Y453 HydrophobicContact CB-CE2 3.58Å; F448-Y453 HydrophobicContact CD1-CE1 4.06Å; F448-Y453 HydrophobicContact CE1-CD1 4.29Å; F448-Y453 AromaticContact CE1-CE1 3.51Å; F448-Y453 HydrophobicContact CE1-CE1 3.51Å; F448-Y453 AromaticContact CE1-CZ 3.91Å; S449-Y453 WeakPolarHBondContact O-CB 3.27Å; S449-Y453 PolarHBondContact O-N 3.34Å; S449-Y453 VanDerWaalsContact O-N 3.13Å; Y453-H455 WeakPolarHBondContact CB-O 3.5Å; Y453-H455 PolarHBondContact O-N 3.39Å; Y453-P457 HydrophobicContact CD2-CG 4.18Å
454	S	92.9	Very high	94.5	Very high	52 Å²	52	46.9 Å²	46.9	36%	0.364	22%	0.224	S	C	.	.	S	Bend	trans	-67.9	-25.5	171	58.2	0	0	0	0	112.6	S407 R408 H452	S407-S454 CarbonylContact C-O 3.53Å; S407-S454 WeakPolarHBondContact CB-O 3.37Å; S407-S454 PolarHBondContact OG-O 3.43Å; R408-S454 PolarHBondContact N-O 3.5Å; H452-S454 PolarHBondContact O-N 3.47Å
455	H	93.1	Very high	94.4	Very high	95 Å²	95	46.1 Å²	46.1	44%	0.44	22%	0.216	S	C	.	.	S	Bend	trans	-104.8	131	170	-63.2	-94.2	0	0	0	110.4	E411 Y453	E411-H455 IonicContact OE1-CE1 3.55Å; E411-H455 PolarHBondContact OE1-CE1 2.97Å; E411-H455 VanDerWaalsContact OE1-CE1 3.25Å; E411-H455 IonicContact OE1-ND1 2.7Å; E411-H455 PolarHBondContact OE1-ND1 3.26Å; E411-H455 IonicContact OE2-CE1 3.42Å; E411-H455 PolarHBondContact OE2-CE1 2.95Å; E411-H455 IonicContact OE2-CG 3.47Å; E411-H455 IonicContact OE2-ND1 2.62Å; E411-H455 PolarHBondContact OE2-ND1 3.2Å; Y453-H455 WeakPolarHBondContact CB-O 3.5Å; Y453-H455 PolarHBondContact O-N 3.39Å
456	P	94.1	Very high	93.6	Very high	5 Å²	5	46.7 Å²	46.7	3%	0.032	23%	0.225	C	C	.	.			trans	-57.4	146.4	175.5	-18.2	29.1	0	0	0	111.4	R408 E411 F412 E460 R461	R408-P456 HydrophobicContact CB-CG 4.07Å; R408-P456 HydrophobicContact CG-CG 4.29Å; E411-P456 VanDerWaalsContact CB-CD 3.5Å; E411-P456 HydrophobicContact CB-CG 4.09Å; F412-P456 HydrophobicContact CD1-CG 4.45Å; F412-P456 HydrophobicContact CD2-CG 3.77Å; F412-P456 HydrophobicContact CE1-CB 4.07Å; F412-P456 HydrophobicContact CE1-CG 4.09Å; F412-P456 HydrophobicContact CE2-CB 3.66Å; F412-P456 HydrophobicContact CE2-CG 3.34Å; F412-P456 HydrophobicContact CG-CG 4.31Å; F412-P456 HydrophobicContact CZ-CB 3.38Å; F412-P456 HydrophobicContact CZ-CG 3.53Å; P456-E460 HydrophobicContact CB-CB 4.36Å; P456-R461 HydrophobicContact CB-CG 3.98Å; P456-R461 HydrophobicContact CG-CG 4.35Å; P456-R461 WeakPolarHBondContact O-CD 3.45Å
