A0A087XQ65_POEFO Loading...

Methylsterol monooxygenase 1

AlphaFold DB (A0A3B3VCZ1), UniProt , Accession A0A087XQ65, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 291 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.8	Very low	53.1	Low	250 Å²	250	104.1 Å²	104.1	100%	1.232	63%	0.634	S	S	*	*				0	74.6	0	-64.9	-179.1	-151	0	0	109.4
2	A	46.8	Very low	54.1	Low	97 Å²	97	101.6 Å²	101.6	80%	0.802	62%	0.624	S	S	*	*			trans	-135	25.9	-176.8	0	0	0	0	0	112.3
3	A	46.4	Very low	54.8	Low	75 Å²	75	97.8 Å²	97.8	62%	0.62	61%	0.609	S	S	*	*	S	Bend	trans	-98.9	-14.3	-177.4	0	0	0	0	0	114
4	N	52.9	Low	55.5	Low	126 Å²	126	99.9 Å²	99.9	67%	0.674	61%	0.606	S	S	*	*	H	α-helix	trans	-82.8	-25.6	-175.1	-84.8	16.4	0	0	0	114.5	S7 D8	N4-S7 PolarHBondContact O-OG 2.99Å; N4-D8 PolarHBondContact O-N 3.39Å
5	G	47.3	Very low	56.2	Low	45 Å²	45	100.3 Å²	100.3	46%	0.464	60%	0.602	S	S	.	*	H	α-helix	trans	-70.5	-37.8	-175.3	0	0	0	0	0	113.3	I9	G5-I9 WeakPolarHBondContact O-CD1 3.44Å; G5-I9 WeakPolarHBondContact O-CG1 3.46Å; G5-I9 PolarHBondContact O-N 3.42Å
6	T	52.5	Low	56.9	Low	91 Å²	91	97.4 Å²	97.4	56%	0.558	59%	0.592	S	S	*	*	H	α-helix	trans	-74.7	-35	-179.8	8	0	0	0	0	112.6	L10	T6-L10 WeakPolarHBondContact O-CB 3.39Å; T6-L10 VanDerWaalsContact O-CG 3.3Å; T6-L10 WeakPolarHBondContact O-CG 3.22Å; T6-L10 PolarHBondContact O-N 3.05Å; T6-L10 VanDerWaalsContact O-N 3.09Å
7	S	55.9	Low	57.3	Low	52 Å²	52	95.7 Å²	95.7	36%	0.364	58%	0.582	S	S	.	*	H	α-helix	trans	-67.8	-36.7	175.4	54	0	0	0	0	112.5	N4 S11	N4-S7 PolarHBondContact O-OG 2.99Å; S7-S11 WeakPolarHBondContact O-CB 3.38Å; S7-S11 PolarHBondContact O-N 2.82Å; S7-S11 PolarHBondContact O-OG 3.41Å
8	D	60.7	Low	57.9	Low	101 Å²	101	94.4 Å²	94.4	54%	0.54	57%	0.568	S	S	.	*	H	α-helix	trans	-70.6	-38.8	177.6	-79.9	-15.9	0	0	0	111.9	N4 S12	N4-D8 PolarHBondContact O-N 3.39Å; D8-S12 VanDerWaalsContact O-CB 3.28Å; D8-S12 WeakPolarHBondContact O-CB 3.47Å; D8-S12 PolarHBondContact O-N 3.32Å; D8-S12 PolarHBondContact O-OG 3.38Å
9	I	61.6	Low	58.4	Low	118 Å²	118	98.4 Å²	98.4	61%	0.605	57%	0.574	S	S	*	*	H	α-helix	trans	-67.8	-44.6	177.2	-67.3	165.4	0	0	0	111	G5 S12 A13	G5-I9 WeakPolarHBondContact O-CD1 3.44Å; G5-I9 WeakPolarHBondContact O-CG1 3.46Å; G5-I9 PolarHBondContact O-N 3.42Å; I9-S12 PolarHBondContact O-N 3.15Å; I9-A13 WeakPolarHBondContact O-CB 3.33Å; I9-A13 PolarHBondContact O-N 3.49Å
10	L	57.9	Low	58.8	Low	124 Å²	124	97.6 Å²	97.6	65%	0.649	57%	0.569	S	S	*	*	H	α-helix	trans	-65.3	-39.6	178.1	-71.8	171.2	0	0	0	111.8	T6 A13 F14	T6-L10 WeakPolarHBondContact O-CB 3.39Å; T6-L10 VanDerWaalsContact O-CG 3.3Å; T6-L10 WeakPolarHBondContact O-CG 3.22Å; T6-L10 PolarHBondContact O-N 3.05Å; T6-L10 VanDerWaalsContact O-N 3.09Å; L10-A13 PolarHBondContact O-N 3.01Å; L10-F14 WeakPolarHBondContact O-CB 3.37Å; L10-F14 PolarHBondContact O-N 3.18Å
11	S	61.2	Low	59	Low	66 Å²	66	94.5 Å²	94.5	46%	0.462	55%	0.551	S	S	.	*	H	α-helix	trans	-65.1	-40.5	174.2	-61.5	0	0	0	0	111.6	S7 F14 L15	S7-S11 WeakPolarHBondContact O-CB 3.38Å; S7-S11 PolarHBondContact O-N 2.82Å; S7-S11 PolarHBondContact O-OG 3.41Å; S11-F14 PolarHBondContact O-N 3.46Å; S11-L15 WeakPolarHBondContact O-CB 3.3Å; S11-L15 VanDerWaalsContact O-CG 3.25Å; S11-L15 WeakPolarHBondContact O-CG 3.49Å; S11-L15 PolarHBondContact O-N 3.32Å
12	S	65.8	Low	60.2	Low	74 Å²	74	86.6 Å²	86.6	52%	0.517	53%	0.526	S	S	.	.	H	α-helix	trans	-66.7	-40.2	177.7	-59.4	0	0	0	0	112.4	D8 I9 L15 A16	D8-S12 VanDerWaalsContact O-CB 3.28Å; D8-S12 WeakPolarHBondContact O-CB 3.47Å; D8-S12 PolarHBondContact O-N 3.32Å; D8-S12 PolarHBondContact O-OG 3.38Å; I9-S12 PolarHBondContact O-N 3.15Å; S12-L15 PolarHBondContact O-N 3.09Å; S12-A16 WeakPolarHBondContact O-CB 3.33Å; S12-A16 PolarHBondContact O-N 2.97Å
13	A	62.1	Low	61.3	Low	52 Å²	52	86.9 Å²	86.9	43%	0.43	52%	0.517	S	S	.	.	H	α-helix	trans	-66.3	-40.6	175.2	0	0	0	0	0	111.6	I9 L10 A16 V17	I9-A13 WeakPolarHBondContact O-CB 3.33Å; I9-A13 PolarHBondContact O-N 3.49Å; L10-A13 PolarHBondContact O-N 3.01Å; A13-A16 PolarHBondContact O-N 3.24Å; A13-V17 WeakPolarHBondContact O-CG2 3.32Å; A13-V17 PolarHBondContact O-N 3.23Å
14	F	64.7	Low	62.3	Low	128 Å²	128	88.1 Å²	88.1	56%	0.561	51%	0.512	S	S	*	.	H	α-helix	trans	-61.9	-47.5	175	-174.3	-96.2	0	0	0	111.7	L10 S11 A16 V17 E18	L10-F14 WeakPolarHBondContact O-CB 3.37Å; L10-F14 PolarHBondContact O-N 3.18Å; S11-F14 PolarHBondContact O-N 3.46Å; F14-A16 VanDerWaalsContact C-N 3.31Å; F14-A16 PolarHBondContact O-N 3.11Å; F14-V17 PolarHBondContact O-N 3.38Å; F14-E18 HydrophobicContact CD1-CG 4.31Å; F14-E18 HydrophobicContact CE1-CG 3.96Å; F14-E18 VanDerWaalsContact CE1-OE1 3.26Å; F14-E18 WeakPolarHBondContact CE1-OE1 3.27Å; F14-E18 HydrophobicContact CZ-CG 4.34Å; F14-E18 PolarHBondContact O-N 2.88Å
15	L	66.9	Low	62.9	Low	106 Å²	106	87.6 Å²	87.6	56%	0.555	52%	0.516	S	S	*	.	H	α-helix	trans	-62.1	-36.1	175.9	-72.4	168.6	0	0	0	112.7	S11 S12 E18 Y19	S11-L15 WeakPolarHBondContact O-CB 3.3Å; S11-L15 VanDerWaalsContact O-CG 3.25Å; S11-L15 WeakPolarHBondContact O-CG 3.49Å; S11-L15 PolarHBondContact O-N 3.32Å; S12-L15 PolarHBondContact O-N 3.09Å; L15-E18 PolarHBondContact O-N 3.05Å; L15-Y19 WeakPolarHBondContact O-CB 3.48Å; L15-Y19 PolarHBondContact O-N 3.4Å
16	A	67.6	Low	63.9	Low	54 Å²	54	93.9 Å²	93.9	45%	0.446	53%	0.533	S	S	.	.	H	α-helix	trans	-66	-39.7	175.5	0	0	0	0	0	112	S12 A13 F14 Y19 V20	S12-A16 WeakPolarHBondContact O-CB 3.33Å; S12-A16 PolarHBondContact O-N 2.97Å; A13-A16 PolarHBondContact O-N 3.24Å; F14-A16 VanDerWaalsContact C-N 3.31Å; F14-A16 PolarHBondContact O-N 3.11Å; A16-Y19 PolarHBondContact O-N 3.06Å; A16-V20 VanDerWaalsContact O-CG2 3.3Å; A16-V20 WeakPolarHBondContact O-CG2 3.37Å; A16-V20 PolarHBondContact O-N 2.84Å
17	V	62.8	Low	64.8	Low	68 Å²	68	91.9 Å²	91.9	41%	0.412	52%	0.519	S	S	.	.	H	α-helix	trans	-65.4	-44.3	174.4	173	0	0	0	0	110.7	A13 F14 Y19 V20 D21	A13-V17 WeakPolarHBondContact O-CG2 3.32Å; A13-V17 PolarHBondContact O-N 3.23Å; F14-V17 PolarHBondContact O-N 3.38Å; V17-Y19 VanDerWaalsContact C-N 3.31Å; V17-Y19 PolarHBondContact O-N 3.48Å; V17-V20 PolarHBondContact O-N 2.94Å; V17-D21 WeakPolarHBondContact O-CB 3.48Å; V17-D21 PolarHBondContact O-N 2.85Å
18	E	67.5	Low	65.8	Low	73 Å²	73	94.7 Å²	94.7	34%	0.341	54%	0.536	S	S	.	.	H	α-helix	trans	-62.2	-38.4	175.8	-71.3	-165.4	143.8	0	0	112.6	F14 L15 D21 A22	F14-E18 HydrophobicContact CD1-CG 4.31Å; F14-E18 HydrophobicContact CE1-CG 3.96Å; F14-E18 VanDerWaalsContact CE1-OE1 3.26Å; F14-E18 WeakPolarHBondContact CE1-OE1 3.27Å; F14-E18 HydrophobicContact CZ-CG 4.34Å; F14-E18 PolarHBondContact O-N 2.88Å; L15-E18 PolarHBondContact O-N 3.05Å; E18-D21 PolarHBondContact O-N 3.4Å; E18-A22 WeakPolarHBondContact O-CB 3.39Å; E18-A22 PolarHBondContact O-N 2.92Å
19	Y	69.1	Low	66.8	Low	170 Å²	170	95.6 Å²	95.6	67%	0.667	54%	0.541	S	S	*	.	H	α-helix	trans	-67.2	-45.3	176.8	-179.7	-99.3	0	0	0	112.1	L15 A16 V17 D21 A22 V23	L15-Y19 WeakPolarHBondContact O-CB 3.48Å; L15-Y19 PolarHBondContact O-N 3.4Å; A16-Y19 PolarHBondContact O-N 3.06Å; V17-Y19 VanDerWaalsContact C-N 3.31Å; V17-Y19 PolarHBondContact O-N 3.48Å; Y19-D21 VanDerWaalsContact C-N 3.3Å; Y19-D21 PolarHBondContact O-N 3.48Å; Y19-A22 PolarHBondContact O-N 2.86Å; Y19-V23 HydrophobicContact CE1-CG2 4.34Å; Y19-V23 HydrophobicContact CE2-CG2 4.46Å; Y19-V23 WeakPolarHBondContact O-CG2 3.47Å; Y19-V23 PolarHBondContact O-N 2.84Å
20	V	66.4	Low	67.8	Low	81 Å²	81	94.1 Å²	94.1	49%	0.491	53%	0.531	S	S	.	.	H	α-helix	trans	-60.2	-43.7	175.4	170.2	0	0	0	0	110.3	A16 V17 A22 V23 L24	A16-V20 VanDerWaalsContact O-CG2 3.3Å; A16-V20 WeakPolarHBondContact O-CG2 3.37Å; A16-V20 PolarHBondContact O-N 2.84Å; V17-V20 PolarHBondContact O-N 2.94Å; V20-A22 VanDerWaalsContact C-N 3.33Å; V20-A22 PolarHBondContact O-N 3.03Å; V20-V23 PolarHBondContact O-N 3.36Å; V20-L24 HydrophobicContact CG1-CD1 4.3Å; V20-L24 WeakPolarHBondContact O-CG 3.39Å; V20-L24 PolarHBondContact O-N 2.96Å
21	D	61.9	Low	69.3	Low	33 Å²	33	92.4 Å²	92.4	18%	0.176	53%	0.527	C	S	.	.	H	α-helix	trans	-61.2	-38.6	176.7	-81.6	-7.8	0	0	0	112.6	V17 E18 Y19 V23 L24 R134 T136	V17-D21 WeakPolarHBondContact O-CB 3.48Å; V17-D21 PolarHBondContact O-N 2.85Å; E18-D21 PolarHBondContact O-N 3.4Å; Y19-D21 VanDerWaalsContact C-N 3.3Å; Y19-D21 PolarHBondContact O-N 3.48Å; D21-V23 PolarHBondContact O-N 2.95Å; D21-L24 PolarHBondContact O-N 3Å; D21-R134 WeakPolarHBondContact OD2-CD 3.26Å; D21-R134 IonicContact OD2-NH1 2.66Å; D21-T136 WeakPolarHBondContact OD1-CG2 3.37Å; D21-T136 PolarHBondContact OD1-OG1 2.87Å; D21-T136 PolarHBondContact OD2-OG1 3.38Å
22	A	65.7	Low	70.7	Confident	85 Å²	85	93.2 Å²	93.2	70%	0.702	53%	0.533	S	S	*	.	H	α-helix	trans	-67.8	-19.6	179	0	0	0	0	0	113.7	E18 Y19 V20	E18-A22 WeakPolarHBondContact O-CB 3.39Å; E18-A22 PolarHBondContact O-N 2.92Å; Y19-A22 PolarHBondContact O-N 2.86Å; V20-A22 VanDerWaalsContact C-N 3.33Å; V20-A22 PolarHBondContact O-N 3.03Å
23	V	71.1	Confident	71.9	Confident	102 Å²	102	92.3 Å²	92.3	62%	0.618	52%	0.522	S	S	*	.	H	α-helix	trans	-101.4	-13.1	-177.6	-175.9	0	0	0	0	111.7	Y19 V20 D21	Y19-V23 HydrophobicContact CE1-CG2 4.34Å; Y19-V23 HydrophobicContact CE2-CG2 4.46Å; Y19-V23 WeakPolarHBondContact O-CG2 3.47Å; Y19-V23 PolarHBondContact O-N 2.84Å; V20-V23 PolarHBondContact O-N 3.36Å; D21-V23 PolarHBondContact O-N 2.95Å
24	L	67.5	Low	73.3	Confident	101 Å²	101	96.2 Å²	96.2	53%	0.529	53%	0.526	S	S	.	.	S	Bend	trans	-73.9	140	174.7	-73.2	171.8	0	0	0	111	V20 D21	V20-L24 HydrophobicContact CG1-CD1 4.3Å; V20-L24 WeakPolarHBondContact O-CG 3.39Å; V20-L24 PolarHBondContact O-N 2.96Å; D21-L24 PolarHBondContact O-N 3Å
25	P	64.9	Low	74.8	Confident	115 Å²	115	97 Å²	97	75%	0.747	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-62.2	147.1	177.3	25.3	-32.8	0	0	0	111.2	N27	P25-N27 PolarHBondContact O-N 3.01Å
26	E	68	Low	76.1	Confident	178 Å²	178	94.7 Å²	94.7	83%	0.832	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-55.3	132	174.2	-72.5	-168	170.4	0	0	110.4	P28	E26-P28 WeakPolarHBondContact O-CD 3.47Å
27	N	72.1	Confident	77.5	Confident	48 Å²	48	92.7 Å²	92.7	26%	0.257	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-69.2	118.5	-176.9	176.5	-15.4	0	0	0	109	P25 L29 Q30 W135	P25-N27 PolarHBondContact O-N 3.01Å; N27-L29 PolarHBondContact O-N 3.15Å; N27-L29 WeakPolarHBondContact OD1-CB 3.44Å; N27-L29 PolarHBondContact OD1-N 2.91Å; N27-Q30 HydrophobicContact CB-CB 4.14Å; N27-Q30 WeakPolarHBondContact O-CB 3.38Å; N27-Q30 PolarHBondContact O-N 3.47Å; N27-W135 PolarHBondContact ND2-NE1 2.89Å
28	P	76.9	Confident	79.1	Confident	112 Å²	112	90.5 Å²	90.5	73%	0.727	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-17.3	-175.9	26.4	-35.3	0	0	0	113.5	E26	E26-P28 WeakPolarHBondContact O-CD 3.47Å
29	L	80.7	Confident	80.5	Confident	120 Å²	120	93.5 Å²	93.5	63%	0.628	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-14.1	175.2	-58	177.7	0	0	0	113	N27 S32 L33	N27-L29 PolarHBondContact O-N 3.15Å; N27-L29 WeakPolarHBondContact OD1-CB 3.44Å; N27-L29 PolarHBondContact OD1-N 2.91Å; L29-S32 PolarHBondContact O-N 3.38Å; L29-L33 WeakPolarHBondContact O-CB 3.28Å; L29-L33 PolarHBondContact O-N 2.77Å
30	Q	84	Confident	81.9	Confident	87 Å²	87	87 Å²	87	41%	0.407	48%	0.484	S	S	.	.	H	α-helix	trans	-61.1	-41.5	-175.4	-170.2	176.2	7.1	0	0	113.4	N27 L33 R34 W129	N27-Q30 HydrophobicContact CB-CB 4.14Å; N27-Q30 WeakPolarHBondContact O-CB 3.38Å; N27-Q30 PolarHBondContact O-N 3.47Å; Q30-L33 PolarHBondContact O-N 2.99Å; Q30-R34 WeakPolarHBondContact O-CB 3.22Å; Q30-R34 PolarHBondContact O-N 3.06Å; Q30-W129 HydrophobicContact CG-CH2 4.34Å; Q30-W129 HydrophobicContact CG-CZ2 3.82Å
31	P	87.6	Confident	83.4	Confident	88 Å²	88	85.7 Å²	85.7	57%	0.571	47%	0.474	S	S	*	.	H	α-helix	trans	-63.8	-44.5	176.7	-22.5	34.7	0	0	0	112.5	R34 H35	P31-R34 PolarHBondContact O-N 3.08Å; P31-H35 PolarHBondContact O-N 2.93Å
32	S	91.4	Very high	85.1	Confident	83 Å²	83	90.8 Å²	90.8	58%	0.58	50%	0.502	S	S	*	.	H	α-helix	trans	-64.7	-42.7	178.2	-58	0	0	0	0	111.6	L29 H35 A36	L29-S32 PolarHBondContact O-N 3.38Å; S32-H35 PolarHBondContact O-N 3.19Å; S32-A36 WeakPolarHBondContact O-CB 3.35Å; S32-A36 PolarHBondContact O-N 2.72Å
33	L	90.4	Very high	86.6	Confident	55 Å²	55	90.8 Å²	90.8	29%	0.288	49%	0.49	S	S	.	.	H	α-helix	trans	-64.3	-41.7	176.2	-174.6	64	0	0	0	111.1	L29 Q30 H35 A36 W37 W129 W135	L29-L33 WeakPolarHBondContact O-CB 3.28Å; L29-L33 PolarHBondContact O-N 2.77Å; Q30-L33 PolarHBondContact O-N 2.99Å; L33-H35 VanDerWaalsContact C-N 3.34Å; L33-H35 PolarHBondContact O-N 3.28Å; L33-A36 PolarHBondContact O-N 2.94Å; L33-W37 WeakPolarHBondContact O-CB 3.43Å; L33-W37 PolarHBondContact O-N 2.66Å; L33-W129 HydrophobicContact CB-CH2 4.1Å; L33-W129 HydrophobicContact CB-CZ3 4.39Å; L33-W129 HydrophobicContact CD2-CH2 4.11Å; L33-W129 HydrophobicContact CD2-CZ3 4.29Å; L33-W129 HydrophobicContact CG-CH2 3.97Å; L33-W129 HydrophobicContact CG-CZ3 3.91Å; L33-W135 HydrophobicContact CD2-CZ2 4.23Å
34	R	93.1	Very high	87.9	Confident	133 Å²	133	91.8 Å²	91.8	50%	0.502	48%	0.483	S	S	.	.	H	α-helix	trans	-59.3	-45.6	174.9	-174.1	170.8	-167.4	176.4	7.5	111.6	Q30 P31 W37 G38 W129 D130	Q30-R34 WeakPolarHBondContact O-CB 3.22Å; Q30-R34 PolarHBondContact O-N 3.06Å; P31-R34 PolarHBondContact O-N 3.08Å; R34-W37 PolarHBondContact O-N 3.18Å; R34-G38 PolarHBondContact O-N 3.07Å; R34-W129 VanDerWaalsContact CA-CZ3 3.41Å; R34-W129 HydrophobicContact CB-CD2 3.91Å; R34-W129 HydrophobicContact CB-CE3 4.12Å; R34-W129 HydrophobicContact CB-CH2 3.73Å; R34-W129 HydrophobicContact CB-CZ2 3.51Å; R34-W129 HydrophobicContact CB-CZ3 4.04Å; R34-W129 HydrophobicContact CG-CD2 3.6Å; R34-W129 HydrophobicContact CG-CE3 4.17Å; R34-W129 HydrophobicContact CG-CG 3.84Å; R34-W129 HydrophobicContact CG-CZ2 4.01Å; R34-W129 VanDerWaalsContact NE-CD1 3.27Å; R34-D130 IonicContact NH2-OD1 2.89Å
35	H	95.1	Very high	89.4	Confident	145 Å²	145	90.6 Å²	90.6	67%	0.671	48%	0.481	S	S	*	.	H	α-helix	trans	-65	-47.6	179.8	-173.6	69.9	0	0	0	111.7	P31 S32 L33 W37 G38 Y39	P31-H35 PolarHBondContact O-N 2.93Å; S32-H35 PolarHBondContact O-N 3.19Å; L33-H35 VanDerWaalsContact C-N 3.34Å; L33-H35 PolarHBondContact O-N 3.28Å; H35-W37 VanDerWaalsContact C-N 3.34Å; H35-W37 PolarHBondContact O-N 3.27Å; H35-G38 PolarHBondContact O-N 2.9Å; H35-Y39 WeakPolarHBondContact O-CB 3.43Å; H35-Y39 PolarHBondContact O-N 2.89Å
36	A	95.1	Very high	90.9	Very high	58 Å²	58	90 Å²	90	48%	0.479	47%	0.466	S	S	.	.	H	α-helix	trans	-63	-41	177.5	0	0	0	0	0	112.2	S32 L33 M40	S32-A36 WeakPolarHBondContact O-CB 3.35Å; S32-A36 PolarHBondContact O-N 2.72Å; L33-A36 PolarHBondContact O-N 2.94Å; A36-M40 PolarHBondContact O-N 3.47Å
37	W	96	Very high	92.3	Very high	12 Å²	12	85.6 Å²	85.6	5%	0.045	44%	0.444	C	S	.	.	H	α-helix	trans	-65.8	-47.5	177.2	-165.9	-95.1	0	0	0	111.7	L33 R34 H35 Y39 M40 L41 Y127 W129 M132 H209 V210 F211 W214	L33-W37 WeakPolarHBondContact O-CB 3.43Å; L33-W37 PolarHBondContact O-N 2.66Å; R34-W37 PolarHBondContact O-N 3.18Å; H35-W37 VanDerWaalsContact C-N 3.34Å; H35-W37 PolarHBondContact O-N 3.27Å; W37-Y39 PolarHBondContact O-N 3.09Å; W37-M40 HydrophobicContact CD2-CE 3.76Å; W37-M40 HydrophobicContact CE3-CE 3.63Å; W37-M40 HydrophobicContact CH2-CE 3.67Å; W37-M40 HydrophobicContact CZ2-CE 3.79Å; W37-M40 HydrophobicContact CZ3-CE 3.6Å; W37-M40 WeakPolarHBondContact O-CB 3.39Å; W37-M40 PolarHBondContact O-N 3.22Å; W37-M40 VanDerWaalsContact O-N 3.15Å; W37-L41 WeakPolarHBondContact O-CG 3.3Å; W37-L41 PolarHBondContact O-N 2.69Å; W37-Y127 PolarHBondContact NE1-O 3.5Å; W37-W129 HydrophobicContact CB-CE3 3.84Å; W37-W129 HydrophobicContact CB-CZ3 4.01Å; W37-W129 AromaticContact CD1-CE3 3.96Å; W37-W129 AromaticContact CG-CE3 3.97Å; W37-W129 HydrophobicContact CG-CE3 3.97Å; W37-W129 HydrophobicContact CG-CZ3 4.37Å; W37-M132 HydrophobicContact CD2-CE 3.63Å; W37-M132 HydrophobicContact CE3-CE 4.13Å; W37-M132 HydrophobicContact CG-CE 3.92Å; W37-M132 HydrophobicContact CZ2-CE 4.05Å; W37-H209 AromaticContact CZ2-CE1 3.65Å; W37-V210 HydrophobicContact CH2-CG1 3.78Å; W37-V210 HydrophobicContact CZ2-CG1 3.52Å; W37-F211 HydrophobicContact CE3-CD2 4.36Å; W37-F211 HydrophobicContact CH2-CB 3.86Å; W37-F211 HydrophobicContact CH2-CD2 4.1Å; W37-F211 HydrophobicContact CH2-CG 4.49Å; W37-F211 HydrophobicContact CZ2-CB 4.28Å; W37-F211 HydrophobicContact CZ3-CB 4.36Å; W37-F211 AromaticContact CZ3-CD2 3.73Å; W37-F211 HydrophobicContact CZ3-CD2 3.73Å; W37-W214 HydrophobicContact CH2-CE3 4Å; W37-W214 HydrophobicContact CH2-CH2 4.3Å; W37-W214 AromaticContact CH2-CZ3 3.74Å; W37-W214 HydrophobicContact CH2-CZ3 3.74Å; W37-W214 AromaticContact CZ3-CE3 3.84Å; W37-W214 HydrophobicContact CZ3-CE3 3.84Å; W37-W214 HydrophobicContact CZ3-CH2 4.32Å; W37-W214 AromaticContact CZ3-CZ3 3.46Å; W37-W214 HydrophobicContact CZ3-CZ3 3.46Å; W37-W214 VanDerWaalsContact CZ3-CZ3 3.46Å
38	G	96.9	Very high	93.5	Very high	22 Å²	22	86.8 Å²	86.8	23%	0.227	45%	0.448	C	S	.	.	H	α-helix	trans	-57.7	-47.5	174.8	0	0	0	0	0	111.8	R34 H35 M40 L41 D42	R34-G38 PolarHBondContact O-N 3.07Å; H35-G38 PolarHBondContact O-N 2.9Å; G38-M40 VanDerWaalsContact C-N 3.28Å; G38-M40 PolarHBondContact O-N 3.28Å; G38-L41 PolarHBondContact O-N 2.9Å; G38-L41 VanDerWaalsContact O-N 3.08Å; G38-D42 WeakPolarHBondContact O-CB 3.3Å; G38-D42 PolarHBondContact O-N 2.89Å
39	Y	97.2	Very high	94.5	Very high	135 Å²	135	81.7 Å²	81.7	53%	0.529	42%	0.415	S	S	.	.	H	α-helix	trans	-55.9	-43.1	175.1	-178.1	-90.4	0	0	0	112.1	H35 W37 D42 N43	H35-Y39 WeakPolarHBondContact O-CB 3.43Å; H35-Y39 PolarHBondContact O-N 2.89Å; W37-Y39 PolarHBondContact O-N 3.09Å; Y39-D42 PolarHBondContact O-N 2.53Å; Y39-N43 WeakPolarHBondContact CD2-ND2 3.17Å; Y39-N43 HydrophobicContact CE1-CB 4.47Å; Y39-N43 WeakPolarHBondContact CE2-ND2 3.48Å; Y39-N43 WeakPolarHBondContact O-CB 3.39Å; Y39-N43 PolarHBondContact O-N 2.95Å; Y39-N43 VanDerWaalsContact O-N 3.13Å; Y39-N43 PolarHBondContact O-ND2 3.39Å
40	M	97.6	Very high	95.3	Very high	33 Å²	33	76 Å²	76	16%	0.163	39%	0.385	C	S	.	.	H	α-helix	trans	-61.8	-45.3	176.2	-178.2	-174.6	66.8	0	0	111.9	A36 W37 G38 D42 N43 Y44 I49 W214	A36-M40 PolarHBondContact O-N 3.47Å; W37-M40 HydrophobicContact CD2-CE 3.76Å; W37-M40 HydrophobicContact CE3-CE 3.63Å; W37-M40 HydrophobicContact CH2-CE 3.67Å; W37-M40 HydrophobicContact CZ2-CE 3.79Å; W37-M40 HydrophobicContact CZ3-CE 3.6Å; W37-M40 WeakPolarHBondContact O-CB 3.39Å; W37-M40 PolarHBondContact O-N 3.22Å; W37-M40 VanDerWaalsContact O-N 3.15Å; G38-M40 VanDerWaalsContact C-N 3.28Å; G38-M40 PolarHBondContact O-N 3.28Å; M40-D42 VanDerWaalsContact C-N 3.31Å; M40-D42 PolarHBondContact O-N 3.37Å; M40-N43 PolarHBondContact O-N 3.48Å; M40-Y44 HydrophobicContact CG-CD2 4.05Å; M40-Y44 WeakPolarHBondContact O-CB 3.32Å; M40-Y44 WeakPolarHBondContact O-CD2 3.45Å; M40-Y44 PolarHBondContact O-N 3.33Å; M40-I49 HydrophobicContact CE-CD1 4.26Å; M40-I49 HydrophobicContact CE-CG2 3.85Å; M40-I49 HydrophobicContact CG-CD1 3.99Å; M40-I49 HydrophobicContact CG-CG1 3.99Å; M40-I49 HydrophobicContact SD-CD1 4.48Å; M40-I49 HydrophobicContact SD-CG1 4.24Å; M40-I49 HydrophobicContact SD-CG2 4.02Å; M40-W214 HydrophobicContact CE-CH2 4Å; M40-W214 HydrophobicContact CE-CZ3 4.23Å; M40-W214 HydrophobicContact SD-CH2 3.72Å; M40-W214 HydrophobicContact SD-CZ3 4.17Å
41	L	97.4	Very high	95.9	Very high	54 Å²	54	72 Å²	72	28%	0.283	37%	0.367	S	S	.	.	H	α-helix	trans	-65.1	-34.8	178.6	-63.4	177.3	0	0	0	112.7	W37 G38 I49 Y127	W37-L41 WeakPolarHBondContact O-CG 3.3Å; W37-L41 PolarHBondContact O-N 2.69Å; G38-L41 PolarHBondContact O-N 2.9Å; G38-L41 VanDerWaalsContact O-N 3.08Å; L41-I49 HydrophobicContact CD2-CD1 3.88Å; L41-Y127 WeakPolarHBondContact CD1-O 3.04Å; L41-Y127 HydrophobicContact CD2-CD1 4.47Å
42	D	97.9	Very high	96.4	Very high	140 Å²	140	73.7 Å²	73.7	75%	0.749	36%	0.362	S	S	*	.	H	α-helix	trans	-75.5	-25.6	-178.8	-67.4	-22.8	0	0	0	112.8	G38 Y39 M40	G38-D42 WeakPolarHBondContact O-CB 3.3Å; G38-D42 PolarHBondContact O-N 2.89Å; Y39-D42 PolarHBondContact O-N 2.53Å; M40-D42 VanDerWaalsContact C-N 3.31Å; M40-D42 PolarHBondContact O-N 3.37Å
43	N	98.3	Very high	96.7	Very high	85 Å²	85	70.5 Å²	70.5	46%	0.455	34%	0.342	S	S	.	.	H	α-helix	trans	-109	-14.8	-172.1	-71	-90.6	0	0	0	114.3	Y39 M40	Y39-N43 WeakPolarHBondContact CD2-ND2 3.17Å; Y39-N43 HydrophobicContact CE1-CB 4.47Å; Y39-N43 WeakPolarHBondContact CE2-ND2 3.48Å; Y39-N43 WeakPolarHBondContact O-CB 3.39Å; Y39-N43 PolarHBondContact O-N 2.95Å; Y39-N43 VanDerWaalsContact O-N 3.13Å; Y39-N43 PolarHBondContact O-ND2 3.39Å; M40-N43 PolarHBondContact O-N 3.48Å
44	Y	98.1	Very high	97	Very high	123 Å²	123	68.2 Å²	68.2	48%	0.482	33%	0.331	S	S	.	.	S	Bend	trans	-130.1	143.4	-176.1	-59.5	-78	0	0	0	112.3	M40	M40-Y44 HydrophobicContact CG-CD2 4.05Å; M40-Y44 WeakPolarHBondContact O-CB 3.32Å; M40-Y44 WeakPolarHBondContact O-CD2 3.45Å; M40-Y44 PolarHBondContact O-N 3.33Å
45	T	97.9	Very high	97.3	Very high	77 Å²	77	63.3 Å²	63.3	47%	0.472	31%	0.314	S	S	.	.			trans	-68.5	155.2	173.4	62	0	0	0	0	111.2	F47 Q48 I49	T45-F47 PolarHBondContact O-N 3.24Å; T45-Q48 PolarHBondContact O-N 3.34Å; T45-Q48 VanDerWaalsContact OG1-CG 3.29Å; T45-Q48 WeakPolarHBondContact OG1-CG 3.12Å; T45-Q48 PolarHBondContact OG1-N 2.97Å; T45-Q48 PolarHBondContact OG1-OE1 3.5Å; T45-I49 WeakPolarHBondContact O-CG1 3.45Å; T45-I49 PolarHBondContact O-N 3.49Å
46	K	96.8	Very high	97.4	Very high	101 Å²	101	61.8 Å²	61.8	44%	0.439	31%	0.31	S	S	.	.	H	α-helix	trans	-51.5	-40.8	171.6	-70.9	-172.7	179.6	-176.7	0	112.5	Q48 I49 A50 Y117 E121 Y127	K46-Q48 PolarHBondContact O-N 2.77Å; K46-I49 PolarHBondContact O-N 3.14Å; K46-A50 WeakPolarHBondContact O-CB 3.07Å; K46-A50 PolarHBondContact O-N 3.43Å; K46-Y117 HydrophobicContact CB-CE2 4.21Å; K46-E121 VanDerWaalsContact CD-OE1 3.24Å; K46-E121 WeakPolarHBondContact CD-OE1 3.38Å; K46-E121 IonicContact NZ-OE1 2.83Å; K46-E121 PolarHBondContact NZ-OE1 2.89Å; K46-Y127 HydrophobicContact CD-CD2 4.45Å
47	F	97.4	Very high	97.5	Very high	86 Å²	86	60.4 Å²	60.4	38%	0.377	30%	0.295	S	S	.	.	H	α-helix	trans	-59.3	-46.5	176.5	174.1	-98.3	0	0	0	112.4	T45 T51 Y117	T45-F47 PolarHBondContact O-N 3.24Å; F47-T51 VanDerWaalsContact O-CB 3.24Å; F47-T51 WeakPolarHBondContact O-CB 3.33Å; F47-T51 PolarHBondContact O-N 3.14Å; F47-T51 PolarHBondContact O-OG1 2.99Å; F47-Y117 VanDerWaalsContact CA-CD2 3.46Å; F47-Y117 HydrophobicContact CB-CD2 3.95Å; F47-Y117 HydrophobicContact CB-CE2 3.9Å; F47-Y117 HydrophobicContact CB-CG 4.33Å; F47-Y117 AromaticContact CD2-CD1 3.73Å; F47-Y117 HydrophobicContact CD2-CD1 3.73Å; F47-Y117 HydrophobicContact CD2-CD2 4.21Å; F47-Y117 HydrophobicContact CD2-CE1 4.19Å; F47-Y117 AromaticContact CD2-CG 3.72Å; F47-Y117 HydrophobicContact CD2-CG 3.72Å; F47-Y117 HydrophobicContact CE2-CD1 4.47Å
48	Q	98	Very high	97.6	Very high	73 Å²	73	60.6 Å²	60.6	34%	0.341	30%	0.297	S	S	.	.	H	α-helix	trans	-64.6	-43.4	178.1	-73.3	166	-55.6	0	0	111.5	T45 K46 W52 G53	T45-Q48 PolarHBondContact O-N 3.34Å; T45-Q48 VanDerWaalsContact OG1-CG 3.29Å; T45-Q48 WeakPolarHBondContact OG1-CG 3.12Å; T45-Q48 PolarHBondContact OG1-N 2.97Å; T45-Q48 PolarHBondContact OG1-OE1 3.5Å; K46-Q48 PolarHBondContact O-N 2.77Å; Q48-W52 WeakPolarHBondContact O-CA 3.3Å; Q48-W52 WeakPolarHBondContact O-CB 3.35Å; Q48-W52 PolarHBondContact O-N 3.48Å; Q48-G53 PolarHBondContact O-N 2.96Å; Q48-G53 VanDerWaalsContact O-N 3.09Å
49	I	98.1	Very high	97.7	Very high	6 Å²	6	61.6 Å²	61.6	3%	0.031	30%	0.296	C	S	.	.	I	π-helix	trans	-64.3	-49.9	178.1	-62.1	170.1	0	0	0	110.2	M40 L41 T45 K46 T51 G53 S54 Y127 W214	M40-I49 HydrophobicContact CE-CD1 4.26Å; M40-I49 HydrophobicContact CE-CG2 3.85Å; M40-I49 HydrophobicContact CG-CD1 3.99Å; M40-I49 HydrophobicContact CG-CG1 3.99Å; M40-I49 HydrophobicContact SD-CD1 4.48Å; M40-I49 HydrophobicContact SD-CG1 4.24Å; M40-I49 HydrophobicContact SD-CG2 4.02Å; L41-I49 HydrophobicContact CD2-CD1 3.88Å; T45-I49 WeakPolarHBondContact O-CG1 3.45Å; T45-I49 PolarHBondContact O-N 3.49Å; K46-I49 PolarHBondContact O-N 3.14Å; I49-T51 VanDerWaalsContact C-N 3.33Å; I49-T51 PolarHBondContact O-N 2.83Å; I49-G53 WeakPolarHBondContact O-CA 3.49Å; I49-G53 PolarHBondContact O-N 2.73Å; I49-G53 VanDerWaalsContact O-N 3.14Å; I49-S54 PolarHBondContact O-N 3.23Å; I49-Y127 HydrophobicContact CB-CD1 4.35Å; I49-Y127 HydrophobicContact CB-CE1 4.02Å; I49-Y127 HydrophobicContact CD1-CD1 4.46Å; I49-Y127 HydrophobicContact CG2-CD1 3.92Å; I49-Y127 HydrophobicContact CG2-CE1 3.72Å; I49-W214 HydrophobicContact CG2-CH2 3.85Å; I49-W214 HydrophobicContact CG2-CZ2 3.82Å
50	A	97.4	Very high	97.7	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	30%	0.298	C	S	.	.	I	π-helix	trans	-63.3	-36.5	-178.2	0	0	0	0	0	113.2	K46 S54 T116 Y117 Y127	K46-A50 WeakPolarHBondContact O-CB 3.07Å; K46-A50 PolarHBondContact O-N 3.43Å; A50-S54 WeakPolarHBondContact O-CB 3.12Å; A50-S54 PolarHBondContact O-OG 2.89Å; A50-T116 HydrophobicContact CB-CG2 4.39Å; A50-T116 WeakPolarHBondContact O-CB 3.28Å; A50-Y117 HydrophobicContact CB-CD2 4.23Å; A50-Y127 WeakPolarHBondContact CB-OH 3.18Å
51	T	96.9	Very high	97.7	Very high	2 Å²	2	61 Å²	61	1%	0.012	30%	0.296	C	S	.	.	I	π-helix	trans	-94.6	-66	-174.5	-52.2	0	0	0	0	111	F47 I49 L55 F110 I113	F47-T51 VanDerWaalsContact O-CB 3.24Å; F47-T51 WeakPolarHBondContact O-CB 3.33Å; F47-T51 PolarHBondContact O-N 3.14Å; F47-T51 PolarHBondContact O-OG1 2.99Å; I49-T51 VanDerWaalsContact C-N 3.33Å; I49-T51 PolarHBondContact O-N 2.83Å; T51-L55 WeakPolarHBondContact O-CB 3.48Å; T51-L55 PolarHBondContact O-N 2.87Å; T51-F110 HydrophobicContact CG2-CE2 4.44Å; T51-I113 WeakPolarHBondContact O-CG2 3.37Å
52	W	97.4	Very high	97.7	Very high	125 Å²	125	58.5 Å²	58.5	47%	0.473	28%	0.283	S	S	.	.	I	π-helix	trans	-73.2	-38.2	-175.9	-60.8	116.6	0	0	0	111.9	Q48 L55 I56 F110	Q48-W52 WeakPolarHBondContact O-CA 3.3Å; Q48-W52 WeakPolarHBondContact O-CB 3.35Å; Q48-W52 PolarHBondContact O-N 3.48Å; W52-L55 HydrophobicContact CE3-CD2 3.89Å; W52-L55 HydrophobicContact CZ3-CD2 3.87Å; W52-L55 PolarHBondContact O-N 3.36Å; W52-I56 WeakPolarHBondContact O-CB 2.94Å; W52-I56 WeakPolarHBondContact O-CD1 3.13Å; W52-I56 VanDerWaalsContact O-CG1 3.22Å; W52-I56 WeakPolarHBondContact O-CG1 3.47Å; W52-I56 PolarHBondContact O-N 3.23Å; W52-F110 HydrophobicContact CH2-CE2 4.27Å; W52-F110 AromaticContact CH2-CZ 4Å; W52-F110 HydrophobicContact CH2-CZ 4Å; W52-F110 AromaticContact CZ3-CE2 3.98Å; W52-F110 HydrophobicContact CZ3-CE2 3.98Å; W52-F110 HydrophobicContact CZ3-CZ 4.15Å
53	G	97.5	Very high	97.7	Very high	16 Å²	16	55.2 Å²	55.2	17%	0.165	26%	0.262	C	S	.	.	I	π-helix	trans	-60.4	-48.4	174	0	0	0	0	0	111.6	Q48 I49 L55 I56 V57	Q48-G53 PolarHBondContact O-N 2.96Å; Q48-G53 VanDerWaalsContact O-N 3.09Å; I49-G53 WeakPolarHBondContact O-CA 3.49Å; I49-G53 PolarHBondContact O-N 2.73Å; I49-G53 VanDerWaalsContact O-N 3.14Å; G53-L55 PolarHBondContact O-N 3.37Å; G53-I56 PolarHBondContact O-N 3.42Å; G53-V57 WeakPolarHBondContact O-CB 3.34Å; G53-V57 VanDerWaalsContact O-CG2 3.28Å; G53-V57 WeakPolarHBondContact O-CG2 3.48Å; G53-V57 PolarHBondContact O-N 3.3Å
54	S	97.6	Very high	97.6	Very high	7 Å²	7	54.8 Å²	54.8	5%	0.049	26%	0.259	C	S	.	.	H	α-helix	trans	-63.1	-39	176.6	-57.3	0	0	0	0	113.1	I49 A50 V57 H58 W214	I49-S54 PolarHBondContact O-N 3.23Å; A50-S54 WeakPolarHBondContact O-CB 3.12Å; A50-S54 PolarHBondContact O-OG 2.89Å; S54-V57 PolarHBondContact O-N 2.82Å; S54-H58 WeakPolarHBondContact O-CB 3.29Å; S54-H58 PolarHBondContact O-N 3.45Å; S54-W214 PolarHBondContact OG-NE1 3.48Å
55	L	97.7	Very high	97.6	Very high	30 Å²	30	52.1 Å²	52.1	16%	0.157	25%	0.25	C	S	.	.	H	α-helix	trans	-62.4	-48.4	174.3	-179.1	65.8	0	0	0	111.3	T51 W52 G53 V57 H58 E59 F110 I113	T51-L55 WeakPolarHBondContact O-CB 3.48Å; T51-L55 PolarHBondContact O-N 2.87Å; W52-L55 HydrophobicContact CE3-CD2 3.89Å; W52-L55 HydrophobicContact CZ3-CD2 3.87Å; W52-L55 PolarHBondContact O-N 3.36Å; G53-L55 PolarHBondContact O-N 3.37Å; L55-V57 VanDerWaalsContact C-N 3.31Å; L55-V57 PolarHBondContact O-N 3.36Å; L55-H58 PolarHBondContact O-N 3.19Å; L55-E59 HydrophobicContact CD1-CG 3.99Å; L55-E59 HydrophobicContact CG-CG 4.33Å; L55-E59 WeakPolarHBondContact O-CG 3.16Å; L55-E59 PolarHBondContact O-N 3.34Å; L55-F110 HydrophobicContact CD1-CD2 4.14Å; L55-F110 HydrophobicContact CD2-CD2 3.88Å; L55-F110 HydrophobicContact CD2-CE2 3.98Å; L55-I113 HydrophobicContact CB-CG2 4.23Å; L55-I113 HydrophobicContact CD1-CD1 3.94Å
56	I	97.8	Very high	97.5	Very high	113 Å²	113	48.9 Å²	48.9	58%	0.579	23%	0.231	S	C	*	.	H	α-helix	trans	-60.3	-44.4	178.5	-70.8	164.7	0	0	0	110.3	W52 G53 F60	W52-I56 WeakPolarHBondContact O-CB 2.94Å; W52-I56 WeakPolarHBondContact O-CD1 3.13Å; W52-I56 VanDerWaalsContact O-CG1 3.22Å; W52-I56 WeakPolarHBondContact O-CG1 3.47Å; W52-I56 PolarHBondContact O-N 3.23Å; G53-I56 PolarHBondContact O-N 3.42Å; I56-F60 WeakPolarHBondContact O-CB 3.39Å; I56-F60 PolarHBondContact O-N 3.38Å
57	V	97.9	Very high	97.4	Very high	28 Å²	28	48.1 Å²	48.1	17%	0.17	23%	0.231	C	C	.	.	H	α-helix	trans	-60.9	-48.2	177.8	167.6	0	0	0	0	111	G53 S54 L55 I61 W214	G53-V57 WeakPolarHBondContact O-CB 3.34Å; G53-V57 VanDerWaalsContact O-CG2 3.28Å; G53-V57 WeakPolarHBondContact O-CG2 3.48Å; G53-V57 PolarHBondContact O-N 3.3Å; S54-V57 PolarHBondContact O-N 2.82Å; L55-V57 VanDerWaalsContact C-N 3.31Å; L55-V57 PolarHBondContact O-N 3.36Å; V57-I61 HydrophobicContact CG1-CD1 3.77Å; V57-I61 HydrophobicContact CG1-CG1 4.49Å; V57-I61 VanDerWaalsContact O-CB 3.23Å; V57-I61 WeakPolarHBondContact O-CB 3.08Å; V57-I61 WeakPolarHBondContact O-CG1 3.42Å; V57-I61 PolarHBondContact O-N 3.23Å; V57-W214 HydrophobicContact CB-CG 4.47Å; V57-W214 HydrophobicContact CG1-CB 4.07Å; V57-W214 HydrophobicContact CG1-CG 4.19Å; V57-W214 HydrophobicContact CG2-CD2 3.84Å; V57-W214 HydrophobicContact CG2-CE3 3.95Å; V57-W214 HydrophobicContact CG2-CG 4.14Å; V57-W214 HydrophobicContact CG2-CZ3 4.37Å
58	H	97.9	Very high	97.3	Very high	17 Å²	17	46.6 Å²	46.6	8%	0.079	23%	0.23	C	C	.	.	H	α-helix	trans	-59.5	-56.1	178.6	174	-80.8	0	0	0	111.3	S54 L55 F60 I61 Y62 H105 Q109 I113 E185 V217 L221	S54-H58 WeakPolarHBondContact O-CB 3.29Å; S54-H58 PolarHBondContact O-N 3.45Å; L55-H58 PolarHBondContact O-N 3.19Å; H58-F60 PolarHBondContact O-N 3.42Å; H58-I61 PolarHBondContact O-N 3.21Å; H58-Y62 VanDerWaalsContact O-CB 3.27Å; H58-Y62 WeakPolarHBondContact O-CB 3.46Å; H58-Y62 PolarHBondContact O-N 2.97Å; H58-H105 AromaticContact CE1-CE1 3.66Å; H58-H105 AromaticContact CE1-ND1 3.94Å; H58-Q109 PolarHBondContact CE1-OE1 3.03Å; H58-Q109 PolarHBondContact NE2-OE1 3.32Å; H58-I113 HydrophobicContact CB-CD1 4.29Å; H58-E185 IonicContact CE1-OE2 3.91Å; H58-E185 IonicContact NE2-OE1 3.53Å; H58-E185 PolarHBondContact NE2-OE1 3.04Å; H58-E185 IonicContact NE2-OE2 3.41Å; H58-E185 PolarHBondContact NE2-OE2 3.15Å; H58-V217 HydrophobicContact CB-CG1 4.29Å; H58-L221 WeakPolarHBondContact O-CD1 3.18Å
59	E	97.9	Very high	97	Very high	43 Å²	43	43.8 Å²	43.8	20%	0.201	22%	0.22	C	C	.	.	H	α-helix	trans	-63	-45.4	-176.2	-65.6	-65.8	171.2	0	0	111.9	L55 I61 Y62 F63 H105	L55-E59 HydrophobicContact CD1-CG 3.99Å; L55-E59 HydrophobicContact CG-CG 4.33Å; L55-E59 WeakPolarHBondContact O-CG 3.16Å; L55-E59 PolarHBondContact O-N 3.34Å; E59-I61 PolarHBondContact O-N 3.15Å; E59-Y62 PolarHBondContact O-N 3.41Å; E59-F63 WeakPolarHBondContact O-CD2 3.48Å; E59-F63 PolarHBondContact O-N 3.18Å; E59-F63 WeakPolarHBondContact OE2-CE2 3.49Å; E59-H105 WeakPolarHBondContact OE1-CB 3.28Å; E59-H105 IonicContact OE1-CE1 3.13Å; E59-H105 IonicContact OE1-CG 3.52Å; E59-H105 IonicContact OE1-ND1 3.78Å; E59-H105 PolarHBondContact OE1-ND1 3.49Å; E59-H105 IonicContact OE2-CE1 3.98Å; E59-H105 IonicContact OE2-ND1 2.6Å; E59-H105 PolarHBondContact OE2-ND1 3.33Å