457	P	94	Very high	91.8	Very high	17 Å²	17	45.9 Å²	45.9	11%	0.11	23%	0.233	C	C	.	.			trans	-47.7	144.4	173.8	-27.4	32.4	0	0	0	112.5	Y453 L459 E460 R461	Y453-P457 HydrophobicContact CD2-CG 4.18Å; P457-L459 VanDerWaalsContact C-N 3.27Å; P457-L459 PolarHBondContact O-N 2.99Å; P457-L459 VanDerWaalsContact O-N 3.16Å; P457-E460 HydrophobicContact CB-CG 4.25Å; P457-E460 HydrophobicContact CG-CG 4.36Å; P457-E460 WeakPolarHBondContact O-CB 3.46Å; P457-E460 PolarHBondContact O-N 3.2Å; P457-R461 PolarHBondContact O-N 2.9Å
458	L	92	Very high	89.7	Confident	22 Å²	22	48 Å²	48	12%	0.115	25%	0.247	C	C	.	.	H	α-helix	trans	-47.8	-49.9	-176	176.5	65	0	0	0	112.1	L431 N435 P442 E460 R461 L462	L431-L458 HydrophobicContact CB-CD1 3.74Å; N435-L458 HydrophobicContact CB-CD2 3.8Å; P442-L458 HydrophobicContact CB-CD2 4.22Å; L458-E460 VanDerWaalsContact C-N 3.28Å; L458-E460 PolarHBondContact O-N 3.46Å; L458-R461 PolarHBondContact O-N 2.93Å; L458-R461 VanDerWaalsContact O-N 3.08Å; L458-L462 HydrophobicContact CD1-CD1 4.09Å; L458-L462 HydrophobicContact CD1-CD2 4.15Å; L458-L462 HydrophobicContact CD1-CG 3.95Å; L458-L462 HydrophobicContact CD2-CD1 4.35Å; L458-L462 HydrophobicContact CG-CD1 3.87Å; L458-L462 HydrophobicContact CG-CG 4.11Å; L458-L462 WeakPolarHBondContact O-CG 3.44Å; L458-L462 PolarHBondContact O-N 3.11Å
459	L	89.8	Confident	86.9	Confident	24 Å²	24	54.1 Å²	54.1	13%	0.126	27%	0.273	C	S	.	.	H	α-helix	trans	-59.4	-35.7	-179.4	-70.2	178.1	0	0	0	113.4	E49 L50 P457 R463	E49-L459 HydrophobicContact CB-CD2 4.31Å; L50-L459 HydrophobicContact CD1-CD1 4.45Å; L50-L459 HydrophobicContact CD1-CD2 3.89Å; L50-L459 HydrophobicContact CD1-CG 4.32Å; L50-L459 HydrophobicContact CD2-CD2 3.64Å; L50-L459 HydrophobicContact CG-CD2 3.71Å; P457-L459 VanDerWaalsContact C-N 3.27Å; P457-L459 PolarHBondContact O-N 2.99Å; P457-L459 VanDerWaalsContact O-N 3.16Å; L459-R463 WeakPolarHBondContact O-CB 3.38Å; L459-R463 WeakPolarHBondContact O-CD 3.49Å; L459-R463 WeakPolarHBondContact O-CG 3.4Å; L459-R463 PolarHBondContact O-N 2.97Å; L459-R463 VanDerWaalsContact O-N 3.08Å