60	F	98	Very high	96.8	Very high	133 Å²	133	46.9 Å²	46.9	58%	0.583	23%	0.234	S	C	*	.	H	α-helix	trans	-59.7	-49	178.7	176.3	-103.4	0	0	0	110.8	I56 H58 L64	I56-F60 WeakPolarHBondContact O-CB 3.39Å; I56-F60 PolarHBondContact O-N 3.38Å; H58-F60 PolarHBondContact O-N 3.42Å; F60-L64 HydrophobicContact CD1-CD2 4.5Å; F60-L64 HydrophobicContact CE1-CD2 3.78Å; F60-L64 HydrophobicContact CZ-CD2 4.02Å; F60-L64 WeakPolarHBondContact O-CB 3.49Å; F60-L64 PolarHBondContact O-N 3.3Å
61	I	98	Very high	96.7	Very high	23 Å²	23	50.8 Å²	50.8	12%	0.118	25%	0.254	C	S	.	.	H	α-helix	trans	-67.6	-43	-178.3	-69	-176.8	0	0	0	111.2	V57 H58 E59 F63 L64 F65 A218 L221	V57-I61 HydrophobicContact CG1-CD1 3.77Å; V57-I61 HydrophobicContact CG1-CG1 4.49Å; V57-I61 VanDerWaalsContact O-CB 3.23Å; V57-I61 WeakPolarHBondContact O-CB 3.08Å; V57-I61 WeakPolarHBondContact O-CG1 3.42Å; V57-I61 PolarHBondContact O-N 3.23Å; H58-I61 PolarHBondContact O-N 3.21Å; E59-I61 PolarHBondContact O-N 3.15Å; I61-F63 PolarHBondContact O-N 3.39Å; I61-L64 PolarHBondContact O-N 3.37Å; I61-F65 HydrophobicContact CG2-CD2 3.39Å; I61-F65 HydrophobicContact CG2-CE2 3.3Å; I61-F65 HydrophobicContact CG2-CG 4.44Å; I61-F65 HydrophobicContact CG2-CZ 4.29Å; I61-F65 PolarHBondContact O-N 3.29Å; I61-A218 HydrophobicContact CD1-CB 3.37Å; I61-L221 HydrophobicContact CB-CD1 4.11Å; I61-L221 HydrophobicContact CG2-CB 3.99Å; I61-L221 HydrophobicContact CG2-CD1 3.96Å
62	Y	97.8	Very high	96.6	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-56.7	-54.9	-180	-171.3	-91.3	0	0	0	111	H58 E59 F65 C66 L101 H105 M182 E185 L221 I225	H58-Y62 VanDerWaalsContact O-CB 3.27Å; H58-Y62 WeakPolarHBondContact O-CB 3.46Å; H58-Y62 PolarHBondContact O-N 2.97Å; E59-Y62 PolarHBondContact O-N 3.41Å; Y62-F65 PolarHBondContact O-N 3.04Å; Y62-C66 PolarHBondContact O-N 3.26Å; Y62-C66 PolarHBondContact O-SG 2.8Å; Y62-L101 HydrophobicContact CD1-CD2 4.43Å; Y62-L101 HydrophobicContact CE1-CD1 3.87Å; Y62-L101 HydrophobicContact CE1-CD2 3.67Å; Y62-L101 HydrophobicContact CE1-CG 4.34Å; Y62-L101 WeakPolarHBondContact OH-CD1 3.37Å; Y62-H105 AromaticContact CD1-CE1 3.88Å; Y62-M182 PolarHBondContact OH-O 3.45Å; Y62-E185 HydrophobicContact CD2-CG 4.39Å; Y62-E185 HydrophobicContact CE2-CB 3.99Å; Y62-E185 HydrophobicContact CE2-CG 3.58Å; Y62-E185 WeakPolarHBondContact CE2-OE2 3.1Å; Y62-E185 PolarHBondContact OH-N 3.09Å; Y62-L221 HydrophobicContact CD2-CD2 3.96Å; Y62-I225 HydrophobicContact CD2-CD1 3.82Å; Y62-I225 HydrophobicContact CD2-CG1 4.38Å; Y62-I225 HydrophobicContact CE2-CD1 4.03Å; Y62-I225 HydrophobicContact CE2-CG1 4.11Å; Y62-I225 HydrophobicContact CG-CD1 4.26Å; Y62-I225 WeakPolarHBondContact O-CD1 3.38Å
63	F	97.4	Very high	96.4	Very high	71 Å²	71	48.3 Å²	48.3	31%	0.311	25%	0.247	S	C	.	.	H	α-helix	trans	-71.1	-33.1	-179.3	-70.7	-62.9	0	0	0	112.7	E59 I61 F65 C66 L67 F98 L101	E59-F63 WeakPolarHBondContact O-CD2 3.48Å; E59-F63 PolarHBondContact O-N 3.18Å; E59-F63 WeakPolarHBondContact OE2-CE2 3.49Å; I61-F63 PolarHBondContact O-N 3.39Å; F63-F65 VanDerWaalsContact C-N 3.35Å; F63-F65 PolarHBondContact O-N 3.25Å; F63-C66 PolarHBondContact O-N 3.22Å; F63-L67 WeakPolarHBondContact O-CB 3.34Å; F63-L67 PolarHBondContact O-N 3.23Å; F63-F98 HydrophobicContact CE1-CE2 4.1Å; F63-F98 HydrophobicContact CZ-CE2 4.23Å; F63-L101 HydrophobicContact CE1-CD2 4.01Å; F63-L101 HydrophobicContact CZ-CD2 4.13Å
64	L	97.1	Very high	96.2	Very high	76 Å²	76	53.8 Å²	53.8	40%	0.398	27%	0.266	S	S	.	.	H	α-helix	trans	-59.9	-44.6	174.3	177.7	64.5	0	0	0	111.4	F60 I61 L67 P68	F60-L64 HydrophobicContact CD1-CD2 4.5Å; F60-L64 HydrophobicContact CE1-CD2 3.78Å; F60-L64 HydrophobicContact CZ-CD2 4.02Å; F60-L64 WeakPolarHBondContact O-CB 3.49Å; F60-L64 PolarHBondContact O-N 3.3Å; I61-L64 PolarHBondContact O-N 3.37Å; L64-L67 WeakPolarHBondContact O-CB 3.36Å; L64-L67 PolarHBondContact O-N 3.05Å; L64-P68 VanDerWaalsContact O-CD 3.24Å; L64-P68 WeakPolarHBondContact O-CD 3.26Å
65	F	96.1	Very high	96.1	Very high	68 Å²	68	56.5 Å²	56.5	30%	0.298	28%	0.28	S	S	.	.	H	α-helix	trans	-81.2	-22	-179.7	-67.7	-33.4	0	0	0	113.8	I61 Y62 F63 L67 P68 L222 I225	I61-F65 HydrophobicContact CG2-CD2 3.39Å; I61-F65 HydrophobicContact CG2-CE2 3.3Å; I61-F65 HydrophobicContact CG2-CG 4.44Å; I61-F65 HydrophobicContact CG2-CZ 4.29Å; I61-F65 PolarHBondContact O-N 3.29Å; Y62-F65 PolarHBondContact O-N 3.04Å; F63-F65 VanDerWaalsContact C-N 3.35Å; F63-F65 PolarHBondContact O-N 3.25Å; F65-L67 VanDerWaalsContact C-N 3.33Å; F65-P68 WeakPolarHBondContact O-CD 3.46Å; F65-L222 HydrophobicContact CD1-CD1 3.99Å; F65-L222 HydrophobicContact CD2-CB 3.76Å; F65-L222 HydrophobicContact CD2-CD1 3.9Å; F65-L222 HydrophobicContact CD2-CG 4.42Å; F65-L222 HydrophobicContact CE1-CD1 4.02Å; F65-L222 HydrophobicContact CE2-CB 3.53Å; F65-L222 HydrophobicContact CE2-CD1 3.92Å; F65-L222 HydrophobicContact CE2-CG 4.18Å; F65-L222 HydrophobicContact CG-CD1 3.95Å; F65-L222 HydrophobicContact CZ-CB 4.24Å; F65-L222 HydrophobicContact CZ-CD1 4Å; F65-L222 HydrophobicContact CZ-CD2 4.49Å; F65-L222 HydrophobicContact CZ-CG 4.46Å; F65-I225 HydrophobicContact CB-CB 4.49Å; F65-I225 HydrophobicContact CB-CD1 3.74Å; F65-I225 HydrophobicContact CB-CG2 4.28Å; F65-I225 WeakPolarHBondContact O-CG2 3.19Å
66	C	96.6	Very high	95.8	Very high	9 Å²	9	60.3 Å²	60.3	6%	0.061	31%	0.307	C	S	.	.	H	α-helix	trans	-70.7	-29.3	168.2	-70.8	0	0	0	0	112.8	Y62 F63 G69 F70	Y62-C66 PolarHBondContact O-N 3.26Å; Y62-C66 PolarHBondContact O-SG 2.8Å; F63-C66 PolarHBondContact O-N 3.22Å; C66-G69 PolarHBondContact O-N 2.97Å; C66-F70 PolarHBondContact O-N 3.21Å; C66-F70 VanDerWaalsContact O-N 3.16Å
67	L	95.6	Very high	95.6	Very high	84 Å²	84	61 Å²	61	44%	0.44	31%	0.306	S	S	.	.	H	α-helix	trans	-58.3	-46	-171.7	179.4	65.7	0	0	0	114	F63 L64 F65 G69 F70 L71	F63-L67 WeakPolarHBondContact O-CB 3.34Å; F63-L67 PolarHBondContact O-N 3.23Å; L64-L67 WeakPolarHBondContact O-CB 3.36Å; L64-L67 PolarHBondContact O-N 3.05Å; F65-L67 VanDerWaalsContact C-N 3.33Å; L67-G69 PolarHBondContact O-N 2.79Å; L67-F70 PolarHBondContact O-N 2.77Å; L67-L71 HydrophobicContact CD1-CD1 4.09Å; L67-L71 HydrophobicContact CD1-CD2 4.38Å; L67-L71 HydrophobicContact CD1-CG 3.99Å; L67-L71 HydrophobicContact CG-CD1 3.96Å; L67-L71 HydrophobicContact CG-CG 4.28Å; L67-L71 WeakPolarHBondContact O-CG 3.4Å; L67-L71 PolarHBondContact O-N 2.86Å
68	P	93.9	Very high	95.5	Very high	55 Å²	55	60.3 Å²	60.3	36%	0.357	30%	0.301	S	S	.	.	H	α-helix	trans	-55	-49.8	176.7	-27.5	34.7	0	0	0	113.3	L64 F65 F70 L71 F72	L64-P68 VanDerWaalsContact O-CD 3.24Å; L64-P68 WeakPolarHBondContact O-CD 3.26Å; F65-P68 WeakPolarHBondContact O-CD 3.46Å; P68-F70 VanDerWaalsContact C-N 3.31Å; P68-F70 PolarHBondContact O-N 3.1Å; P68-L71 PolarHBondContact O-N 3.42Å; P68-L71 VanDerWaalsContact O-N 3.09Å; P68-F72 HydrophobicContact CB-CE1 4.33Å; P68-F72 HydrophobicContact CB-CE2 3.86Å; P68-F72 HydrophobicContact CB-CZ 3.67Å; P68-F72 VanDerWaalsContact O-CD1 3.22Å; P68-F72 WeakPolarHBondContact O-CD1 3.25Å; P68-F72 VanDerWaalsContact O-CD2 3.25Å; P68-F72 WeakPolarHBondContact O-CD2 3.47Å; P68-F72 WeakPolarHBondContact O-CG 3.46Å; P68-F72 PolarHBondContact O-N 2.95Å
69	G	92.8	Very high	95.1	Very high	14 Å²	14	62.2 Å²	62.2	14%	0.144	31%	0.31	C	S	.	.	H	α-helix	trans	-59.5	-41.2	178.9	0	0	0	0	0	112.6	C66 L67 F72	C66-G69 PolarHBondContact O-N 2.97Å; L67-G69 PolarHBondContact O-N 2.79Å; G69-F72 PolarHBondContact O-N 2.7Å
70	F	94.1	Very high	94.9	Very high	71 Å²	71	67 Å²	67	31%	0.311	33%	0.33	S	S	.	.	H	α-helix	trans	-63.6	-40.8	174	177.4	-98.5	0	0	0	112.6	C66 L67 P68 Q73 F74 Q94	C66-F70 PolarHBondContact O-N 3.21Å; C66-F70 VanDerWaalsContact O-N 3.16Å; L67-F70 PolarHBondContact O-N 2.77Å; P68-F70 VanDerWaalsContact C-N 3.31Å; P68-F70 PolarHBondContact O-N 3.1Å; F70-Q73 VanDerWaalsContact CD2-NE2 3.27Å; F70-Q73 VanDerWaalsContact O-CD 3.25Å; F70-Q73 WeakPolarHBondContact O-CG 3.42Å; F70-Q73 PolarHBondContact O-NE2 3.33Å; F70-F74 HydrophobicContact CD1-CE2 4.09Å; F70-F74 AromaticContact CE1-CE2 3.62Å; F70-F74 HydrophobicContact CE1-CE2 3.62Å; F70-F74 HydrophobicContact CE1-CZ 4.33Å; F70-F74 HydrophobicContact CE2-CE2 4.19Å; F70-F74 HydrophobicContact CE2-CZ 4.33Å; F70-F74 AromaticContact CZ-CE2 3.67Å; F70-F74 HydrophobicContact CZ-CE2 3.67Å; F70-F74 AromaticContact CZ-CZ 3.93Å; F70-F74 HydrophobicContact CZ-CZ 3.93Å; F70-F74 WeakPolarHBondContact O-CD2 3.06Å; F70-F74 WeakPolarHBondContact O-CE2 3.4Å; F70-Q94 VanDerWaalsContact CE2-OE1 3.29Å
71	L	95.1	Very high	94.7	Very high	81 Å²	81	63.7 Å²	63.7	42%	0.424	31%	0.314	S	S	.	.	H	α-helix	trans	-70	-35	178.4	-68.1	176.2	0	0	0	112.4	L67 P68 Q73 F74	L67-L71 HydrophobicContact CD1-CD1 4.09Å; L67-L71 HydrophobicContact CD1-CD2 4.38Å; L67-L71 HydrophobicContact CD1-CG 3.99Å; L67-L71 HydrophobicContact CG-CD1 3.96Å; L67-L71 HydrophobicContact CG-CG 4.28Å; L67-L71 WeakPolarHBondContact O-CG 3.4Å; L67-L71 PolarHBondContact O-N 2.86Å; P68-L71 PolarHBondContact O-N 3.42Å; P68-L71 VanDerWaalsContact O-N 3.09Å; L71-Q73 PolarHBondContact O-N 3.28Å; L71-F74 PolarHBondContact O-N 2.86Å
72	F	94.3	Very high	94.6	Very high	40 Å²	40	63.2 Å²	63.2	18%	0.175	31%	0.311	C	S	.	.	H	α-helix	trans	-59.8	-29.8	-179	-63.3	-21.1	0	0	0	113.4	P68 G69 F74 L75 M78 Q79 Y231 I233	P68-F72 HydrophobicContact CB-CE1 4.33Å; P68-F72 HydrophobicContact CB-CE2 3.86Å; P68-F72 HydrophobicContact CB-CZ 3.67Å; P68-F72 VanDerWaalsContact O-CD1 3.22Å; P68-F72 WeakPolarHBondContact O-CD1 3.25Å; P68-F72 VanDerWaalsContact O-CD2 3.25Å; P68-F72 WeakPolarHBondContact O-CD2 3.47Å; P68-F72 WeakPolarHBondContact O-CG 3.46Å; P68-F72 PolarHBondContact O-N 2.95Å; G69-F72 PolarHBondContact O-N 2.7Å; F72-F74 PolarHBondContact O-N 3.48Å; F72-F74 VanDerWaalsContact O-N 3.15Å; F72-L75 HydrophobicContact CD1-CD1 4.32Å; F72-L75 PolarHBondContact O-N 3Å; F72-L75 VanDerWaalsContact O-N 3.11Å; F72-M78 HydrophobicContact CB-CB 3.86Å; F72-M78 HydrophobicContact CB-CE 4.4Å; F72-M78 HydrophobicContact CB-CG 4.18Å; F72-M78 HydrophobicContact CD1-CB 4.32Å; F72-M78 HydrophobicContact CD1-CE 3.61Å; F72-M78 HydrophobicContact CD1-CG 3.68Å; F72-M78 HydrophobicContact CD1-SD 4.21Å; F72-M78 HydrophobicContact CD2-CE 3.74Å; F72-M78 HydrophobicContact CE1-CE 3.68Å; F72-M78 HydrophobicContact CE1-CG 4.36Å; F72-M78 HydrophobicContact CE1-SD 4.36Å; F72-M78 HydrophobicContact CE2-CE 3.87Å; F72-M78 HydrophobicContact CG-CB 4.22Å; F72-M78 HydrophobicContact CG-CE 3.63Å; F72-M78 HydrophobicContact CG-CG 4.06Å; F72-M78 HydrophobicContact CZ-CE 3.8Å; F72-Q79 PolarHBondContact O-NE2 3.48Å; F72-Q79 VanDerWaalsContact O-NE2 3.14Å; F72-Y231 HydrophobicContact CB-CD1 4.25Å; F72-Y231 HydrophobicContact CB-CE1 3.73Å; F72-Y231 HydrophobicContact CB-CE2 4.06Å; F72-Y231 HydrophobicContact CD2-CD1 4.33Å; F72-Y231 HydrophobicContact CD2-CD2 4.19Å; F72-Y231 HydrophobicContact CD2-CG 4.12Å; F72-I233 HydrophobicContact CD2-CD1 3.96Å; F72-I233 HydrophobicContact CE2-CD1 3.2Å; F72-I233 HydrophobicContact CZ-CD1 3.76Å
73	Q	92.9	Very high	94.5	Very high	35 Å²	35	64.4 Å²	64.4	16%	0.164	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-22.2	177.6	85.7	-161.9	-12.4	0	0	113.1	F70 L71 Q79 Y231	F70-Q73 VanDerWaalsContact CD2-NE2 3.27Å; F70-Q73 VanDerWaalsContact O-CD 3.25Å; F70-Q73 WeakPolarHBondContact O-CG 3.42Å; F70-Q73 PolarHBondContact O-NE2 3.33Å; L71-Q73 PolarHBondContact O-N 3.28Å; Q73-Q79 PolarHBondContact O-NE2 3.14Å; Q73-Y231 WeakPolarHBondContact CA-OH 3.17Å; Q73-Y231 PolarHBondContact N-OH 3.12Å
74	F	93.6	Very high	94.3	Very high	131 Å²	131	61.7 Å²	61.7	58%	0.575	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-6.1	179.6	-54.4	-66.9	0	0	0	113.6	F70 L71 F72 P76	F70-F74 HydrophobicContact CD1-CE2 4.09Å; F70-F74 AromaticContact CE1-CE2 3.62Å; F70-F74 HydrophobicContact CE1-CE2 3.62Å; F70-F74 HydrophobicContact CE1-CZ 4.33Å; F70-F74 HydrophobicContact CE2-CE2 4.19Å; F70-F74 HydrophobicContact CE2-CZ 4.33Å; F70-F74 AromaticContact CZ-CE2 3.67Å; F70-F74 HydrophobicContact CZ-CE2 3.67Å; F70-F74 AromaticContact CZ-CZ 3.93Å; F70-F74 HydrophobicContact CZ-CZ 3.93Å; F70-F74 WeakPolarHBondContact O-CD2 3.06Å; F70-F74 WeakPolarHBondContact O-CE2 3.4Å; L71-F74 PolarHBondContact O-N 2.86Å; F72-F74 PolarHBondContact O-N 3.48Å; F72-F74 VanDerWaalsContact O-N 3.15Å; F74-P76 WeakPolarHBondContact O-CD 3.46Å
75	L	94.7	Very high	94.1	Very high	65 Å²	65	63 Å²	63	34%	0.34	31%	0.309	S	S	.	.			trans	-103.5	110	-176	-63.5	176	0	0	0	109.8	F72 F77 M78 Q79	F72-L75 HydrophobicContact CD1-CD1 4.32Å; F72-L75 PolarHBondContact O-N 3Å; F72-L75 VanDerWaalsContact O-N 3.11Å; L75-F77 HydrophobicContact CB-CD1 4.23Å; L75-F77 HydrophobicContact CB-CE1 3.85Å; L75-F77 HydrophobicContact CB-CZ 4.16Å; L75-F77 HydrophobicContact CD1-CE1 4.15Å; L75-F77 HydrophobicContact CD1-CZ 3.84Å; L75-F77 HydrophobicContact CD2-CE1 4.07Å; L75-F77 HydrophobicContact CG-CE1 4.24Å; L75-F77 HydrophobicContact CG-CZ 4.41Å; L75-F77 PolarHBondContact O-N 3.34Å; L75-F77 VanDerWaalsContact O-N 3.14Å; L75-M78 HydrophobicContact CB-CB 4.09Å; L75-M78 HydrophobicContact CB-CG 3.85Å; L75-M78 HydrophobicContact CD1-CG 4.16Å; L75-M78 WeakPolarHBondContact O-CB 3.45Å; L75-M78 PolarHBondContact O-N 2.93Å; L75-Q79 PolarHBondContact O-N 3.14Å
76	P	93.4	Very high	93.8	Very high	110 Å²	110	65.9 Å²	65.9	71%	0.714	33%	0.328	S	S	*	.	H	α-helix	trans	-56.8	-35.5	-175.8	-28.3	35.6	0	0	0	114	F74 M78 Q79	F74-P76 WeakPolarHBondContact O-CD 3.46Å; P76-M78 PolarHBondContact O-N 3.26Å; P76-Q79 WeakPolarHBondContact O-CB 3.32Å; P76-Q79 PolarHBondContact O-N 3.3Å
77	F	93.6	Very high	93.6	Very high	128 Å²	128	68.6 Å²	68.6	56%	0.561	34%	0.339	S	S	*	.	H	α-helix	trans	-71.5	-17.7	179.2	68.9	-95.3	0	0	0	113.7	L75 K80	L75-F77 HydrophobicContact CB-CD1 4.23Å; L75-F77 HydrophobicContact CB-CE1 3.85Å; L75-F77 HydrophobicContact CB-CZ 4.16Å; L75-F77 HydrophobicContact CD1-CE1 4.15Å; L75-F77 HydrophobicContact CD1-CZ 3.84Å; L75-F77 HydrophobicContact CD2-CE1 4.07Å; L75-F77 HydrophobicContact CG-CE1 4.24Å; L75-F77 HydrophobicContact CG-CZ 4.41Å; L75-F77 PolarHBondContact O-N 3.34Å; L75-F77 VanDerWaalsContact O-N 3.14Å; F77-K80 WeakPolarHBondContact O-CE 3.47Å; F77-K80 WeakPolarHBondContact O-CG 3.3Å
78	M	94.2	Very high	93.2	Very high	13 Å²	13	68.6 Å²	68.6	6%	0.064	34%	0.344	C	S	.	.	H	α-helix	trans	-86.2	-19.7	176.1	-68.5	-57.2	-64.5	0	0	112.6	F72 L75 P76 K80 Y81 I233	F72-M78 HydrophobicContact CB-CB 3.86Å; F72-M78 HydrophobicContact CB-CE 4.4Å; F72-M78 HydrophobicContact CB-CG 4.18Å; F72-M78 HydrophobicContact CD1-CB 4.32Å; F72-M78 HydrophobicContact CD1-CE 3.61Å; F72-M78 HydrophobicContact CD1-CG 3.68Å; F72-M78 HydrophobicContact CD1-SD 4.21Å; F72-M78 HydrophobicContact CD2-CE 3.74Å; F72-M78 HydrophobicContact CE1-CE 3.68Å; F72-M78 HydrophobicContact CE1-CG 4.36Å; F72-M78 HydrophobicContact CE1-SD 4.36Å; F72-M78 HydrophobicContact CE2-CE 3.87Å; F72-M78 HydrophobicContact CG-CB 4.22Å; F72-M78 HydrophobicContact CG-CE 3.63Å; F72-M78 HydrophobicContact CG-CG 4.06Å; F72-M78 HydrophobicContact CZ-CE 3.8Å; L75-M78 HydrophobicContact CB-CB 4.09Å; L75-M78 HydrophobicContact CB-CG 3.85Å; L75-M78 HydrophobicContact CD1-CG 4.16Å; L75-M78 WeakPolarHBondContact O-CB 3.45Å; L75-M78 PolarHBondContact O-N 2.93Å; P76-M78 PolarHBondContact O-N 3.26Å; M78-K80 PolarHBondContact O-N 2.82Å; M78-Y81 HydrophobicContact CE-CD2 3.71Å; M78-Y81 HydrophobicContact CE-CE2 4.34Å; M78-Y81 WeakPolarHBondContact O-CB 3.25Å; M78-Y81 PolarHBondContact O-N 3.01Å; M78-Y81 HydrophobicContact SD-CD2 3.76Å; M78-Y81 HydrophobicContact SD-CE2 3.94Å; M78-I233 HydrophobicContact CE-CD1 3.99Å; M78-I233 HydrophobicContact CE-CG1 4.28Å
79	Q	91.1	Very high	93	Very high	57 Å²	57	67.7 Å²	67.7	27%	0.266	34%	0.335	S	S	.	.	H	α-helix	trans	-57.3	-36.3	-179.3	-66	-56.7	-52	0	0	112.2	F72 Q73 L75 P76 Y81 K82 Q85	F72-Q79 PolarHBondContact O-NE2 3.48Å; F72-Q79 VanDerWaalsContact O-NE2 3.14Å; Q73-Q79 PolarHBondContact O-NE2 3.14Å; L75-Q79 PolarHBondContact O-N 3.14Å; P76-Q79 WeakPolarHBondContact O-CB 3.32Å; P76-Q79 PolarHBondContact O-N 3.3Å; Q79-Y81 PolarHBondContact O-N 2.93Å; Q79-Y81 VanDerWaalsContact O-N 3.07Å; Q79-K82 VanDerWaalsContact O-CB 3.25Å; Q79-K82 WeakPolarHBondContact O-CB 3.44Å; Q79-K82 PolarHBondContact O-N 3.38Å; Q79-Q85 PolarHBondContact O-NE2 3.43Å; Q79-Q85 PolarHBondContact O-OE1 2.97Å
80	K	93.2	Very high	93	Very high	142 Å²	142	69.5 Å²	69.5	62%	0.617	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-20.3	176.1	73.1	-172.4	-176.8	174.7	0	114.8	F77 M78	F77-K80 WeakPolarHBondContact O-CE 3.47Å; F77-K80 WeakPolarHBondContact O-CG 3.3Å; M78-K80 PolarHBondContact O-N 2.82Å
81	Y	94.1	Very high	92.9	Very high	65 Å²	65	74.5 Å²	74.5	26%	0.255	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-9.5	178.3	-59.1	-58.5	0	0	0	112.9	M78 Q79 Y231 D232 P234	M78-Y81 HydrophobicContact CE-CD2 3.71Å; M78-Y81 HydrophobicContact CE-CE2 4.34Å; M78-Y81 WeakPolarHBondContact O-CB 3.25Å; M78-Y81 PolarHBondContact O-N 3.01Å; M78-Y81 HydrophobicContact SD-CD2 3.76Å; M78-Y81 HydrophobicContact SD-CE2 3.94Å; Q79-Y81 PolarHBondContact O-N 2.93Å; Q79-Y81 VanDerWaalsContact O-N 3.07Å; Y81-Y231 WeakPolarHBondContact O-CA 3.46Å; Y81-D232 PolarHBondContact O-N 3.16Å; Y81-P234 HydrophobicContact CD1-CG 4.14Å; Y81-P234 HydrophobicContact CE1-CG 3.48Å; Y81-P234 VanDerWaalsContact CE1-CG 3.48Å
82	K	95.1	Very high	92.8	Very high	12 Å²	12	77.8 Å²	77.8	5%	0.052	37%	0.373	C	S	.	.	B	Isolated β-bridge	trans	-63.9	137.5	174.1	-177.1	166	168.5	123.3	0	110.3	Q79 Q84 Q85 K87 E89 Y231	Q79-K82 VanDerWaalsContact O-CB 3.25Å; Q79-K82 WeakPolarHBondContact O-CB 3.44Å; Q79-K82 PolarHBondContact O-N 3.38Å; K82-Q84 WeakPolarHBondContact CE-O 3.22Å; K82-Q85 PolarHBondContact O-NE2 2.96Å; K82-K87 VanDerWaalsContact CE-O 3.25Å; K82-K87 WeakPolarHBondContact CE-O 3.32Å; K82-K87 PolarHBondContact NZ-O 3.06Å; K82-E89 IonicContact NZ-OE1 3.46Å; K82-E89 PolarHBondContact NZ-OE1 3.13Å; K82-E89 IonicContact NZ-OE2 3.14Å; K82-E89 PolarHBondContact NZ-OE2 3.12Å; K82-Y231 HydrophobicContact CB-CD1 4.09Å; K82-Y231 HydrophobicContact CB-CE1 3.81Å; K82-Y231 HydrophobicContact CG-CE1 4.45Å
83	I	94.8	Very high	92.7	Very high	25 Å²	25	81.1 Å²	81.1	13%	0.128	39%	0.388	C	S	.	.	S	Bend	trans	-77.9	-54.1	-174	-61.1	165.4	0	0	0	110.4	G230 D232 A247 R248 D251	I83-G230 PolarHBondContact N-O 3.11Å; I83-D232 HydrophobicContact CD1-CB 4.37Å; I83-D232 HydrophobicContact CG1-CB 4.08Å; I83-A247 HydrophobicContact CD1-CB 3.75Å; I83-R248 HydrophobicContact CD1-CG 4.1Å; I83-R248 HydrophobicContact CG1-CG 4.32Å; I83-D251 HydrophobicContact CD1-CB 3.98Å; I83-D251 HydrophobicContact CG2-CB 4.12Å; I83-D251 WeakPolarHBondContact CG2-OD1 3.35Å
84	Q	94.4	Very high	92.8	Very high	14 Å²	14	80 Å²	80	7%	0.065	38%	0.383	C	S	.	.			trans	-99.2	88.9	176.6	-64.4	-175.5	53.5	0	0	111.2	K82 D86 K87 T177 A178 D251	K82-Q84 WeakPolarHBondContact CE-O 3.22Å; Q84-D86 VanDerWaalsContact C-N 3.28Å; Q84-D86 PolarHBondContact O-N 2.77Å; Q84-K87 HydrophobicContact CB-CB 4.4Å; Q84-K87 PolarHBondContact O-N 3.04Å; Q84-K87 VanDerWaalsContact OE1-CD 3.29Å; Q84-T177 PolarHBondContact NE2-O 2.89Å; Q84-A178 HydrophobicContact CB-CB 4.15Å; Q84-A178 HydrophobicContact CG-CB 4.47Å; Q84-D251 WeakPolarHBondContact CG-OD1 3.35Å; Q84-D251 PolarHBondContact NE2-OD1 2.83Å; Q84-D251 PolarHBondContact NE2-OD2 3.47Å
85	Q	91.7	Very high	92.9	Very high	103 Å²	103	79.4 Å²	79.4	48%	0.481	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-29.7	-175.1	-64.6	-69	-29.3	0	0	114	Q79 K82 K87	Q79-Q85 PolarHBondContact O-NE2 3.43Å; Q79-Q85 PolarHBondContact O-OE1 2.97Å; K82-Q85 PolarHBondContact O-NE2 2.96Å; Q85-K87 VanDerWaalsContact C-N 3.29Å; Q85-K87 PolarHBondContact O-N 3.19Å
86	D	91.8	Very high	92.9	Very high	129 Å²	129	79.2 Å²	79.2	69%	0.69	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-6.7	-177.8	61.5	-50.4	0	0	0	113.5	Q84 P88	Q84-D86 VanDerWaalsContact C-N 3.28Å; Q84-D86 PolarHBondContact O-N 2.77Å; D86-P88 WeakPolarHBondContact O-CD 3.32Å
87	K	90.9	Very high	93	Very high	66 Å²	66	74 Å²	74	29%	0.287	34%	0.344	S	S	.	.			trans	-124.1	75.4	-176.7	-64.8	180	-169.4	167.8	0	111.4	K82 Q84 Q85 T177 A178	K82-K87 VanDerWaalsContact CE-O 3.25Å; K82-K87 WeakPolarHBondContact CE-O 3.32Å; K82-K87 PolarHBondContact NZ-O 3.06Å; Q84-K87 HydrophobicContact CB-CB 4.4Å; Q84-K87 PolarHBondContact O-N 3.04Å; Q84-K87 VanDerWaalsContact OE1-CD 3.29Å; Q85-K87 VanDerWaalsContact C-N 3.29Å; Q85-K87 PolarHBondContact O-N 3.19Å; K87-T177 PolarHBondContact NZ-OG1 3.32Å; K87-A178 HydrophobicContact CB-CB 3.76Å; K87-A178 HydrophobicContact CD-CB 3.74Å; K87-A178 HydrophobicContact CG-CB 4.45Å
88	P	87.8	Confident	93.1	Very high	84 Å²	84	70.5 Å²	70.5	55%	0.545	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-64.4	150.7	173.9	28.7	-34.9	0	0	0	111.4	D86 T90	D86-P88 WeakPolarHBondContact O-CD 3.32Å; P88-T90 PolarHBondContact O-N 3.43Å
89	E	89.8	Confident	93.2	Very high	36 Å²	36	75 Å²	75	17%	0.168	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-70.7	127.2	173	-58.4	76.4	-168.3	0	0	109.1	K82 Q94 F180	K82-E89 IonicContact NZ-OE1 3.46Å; K82-E89 PolarHBondContact NZ-OE1 3.13Å; K82-E89 IonicContact NZ-OE2 3.14Å; K82-E89 PolarHBondContact NZ-OE2 3.12Å; E89-Q94 HydrophobicContact CB-CG 4.34Å; E89-F180 HydrophobicContact CG-CB 3.96Å; E89-F180 HydrophobicContact CG-CD1 4.3Å; E89-F180 HydrophobicContact CG-CG 4.14Å
90	T	91.6	Very high	93.4	Very high	52 Å²	52	74.6 Å²	74.6	32%	0.319	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-101.1	148.5	175.7	69	0	0	0	0	110.6	P88 E92 K93 Q94	P88-T90 PolarHBondContact O-N 3.43Å; T90-E92 PolarHBondContact O-N 2.98Å; T90-K93 PolarHBondContact O-N 3.37Å; T90-K93 WeakPolarHBondContact OG1-CB 3.42Å; T90-K93 WeakPolarHBondContact OG1-CG 3.27Å; T90-K93 PolarHBondContact OG1-N 2.94Å; T90-Q94 WeakPolarHBondContact O-CG 3.43Å; T90-Q94 PolarHBondContact O-N 2.94Å
91	W	92.6	Very high	93.5	Very high	177 Å²	177	67.8 Å²	67.8	67%	0.67	32%	0.317	S	S	*	.	H	α-helix	trans	-55	-41.6	177	177.6	-107.6	0	0	0	112.5	K93 Q94 W95	W91-K93 PolarHBondContact O-N 2.8Å; W91-Q94 PolarHBondContact O-N 2.92Å; W91-W95 VanDerWaalsContact O-CB 3.29Å; W91-W95 WeakPolarHBondContact O-CB 3.4Å; W91-W95 PolarHBondContact O-N 2.98Å
92	E	93.6	Very high	93.6	Very high	150 Å²	150	68.5 Å²	68.5	70%	0.701	33%	0.325	S	S	*	.	H	α-helix	trans	-60.3	-43.8	179.4	-64.2	165.6	177.4	0	0	112.4	T90 T96	T90-E92 PolarHBondContact O-N 2.98Å; E92-T96 WeakPolarHBondContact O-CB 3.46Å; E92-T96 PolarHBondContact O-N 3.12Å; E92-T96 PolarHBondContact O-OG1 3.4Å
93	K	92.4	Very high	93.6	Very high	109 Å²	109	72.7 Å²	72.7	47%	0.474	34%	0.343	S	S	.	.	H	α-helix	trans	-67	-46.3	177.1	-82	-176.5	178.6	-176.8	0	111.5	T90 W91 W95 T96 C97 F176	T90-K93 PolarHBondContact O-N 3.37Å; T90-K93 WeakPolarHBondContact OG1-CB 3.42Å; T90-K93 WeakPolarHBondContact OG1-CG 3.27Å; T90-K93 PolarHBondContact OG1-N 2.94Å; W91-K93 PolarHBondContact O-N 2.8Å; K93-W95 VanDerWaalsContact C-N 3.33Å; K93-W95 PolarHBondContact O-N 3.33Å; K93-T96 PolarHBondContact O-N 2.84Å; K93-C97 WeakPolarHBondContact O-CB 3.42Å; K93-C97 PolarHBondContact O-N 3.46Å; K93-F176 HydrophobicContact CB-CD1 4.43Å; K93-F176 HydrophobicContact CB-CE1 3.79Å; K93-F176 HydrophobicContact CD-CD1 4.29Å; K93-F176 HydrophobicContact CD-CE1 4.33Å; K93-F176 HydrophobicContact CG-CD1 4.48Å; K93-F176 HydrophobicContact CG-CE1 4.02Å
94	Q	94.3	Very high	93.7	Very high	13 Å²	13	71.5 Å²	71.5	6%	0.061	34%	0.337	C	S	.	.	H	α-helix	trans	-61.6	-42.5	177.3	-68.9	-177.4	43	0	0	111.4	F70 E89 T90 W91 T96 C97 F98 F180	F70-Q94 VanDerWaalsContact CE2-OE1 3.29Å; E89-Q94 HydrophobicContact CB-CG 4.34Å; T90-Q94 WeakPolarHBondContact O-CG 3.43Å; T90-Q94 PolarHBondContact O-N 2.94Å; W91-Q94 PolarHBondContact O-N 2.92Å; Q94-T96 VanDerWaalsContact C-N 3.35Å; Q94-T96 PolarHBondContact O-N 3.2Å; Q94-C97 WeakPolarHBondContact O-CB 3.4Å; Q94-C97 PolarHBondContact O-N 3.47Å; Q94-F98 VanDerWaalsContact O-CB 3.29Å; Q94-F98 WeakPolarHBondContact O-CB 3.1Å; Q94-F98 PolarHBondContact O-N 3.42Å; Q94-F180 HydrophobicContact CG-CE2 3.97Å; Q94-F180 HydrophobicContact CG-CZ 4.21Å
95	W	95.6	Very high	93.8	Very high	118 Å²	118	71 Å²	71	45%	0.447	34%	0.335	S	S	.	.	H	α-helix	trans	-67.4	-35.7	178.1	-173	-125.2	0	0	0	112.9	W91 K93 F98 K99	W91-W95 VanDerWaalsContact O-CB 3.29Å; W91-W95 WeakPolarHBondContact O-CB 3.4Å; W91-W95 PolarHBondContact O-N 2.98Å; K93-W95 VanDerWaalsContact C-N 3.33Å; K93-W95 PolarHBondContact O-N 3.33Å; W95-F98 HydrophobicContact CE3-CB 4.41Å; W95-F98 AromaticContact CE3-CD1 3.78Å; W95-F98 HydrophobicContact CE3-CD1 3.78Å; W95-F98 HydrophobicContact CE3-CG 4.44Å; W95-F98 HydrophobicContact CH2-CD1 4.1Å; W95-F98 HydrophobicContact CH2-CE1 4.24Å; W95-F98 AromaticContact CZ3-CD1 3.38Å; W95-F98 HydrophobicContact CZ3-CD1 3.38Å; W95-F98 AromaticContact CZ3-CE1 3.73Å; W95-F98 HydrophobicContact CZ3-CE1 3.73Å; W95-F98 HydrophobicContact CZ3-CG 4.38Å; W95-K99 HydrophobicContact CZ2-CG 4.48Å; W95-K99 VanDerWaalsContact NE1-CE 3.31Å; W95-K99 WeakPolarHBondContact O-CE 3.46Å; W95-K99 PolarHBondContact O-N 3.25Å; W95-K99 VanDerWaalsContact O-N 3.12Å
96	T	94.4	Very high	94	Very high	61 Å²	61	72.1 Å²	72.1	37%	0.374	34%	0.338	S	S	.	.	H	α-helix	trans	-65.3	-47.7	173.5	-59.7	0	0	0	0	110.8	E92 K93 Q94 F98 K99 M100	E92-T96 WeakPolarHBondContact O-CB 3.46Å; E92-T96 PolarHBondContact O-N 3.12Å; E92-T96 PolarHBondContact O-OG1 3.4Å; K93-T96 PolarHBondContact O-N 2.84Å; Q94-T96 VanDerWaalsContact C-N 3.35Å; Q94-T96 PolarHBondContact O-N 3.2Å; T96-F98 PolarHBondContact O-N 2.96Å; T96-K99 PolarHBondContact O-N 3.45Å; T96-M100 PolarHBondContact O-N 3.4Å
97	C	95.9	Very high	94.2	Very high	0 Å²	0	71.5 Å²	71.5	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-56.1	-50.1	174	-176	0	0	0	0	111.3	K93 Q94 K99 M100 L101 F176 F180 Y186	K93-C97 WeakPolarHBondContact O-CB 3.42Å; K93-C97 PolarHBondContact O-N 3.46Å; Q94-C97 WeakPolarHBondContact O-CB 3.4Å; Q94-C97 PolarHBondContact O-N 3.47Å; C97-K99 PolarHBondContact O-N 3.47Å; C97-M100 PolarHBondContact O-N 2.95Å; C97-L101 VanDerWaalsContact O-CB 3.3Å; C97-L101 WeakPolarHBondContact O-CB 2.98Å; C97-L101 PolarHBondContact O-N 3.45Å; C97-F176 HydrophobicContact CB-CE2 4.2Å; C97-F176 HydrophobicContact CB-CZ 3.83Å; C97-F180 HydrophobicContact CB-CE2 4.21Å; C97-F180 HydrophobicContact CB-CZ 3.73Å; C97-Y186 HydrophobicContact CB-CD2 4.25Å
98	F	96	Very high	94.4	Very high	54 Å²	54	69.8 Å²	69.8	24%	0.237	32%	0.323	C	S	.	.	H	α-helix	trans	-58.9	-42.4	-178.2	-177.3	-106.7	0	0	0	113.1	F63 Q94 W95 T96 M100 L101 L102 M182	F63-F98 HydrophobicContact CE1-CE2 4.1Å; F63-F98 HydrophobicContact CZ-CE2 4.23Å; Q94-F98 VanDerWaalsContact O-CB 3.29Å; Q94-F98 WeakPolarHBondContact O-CB 3.1Å; Q94-F98 PolarHBondContact O-N 3.42Å; W95-F98 HydrophobicContact CE3-CB 4.41Å; W95-F98 AromaticContact CE3-CD1 3.78Å; W95-F98 HydrophobicContact CE3-CD1 3.78Å; W95-F98 HydrophobicContact CE3-CG 4.44Å; W95-F98 HydrophobicContact CH2-CD1 4.1Å; W95-F98 HydrophobicContact CH2-CE1 4.24Å; W95-F98 AromaticContact CZ3-CD1 3.38Å; W95-F98 HydrophobicContact CZ3-CD1 3.38Å; W95-F98 AromaticContact CZ3-CE1 3.73Å; W95-F98 HydrophobicContact CZ3-CE1 3.73Å; W95-F98 HydrophobicContact CZ3-CG 4.38Å; T96-F98 PolarHBondContact O-N 2.96Å; F98-M100 PolarHBondContact O-N 2.97Å; F98-L101 WeakPolarHBondContact O-CB 3.2Å; F98-L101 PolarHBondContact O-N 2.88Å; F98-L102 HydrophobicContact CD1-CD1 4.04Å; F98-L102 HydrophobicContact CD1-CG 4.44Å; F98-L102 HydrophobicContact CE1-CD1 3.43Å; F98-L102 VanDerWaalsContact CE1-CD1 3.43Å; F98-L102 HydrophobicContact CE1-CG 4.07Å; F98-L102 HydrophobicContact CE2-CD1 4.41Å; F98-L102 HydrophobicContact CE2-CD2 4.24Å; F98-L102 HydrophobicContact CE2-CG 4.24Å; F98-L102 HydrophobicContact CZ-CD1 3.65Å; F98-L102 HydrophobicContact CZ-CD2 4.08Å; F98-L102 HydrophobicContact CZ-CG 3.96Å; F98-L102 WeakPolarHBondContact O-CG 3.44Å; F98-L102 PolarHBondContact O-N 3.34Å; F98-M182 HydrophobicContact CB-SD 3.88Å; F98-M182 HydrophobicContact CD2-CE 4.37Å; F98-M182 HydrophobicContact CD2-SD 3.91Å; F98-M182 HydrophobicContact CG-SD 4.39Å
99	K	95.9	Very high	94.8	Very high	109 Å²	109	66.5 Å²	66.5	47%	0.474	30%	0.301	S	S	.	.	H	α-helix	trans	-62.8	-43.4	178	-80.6	178.4	-80	175.5	0	112.7	W95 T96 C97 F103	W95-K99 HydrophobicContact CZ2-CG 4.48Å; W95-K99 VanDerWaalsContact NE1-CE 3.31Å; W95-K99 WeakPolarHBondContact O-CE 3.46Å; W95-K99 PolarHBondContact O-N 3.25Å; W95-K99 VanDerWaalsContact O-N 3.12Å; T96-K99 PolarHBondContact O-N 3.45Å; C97-K99 PolarHBondContact O-N 3.47Å; K99-F103 PolarHBondContact O-N 3.27Å; K99-F103 VanDerWaalsContact O-N 3.16Å
100	M	94.9	Very high	95.1	Very high	47 Å²	47	67 Å²	67	23%	0.232	30%	0.302	C	S	.	.	H	α-helix	trans	-72.8	-35	178.1	-178.8	153.1	175.5	0	0	112	T96 C97 F98 F103 N104 V172 Y186 A187	T96-M100 PolarHBondContact O-N 3.4Å; C97-M100 PolarHBondContact O-N 2.95Å; F98-M100 PolarHBondContact O-N 2.97Å; M100-F103 WeakPolarHBondContact O-CB 3.43Å; M100-F103 PolarHBondContact O-N 2.58Å; M100-N104 PolarHBondContact O-N 2.77Å; M100-V172 HydrophobicContact CE-CG1 3.52Å; M100-V172 HydrophobicContact SD-CG1 4.07Å; M100-Y186 HydrophobicContact CB-CD2 3.7Å; M100-Y186 HydrophobicContact CB-CE2 3.43Å; M100-Y186 VanDerWaalsContact CB-CE2 3.43Å; M100-Y186 HydrophobicContact CG-CD2 3.85Å; M100-Y186 HydrophobicContact CG-CE2 3.69Å; M100-Y186 HydrophobicContact SD-CD2 4.06Å; M100-Y186 HydrophobicContact SD-CE1 4.45Å; M100-Y186 HydrophobicContact SD-CE2 3.46Å; M100-Y186 WeakPolarHBondContact SD-CE2 3.19Å; M100-A187 WeakPolarHBondContact CE-O 3.44Å
101	L	95.7	Very high	95.4	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-56.6	-52.3	171.9	-177.4	78.1	0	0	0	110.7	Y62 F63 C97 F98 F103 N104 H105 M182 E185	Y62-L101 HydrophobicContact CD1-CD2 4.43Å; Y62-L101 HydrophobicContact CE1-CD1 3.87Å; Y62-L101 HydrophobicContact CE1-CD2 3.67Å; Y62-L101 HydrophobicContact CE1-CG 4.34Å; Y62-L101 WeakPolarHBondContact OH-CD1 3.37Å; F63-L101 HydrophobicContact CE1-CD2 4.01Å; F63-L101 HydrophobicContact CZ-CD2 4.13Å; C97-L101 VanDerWaalsContact O-CB 3.3Å; C97-L101 WeakPolarHBondContact O-CB 2.98Å; C97-L101 PolarHBondContact O-N 3.45Å; F98-L101 WeakPolarHBondContact O-CB 3.2Å; F98-L101 PolarHBondContact O-N 2.88Å; L101-F103 VanDerWaalsContact C-N 3.25Å; L101-F103 PolarHBondContact O-N 3.32Å; L101-N104 PolarHBondContact O-N 3.13Å; L101-H105 WeakPolarHBondContact CD1-NE2 3.07Å; L101-H105 WeakPolarHBondContact CG-NE2 3.44Å; L101-H105 PolarHBondContact O-CD2 3.27Å; L101-H105 PolarHBondContact O-N 3.07Å; L101-M182 HydrophobicContact CD2-CG 3.75Å; L101-M182 HydrophobicContact CD2-SD 4.44Å; L101-E185 HydrophobicContact CD1-CB 3.73Å
102	L	95.9	Very high	95.5	Very high	79 Å²	79	62.4 Å²	62.4	41%	0.414	29%	0.293	S	S	.	.	H	α-helix	trans	-59.1	-37.6	177	-70.5	-176.7	0	0	0	112.4	F98 F106	F98-L102 HydrophobicContact CD1-CD1 4.04Å; F98-L102 HydrophobicContact CD1-CG 4.44Å; F98-L102 HydrophobicContact CE1-CD1 3.43Å; F98-L102 VanDerWaalsContact CE1-CD1 3.43Å; F98-L102 HydrophobicContact CE1-CG 4.07Å; F98-L102 HydrophobicContact CE2-CD1 4.41Å; F98-L102 HydrophobicContact CE2-CD2 4.24Å; F98-L102 HydrophobicContact CE2-CG 4.24Å; F98-L102 HydrophobicContact CZ-CD1 3.65Å; F98-L102 HydrophobicContact CZ-CD2 4.08Å; F98-L102 HydrophobicContact CZ-CG 3.96Å; F98-L102 WeakPolarHBondContact O-CG 3.44Å; F98-L102 PolarHBondContact O-N 3.34Å; L102-F106 VanDerWaalsContact O-CB 3.27Å; L102-F106 WeakPolarHBondContact O-CB 3.34Å; L102-F106 PolarHBondContact O-N 3.29Å