460	E	93.1	Very high	84.1	Confident	64 Å²	64	61.1 Å²	61.1	30%	0.299	31%	0.306	S	S	.	.	H	α-helix	trans	-66.4	-41.3	176.4	-62.9	-178.1	-170.3	0	0	111	R408 F412 P456 P457 L458 A464	R408-E460 IonicContact NH2-OE1 3.53Å; R408-E460 IonicContact NH2-OE2 3.41Å; R408-E460 PolarHBondContact NH2-OE2 3.39Å; F412-E460 HydrophobicContact CE1-CB 4.34Å; F412-E460 HydrophobicContact CZ-CB 3.94Å; P456-E460 HydrophobicContact CB-CB 4.36Å; P457-E460 HydrophobicContact CB-CG 4.25Å; P457-E460 HydrophobicContact CG-CG 4.36Å; P457-E460 WeakPolarHBondContact O-CB 3.46Å; P457-E460 PolarHBondContact O-N 3.2Å; L458-E460 VanDerWaalsContact C-N 3.28Å; L458-E460 PolarHBondContact O-N 3.46Å; E460-A464 WeakPolarHBondContact O-CB 3.29Å; E460-A464 PolarHBondContact O-N 3.37Å; E460-A464 VanDerWaalsContact O-N 3.09Å
461	R	94.6	Very high	81	Confident	24 Å²	24	67.3 Å²	67.3	9%	0.091	34%	0.34	C	S	.	.	H	α-helix	trans	-67	-45.8	177.9	-62.2	-178.1	66.1	-179.9	2.9	111.9	H331 E411 F412 D415 L431 P456 P457 L458 R463 A464 L465	H331-R461 PolarHBondContact CE1-NH2 2.91Å; H331-R461 PolarHBondContact ND1-NH2 2.93Å; E411-R461 IonicContact OE2-CZ 3.36Å; E411-R461 IonicContact OE2-NH1 2.7Å; E411-R461 IonicContact OE2-NH2 3.92Å; F412-R461 HydrophobicContact CE1-CG 4.34Å; D415-R461 IonicContact OD1-CZ 2.93Å; D415-R461 IonicContact OD1-NE 3.62Å; D415-R461 IonicContact OD1-NH2 2.79Å; D415-R461 PolarHBondContact OD1-NH2 2.94Å; D415-R461 IonicContact OD2-CZ 3.25Å; D415-R461 IonicContact OD2-NE 3.47Å; D415-R461 PolarHBondContact OD2-NE 3.47Å; D415-R461 IonicContact OD2-NH2 3.41Å; D415-R461 PolarHBondContact OD2-NH2 3.39Å; L431-R461 HydrophobicContact CD1-CB 4.16Å; P456-R461 HydrophobicContact CB-CG 3.98Å; P456-R461 HydrophobicContact CG-CG 4.35Å; P456-R461 WeakPolarHBondContact O-CD 3.45Å; P457-R461 PolarHBondContact O-N 2.9Å; L458-R461 PolarHBondContact O-N 2.93Å; L458-R461 VanDerWaalsContact O-N 3.08Å; R461-R463 VanDerWaalsContact C-N 3.34Å; R461-R463 PolarHBondContact O-N 3.1Å; R461-A464 WeakPolarHBondContact O-CB 3.45Å; R461-A464 PolarHBondContact O-N 3.47Å; R461-A464 VanDerWaalsContact O-N 3.1Å; R461-L465 WeakPolarHBondContact O-CG 3.3Å; R461-L465 PolarHBondContact O-N 2.98Å
462	L	91.6	Very high	80.2	Confident	4 Å²	4	68.1 Å²	68.1	2%	0.021	35%	0.347	C	S	.	.	H	α-helix	trans	-59.3	-44.1	177.4	-66.1	-176.4	0	0	0	111.5	L50 Y428 L431 I432 L458 A464 L465 G466	L50-L462 HydrophobicContact CD2-CD1 4.37Å; Y428-L462 HydrophobicContact CD1-CD2 4.15Å; Y428-L462 HydrophobicContact CD2-CB 4.12Å; Y428-L462 HydrophobicContact CD2-CD2 3.58Å; Y428-L462 HydrophobicContact CD2-CG 4.36Å; Y428-L462 HydrophobicContact CE1-CD2 4.27Å; Y428-L462 HydrophobicContact CE2-CB 3.59Å; Y428-L462 HydrophobicContact CE2-CD1 4.32Å; Y428-L462 