103	F	96.1	Very high	95.6	Very high	101 Å²	101	56.3 Å²	56.3	44%	0.443	26%	0.264	S	S	.	.	H	α-helix	trans	-61.8	-47.7	173.1	176.8	-86.9	0	0	0	111.4	K99 M100 L101 F106 F107 P189	K99-F103 PolarHBondContact O-N 3.27Å; K99-F103 VanDerWaalsContact O-N 3.16Å; M100-F103 WeakPolarHBondContact O-CB 3.43Å; M100-F103 PolarHBondContact O-N 2.58Å; L101-F103 VanDerWaalsContact C-N 3.25Å; L101-F103 PolarHBondContact O-N 3.32Å; F103-F106 PolarHBondContact O-N 3.27Å; F103-F107 AromaticContact CD2-CD2 3.35Å; F103-F107 HydrophobicContact CD2-CD2 3.35Å; F103-F107 AromaticContact CD2-CE2 3.76Å; F103-F107 HydrophobicContact CD2-CE2 3.76Å; F103-F107 HydrophobicContact CD2-CG 4.28Å; F103-F107 HydrophobicContact CE1-CB 4.41Å; F103-F107 HydrophobicContact CE2-CB 4.35Å; F103-F107 AromaticContact CE2-CD2 3.46Å; F103-F107 HydrophobicContact CE2-CD2 3.46Å; F103-F107 VanDerWaalsContact CE2-CD2 3.46Å; F103-F107 AromaticContact CE2-CE2 3.93Å; F103-F107 HydrophobicContact CE2-CE2 3.93Å; F103-F107 HydrophobicContact CE2-CG 4Å; F103-F107 AromaticContact CG-CD2 3.97Å; F103-F107 HydrophobicContact CG-CD2 3.97Å; F103-F107 HydrophobicContact CZ-CB 4.21Å; F103-F107 HydrophobicContact CZ-CD2 4.16Å; F103-F107 HydrophobicContact CZ-CG 4.33Å; F103-F107 WeakPolarHBondContact O-CB 3.46Å; F103-F107 WeakPolarHBondContact O-CD2 3.39Å; F103-F107 PolarHBondContact O-N 3.41Å; F103-P189 HydrophobicContact CE1-CG 4.34Å
104	N	95.9	Very high	95.8	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64	-44.9	179.2	-77.5	-10.4	0	0	0	111.9	M100 L101 F106 I108 Q109 E185 A187	M100-N104 PolarHBondContact O-N 2.77Å; L101-N104 PolarHBondContact O-N 3.13Å; N104-F106 PolarHBondContact O-N 3.13Å; N104-I108 WeakPolarHBondContact O-CA 3.29Å; N104-I108 VanDerWaalsContact O-CB 3.27Å; N104-I108 WeakPolarHBondContact O-CB 3.44Å; N104-I108 PolarHBondContact O-N 3.4Å; N104-Q109 PolarHBondContact O-N 3.15Å; N104-E185 PolarHBondContact ND2-O 3.28Å; N104-E185 VanDerWaalsContact ND2-O 3.1Å; N104-A187 PolarHBondContact ND2-O 3.07Å
105	H	96.7	Very high	95.8	Very high	4 Å²	4	53.7 Å²	53.7	2%	0.019	27%	0.266	C	S	.	.	I	π-helix	trans	-59.5	-47.4	177.6	-75.9	-145.6	0	0	0	110.8	H58 E59 Y62 L101 Q109 F110 E185	H58-H105 AromaticContact CE1-CE1 3.66Å; H58-H105 AromaticContact CE1-ND1 3.94Å; E59-H105 WeakPolarHBondContact OE1-CB 3.28Å; E59-H105 IonicContact OE1-CE1 3.13Å; E59-H105 IonicContact OE1-CG 3.52Å; E59-H105 IonicContact OE1-ND1 3.78Å; E59-H105 PolarHBondContact OE1-ND1 3.49Å; E59-H105 IonicContact OE2-CE1 3.98Å; E59-H105 IonicContact OE2-ND1 2.6Å; E59-H105 PolarHBondContact OE2-ND1 3.33Å; Y62-H105 AromaticContact CD1-CE1 3.88Å; L101-H105 WeakPolarHBondContact CD1-NE2 3.07Å; L101-H105 WeakPolarHBondContact CG-NE2 3.44Å; L101-H105 PolarHBondContact O-CD2 3.27Å; L101-H105 PolarHBondContact O-N 3.07Å; H105-Q109 PolarHBondContact CD2-OE1 3.42Å; H105-F110 VanDerWaalsContact O-CB 3.31Å; H105-F110 WeakPolarHBondContact O-CB 3.36Å; H105-F110 PolarHBondContact O-N 3.35Å; H105-E185 IonicContact CD2-OE2 3.19Å; H105-E185 IonicContact CE1-OE2 3.53Å; H105-E185 IonicContact NE2-OE2 2.93Å; H105-E185 PolarHBondContact NE2-OE2 3.42Å
106	F	96.1	Very high	95.8	Very high	125 Å²	125	48.8 Å²	48.8	55%	0.548	25%	0.249	S	C	.	.	I	π-helix	trans	-77.8	-42.6	-175.6	-170.1	-94.2	0	0	0	114.2	L102 F103 N104 F110	L102-F106 VanDerWaalsContact O-CB 3.27Å; L102-F106 WeakPolarHBondContact O-CB 3.34Å; L102-F106 PolarHBondContact O-N 3.29Å; F103-F106 PolarHBondContact O-N 3.27Å; N104-F106 PolarHBondContact O-N 3.13Å; F106-F110 WeakPolarHBondContact O-CB 3.4Å
107	F	96.4	Very high	96	Very high	117 Å²	117	48.9 Å²	48.9	51%	0.513	24%	0.243	S	C	.	.	I	π-helix	trans	-96.8	-20.4	-172.2	-70.4	-75.6	0	0	0	114.2	F103 P111	F103-F107 AromaticContact CD2-CD2 3.35Å; F103-F107 HydrophobicContact CD2-CD2 3.35Å; F103-F107 AromaticContact CD2-CE2 3.76Å; F103-F107 HydrophobicContact CD2-CE2 3.76Å; F103-F107 HydrophobicContact CD2-CG 4.28Å; F103-F107 HydrophobicContact CE1-CB 4.41Å; F103-F107 HydrophobicContact CE2-CB 4.35Å; F103-F107 AromaticContact CE2-CD2 3.46Å; F103-F107 HydrophobicContact CE2-CD2 3.46Å; F103-F107 VanDerWaalsContact CE2-CD2 3.46Å; F103-F107 AromaticContact CE2-CE2 3.93Å; F103-F107 HydrophobicContact CE2-CE2 3.93Å; F103-F107 HydrophobicContact CE2-CG 4Å; F103-F107 AromaticContact CG-CD2 3.97Å; F103-F107 HydrophobicContact CG-CD2 3.97Å; F103-F107 HydrophobicContact CZ-CB 4.21Å; F103-F107 HydrophobicContact CZ-CD2 4.16Å; F103-F107 HydrophobicContact CZ-CG 4.33Å; F103-F107 WeakPolarHBondContact O-CB 3.46Å; F103-F107 WeakPolarHBondContact O-CD2 3.39Å; F103-F107 PolarHBondContact O-N 3.41Å; F107-P111 WeakPolarHBondContact O-CG 3.49Å
108	I	95.7	Very high	96	Very high	29 Å²	29	56.6 Å²	56.6	15%	0.149	27%	0.273	C	S	.	.	I	π-helix	trans	-113.1	-57.1	-176.8	-49.7	-57.4	0	0	0	110.4	N104 P111 L112 P189 T192 I193	N104-I108 WeakPolarHBondContact O-CA 3.29Å; N104-I108 VanDerWaalsContact O-CB 3.27Å; N104-I108 WeakPolarHBondContact O-CB 3.44Å; N104-I108 PolarHBondContact O-N 3.4Å; I108-P111 WeakPolarHBondContact O-CD 3.29Å; I108-L112 WeakPolarHBondContact O-CG 3.09Å; I108-L112 PolarHBondContact O-N 2.57Å; I108-P189 HydrophobicContact CD1-CB 3.7Å; I108-P189 HydrophobicContact CD1-CG 4.18Å; I108-P189 HydrophobicContact CG1-CB 3.99Å; I108-P189 HydrophobicContact CG1-CG 4.27Å; I108-T192 HydrophobicContact CG2-CG2 4.01Å; I108-I193 HydrophobicContact CG2-CG1 4.17Å
109	Q	95.9	Very high	96	Very high	16 Å²	16	55.5 Å²	55.5	8%	0.075	27%	0.269	C	S	.	.	I	π-helix	trans	-75.2	-40.7	-174.9	-63	172.1	-7	0	0	112.6	H58 N104 H105 L112 I113 E185	H58-Q109 PolarHBondContact CE1-OE1 3.03Å; H58-Q109 PolarHBondContact NE2-OE1 3.32Å; N104-Q109 PolarHBondContact O-N 3.15Å; H105-Q109 PolarHBondContact CD2-OE1 3.42Å; Q109-L112 CarbonylContact O-C 3.52Å; Q109-L112 WeakPolarHBondContact O-CA 3.28Å; Q109-L112 WeakPolarHBondContact O-CB 3.4Å; Q109-L112 PolarHBondContact O-N 2.96Å; Q109-I113 WeakPolarHBondContact O-CG1 3.27Å; Q109-I113 PolarHBondContact O-N 3.48Å; Q109-E185 PolarHBondContact NE2-OE2 3.32Å
110	F	96.4	Very high	96.1	Very high	45 Å²	45	50.4 Å²	50.4	20%	0.197	25%	0.246	C	C	.	.	H	α-helix	trans	-60.7	-42.8	-179.9	173.8	-117	0	0	0	113.3	T51 W52 L55 H105 F106 L112 I113 C114	T51-F110 HydrophobicContact CG2-CE2 4.44Å; W52-F110 HydrophobicContact CH2-CE2 4.27Å; W52-F110 AromaticContact CH2-CZ 4Å; W52-F110 HydrophobicContact CH2-CZ 4Å; W52-F110 AromaticContact CZ3-CE2 3.98Å; W52-F110 HydrophobicContact CZ3-CE2 3.98Å; W52-F110 HydrophobicContact CZ3-CZ 4.15Å; L55-F110 HydrophobicContact CD1-CD2 4.14Å; L55-F110 HydrophobicContact CD2-CD2 3.88Å; L55-F110 HydrophobicContact CD2-CE2 3.98Å; H105-F110 VanDerWaalsContact O-CB 3.31Å; H105-F110 WeakPolarHBondContact O-CB 3.36Å; H105-F110 PolarHBondContact O-N 3.35Å; F106-F110 WeakPolarHBondContact O-CB 3.4Å; F110-L112 VanDerWaalsContact C-N 3.31Å; F110-L112 PolarHBondContact O-N 3.26Å; F110-I113 PolarHBondContact O-N 3.01Å; F110-C114 PolarHBondContact O-N 3.33Å; F110-C114 PolarHBondContact O-SG 2.96Å
111	P	96.1	Very high	96.2	Very high	70 Å²	70	52 Å²	52	46%	0.455	25%	0.253	S	S	.	.	H	α-helix	trans	-58.6	-38.9	169	-29.2	37.4	0	0	0	113.9	F107 I108 C114 G115	F107-P111 WeakPolarHBondContact O-CG 3.49Å; I108-P111 WeakPolarHBondContact O-CD 3.29Å; P111-C114 WeakPolarHBondContact O-CB 3.47Å; P111-C114 PolarHBondContact O-N 2.93Å; P111-G115 PolarHBondContact O-N 2.82Å
112	L	95.2	Very high	96.3	Very high	64 Å²	64	59.7 Å²	59.7	34%	0.335	29%	0.287	S	S	.	.	H	α-helix	trans	-65.8	-40.6	175.2	-66.3	171.9	0	0	0	111.6	I108 Q109 F110 G115 F200	I108-L112 WeakPolarHBondContact O-CG 3.09Å; I108-L112 PolarHBondContact O-N 2.57Å; Q109-L112 CarbonylContact O-C 3.52Å; Q109-L112 WeakPolarHBondContact O-CA 3.28Å; Q109-L112 WeakPolarHBondContact O-CB 3.4Å; Q109-L112 PolarHBondContact O-N 2.96Å; F110-L112 VanDerWaalsContact C-N 3.31Å; F110-L112 PolarHBondContact O-N 3.26Å; L112-G115 WeakPolarHBondContact O-CA 3.23Å; L112-G115 PolarHBondContact O-N 3.45Å; L112-F200 HydrophobicContact CB-CZ 4.12Å; L112-F200 HydrophobicContact CD1-CE2 4.35Å; L112-F200 HydrophobicContact CD1-CZ 4.43Å; L112-F200 HydrophobicContact CD2-CE2 4.37Å; L112-F200 HydrophobicContact CD2-CZ 4.26Å
113	I	96.4	Very high	96.3	Very high	21 Å²	21	60.2 Å²	60.2	11%	0.108	29%	0.286	C	S	.	.	H	α-helix	trans	-65.4	-39.1	176.8	-69.8	167.8	0	0	0	110.9	T51 L55 H58 Q109 F110 G115 T116	T51-I113 WeakPolarHBondContact O-CG2 3.37Å; L55-I113 HydrophobicContact CB-CG2 4.23Å; L55-I113 HydrophobicContact CD1-CD1 3.94Å; H58-I113 HydrophobicContact CB-CD1 4.29Å; Q109-I113 WeakPolarHBondContact O-CG1 3.27Å; Q109-I113 PolarHBondContact O-N 3.48Å; F110-I113 PolarHBondContact O-N 3.01Å; I113-G115 PolarHBondContact O-N 3.14Å; I113-T116 WeakPolarHBondContact O-CB 3.25Å; I113-T116 PolarHBondContact O-N 3.31Å; I113-T116 PolarHBondContact O-OG1 3.28Å
114	C	95.9	Very high	96.4	Very high	36 Å²	36	60.3 Å²	60.3	24%	0.243	30%	0.299	C	S	.	.	H	α-helix	trans	-56.9	-30.9	170.5	-67.6	0	0	0	0	112	F110 P111 T116	F110-C114 PolarHBondContact O-N 3.33Å; F110-C114 PolarHBondContact O-SG 2.96Å; P111-C114 WeakPolarHBondContact O-CB 3.47Å; P111-C114 PolarHBondContact O-N 2.93Å; C114-T116 PolarHBondContact O-N 3.02Å
115	G	95.8	Very high	96.5	Very high	32 Å²	32	60.8 Å²	60.8	33%	0.33	30%	0.302	S	S	.	.	H	α-helix	trans	-61.8	-22.1	172.8	0	0	0	0	0	114.2	P111 L112 I113 Y117 Y118 F119	P111-G115 PolarHBondContact O-N 2.82Å; L112-G115 WeakPolarHBondContact O-CA 3.23Å; L112-G115 PolarHBondContact O-N 3.45Å; I113-G115 PolarHBondContact O-N 3.14Å; G115-Y117 VanDerWaalsContact C-N 3.32Å; G115-Y117 PolarHBondContact O-N 3.04Å; G115-Y118 PolarHBondContact O-N 3.09Å; G115-F119 PolarHBondContact O-N 3.27Å
116	T	95.3	Very high	96.5	Very high	14 Å²	14	62.3 Å²	62.3	9%	0.086	31%	0.312	C	S	.	.	H	α-helix	trans	-58.1	-42.4	-178.6	-52.8	0	0	0	0	111.8	A50 I113 C114 Y118 F119 T120 L213	A50-T116 HydrophobicContact CB-CG2 4.39Å; A50-T116 WeakPolarHBondContact O-CB 3.28Å; I113-T116 WeakPolarHBondContact O-CB 3.25Å; I113-T116 PolarHBondContact O-N 3.31Å; I113-T116 PolarHBondContact O-OG1 3.28Å; C114-T116 PolarHBondContact O-N 3.02Å; T116-Y118 PolarHBondContact O-N 2.92Å; T116-F119 WeakPolarHBondContact O-CB 3.25Å; T116-F119 PolarHBondContact O-N 3.11Å; T116-T120 HydrophobicContact CG2-CG2 4.3Å; T116-T120 WeakPolarHBondContact O-CG2 3.04Å; T116-T120 PolarHBondContact O-N 2.68Å; T116-T120 PolarHBondContact O-OG1 3.22Å; T116-T120 VanDerWaalsContact O-OG1 3.07Å; T116-L213 HydrophobicContact CG2-CD1 4.2Å; T116-L213 HydrophobicContact CG2-CD2 3.8Å
117	Y	97.1	Very high	96.6	Very high	64 Å²	64	56.8 Å²	56.8	25%	0.251	29%	0.288	S	S	.	.	H	α-helix	trans	-59.6	-47	177.9	173.5	-110.3	0	0	0	112	K46 F47 A50 G115 F119 T120 E121	K46-Y117 HydrophobicContact CB-CE2 4.21Å; F47-Y117 VanDerWaalsContact CA-CD2 3.46Å; F47-Y117 HydrophobicContact CB-CD2 3.95Å; F47-Y117 HydrophobicContact CB-CE2 3.9Å; F47-Y117 HydrophobicContact CB-CG 4.33Å; F47-Y117 AromaticContact CD2-CD1 3.73Å; F47-Y117 HydrophobicContact CD2-CD1 3.73Å; F47-Y117 HydrophobicContact CD2-CD2 4.21Å; F47-Y117 HydrophobicContact CD2-CE1 4.19Å; F47-Y117 AromaticContact CD2-CG 3.72Å; F47-Y117 HydrophobicContact CD2-CG 3.72Å; F47-Y117 HydrophobicContact CE2-CD1 4.47Å; A50-Y117 HydrophobicContact CB-CD2 4.23Å; G115-Y117 VanDerWaalsContact C-N 3.32Å; G115-Y117 PolarHBondContact O-N 3.04Å; Y117-F119 VanDerWaalsContact C-N 3.33Å; Y117-F119 PolarHBondContact O-N 2.99Å; Y117-T120 WeakPolarHBondContact CA-OG1 3.48Å; Y117-T120 PolarHBondContact O-N 3.42Å; Y117-T120 PolarHBondContact O-OG1 2.92Å; Y117-E121 HydrophobicContact CD2-CG 4.09Å; Y117-E121 HydrophobicContact CE1-CG 4.28Å; Y117-E121 HydrophobicContact CE2-CG 3.62Å; Y117-E121 WeakPolarHBondContact O-CG 3.47Å; Y117-E121 PolarHBondContact O-N 3.37Å
118	Y	96.9	Very high	96.5	Very high	162 Å²	162	54.2 Å²	54.2	64%	0.635	28%	0.279	S	S	*	.	H	α-helix	trans	-65.3	-39.7	178.8	-63.8	-75.1	0	0	0	111.6	G115 T116 F122	G115-Y118 PolarHBondContact O-N 3.09Å; T116-Y118 PolarHBondContact O-N 2.92Å; Y118-F122 WeakPolarHBondContact O-CB 3.44Å; Y118-F122 PolarHBondContact O-N 3.32Å
119	F	96.6	Very high	96.4	Very high	31 Å²	31	54.7 Å²	54.7	14%	0.136	28%	0.279	C	S	.	.	H	α-helix	trans	-58.8	-50.3	173.3	170.7	-92.7	0	0	0	111.1	G115 T116 Y117 E121 F122 F123 I125 I203 M204 C207 L213	G115-F119 PolarHBondContact O-N 3.27Å; T116-F119 WeakPolarHBondContact O-CB 3.25Å; T116-F119 PolarHBondContact O-N 3.11Å; Y117-F119 VanDerWaalsContact C-N 3.33Å; Y117-F119 PolarHBondContact O-N 2.99Å; F119-E121 VanDerWaalsContact C-N 3.34Å; F119-E121 PolarHBondContact O-N 2.64Å; F119-F122 PolarHBondContact O-N 2.92Å; F119-F123 AromaticContact CD2-CD2 3.45Å; F119-F123 HydrophobicContact CD2-CD2 3.45Å; F119-F123 VanDerWaalsContact CD2-CD2 3.45Å; F119-F123 AromaticContact CD2-CE2 3.53Å; F119-F123 HydrophobicContact CD2-CE2 3.53Å; F119-F123 AromaticContact CE2-CD2 3.37Å; F119-F123 HydrophobicContact CE2-CD2 3.37Å; F119-F123 AromaticContact CE2-CE2 3.46Å; F119-F123 HydrophobicContact CE2-CE2 3.46Å; F119-F123 VanDerWaalsContact CE2-CE2 3.46Å; F119-F123 HydrophobicContact CE2-CG 4.34Å; F119-F123 HydrophobicContact CE2-CZ 4.48Å; F119-F123 HydrophobicContact CG-CD2 4.13Å; F119-F123 AromaticContact CZ-CD2 3.99Å; F119-F123 HydrophobicContact CZ-CD2 3.99Å; F119-F123 HydrophobicContact CZ-CE2 4.45Å; F119-F123 WeakPolarHBondContact O-CD2 3.31Å; F119-F123 PolarHBondContact O-N 3.2Å; F119-I125 HydrophobicContact CD1-CG1 4.48Å; F119-I125 HydrophobicContact CE1-CD1 4.45Å; F119-I125 HydrophobicContact CE1-CG1 4.02Å; F119-I203 HydrophobicContact CE1-CD1 4.25Å; F119-I203 HydrophobicContact CE2-CD1 4.22Å; F119-I203 HydrophobicContact CE2-CG1 4.32Å; F119-I203 HydrophobicContact CZ-CB 4.4Å; F119-I203 HydrophobicContact CZ-CD1 4.08Å; F119-I203 HydrophobicContact CZ-CG1 4.15Å; F119-M204 HydrophobicContact CE2-CG 4.13Å; F119-C207 HydrophobicContact CE1-CB 4.17Å; F119-C207 HydrophobicContact CZ-CB 4.07Å; F119-L213 HydrophobicContact CD1-CD1 4.39Å; F119-L213 HydrophobicContact CE1-CD1 4.28Å
120	T	97.1	Very high	96.2	Very high	1 Å²	1	60.3 Å²	60.3	1%	0.006	31%	0.31	C	S	.	.	H	α-helix	trans	-65.9	-36.6	-177.6	51.9	0	0	0	0	112.7	T116 Y117 S124 I125 Y127	T116-T120 HydrophobicContact CG2-CG2 4.3Å; T116-T120 WeakPolarHBondContact O-CG2 3.04Å; T116-T120 PolarHBondContact O-N 2.68Å; T116-T120 PolarHBondContact O-OG1 3.22Å; T116-T120 VanDerWaalsContact O-OG1 3.07Å; Y117-T120 WeakPolarHBondContact CA-OG1 3.48Å; Y117-T120 PolarHBondContact O-N 3.42Å; Y117-T120 PolarHBondContact O-OG1 2.92Å; T120-S124 CarbonylContact O-C 3.55Å; T120-S124 WeakPolarHBondContact O-CA 3.46Å; T120-S124 PolarHBondContact O-N 3.05Å; T120-S124 VanDerWaalsContact O-N 3.09Å; T120-I125 HydrophobicContact CG2-CB 3.96Å; T120-I125 HydrophobicContact CG2-CG1 4.31Å; T120-I125 HydrophobicContact CG2-CG2 4.18Å; T120-I125 PolarHBondContact O-N 3.15Å; T120-Y127 WeakPolarHBondContact CB-OH 3.22Å; T120-Y127 HydrophobicContact CG2-CE2 4.19Å; T120-Y127 WeakPolarHBondContact CG2-OH 3.43Å; T120-Y127 PolarHBondContact OG1-OH 3.09Å
121	E	97.5	Very high	96	Very high	80 Å²	80	60.7 Å²	60.7	37%	0.374	32%	0.318	S	S	.	.	H	α-helix	trans	-72.5	-42.8	175.9	-70.2	-67.2	117.3	0	0	111.6	K46 Y117 F119 F123 S124	K46-E121 VanDerWaalsContact CD-OE1 3.24Å; K46-E121 WeakPolarHBondContact CD-OE1 3.38Å; K46-E121 IonicContact NZ-OE1 2.83Å; K46-E121 PolarHBondContact NZ-OE1 2.89Å; Y117-E121 HydrophobicContact CD2-CG 4.09Å; Y117-E121 HydrophobicContact CE1-CG 4.28Å; Y117-E121 HydrophobicContact CE2-CG 3.62Å; Y117-E121 WeakPolarHBondContact O-CG 3.47Å; Y117-E121 PolarHBondContact O-N 3.37Å; F119-E121 VanDerWaalsContact C-N 3.34Å; F119-E121 PolarHBondContact O-N 2.64Å; E121-F123 PolarHBondContact O-N 3.47Å; E121-S124 PolarHBondContact O-N 3.11Å
122	F	97.1	Very high	95.7	Very high	162 Å²	162	59 Å²	59	71%	0.711	30%	0.304	S	S	*	.	H	α-helix	trans	-61.6	-43.7	179.8	-176.9	-92	0	0	0	112.4	Y118 F119 S124	Y118-F122 WeakPolarHBondContact O-CB 3.44Å; Y118-F122 PolarHBondContact O-N 3.32Å; F119-F122 PolarHBondContact O-N 2.92Å; F122-S124 VanDerWaalsContact C-N 3.34Å
123	F	96.8	Very high	95.4	Very high	90 Å²	90	56.5 Å²	56.5	40%	0.395	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	4.9	178.8	-69.4	-75.4	0	0	0	113.7	F119 E121 I125 M204	F119-F123 AromaticContact CD2-CD2 3.45Å; F119-F123 HydrophobicContact CD2-CD2 3.45Å; F119-F123 VanDerWaalsContact CD2-CD2 3.45Å; F119-F123 AromaticContact CD2-CE2 3.53Å; F119-F123 HydrophobicContact CD2-CE2 3.53Å; F119-F123 AromaticContact CE2-CD2 3.37Å; F119-F123 HydrophobicContact CE2-CD2 3.37Å; F119-F123 AromaticContact CE2-CE2 3.46Å; F119-F123 HydrophobicContact CE2-CE2 3.46Å; F119-F123 VanDerWaalsContact CE2-CE2 3.46Å; F119-F123 HydrophobicContact CE2-CG 4.34Å; F119-F123 HydrophobicContact CE2-CZ 4.48Å; F119-F123 HydrophobicContact CG-CD2 4.13Å; F119-F123 AromaticContact CZ-CD2 3.99Å; F119-F123 HydrophobicContact CZ-CD2 3.99Å; F119-F123 HydrophobicContact CZ-CE2 4.45Å; F119-F123 WeakPolarHBondContact O-CD2 3.31Å; F119-F123 PolarHBondContact O-N 3.2Å; E121-F123 PolarHBondContact O-N 3.47Å; F123-I125 HydrophobicContact CB-CD1 3.87Å; F123-I125 HydrophobicContact CB-CG1 3.9Å; F123-I125 PolarHBondContact O-N 3.15Å; F123-M204 HydrophobicContact CZ-CE 4.46Å
124	S	97.1	Very high	95	Very high	103 Å²	103	62.2 Å²	62.2	72%	0.72	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	42.5	-177.3	-59	0	0	0	0	113	T120 E121 F122 P126	T120-S124 CarbonylContact O-C 3.55Å; T120-S124 WeakPolarHBondContact O-CA 3.46Å; T120-S124 PolarHBondContact O-N 3.05Å; T120-S124 VanDerWaalsContact O-N 3.09Å; E121-S124 PolarHBondContact O-N 3.11Å; F122-S124 VanDerWaalsContact C-N 3.34Å; S124-P126 WeakPolarHBondContact O-CD 3.27Å
125	I	97.8	Very high	94.4	Very high	11 Å²	11	66.4 Å²	66.4	6%	0.056	32%	0.323	C	S	.	.			trans	-68.6	124.1	-179.4	-58.5	-60.8	0	0	0	109.4	F119 T120 F123 Y127	F119-I125 HydrophobicContact CD1-CG1 4.48Å; F119-I125 HydrophobicContact CE1-CD1 4.45Å; F119-I125 HydrophobicContact CE1-CG1 4.02Å; T120-I125 HydrophobicContact CG2-CB 3.96Å; T120-I125 HydrophobicContact CG2-CG1 4.31Å; T120-I125 HydrophobicContact CG2-CG2 4.18Å; T120-I125 PolarHBondContact O-N 3.15Å; F123-I125 HydrophobicContact CB-CD1 3.87Å; F123-I125 HydrophobicContact CB-CG1 3.9Å; F123-I125 PolarHBondContact O-N 3.15Å; I125-Y127 WeakPolarHBondContact O-CD2 3.44Å; I125-Y127 WeakPolarHBondContact O-CE2 3.26Å
126	P	97.4	Very high	93.9	Very high	36 Å²	36	67 Å²	67	23%	0.234	32%	0.321	C	S	.	.			trans	-71.9	156.2	179.8	27.7	-34.1	0	0	0	112.9	S124 D128 N208 H209 V210	S124-P126 WeakPolarHBondContact O-CD 3.27Å; P126-D128 WeakPolarHBondContact CB-OD2 3.48Å; P126-N208 WeakPolarHBondContact CD-O 3.47Å; P126-N208 WeakPolarHBondContact CG-O 3.42Å; P126-H209 PolarHBondContact O-CD2 2.99Å; P126-H209 VanDerWaalsContact O-CD2 3.3Å; P126-V210 PolarHBondContact O-N 3.4Å
127	Y	97.5	Very high	93.5	Very high	9 Å²	9	68.3 Å²	68.3	4%	0.035	33%	0.33	C	S	.	.			trans	-122.2	-17.3	177.5	-76.4	-117.2	0	0	0	111.4	W37 L41 K46 I49 A50 T120 I125 V210	W37-Y127 PolarHBondContact NE1-O 3.5Å; L41-Y127 WeakPolarHBondContact CD1-O 3.04Å; L41-Y127 HydrophobicContact CD2-CD1 4.47Å; K46-Y127 HydrophobicContact CD-CD2 4.45Å; I49-Y127 HydrophobicContact CB-CD1 4.35Å; I49-Y127 HydrophobicContact CB-CE1 4.02Å; I49-Y127 HydrophobicContact CD1-CD1 4.46Å; I49-Y127 HydrophobicContact CG2-CD1 3.92Å; I49-Y127 HydrophobicContact CG2-CE1 3.72Å; A50-Y127 WeakPolarHBondContact CB-OH 3.18Å; T120-Y127 WeakPolarHBondContact CB-OH 3.22Å; T120-Y127 HydrophobicContact CG2-CE2 4.19Å; T120-Y127 WeakPolarHBondContact CG2-OH 3.43Å; T120-Y127 PolarHBondContact OG1-OH 3.09Å; I125-Y127 WeakPolarHBondContact O-CD2 3.44Å; I125-Y127 WeakPolarHBondContact O-CE2 3.26Å; Y127-V210 HydrophobicContact CD1-CB 4.13Å; Y127-V210 HydrophobicContact CD1-CG1 3.63Å; Y127-V210 HydrophobicContact CD1-CG2 4.38Å; Y127-V210 HydrophobicContact CD2-CB 4.42Å; Y127-V210 HydrophobicContact CD2-CG1 4.37Å; Y127-V210 HydrophobicContact CE1-CB 3.93Å; Y127-V210 HydrophobicContact CE1-CG1 3.92Å; Y127-V210 HydrophobicContact CE1-CG2 3.79Å; Y127-V210 HydrophobicContact CE2-CB 4.23Å; Y127-V210 HydrophobicContact CG-CB 4.34Å; Y127-V210 HydrophobicContact CG-CG1 3.85Å
128	D	95.5	Very high	93.3	Very high	62 Å²	62	65.6 Å²	65.6	33%	0.332	32%	0.32	S	S	.	.	S	Bend	trans	-70.2	152.4	-174	60.4	98.6	0	0	0	112.2	P126 D130 S131 H209	P126-D128 WeakPolarHBondContact CB-OD2 3.48Å; D128-D130 VanDerWaalsContact C-N 3.27Å; D128-D130 PolarHBondContact O-N 3.17Å; D128-D130 PolarHBondContact OD1-N 3.22Å; D128-S131 PolarHBondContact O-N 3.26Å; D128-S131 VanDerWaalsContact OD1-CB 3.25Å; D128-S131 WeakPolarHBondContact OD1-CB 3.21Å; D128-S131 PolarHBondContact OD1-N 3.1Å; D128-S131 PolarHBondContact OD1-OG 3.45Å; D128-S131 PolarHBondContact OD2-OG 2.78Å; D128-H209 PolarHBondContact O-NE2 2.91Å
129	W	93.4	Very high	93	Very high	39 Å²	39	63.8 Å²	63.8	15%	0.148	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-62.5	-34.6	-179.8	-178.7	-92.2	0	0	0	113.3	Q30 L33 R34 W37 S131 M132	Q30-W129 HydrophobicContact CG-CH2 4.34Å; Q30-W129 HydrophobicContact CG-CZ2 3.82Å; L33-W129 HydrophobicContact CB-CH2 4.1Å; L33-W129 HydrophobicContact CB-CZ3 4.39Å; L33-W129 HydrophobicContact CD2-CH2 4.11Å; L33-W129 HydrophobicContact CD2-CZ3 4.29Å; L33-W129 HydrophobicContact CG-CH2 3.97Å; L33-W129 HydrophobicContact CG-CZ3 3.91Å; R34-W129 VanDerWaalsContact CA-CZ3 3.41Å; R34-W129 HydrophobicContact CB-CD2 3.91Å; R34-W129 HydrophobicContact CB-CE3 4.12Å; R34-W129 HydrophobicContact CB-CH2 3.73Å; R34-W129 HydrophobicContact CB-CZ2 3.51Å; R34-W129 HydrophobicContact CB-CZ3 4.04Å; R34-W129 HydrophobicContact CG-CD2 3.6Å; R34-W129 HydrophobicContact CG-CE3 4.17Å; R34-W129 HydrophobicContact CG-CG 3.84Å; R34-W129 HydrophobicContact CG-CZ2 4.01Å; R34-W129 VanDerWaalsContact NE-CD1 3.27Å; W37-W129 HydrophobicContact CB-CE3 3.84Å; W37-W129 HydrophobicContact CB-CZ3 4.01Å; W37-W129 AromaticContact CD1-CE3 3.96Å; W37-W129 AromaticContact CG-CE3 3.97Å; W37-W129 HydrophobicContact CG-CE3 3.97Å; W37-W129 HydrophobicContact CG-CZ3 4.37Å; W129-S131 PolarHBondContact O-N 3.03Å; W129-M132 HydrophobicContact CE3-CE 3.74Å; W129-M132 HydrophobicContact CZ3-CE 3.8Å; W129-M132 WeakPolarHBondContact O-CB 3.29Å; W129-M132 PolarHBondContact O-N 3.48Å
130	D	90.9	Very high	92.7	Very high	134 Å²	134	65.3 Å²	65.3	72%	0.717	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-71	-25.2	-172.6	-61.7	-26.9	0	0	0	111.6	R34 D128	R34-D130 IonicContact NH2-OD1 2.89Å; D128-D130 VanDerWaalsContact C-N 3.27Å; D128-D130 PolarHBondContact O-N 3.17Å; D128-D130 PolarHBondContact OD1-N 3.22Å
131	S	92.5	Very high	92.6	Very high	54 Å²	54	68.8 Å²	68.8	38%	0.378	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-90.6	3.1	172.5	-54.8	0	0	0	0	114	D128 W129 H209	D128-S131 PolarHBondContact O-N 3.26Å; D128-S131 VanDerWaalsContact OD1-CB 3.25Å; D128-S131 WeakPolarHBondContact OD1-CB 3.21Å; D128-S131 PolarHBondContact OD1-N 3.1Å; D128-S131 PolarHBondContact OD1-OG 3.45Å; D128-S131 PolarHBondContact OD2-OG 2.78Å; W129-S131 PolarHBondContact O-N 3.03Å; S131-H209 PolarHBondContact O-CD2 3.34Å
132	M	90.9	Very high	92.6	Very high	33 Å²	33	65.5 Å²	65.5	16%	0.163	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-59.3	127.9	-179.4	-174.5	71.6	75.4	0	0	110.5	W37 W129 R134 H209 F211	W37-M132 HydrophobicContact CD2-CE 3.63Å; W37-M132 HydrophobicContact CE3-CE 4.13Å; W37-M132 HydrophobicContact CG-CE 3.92Å; W37-M132 HydrophobicContact CZ2-CE 4.05Å; W129-M132 HydrophobicContact CE3-CE 3.74Å; W129-M132 HydrophobicContact CZ3-CE 3.8Å; W129-M132 WeakPolarHBondContact O-CB 3.29Å; W129-M132 PolarHBondContact O-N 3.48Å; M132-R134 PolarHBondContact O-N 3.47Å; M132-H209 VanDerWaalsContact SD-CE1 3.57Å; M132-F211 HydrophobicContact CE-CB 4.02Å; M132-F211 HydrophobicContact CE-CD2 4.32Å; M132-F211 HydrophobicContact CE-CG 4.12Å; M132-F211 HydrophobicContact SD-CB 3.3Å; M132-F211 WeakPolarHBondContact SD-CB 3Å; M132-F211 HydrophobicContact SD-CD1 3.52Å; M132-F211 VanDerWaalsContact SD-CD1 3.52Å; M132-F211 HydrophobicContact SD-CD2 4.12Å; M132-F211 HydrophobicContact SD-CE1 4.36Å; M132-F211 HydrophobicContact SD-CG 3.38Å; M132-F211 WeakPolarHBondContact SD-CG 3.47Å
133	P	88.9	Confident	92.5	Very high	13 Å²	13	63 Å²	63	8%	0.084	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-65	138.2	-179.9	25.9	-34.2	0	0	0	110.7	L138 H209 F212	P133-L138 HydrophobicContact CG-CD1 4.07Å; P133-H209 HydrophobicContact CG-CB 4.16Å; P133-F212 HydrophobicContact CG-CB 4.31Å
134	R	86.6	Confident	92.5	Very high	140 Å²	140	59.3 Å²	59.3	53%	0.528	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-62.2	150.8	169	-61.1	-174.6	-175.5	169	4.2	110.3	D21 M132 T136 S137 L138	D21-R134 WeakPolarHBondContact OD2-CD 3.26Å; D21-R134 IonicContact OD2-NH1 2.66Å; M132-R134 PolarHBondContact O-N 3.47Å; R134-T136 VanDerWaalsContact C-N 3.31Å; R134-T136 PolarHBondContact O-N 3.4Å; R134-S137 PolarHBondContact O-N 2.81Å; R134-S137 VanDerWaalsContact O-N 3.13Å; R134-L138 WeakPolarHBondContact O-CB 3.45Å; R134-L138 PolarHBondContact O-N 2.96Å
135	W	84.6	Confident	92.5	Very high	125 Å²	125	54.4 Å²	54.4	47%	0.473	28%	0.279	S	S	.	.	H	α-helix	trans	-57.8	-39.6	-176.9	-66.1	106	0	0	0	113.5	N27 L33 L138 L139 F211	N27-W135 PolarHBondContact ND2-NE1 2.89Å; L33-W135 HydrophobicContact CD2-CZ2 4.23Å; W135-L138 HydrophobicContact CE3-CD2 3.63Å; W135-L138 HydrophobicContact CZ3-CD2 3.72Å; W135-L138 WeakPolarHBondContact O-CB 3.3Å; W135-L138 PolarHBondContact O-N 3.47Å; W135-L139 VanDerWaalsContact O-CG 3.29Å; W135-L139 WeakPolarHBondContact O-CG 3.49Å; W135-L139 PolarHBondContact O-N 2.87Å; W135-F211 HydrophobicContact CH2-CE1 4.13Å; W135-F211 AromaticContact CH2-CZ 3.88Å; W135-F211 HydrophobicContact CH2-CZ 3.88Å; W135-F211 HydrophobicContact CZ3-CE1 4.17Å; W135-F211 HydrophobicContact CZ3-CZ 4.25Å
136	T	85.2	Confident	92.5	Very high	44 Å²	44	53.9 Å²	53.9	27%	0.27	28%	0.277	S	S	.	.	H	α-helix	trans	-62.9	-47.5	175.7	47.4	0	0	0	0	111.8	D21 R134 L138 L139 A140	D21-T136 WeakPolarHBondContact OD1-CG2 3.37Å; D21-T136 PolarHBondContact OD1-OG1 2.87Å; D21-T136 PolarHBondContact OD2-OG1 3.38Å; R134-T136 VanDerWaalsContact C-N 3.31Å; R134-T136 PolarHBondContact O-N 3.4Å; T136-L138 VanDerWaalsContact C-N 3.31Å; T136-L138 PolarHBondContact O-N 3.15Å; T136-L139 PolarHBondContact O-N 3.3Å; T136-A140 WeakPolarHBondContact O-CB 3.11Å; T136-A140 PolarHBondContact O-N 3.45Å
137	S	86.8	Confident	92.5	Very high	41 Å²	41	54.1 Å²	54.1	29%	0.287	28%	0.278	S	S	.	.	H	α-helix	trans	-63	-38	173.9	179	0	0	0	0	112	R134 R141	R134-S137 PolarHBondContact O-N 2.81Å; R134-S137 VanDerWaalsContact O-N 3.13Å; S137-R141 VanDerWaalsContact O-CB 3.3Å; S137-R141 WeakPolarHBondContact O-CB 3.27Å; S137-R141 WeakPolarHBondContact O-CD 3.49Å; S137-R141 WeakPolarHBondContact O-CG 3.48Å; S137-R141 PolarHBondContact O-N 3.33Å; S137-R141 PolarHBondContact OG-NE 2.75Å; S137-R141 VanDerWaalsContact OG-NE 3.12Å
138	L	91.2	Very high	92.5	Very high	8 Å²	8	55.5 Å²	55.5	4%	0.042	29%	0.287	C	S	.	.	H	α-helix	trans	-60.7	-51.6	177.4	-175.5	75.1	0	0	0	110	P133 R134 W135 T136 R141 C142 F211 F212 A215	P133-L138 HydrophobicContact CG-CD1 4.07Å; R134-L138 WeakPolarHBondContact O-CB 3.45Å; R134-L138 PolarHBondContact O-N 2.96Å; W135-L138 HydrophobicContact CE3-CD2 3.63Å; W135-L138 HydrophobicContact CZ3-CD2 3.72Å; W135-L138 WeakPolarHBondContact O-CB 3.3Å; W135-L138 PolarHBondContact O-N 3.47Å; T136-L138 VanDerWaalsContact C-N 3.31Å; T136-L138 PolarHBondContact O-N 3.15Å; L138-R141 PolarHBondContact O-N 3.44Å; L138-C142 WeakPolarHBondContact O-CB 3.44Å; L138-C142 PolarHBondContact O-N 2.96Å; L138-C142 PolarHBondContact O-SG 3.3Å; L138-C142 VanDerWaalsContact O-SG 3.36Å; L138-F211 HydrophobicContact CD1-CD1 4.39Å; L138-F211 HydrophobicContact CD2-CE1 3.93Å; L138-F212 HydrophobicContact CD1-CB 3.94Å; L138-F212 HydrophobicContact CD1-CD2 3.56Å; L138-F212 HydrophobicContact CD1-CE2 4.5Å; L138-F212 HydrophobicContact CD1-CG 4.21Å; L138-A215 HydrophobicContact CD1-CB 3.65Å; L138-A215 HydrophobicContact CD2-CB 3.88Å; L138-A215 HydrophobicContact CG-CB 4.07Å
139	L	91.6	Very high	92.6	Very high	123 Å²	123	52.9 Å²	52.9	64%	0.644	27%	0.273	S	S	*	.	H	α-helix	trans	-61.6	-45.7	179.1	-69.7	173.5	0	0	0	112.1	W135 T136 R141 C142 F143	W135-L139 VanDerWaalsContact O-CG 3.29Å; W135-L139 WeakPolarHBondContact O-CG 3.49Å; W135-L139 PolarHBondContact O-N 2.87Å; T136-L139 PolarHBondContact O-N 3.3Å; L139-R141 VanDerWaalsContact C-N 3.34Å; L139-R141 PolarHBondContact O-N 3.18Å; L139-C142 PolarHBondContact O-N 3.17Å; L139-F143 WeakPolarHBondContact O-CB 3.46Å; L139-F143 PolarHBondContact O-N 2.82Å
140	A	91.3	Very high	92.8	Very high	63 Å²	63	51 Å²	51	52%	0.521	27%	0.266	S	S	.	.	H	α-helix	trans	-62.4	-40.9	178.7	0	0	0	0	0	112.3	T136 F143 G144	T136-A140 WeakPolarHBondContact O-CB 3.11Å; T136-A140 PolarHBondContact O-N 3.45Å; A140-F143 PolarHBondContact O-N 3.23Å; A140-G144 PolarHBondContact O-N 2.85Å
141	R	94.7	Very high	93.2	Very high	75 Å²	75	46.5 Å²	46.5	28%	0.283	24%	0.243	S	C	.	.	H	α-helix	trans	-70.3	-39.9	176.6	-72.4	171	-178.1	-103.1	-0.1	112	S137 L138 L139 F143 G144 C145 F206 N208 F212	S137-R141 VanDerWaalsContact O-CB 3.3Å; S137-R141 WeakPolarHBondContact O-CB 3.27Å; S137-R141 WeakPolarHBondContact O-CD 3.49Å; S137-R141 WeakPolarHBondContact O-CG 3.48Å; S137-R141 PolarHBondContact O-N 3.33Å; S137-R141 PolarHBondContact OG-NE 2.75Å; S137-R141 VanDerWaalsContact OG-NE 3.12Å; L138-R141 PolarHBondContact O-N 3.44Å; L139-R141 VanDerWaalsContact C-N 3.34Å; L139-R141 PolarHBondContact O-N 3.18Å; R141-F143 VanDerWaalsContact C-N 3.31Å; R141-F143 PolarHBondContact O-N 3.28Å; R141-G144 PolarHBondContact O-N 3.38Å; R141-C145 PolarHBondContact O-N 3.07Å; R141-F206 HydrophobicContact CB-CB 4.22Å; R141-F206 HydrophobicContact CG-CB 4.47Å; R141-F206 HydrophobicContact CG-CD1 4.43Å; R141-F206 PolarHBondContact NH1-O 2.61Å; R141-N208 VanDerWaalsContact CZ-CG 3.49Å; R141-F212 HydrophobicContact CB-CD2 3.96Å; R141-F212 HydrophobicContact CB-CE2 3.22Å; R141-F212 HydrophobicContact CB-CZ 3.77Å; R141-F212 HydrophobicContact CG-CE2 4.4Å
142	C	96.3	Very high	93.4	Very high	10 Å²	10	48 Å²	48	7%	0.068	24%	0.24	C	C	.	.	H	α-helix	trans	-62.3	-40.9	173.9	-75.3	0	0	0	0	111	L138 L139 C145 A146 W216	L138-C142 WeakPolarHBondContact O-CB 3.44Å; L138-C142 PolarHBondContact O-N 2.96Å; L138-C142 PolarHBondContact O-SG 3.3Å; L138-C142 VanDerWaalsContact O-SG 3.36Å; L139-C142 PolarHBondContact O-N 3.17Å; C142-C145 WeakPolarHBondContact O-CB 3.48Å; C142-C145 PolarHBondContact O-N 2.95Å; C142-A146 WeakPolarHBondContact O-CB 3.37Å; C142-A146 PolarHBondContact O-N 2.74Å; C142-W216 HydrophobicContact CB-CE3 4.14Å; C142-W216 VanDerWaalsContact O-CZ3 3.27Å; C142-W216 WeakPolarHBondContact O-CZ3 3.45Å
143	F	95.6	Very high	93.8	Very high	110 Å²	110	47.5 Å²	47.5	48%	0.482	24%	0.238	S	C	.	.	H	α-helix	trans	-61	-44.6	172.2	179.2	-102.4	0	0	0	111.5	L139 A140 R141 C145 A146 V147 F265 W267	L139-F143 WeakPolarHBondContact O-CB 3.46Å; L139-F143 PolarHBondContact O-N 2.82Å; A140-F143 PolarHBondContact O-N 3.23Å; R141-F143 VanDerWaalsContact C-N 3.31Å; R141-F143 PolarHBondContact O-N 3.28Å; F143-C145 PolarHBondContact O-N 3.4Å; F143-A146 WeakPolarHBondContact O-CB 3.4Å; F143-A146 PolarHBondContact O-N 3.26Å; F143-A146 VanDerWaalsContact O-N 3.13Å; F143-V147 HydrophobicContact CD1-CG2 4.37Å; F143-V147 HydrophobicContact CE1-CG2 3.93Å; F143-V147 HydrophobicContact CE2-CG2 4.3Å; F143-V147 HydrophobicContact CZ-CG2 3.89Å; F143-V147 WeakPolarHBondContact O-CG2 3.37Å; F143-V147 PolarHBondContact O-N 3.05Å; F143-F265 HydrophobicContact CD2-CZ 4.17Å; F143-F265 HydrophobicContact CE2-CE1 4.18Å; F143-F265 AromaticContact CE2-CZ 3.77Å; F143-F265 HydrophobicContact CE2-CZ 3.77Å; F143-W267 HydrophobicContact CE2-CH2 4.45Å; F143-W267 HydrophobicContact CZ-CH2 4.07Å