HydrophobicContact CE2-CD2 3.72Å; Y428-L462 HydrophobicContact CE2-CG 4.04Å; Y428-L462 HydrophobicContact CG-CD2 3.78Å; L431-L462 HydrophobicContact CB-CD2 4.32Å; L431-L462 HydrophobicContact CD1-CD2 4.44Å; I432-L462 HydrophobicContact CD1-CD1 4.17Å; I432-L462 HydrophobicContact CD1-CD2 4.33Å; I432-L462 HydrophobicContact CG1-CD1 3.96Å; I432-L462 HydrophobicContact CG1-CD2 4.22Å; L458-L462 HydrophobicContact CD1-CD1 4.09Å; L458-L462 HydrophobicContact CD1-CD2 4.15Å; L458-L462 HydrophobicContact CD1-CG 3.95Å; L458-L462 HydrophobicContact CD2-CD1 4.35Å; L458-L462 HydrophobicContact CG-CD1 3.87Å; L458-L462 HydrophobicContact CG-CG 4.11Å; L458-L462 WeakPolarHBondContact O-CG 3.44Å; L458-L462 PolarHBondContact O-N 3.11Å; L462-A464 VanDerWaalsContact C-N 3.32Å; L462-A464 PolarHBondContact O-N 2.95Å; L462-L465 PolarHBondContact O-N 3.41Å; L462-G466 PolarHBondContact O-N 3.38Å
463	R	91	Very high	79.3	Confident	141 Å²	141	68 Å²	68	53%	0.532	35%	0.348	S	S	.	.	H	α-helix	trans	-62.7	-37.3	174.8	-70.2	170.9	-166.5	162.6	-1.2	112.4	E49 L459 R461 G466	E49-R463 IonicContact OE1-CZ 3.83Å; E49-R463 IonicContact OE1-NH2 2.84Å; E49-R463 PolarHBondContact OE1-NH2 3.17Å; E49-R463 IonicContact OE2-CZ 3.45Å; E49-R463 IonicContact OE2-NE 3.42Å; E49-R463 PolarHBondContact OE2-NE 3.22Å; E49-R463 IonicContact OE2-NH2 2.71Å; E49-R463 PolarHBondContact OE2-NH2 3.25Å; L459-R463 WeakPolarHBondContact O-CB 3.38Å; L459-R463 WeakPolarHBondContact O-CD 3.49Å; L459-R463 WeakPolarHBondContact O-CG 3.4Å; L459-R463 PolarHBondContact O-N 2.97Å; L459-R463 VanDerWaalsContact O-N 3.08Å; R461-R463 VanDerWaalsContact C-N 3.34Å; R461-R463 PolarHBondContact O-N 3.1Å; R463-G466 PolarHBondContact O-N 3.48Å
464	A	93.2	Very high	78.4	Confident	50 Å²	50	68.4 Å²	68.4	41%	0.413	36%	0.355	S	S	.	.	H	α-helix	trans	-70.4	-33.4	178.6	0	0	0	0	0	113.4	F412 E460 R461 L462 G466	F412-A464 HydrophobicContact CD1-CB 3.88Å; F412-A464 HydrophobicContact CE1-CB 3.93Å; E460-A464 WeakPolarHBondContact O-CB 3.29Å; E460-A464 PolarHBondContact O-N 3.37Å; E460-A464 VanDerWaalsContact O-N 3.09Å; R461-A464 WeakPolarHBondContact O-CB 3.45Å; R461-A464 PolarHBondContact O-N 3.47Å; R461-A464 VanDerWaalsContact O-N 3.1Å; L462-A464 VanDerWaalsContact C-N 3.32Å; L462-A464 PolarHBondContact O-N 2.95Å; A464-G466 PolarHBondContact O-N 2.98Å