144	G	96.6	Very high	94.2	Very high	12 Å²	12	46.9 Å²	46.9	12%	0.124	23%	0.234	C	C	.	.	H	α-helix	trans	-56.1	-46.1	173.3	0	0	0	0	0	113.1	A140 R141 V147 V148 F206	A140-G144 PolarHBondContact O-N 2.85Å; R141-G144 PolarHBondContact O-N 3.38Å; G144-V147 PolarHBondContact O-N 3.06Å; G144-V148 WeakPolarHBondContact O-CG2 3.46Å; G144-V148 PolarHBondContact O-N 2.88Å; G144-F206 WeakPolarHBondContact O-CE2 3.29Å
145	C	97.9	Very high	94.8	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60	-44.4	173	-75.2	0	0	0	0	112.2	R141 C142 F143 V147 V148 E149 G202 W216	R141-C145 PolarHBondContact O-N 3.07Å; C142-C145 WeakPolarHBondContact O-CB 3.48Å; C142-C145 PolarHBondContact O-N 2.95Å; F143-C145 PolarHBondContact O-N 3.4Å; C145-V147 VanDerWaalsContact C-N 3.31Å; C145-V147 PolarHBondContact O-N 3.43Å; C145-V148 PolarHBondContact O-N 3.13Å; C145-E149 VanDerWaalsContact O-CB 3.29Å; C145-E149 WeakPolarHBondContact O-CB 3.32Å; C145-E149 PolarHBondContact O-N 3.35Å; C145-G202 VanDerWaalsContact SG-C 3.51Å; C145-G202 PolarHBondContact SG-O 3.41Å; C145-W216 HydrophobicContact CB-CD2 3.52Å; C145-W216 VanDerWaalsContact CB-CE2 3.46Å; C145-W216 HydrophobicContact CB-CE3 3.6Å; C145-W216 HydrophobicContact CB-CG 4.28Å; C145-W216 HydrophobicContact CB-CH2 3.71Å; C145-W216 HydrophobicContact CB-CZ2 3.59Å; C145-W216 HydrophobicContact CB-CZ3 3.68Å
146	A	97.4	Very high	95.4	Very high	1 Å²	1	40 Å²	40	1%	0.008	21%	0.213	C	C	.	.	H	α-helix	trans	-60.4	-39.9	179	0	0	0	0	0	112.1	C142 F143 D150 W216 F219 F265	C142-A146 WeakPolarHBondContact O-CB 3.37Å; C142-A146 PolarHBondContact O-N 2.74Å; F143-A146 WeakPolarHBondContact O-CB 3.4Å; F143-A146 PolarHBondContact O-N 3.26Å; F143-A146 VanDerWaalsContact O-N 3.13Å; A146-D150 WeakPolarHBondContact O-CB 3.34Å; A146-D150 PolarHBondContact O-N 2.99Å; A146-W216 HydrophobicContact CB-CH2 3.97Å; A146-W216 HydrophobicContact CB-CZ3 3.98Å; A146-F219 HydrophobicContact CB-CE1 4.02Å; A146-F265 HydrophobicContact CB-CE2 3.91Å; A146-F265 HydrophobicContact CB-CZ 4.2Å
147	V	97.2	Very high	96	Very high	41 Å²	41	38 Å²	38	25%	0.248	20%	0.2	C	C	.	.	H	α-helix	trans	-64.9	-43.5	176.3	173.2	0	0	0	0	112	F143 G144 C145 T151 F265 W267	F143-V147 HydrophobicContact CD1-CG2 4.37Å; F143-V147 HydrophobicContact CE1-CG2 3.93Å; F143-V147 HydrophobicContact CE2-CG2 4.3Å; F143-V147 HydrophobicContact CZ-CG2 3.89Å; F143-V147 WeakPolarHBondContact O-CG2 3.37Å; F143-V147 PolarHBondContact O-N 3.05Å; G144-V147 PolarHBondContact O-N 3.06Å; C145-V147 VanDerWaalsContact C-N 3.31Å; C145-V147 PolarHBondContact O-N 3.43Å; V147-T151 WeakPolarHBondContact O-CB 3.2Å; V147-T151 PolarHBondContact O-N 3.08Å; V147-T151 VanDerWaalsContact O-N 3.12Å; V147-T151 PolarHBondContact O-OG1 2.99Å; V147-F265 HydrophobicContact CG2-CE2 4.21Å; V147-W267 HydrophobicContact CB-CZ3 4.41Å; V147-W267 HydrophobicContact CG1-CZ3 4.1Å; V147-W267 HydrophobicContact CG2-CH2 3.75Å; V147-W267 HydrophobicContact CG2-CZ3 3.75Å
148	V	97.9	Very high	96.5	Very high	37 Å²	37	41 Å²	41	22%	0.224	21%	0.205	C	C	.	.	H	α-helix	trans	-66.6	-47.4	178.9	170.3	0	0	0	0	110.9	G144 C145 T151 W152 I201 I205 F206	G144-V148 WeakPolarHBondContact O-CG2 3.46Å; G144-V148 PolarHBondContact O-N 2.88Å; C145-V148 PolarHBondContact O-N 3.13Å; V148-T151 PolarHBondContact O-N 2.84Å; V148-W152 PolarHBondContact O-N 3.47Å; V148-I201 HydrophobicContact CG1-CB 4.21Å; V148-I201 HydrophobicContact CG1-CG2 3.65Å; V148-I205 HydrophobicContact CG1-CD1 4.41Å; V148-I205 HydrophobicContact CG2-CD1 4.27Å; V148-F206 HydrophobicContact CG2-CE2 4.03Å
149	E	97.8	Very high	96.8	Very high	8 Å²	8	45 Å²	45	4%	0.037	23%	0.226	C	C	.	.	H	α-helix	trans	-65.3	-46.6	-179.8	-170.2	-84.2	142.3	0	0	111.1	C145 T151 W152 H153 W216 R220	C145-E149 VanDerWaalsContact O-CB 3.29Å; C145-E149 WeakPolarHBondContact O-CB 3.32Å; C145-E149 PolarHBondContact O-N 3.35Å; E149-T151 VanDerWaalsContact C-N 3.3Å; E149-T151 PolarHBondContact O-N 2.87Å; E149-W152 WeakPolarHBondContact O-CB 3.49Å; E149-W152 PolarHBondContact O-N 3.13Å; E149-W152 VanDerWaalsContact O-N 3.15Å; E149-H153 WeakPolarHBondContact O-CB 3.34Å; E149-H153 PolarHBondContact O-N 3Å; E149-H153 IonicContact OE1-CG 2.77Å; E149-H153 IonicContact OE1-ND1 3.51Å; E149-H153 PolarHBondContact OE1-ND1 3.36Å; E149-W216 HydrophobicContact CB-CZ2 4.14Å; E149-W216 HydrophobicContact CG-CZ2 4.44Å; E149-R220 IonicContact OE2-CZ 2.64Å; E149-R220 IonicContact OE2-NE 3.02Å; E149-R220 IonicContact OE2-NH1 3.87Å; E149-R220 PolarHBondContact OE2-NH1 3.2Å
150	D	97.5	Very high	97.1	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-60.4	-39.7	177.7	-177.9	79.3	0	0	0	112.1	A146 H153 Y154 S263 T264 F265	A146-D150 WeakPolarHBondContact O-CB 3.34Å; A146-D150 PolarHBondContact O-N 2.99Å; D150-H153 PolarHBondContact O-N 2.87Å; D150-Y154 VanDerWaalsContact O-CB 3.27Å; D150-Y154 WeakPolarHBondContact O-CB 3.34Å; D150-Y154 PolarHBondContact O-N 3.29Å; D150-S263 PolarHBondContact OD1-N 2.82Å; D150-T264 PolarHBondContact OD1-N 3.49Å; D150-F265 HydrophobicContact CB-CD2 3.88Å; D150-F265 PolarHBondContact OD1-N 2.87Å
151	T	97.8	Very high	97.4	Very high	39 Å²	39	37.3 Å²	37.3	24%	0.239	18%	0.176	C	C	.	.	H	α-helix	trans	-63.3	-48.9	174.7	-58.9	0	0	0	0	111.3	V147 V148 E149 H153 F155 W268	V147-T151 WeakPolarHBondContact O-CB 3.2Å; V147-T151 PolarHBondContact O-N 3.08Å; V147-T151 VanDerWaalsContact O-N 3.12Å; V147-T151 PolarHBondContact O-OG1 2.99Å; V148-T151 PolarHBondContact O-N 2.84Å; E149-T151 VanDerWaalsContact C-N 3.3Å; E149-T151 PolarHBondContact O-N 2.87Å; T151-H153 VanDerWaalsContact C-N 3.35Å; T151-H153 PolarHBondContact O-N 3.22Å; T151-F155 HydrophobicContact CG2-CD2 4.2Å; T151-F155 HydrophobicContact CG2-CE2 4.02Å; T151-F155 WeakPolarHBondContact O-CD2 3.46Å; T151-F155 PolarHBondContact O-N 3.41Å; T151-W268 HydrophobicContact CG2-CH2 4.44Å; T151-W268 HydrophobicContact CG2-CZ2 3.54Å; T151-W268 PolarHBondContact OG1-NE1 2.83Å; T151-W268 VanDerWaalsContact OG1-NE1 3.12Å
152	W	98.3	Very high	97.5	Very high	84 Å²	84	38.5 Å²	38.5	32%	0.318	18%	0.184	S	C	.	.	H	α-helix	trans	-58.5	-49.1	176.5	176.9	-91.5	0	0	0	111.3	V148 E149 L156 I194 A197 G198 I201	V148-W152 PolarHBondContact O-N 3.47Å; E149-W152 WeakPolarHBondContact O-CB 3.49Å; E149-W152 PolarHBondContact O-N 3.13Å; E149-W152 VanDerWaalsContact O-N 3.15Å; W152-L156 HydrophobicContact CD2-CG 4.37Å; W152-L156 HydrophobicContact CH2-CD1 4.37Å; W152-L156 HydrophobicContact CZ2-CD1 3.7Å; W152-L156 HydrophobicContact CZ2-CG 4.21Å; W152-L156 WeakPolarHBondContact O-CB 3.27Å; W152-L156 PolarHBondContact O-N 3.32Å; W152-L156 VanDerWaalsContact O-N 3.17Å; W152-I194 PolarHBondContact NE1-O 2.83Å; W152-A197 HydrophobicContact CZ2-CB 3.67Å; W152-G198 VanDerWaalsContact CD1-N 3.28Å; W152-I201 HydrophobicContact CD2-CD1 3.85Å; W152-I201 HydrophobicContact CE3-CD1 3.44Å; W152-I201 VanDerWaalsContact CE3-CD1 3.44Å; W152-I201 HydrophobicContact CH2-CD1 4.18Å; W152-I201 HydrophobicContact CZ3-CD1 3.62Å
153	H	97.9	Very high	97.4	Very high	23 Å²	23	48.8 Å²	48.8	11%	0.106	22%	0.222	C	C	.	.	H	α-helix	trans	-58.5	-54.2	-179	-168.9	111.3	0	0	0	110.6	E149 D150 T151 F155 L156 H157	E149-H153 WeakPolarHBondContact O-CB 3.34Å; E149-H153 PolarHBondContact O-N 3Å; E149-H153 IonicContact OE1-CG 2.77Å; E149-H153 IonicContact OE1-ND1 3.51Å; E149-H153 PolarHBondContact OE1-ND1 3.36Å; D150-H153 PolarHBondContact O-N 2.87Å; T151-H153 VanDerWaalsContact C-N 3.35Å; T151-H153 PolarHBondContact O-N 3.22Å; H153-F155 VanDerWaalsContact C-N 3.35Å; H153-F155 PolarHBondContact O-N 3.23Å; H153-L156 PolarHBondContact O-N 3.49Å; H153-H157 AromaticContact CD2-ND1 3.86Å; H153-H157 AromaticContact NE2-CG 3.85Å; H153-H157 AromaticContact NE2-ND1 3.58Å; H153-H157 WeakPolarHBondContact O-CA 3.2Å; H153-H157 WeakPolarHBondContact O-CB 3.13Å; H153-H157 PolarHBondContact O-N 3.05Å
154	Y	98.4	Very high	97.4	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-52.2	-51	-175.7	173.8	-87.1	0	0	0	112.3	D150 R158 Y261 W268 D269 L272 T274	D150-Y154 VanDerWaalsContact O-CB 3.27Å; D150-Y154 WeakPolarHBondContact O-CB 3.34Å; D150-Y154 PolarHBondContact O-N 3.29Å; Y154-R158 VanDerWaalsContact O-CB 3.32Å; Y154-R158 WeakPolarHBondContact O-CB 3.35Å; Y154-R158 PolarHBondContact O-N 2.95Å; Y154-R158 PolarHBondContact OH-NH1 2.98Å; Y154-Y261 HydrophobicContact CE2-CD2 4.36Å; Y154-W268 HydrophobicContact CD1-CB 3.57Å; Y154-W268 AromaticContact CD1-CG 3.99Å; Y154-W268 HydrophobicContact CD1-CG 3.99Å; Y154-W268 HydrophobicContact CD2-CB 3.35Å; Y154-W268 HydrophobicContact CD2-CG 4.27Å; Y154-W268 HydrophobicContact CE1-CB 3.81Å; Y154-W268 HydrophobicContact CE2-CB 3.54Å; Y154-W268 HydrophobicContact CG-CB 3.37Å; Y154-W268 AromaticContact CG-CG 3.87Å; Y154-W268 HydrophobicContact CG-CG 3.87Å; Y154-D269 HydrophobicContact CE2-CB 4.41Å; Y154-L272 HydrophobicContact CD1-CD1 4.44Å; Y154-L272 HydrophobicContact CE1-CD1 3.38Å; Y154-L272 WeakPolarHBondContact OH-CB 3.24Å; Y154-L272 WeakPolarHBondContact OH-CD1 3.46Å; Y154-T274 PolarHBondContact OH-OG1 3.19Å
155	F	98.3	Very high	97.4	Very high	80 Å²	80	55 Å²	55	35%	0.351	24%	0.241	S	C	.	.	H	α-helix	trans	-69.3	-42.1	-176.4	-73.6	-70	0	0	0	111.9	T151 H153 R158 I159 W268 L272	T151-F155 HydrophobicContact CG2-CD2 4.2Å; T151-F155 HydrophobicContact CG2-CE2 4.02Å; T151-F155 WeakPolarHBondContact O-CD2 3.46Å; T151-F155 PolarHBondContact O-N 3.41Å; H153-F155 VanDerWaalsContact C-N 3.35Å; H153-F155 PolarHBondContact O-N 3.23Å; F155-R158 PolarHBondContact O-N 3.15Å; F155-I159 VanDerWaalsContact O-CG1 3.31Å; F155-I159 WeakPolarHBondContact O-CG1 3.42Å; F155-I159 PolarHBondContact O-N 3.39Å; F155-W268 HydrophobicContact CE2-CD2 4.24Å; F155-W268 HydrophobicContact CE2-CE3 4.15Å; F155-W268 HydrophobicContact CE2-CH2 4.22Å; F155-W268 HydrophobicContact CE2-CZ2 4.31Å; F155-W268 HydrophobicContact CE2-CZ3 4.14Å; F155-W268 HydrophobicContact CZ-CD2 4.38Å; F155-W268 AromaticContact CZ-CE3 3.89Å; F155-W268 HydrophobicContact CZ-CE3 3.89Å; F155-W268 HydrophobicContact CZ-CH2 4.39Å; F155-W268 AromaticContact CZ-CZ3 3.9Å; F155-W268 HydrophobicContact CZ-CZ3 3.9Å; F155-L272 HydrophobicContact CE1-CD1 4.02Å; F155-L272 HydrophobicContact CZ-CD1 4.36Å
156	L	98.2	Very high	97.3	Very high	42 Å²	42	57.4 Å²	57.4	22%	0.22	25%	0.251	C	S	.	.	H	α-helix	trans	-74.6	-39	-176.8	-72.8	-119.8	0	0	0	110.8	W152 H153 R158 I159 L160 I194 L195	W152-L156 HydrophobicContact CD2-CG 4.37Å; W152-L156 HydrophobicContact CH2-CD1 4.37Å; W152-L156 HydrophobicContact CZ2-CD1 3.7Å; W152-L156 HydrophobicContact CZ2-CG 4.21Å; W152-L156 WeakPolarHBondContact O-CB 3.27Å; W152-L156 PolarHBondContact O-N 3.32Å; W152-L156 VanDerWaalsContact O-N 3.17Å; H153-L156 PolarHBondContact O-N 3.49Å; L156-R158 VanDerWaalsContact C-N 3.34Å; L156-R158 PolarHBondContact O-N 3.5Å; L156-I159 HydrophobicContact CD2-CD1 4.13Å; L156-I159 CarbonylContact O-C 3.45Å; L156-I159 WeakPolarHBondContact O-CB 3.42Å; L156-I159 PolarHBondContact O-N 3.34Å; L156-I159 VanDerWaalsContact O-N 3.1Å; L156-L160 WeakPolarHBondContact O-CB 3.24Å; L156-L160 VanDerWaalsContact O-CG 3.27Å; L156-L160 WeakPolarHBondContact O-CG 3.48Å; L156-L160 PolarHBondContact O-N 3.31Å; L156-I194 HydrophobicContact CB-CG2 4.34Å; L156-I194 HydrophobicContact CD1-CG2 3.38Å; L156-I194 HydrophobicContact CG-CG2 4.47Å; L156-L195 HydrophobicContact CB-CD2 3.78Å
157	H	97.9	Very high	97.2	Very high	1 Å²	1	63 Å²	63	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-57.4	-47.3	171.9	-175.6	-163.4	0	0	0	110.7	H153 I159 L160 H161 H170 L195 H253 Y261	H153-H157 AromaticContact CD2-ND1 3.86Å; H153-H157 AromaticContact NE2-CG 3.85Å; H153-H157 AromaticContact NE2-ND1 3.58Å; H153-H157 WeakPolarHBondContact O-CA 3.2Å; H153-H157 WeakPolarHBondContact O-CB 3.13Å; H153-H157 PolarHBondContact O-N 3.05Å; H157-I159 VanDerWaalsContact C-N 3.31Å; H157-I159 PolarHBondContact O-N 2.98Å; H157-L160 WeakPolarHBondContact O-CB 3.36Å; H157-L160 PolarHBondContact O-N 3.42Å; H157-L160 VanDerWaalsContact O-N 3.15Å; H157-H161 AromaticContact CD2-CD2 3.4Å; H157-H161 PolarHBondContact CD2-CD2 3.3Å; H157-H161 VanDerWaalsContact CD2-CD2 3.4Å; H157-H161 AromaticContact CD2-NE2 3.53Å; H157-H161 AromaticContact NE2-CD2 3.43Å; H157-H161 PolarHBondContact NE2-CD2 3.43Å; H157-H161 AromaticContact NE2-NE2 3.06Å; H157-H161 PolarHBondContact NE2-NE2 3.09Å; H157-H161 PolarHBondContact O-CD2 2.92Å; H157-H161 VanDerWaalsContact O-CD2 3.26Å; H157-H161 PolarHBondContact O-N 3.29Å; H157-H170 AromaticContact CD2-CE1 3.55Å; H157-H170 AromaticContact CD2-NE2 3.28Å; H157-H170 PolarHBondContact CD2-NE2 2.92Å; H157-H170 VanDerWaalsContact CD2-NE2 3.28Å; H157-H170 AromaticContact NE2-CE1 3.52Å; H157-H170 AromaticContact NE2-NE2 3.05Å; H157-H170 PolarHBondContact NE2-NE2 3.47Å; H157-L195 HydrophobicContact CB-CD2 4.41Å; H157-H253 AromaticContact CE1-CD2 3.85Å; H157-H253 AromaticContact CE1-CE1 3.62Å; H157-H253 AromaticContact CE1-NE2 3.27Å; H157-H253 PolarHBondContact CE1-NE2 3.44Å; H157-H253 VanDerWaalsContact CE1-NE2 3.27Å; H157-H253 AromaticContact NE2-CE1 3.57Å; H157-H253 AromaticContact NE2-NE2 3.07Å; H157-H253 PolarHBondContact NE2-NE2 3.01Å; H157-Y261 PolarHBondContact ND1-O 2.99Å
158	R	97.4	Very high	97.2	Very high	104 Å²	104	67.9 Å²	67.9	39%	0.392	29%	0.29	S	S	.	.	H	α-helix	trans	-60.1	-38.2	173.9	-175.3	174.5	178.7	174.7	-0.4	113.1	Y154 F155 L156 H161 Y261	Y154-R158 VanDerWaalsContact O-CB 3.32Å; Y154-R158 WeakPolarHBondContact O-CB 3.35Å; Y154-R158 PolarHBondContact O-N 2.95Å; Y154-R158 PolarHBondContact OH-NH1 2.98Å; F155-R158 PolarHBondContact O-N 3.15Å; L156-R158 VanDerWaalsContact C-N 3.34Å; L156-R158 PolarHBondContact O-N 3.5Å; R158-H161 PolarHBondContact O-N 3.37Å; R158-Y261 HydrophobicContact CB-CD1 4.31Å; R158-Y261 HydrophobicContact CB-CD2 3.99Å; R158-Y261 HydrophobicContact CB-CE2 4.26Å; R158-Y261 HydrophobicContact CB-CG 4.01Å; R158-Y261 HydrophobicContact CG-CD2 3.96Å; R158-Y261 HydrophobicContact CG-CE2 3.8Å; R158-Y261 HydrophobicContact CG-CG 4.44Å
159	I	97.8	Very high	97.1	Very high	91 Å²	91	67.2 Å²	67.2	47%	0.467	29%	0.285	S	S	.	.	H	α-helix	trans	-67.8	-41.1	175	-72.2	164	0	0	0	111.1	F155 L156 H157 H161 H162 I165	F155-I159 VanDerWaalsContact O-CG1 3.31Å; F155-I159 WeakPolarHBondContact O-CG1 3.42Å; F155-I159 PolarHBondContact O-N 3.39Å; L156-I159 HydrophobicContact CD2-CD1 4.13Å; L156-I159 CarbonylContact O-C 3.45Å; L156-I159 WeakPolarHBondContact O-CB 3.42Å; L156-I159 PolarHBondContact O-N 3.34Å; L156-I159 VanDerWaalsContact O-N 3.1Å; H157-I159 VanDerWaalsContact C-N 3.31Å; H157-I159 PolarHBondContact O-N 2.98Å; I159-H161 PolarHBondContact O-N 2.96Å; I159-H162 WeakPolarHBondContact O-CB 3.32Å; I159-H162 PolarHBondContact O-N 3.18Å; I159-I165 HydrophobicContact CG2-CD1 3.71Å