465	L	91.3	Very high	77.5	Confident	8 Å²	8	69.4 Å²	69.4	4%	0.042	35%	0.354	C	S	.	.	H	α-helix	trans	-68.2	-19.6	171.6	-69.5	171.2	0	0	0	112.2	D415 R419 L427 L431 R461 L462	D415-L465 HydrophobicContact CB-CD2 4.04Å; R419-L465 HydrophobicContact CB-CD2 4.33Å; L427-L465 HydrophobicContact CB-CD1 4.29Å; L427-L465 HydrophobicContact CD2-CD1 4.08Å; L427-L465 HydrophobicContact CD2-CD2 3.93Å; L427-L465 HydrophobicContact CG-CD1 3.93Å; L431-L465 HydrophobicContact CD1-CD1 3.89Å; R461-L465 WeakPolarHBondContact O-CG 3.3Å; R461-L465 PolarHBondContact O-N 2.98Å; L462-L465 PolarHBondContact O-N 3.41Å
466	G	80.1	Confident	76.5	Confident	26 Å²	26	67.8 Å²	67.8	27%	0.268	35%	0.349	S	S	.	.			trans	90.3	153.6	179.6	0	0	0	0	0	111.5	L462 R463 A464 V468	L462-G466 PolarHBondContact O-N 3.38Å; R463-G466 PolarHBondContact O-N 3.48Å; A464-G466 PolarHBondContact O-N 2.98Å; G466-V468 VanDerWaalsContact C-N 3.25Å; G466-V468 PolarHBondContact O-N 3.21Å
467	N	59.5	Low	75.4	Confident	145 Å²	145	72 Å²	72	78%	0.775	37%	0.37	S	S	*	.			trans	-63.3	94.9	167.3	-78.1	-8.7	0	0	0	107.3	K469	N467-K469 PolarHBondContact O-N 3.28Å
468	V	53.2	Low	74	Confident	63 Å²	63	75.9 Å²	75.9	38%	0.382	39%	0.389	S	S	.	.			trans	-56.1	113.1	165.7	-177.9	0	0	0	0	104.6	Y428 G466 Q470	Y428-V468 HydrophobicContact CD2-CG2 4.5Å; G466-V468 VanDerWaalsContact C-N 3.25Å; G466-V468 PolarHBondContact O-N 3.21Å; V468-Q470 PolarHBondContact O-N 3.09Å
469	K	39.4	Very low	72.7	Confident	156 Å²	156	80.1 Å²	80.1	68%	0.678	41%	0.41	S	S	*	.			trans	-44.3	116.4	178.9	-76.4	167.9	135.6	-131.3	0	108.8	N467 D471	N467-K469 PolarHBondContact O-N 3.28Å; K469-D471 HydrophobicContact CB-CB 4.29Å; K469-D471 WeakPolarHBondContact CD-OD2 3.41Å; K469-D471 IonicContact NZ-OD2 2.76Å; K469-D471 PolarHBondContact NZ-OD2 3.12Å; K469-D471 PolarHBondContact O-N 3.26Å
470	Q	37.2	Very low	71.2	Confident	148 Å²	148	84.8 Å²	84.8	69%	0.692	43%	0.433	S	S	*	.			trans	-71.9	70.5	154.3	-70.1	-176.2	-20.3	0	0	105.6	V468	V468-Q470 PolarHBondContact O-N 3.09Å
471	D	30.7	Very low	69.2	Low	188 Å²	188	86.6 Å²	86.6	100%	1.005	45%	0.445	S	S	*	.			trans	-89.5	0	165.9	-77	-8.2	0	0	0	108	K469	K469-D471 HydrophobicContact CB-CB 4.29Å; K469-D471 WeakPolarHBondContact CD-OD2 3.41Å; K469-D471 IonicContact NZ-OD2 2.76Å; K469-D471 PolarHBondContact NZ-OD2 3.12Å; K469-D471 PolarHBondContact O-N 3.26Å

Retrieved 471 of 471 residues in 1110.4 ms (Link to these results)

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