160	L	97.6	Very high	97.1	Very high	5 Å²	5	66.9 Å²	66.9	3%	0.026	28%	0.283	C	S	.	.	H	α-helix	trans	-61.8	-30.6	177.5	-74.2	-178.6	0	0	0	111.8	L156 H157 H162 I165 Y166 I169 H170 E191 I194 L195	L156-L160 WeakPolarHBondContact O-CB 3.24Å; L156-L160 VanDerWaalsContact O-CG 3.27Å; L156-L160 WeakPolarHBondContact O-CG 3.48Å; L156-L160 PolarHBondContact O-N 3.31Å; H157-L160 WeakPolarHBondContact O-CB 3.36Å; H157-L160 PolarHBondContact O-N 3.42Å; H157-L160 VanDerWaalsContact O-N 3.15Å; L160-H162 VanDerWaalsContact C-N 3.26Å; L160-H162 PolarHBondContact O-N 3.23Å; L160-I165 HydrophobicContact CD2-CG2 3.78Å; L160-Y166 WeakPolarHBondContact O-CA 3.14Å; L160-Y166 WeakPolarHBondContact O-CB 3.36Å; L160-Y166 PolarHBondContact O-N 2.6Å; L160-Y166 VanDerWaalsContact O-N 3.08Å; L160-I169 HydrophobicContact CD2-CB 4.29Å; L160-I169 HydrophobicContact CD2-CD1 4.33Å; L160-I169 HydrophobicContact CD2-CG2 3.84Å; L160-H170 HydrophobicContact CB-CB 4Å; L160-E191 HydrophobicContact CD1-CG 3.94Å; L160-I194 HydrophobicContact CD2-CD1 4.42Å; L160-L195 HydrophobicContact CD1-CD1 4.03Å; L160-L195 HydrophobicContact CD1-CD2 3.89Å; L160-L195 HydrophobicContact CD1-CG 3.9Å
161	H	97.1	Very high	97	Very high	21 Å²	21	72.9 Å²	72.9	10%	0.097	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-7.9	170.4	-84.9	-74.5	0	0	0	115.3	H157 R158 I159 R163 Y166 H170 H174 H253 F257 Y261	H157-H161 AromaticContact CD2-CD2 3.4Å; H157-H161 PolarHBondContact CD2-CD2 3.3Å; H157-H161 VanDerWaalsContact CD2-CD2 3.4Å; H157-H161 AromaticContact CD2-NE2 3.53Å; H157-H161 AromaticContact NE2-CD2 3.43Å; H157-H161 PolarHBondContact NE2-CD2 3.43Å; H157-H161 AromaticContact NE2-NE2 3.06Å; H157-H161 PolarHBondContact NE2-NE2 3.09Å; H157-H161 PolarHBondContact O-CD2 2.92Å; H157-H161 VanDerWaalsContact O-CD2 3.26Å; H157-H161 PolarHBondContact O-N 3.29Å; R158-H161 PolarHBondContact O-N 3.37Å; I159-H161 PolarHBondContact O-N 2.96Å; H161-R163 PolarHBondContact O-N 2.94Å; H161-Y166 AromaticContact ND1-CD2 3.8Å; H161-Y166 AromaticContact ND1-CE2 3.98Å; H161-H170 AromaticContact CD2-CD2 3.5Å; H161-H170 AromaticContact CD2-NE2 3.56Å; H161-H170 AromaticContact CE1-CD2 3.31Å; H161-H170 PolarHBondContact CE1-CD2 2.83Å; H161-H170 AromaticContact CE1-NE2 3.5Å; H161-H170 PolarHBondContact CE1-NE2 2.89Å; H161-H170 AromaticContact CG-CD2 3.93Å; H161-H170 AromaticContact ND1-CD2 3.82Å; H161-H170 AromaticContact NE2-CD2 3.07Å; H161-H170 PolarHBondContact NE2-CD2 2.72Å; H161-H170 AromaticContact NE2-NE2 2.88Å; H161-H170 PolarHBondContact NE2-NE2 3.46Å; H161-H174 AromaticContact CE1-CD2 3.81Å; H161-H174 AromaticContact CE1-CE1 3.67Å; H161-H174 AromaticContact CE1-NE2 3.23Å; H161-H174 PolarHBondContact CE1-NE2 3.32Å; H161-H174 AromaticContact NE2-NE2 3.38Å; H161-H174 PolarHBondContact NE2-NE2 3.5Å; H161-H253 AromaticContact CD2-CE1 3.77Å; H161-H253 AromaticContact CE1-CE1 3.49Å; H161-H253 PolarHBondContact CE1-CE1 3.09Å; H161-H253 VanDerWaalsContact CE1-CE1 3.49Å; H161-H253 AromaticContact CE1-NE2 3.5Å; H161-H253 AromaticContact NE2-CE1 2.99Å; H161-H253 PolarHBondContact NE2-CE1 3.3Å; H161-H253 AromaticContact NE2-NE2 2.95Å; H161-H253 PolarHBondContact NE2-NE2 3.35Å; H161-F257 PolarHBondContact CE1-O 2.78Å; H161-F257 PolarHBondContact ND1-O 2.64Å; H161-Y261 HydrophobicContact CB-CE1 3.9Å; H161-Y261 AromaticContact CD2-CD1 3.75Å; H161-Y261 AromaticContact CD2-CE1 3.43Å; H161-Y261 VanDerWaalsContact CD2-CE1 3.43Å; H161-Y261 WeakPolarHBondContact CD2-CE1 3.37Å; H161-Y261 AromaticContact CG-CE1 3.7Å
162	H	96.6	Very high	96.9	Very high	99 Å²	99	72.7 Å²	72.7	46%	0.458	31%	0.309	S	S	.	.	S	Bend	trans	-62.5	135.3	175.4	-172.9	-98.3	0	0	0	110.2	I159 L160 R164 I165 Y166	I159-H162 WeakPolarHBondContact O-CB 3.32Å; I159-H162 PolarHBondContact O-N 3.18Å; L160-H162 VanDerWaalsContact C-N 3.26Å; L160-H162 PolarHBondContact O-N 3.23Å; H162-R164 PolarHBondContact O-N 3.45Å; H162-I165 PolarHBondContact O-N 3.42Å; H162-Y166 PolarHBondContact O-N 3.47Å
163	R	93.9	Very high	96.8	Very high	226 Å²	226	69.2 Å²	69.2	85%	0.853	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.7	-27.9	-172	-63.8	-178.8	179.6	-175.9	-0.5	115	H161	H161-R163 PolarHBondContact O-N 2.94Å
164	R	95.9	Very high	96.7	Very high	201 Å²	201	68.4 Å²	68.4	76%	0.758	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-24.2	179.3	-63.7	-176.7	-176.9	169.6	-0.2	113.7	H162 Y168	H162-R164 PolarHBondContact O-N 3.45Å; R164-Y168 WeakPolarHBondContact O-CD2 3.41Å
165	I	96.2	Very high	96.5	Very high	51 Å²	51	73.8 Å²	73.8	26%	0.262	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.6	-43.2	-173.2	-58.3	175.1	0	0	0	110.6	I159 L160 H162 K167 Y168 I169	I159-I165 HydrophobicContact CG2-CD1 3.71Å; L160-I165 HydrophobicContact CD2-CG2 3.78Å; H162-I165 PolarHBondContact O-N 3.42Å; I165-K167 VanDerWaalsContact C-N 3.33Å; I165-K167 PolarHBondContact O-N 3.25Å; I165-K167 VanDerWaalsContact O-N 3.13Å; I165-Y168 PolarHBondContact O-N 3.08Å; I165-I169 HydrophobicContact CG2-CB 4.29Å; I165-I169 HydrophobicContact CG2-CD1 3.88Å; I165-I169 HydrophobicContact CG2-CG1 4.26Å; I165-I169 PolarHBondContact O-N 3.25Å
166	Y	96.3	Very high	96.2	Very high	51 Å²	51	70.5 Å²	70.5	20%	0.2	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-44.1	-53.4	-173.6	174.9	-99.5	0	0	0	113.6	L160 H161 H162 Y168 I169 H170 K171 H174 F257	L160-Y166 WeakPolarHBondContact O-CA 3.14Å; L160-Y166 WeakPolarHBondContact O-CB 3.36Å; L160-Y166 PolarHBondContact O-N 2.6Å; L160-Y166 VanDerWaalsContact O-N 3.08Å; H161-Y166 AromaticContact ND1-CD2 3.8Å; H161-Y166 AromaticContact ND1-CE2 3.98Å; H162-Y166 PolarHBondContact O-N 3.47Å; Y166-Y168 PolarHBondContact O-N 3.28Å; Y166-I169 PolarHBondContact O-N 3.36Å; Y166-H170 HydrophobicContact CD2-CB 4.04Å; Y166-H170 PolarHBondContact O-N 2.95Å; Y166-H170 VanDerWaalsContact O-N 3.13Å; Y166-K171 HydrophobicContact CD1-CB 4.28Å; Y166-K171 HydrophobicContact CE1-CB 3.92Å; Y166-K171 HydrophobicContact CE1-CG 4.09Å; Y166-K171 WeakPolarHBondContact O-CB 3.39Å; Y166-K171 PolarHBondContact O-N 3.41Å; Y166-H174 HydrophobicContact CE2-CB 4.24Å; Y166-H174 WeakPolarHBondContact OH-CB 3.33Å; Y166-F257 WeakPolarHBondContact OH-CD1 3.27Å
167	K	95.9	Very high	95.9	Very high	118 Å²	118	70.5 Å²	70.5	51%	0.513	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-19.6	-176.1	57.8	163.4	160.8	162.8	0	115	I165	I165-K167 VanDerWaalsContact C-N 3.33Å; I165-K167 PolarHBondContact O-N 3.25Å; I165-K167 VanDerWaalsContact O-N 3.13Å
168	Y	96.2	Very high	95.8	Very high	144 Å²	144	71.4 Å²	71.4	57%	0.565	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.4	-30.7	-175.1	-61.8	-63.4	0	0	0	113.5	R164 I165 Y166	R164-Y168 WeakPolarHBondContact O-CD2 3.41Å; I165-Y168 PolarHBondContact O-N 3.08Å; Y166-Y168 PolarHBondContact O-N 3.28Å
169	I	96.3	Very high	95.6	Very high	23 Å²	23	66.5 Å²	66.5	12%	0.118	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117	-65.6	-173	-59.4	-177.2	0	0	0	109	L160 I165 Y166 K171 H188 L190 E191 I194	L160-I169 HydrophobicContact CD2-CB 4.29Å; L160-I169 HydrophobicContact CD2-CD1 4.33Å; L160-I169 HydrophobicContact CD2-CG2 3.84Å; I165-I169 HydrophobicContact CG2-CB 4.29Å; I165-I169 HydrophobicContact CG2-CD1 3.88Å; I165-I169 HydrophobicContact CG2-CG1 4.26Å; I165-I169 PolarHBondContact O-N 3.25Å; Y166-I169 PolarHBondContact O-N 3.36Å; I169-K171 PolarHBondContact O-N 3.4Å; I169-H188 HydrophobicContact CG2-CB 4.4Å; I169-H188 WeakPolarHBondContact O-CB 3.45Å; I169-L190 HydrophobicContact CD1-CB 4.25Å; I169-L190 HydrophobicContact CD1-CD1 4.12Å; I169-L190 HydrophobicContact CG1-CD1 4.42Å; I169-L190 HydrophobicContact CG2-CB 4.4Å; I169-E191 HydrophobicContact CG2-CB 3.71Å; I169-I194 HydrophobicContact CD1-CD1 4.39Å
170	H	97	Very high	95.4	Very high	1 Å²	1	63 Å²	63	1%	0.005	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-15.8	-165.4	-160.7	51.9	0	0	0	115.8	H157 L160 H161 Y166 V172 H173 H174 E191	H157-H170 AromaticContact CD2-CE1 3.55Å; H157-H170 AromaticContact CD2-NE2 3.28Å; H157-H170 PolarHBondContact CD2-NE2 2.92Å; H157-H170 VanDerWaalsContact CD2-NE2 3.28Å; H157-H170 AromaticContact NE2-CE1 3.52Å; H157-H170 AromaticContact NE2-NE2 3.05Å; H157-H170 PolarHBondContact NE2-NE2 3.47Å; L160-H170 HydrophobicContact CB-CB 4Å; H161-H170 AromaticContact CD2-CD2 3.5Å; H161-H170 AromaticContact CD2-NE2 3.56Å; H161-H170 AromaticContact CE1-CD2 3.31Å; H161-H170 PolarHBondContact CE1-CD2 2.83Å; H161-H170 AromaticContact CE1-NE2 3.5Å; H161-H170 PolarHBondContact CE1-NE2 2.89Å; H161-H170 AromaticContact CG-CD2 3.93Å; H161-H170 AromaticContact ND1-CD2 3.82Å; H161-H170 AromaticContact NE2-CD2 3.07Å; H161-H170 PolarHBondContact NE2-CD2 2.72Å; H161-H170 AromaticContact NE2-NE2 2.88Å; H161-H170 PolarHBondContact NE2-NE2 3.46Å; Y166-H170 HydrophobicContact CD2-CB 4.04Å; Y166-H170 PolarHBondContact O-N 2.95Å; Y166-H170 VanDerWaalsContact O-N 3.13Å; H170-V172 PolarHBondContact O-N 3Å; H170-H173 AromaticContact CE1-CD2 3.47Å; H170-H173 PolarHBondContact CE1-CD2 2.91Å; H170-H173 VanDerWaalsContact CE1-CD2 3.47Å; H170-H173 AromaticContact CE1-CG 4Å; H170-H173 PolarHBondContact O-N 3.11Å; H170-H174 AromaticContact CD2-CD2 3.32Å; H170-H174 PolarHBondContact CD2-CD2 3.16Å; H170-H174 AromaticContact CD2-NE2 3.52Å; H170-H174 AromaticContact CE1-CD2 3.81Å; H170-H174 AromaticContact CE1-NE2 3.81Å; H170-H174 AromaticContact NE2-CD2 3.15Å; H170-H174 PolarHBondContact NE2-CD2 3.43Å; H170-H174 AromaticContact NE2-NE2 2.95Å; H170-H174 PolarHBondContact NE2-NE2 3.07Å; H170-H174 PolarHBondContact O-CD2 3.26Å; H170-H174 PolarHBondContact O-N 3.25Å; H170-E191 WeakPolarHBondContact CA-OE2 3.19Å; H170-E191 IonicContact CE1-OE1 2.87Å; H170-E191 PolarHBondContact CE1-OE1 2.97Å; H170-E191 IonicContact CE1-OE2 3.87Å; H170-E191 IonicContact CG-OE2 3.57Å; H170-E191 IonicContact ND1-OE1 3.7Å; H170-E191 PolarHBondContact ND1-OE1 3.13Å; H170-E191 IonicContact ND1-OE2 4Å; H170-E191 PolarHBondContact ND1-OE2 3.01Å
171	K	96.1	Very high	95.2	Very high	126 Å²	126	63.1 Å²	63.1	55%	0.548	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-31.2	175.3	-177.4	-179	176.7	-170	0	112.4	Y166 I169 H174 E175	Y166-K171 HydrophobicContact CD1-CB 4.28Å; Y166-K171 HydrophobicContact CE1-CB 3.92Å; Y166-K171 HydrophobicContact CE1-CG 4.09Å; Y166-K171 WeakPolarHBondContact O-CB 3.39Å; Y166-K171 PolarHBondContact O-N 3.41Å; I169-K171 PolarHBondContact O-N 3.4Å; K171-H174 CarbonylContact O-C 3.54Å; K171-H174 PolarHBondContact O-N 3.41Å; K171-E175 PolarHBondContact O-N 3.31Å
172	V	95.5	Very high	95	Very high	36 Å²	36	63.6 Å²	63.6	22%	0.218	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-47.8	178.6	-179.6	0	0	0	0	110.2	M100 H170 H174 E175 Y186 H188	M100-V172 HydrophobicContact CE-CG1 3.52Å; M100-V172 HydrophobicContact SD-CG1 4.07Å; H170-V172 PolarHBondContact O-N 3Å; V172-H174 PolarHBondContact O-N 3.46Å; V172-E175 VanDerWaalsContact O-CB 3.23Å; V172-E175 WeakPolarHBondContact O-CB 3.47Å; V172-E175 PolarHBondContact O-N 3.33Å; V172-E175 VanDerWaalsContact O-N 3.08Å; V172-Y186 HydrophobicContact CG1-CD1 4.33Å; V172-Y186 HydrophobicContact CG1-CE1 3.76Å; V172-Y186 WeakPolarHBondContact O-CE1 3.44Å; V172-H188 HydrophobicContact CB-CB 4.26Å; V172-H188 HydrophobicContact CG2-CB 4.15Å
173	H	96.1	Very high	94.9	Very high	10 Å²	10	58.9 Å²	58.9	5%	0.046	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-58.3	-37.1	177.2	-178.1	68.1	0	0	0	112.7	H170 E175 Q183 Y186 A187 E191 H228 H254	H170-H173 AromaticContact CE1-CD2 3.47Å; H170-H173 PolarHBondContact CE1-CD2 2.91Å; H170-H173 VanDerWaalsContact CE1-CD2 3.47Å; H170-H173 AromaticContact CE1-CG 4Å; H170-H173 PolarHBondContact O-N 3.11Å; H173-E175 VanDerWaalsContact C-N 3.31Å; H173-E175 PolarHBondContact O-N 3.04Å; H173-Q183 PolarHBondContact O-NE2 2.99Å; H173-Y186 WeakPolarHBondContact CA-O 3.19Å; H173-Y186 PolarHBondContact ND1-O 3.45Å; H173-A187 HydrophobicContact CB-CB 4.46Å; H173-E191 WeakPolarHBondContact CB-OE1 3.38Å; H173-E191 IonicContact CD2-OE1 2.84Å; H173-E191 IonicContact CG-OE1 3.69Å; H173-H228 AromaticContact CE1-NE2 3.18Å; H173-H228 PolarHBondContact CE1-NE2 2.86Å; H173-H228 AromaticContact NE2-NE2 3.35Å; H173-H228 PolarHBondContact NE2-NE2 3.42Å; H173-H254 AromaticContact CD2-CE1 3.51Å; H173-H254 AromaticContact CD2-NE2 3.97Å; H173-H254 AromaticContact CE1-CE1 3.9Å; H173-H254 AromaticContact NE2-CE1 3.23Å; H173-H254 PolarHBondContact NE2-CE1 3Å; H173-H254 AromaticContact NE2-NE2 3.3Å; H173-H254 PolarHBondContact NE2-NE2 2.76Å
174	H	95.6	Very high	94.9	Very high	6 Å²	6	48.6 Å²	48.6	3%	0.028	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-83	7.9	178.7	-83.9	-86.9	0	0	0	115.3	H161 Y166 H170 K171 V172 F176 H253 H254 F257	H161-H174 AromaticContact CE1-CD2 3.81Å; H161-H174 AromaticContact CE1-CE1 3.67Å; H161-H174 AromaticContact CE1-NE2 3.23Å; H161-H174 PolarHBondContact CE1-NE2 3.32Å; H161-H174 AromaticContact NE2-NE2 3.38Å; H161-H174 PolarHBondContact NE2-NE2 3.5Å; Y166-H174 HydrophobicContact CE2-CB 4.24Å; Y166-H174 WeakPolarHBondContact OH-CB 3.33Å; H170-H174 AromaticContact CD2-CD2 3.32Å; H170-H174 PolarHBondContact CD2-CD2 3.16Å; H170-H174 AromaticContact CD2-NE2 3.52Å; H170-H174 AromaticContact CE1-CD2 3.81Å; H170-H174 AromaticContact CE1-NE2 3.81Å; H170-H174 AromaticContact NE2-CD2 3.15Å; H170-H174 PolarHBondContact NE2-CD2 3.43Å; H170-H174 AromaticContact NE2-NE2 2.95Å; H170-H174 PolarHBondContact NE2-NE2 3.07Å; H170-H174 PolarHBondContact O-CD2 3.26Å; H170-H174 PolarHBondContact O-N 3.25Å; K171-H174 CarbonylContact O-C 3.54Å; K171-H174 PolarHBondContact O-N 3.41Å; V172-H174 PolarHBondContact O-N 3.46Å; H174-F176 PolarHBondContact O-N 2.92Å; H174-H253 AromaticContact CE1-CD2 3.41Å; H174-H253 PolarHBondContact CE1-CD2 3.2Å; H174-H253 VanDerWaalsContact CE1-CD2 3.41Å; H174-H253 AromaticContact CE1-NE2 3.13Å; H174-H253 PolarHBondContact CE1-NE2 3.35Å; H174-H253 AromaticContact NE2-CD2 3.74Å; H174-H253 AromaticContact NE2-NE2 3.13Å; H174-H253 PolarHBondContact NE2-NE2 3.42Å; H174-H253 VanDerWaalsContact NE2-NE2 3.13Å; H174-H254 AromaticContact ND1-ND1 3.96Å; H174-F257 HydrophobicContact CB-CD1 4.1Å; H174-F257 HydrophobicContact CB-CE1 3.92Å; H174-F257 AromaticContact CG-CD1 3.91Å; H174-F257 AromaticContact ND1-CD1 3.36Å; H174-F257 WeakPolarHBondContact ND1-CD1 3.38Å; H174-F257 AromaticContact ND1-CE1 3.74Å
175	E	93.7	Very high	94.9	Very high	113 Å²	113	40.5 Å²	40.5	53%	0.528	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-60.7	-31.8	177.6	-174.4	172.9	172	0	0	112	K171 V172 H173 Y186	K171-E175 PolarHBondContact O-N 3.31Å; V172-E175 VanDerWaalsContact O-CB 3.23Å; V172-E175 WeakPolarHBondContact O-CB 3.47Å; V172-E175 PolarHBondContact O-N 3.33Å; V172-E175 VanDerWaalsContact O-N 3.08Å; H173-E175 VanDerWaalsContact C-N 3.31Å; H173-E175 PolarHBondContact O-N 3.04Å; E175-Y186 HydrophobicContact CB-CE1 4.15Å; E175-Y186 PolarHBondContact OE2-OH 3.13Å
176	F	92.4	Very high	94.9	Very high	11 Å²	11	38.5 Å²	38.5	5%	0.048	18%	0.181	C	C	.	.			trans	-104.4	96.2	176	-50.8	-89.5	0	0	0	110.5	K93 C97 H174 A178 F180 Q183 Y186 H254	K93-F176 HydrophobicContact CB-CD1 4.43Å; K93-F176 HydrophobicContact CB-CE1 3.79Å; K93-F176 HydrophobicContact CD-CD1 4.29Å; K93-F176 HydrophobicContact CD-CE1 4.33Å; K93-F176 HydrophobicContact CG-CD1 4.48Å; K93-F176 HydrophobicContact CG-CE1 4.02Å; C97-F176 HydrophobicContact CB-CE2 4.2Å; C97-F176 HydrophobicContact CB-CZ 3.83Å; H174-F176 PolarHBondContact O-N 2.92Å; F176-A178 PolarHBondContact O-N 3.37Å; F176-A178 VanDerWaalsContact O-N 3.11Å; F176-F180 AromaticContact CD1-CE1 3.8Å; F176-F180 HydrophobicContact CD1-CE1 3.8Å; F176-F180 HydrophobicContact CE1-CE1 4.02Å; F176-F180 HydrophobicContact CE1-CZ 4.31Å; F176-F180 HydrophobicContact CG-CE1 4.17Å; F176-Q183 VanDerWaalsContact CB-CD 3.44Å; F176-Q183 HydrophobicContact CB-CG 4.47Å; F176-Q183 VanDerWaalsContact CD2-CD 3.48Å; F176-Q183 HydrophobicContact CD2-CG 3.63Å; F176-Q183 HydrophobicContact CE2-CG 4.22Å; F176-Q183 HydrophobicContact CG-CG 4.32Å; F176-Q183 PolarHBondContact O-NE2 3.48Å; F176-Y186 AromaticContact CD2-CD1 3.99Å; F176-Y186 HydrophobicContact CD2-CD1 3.99Å; F176-Y186 HydrophobicContact CD2-CE1 4.09Å; F176-Y186 AromaticContact CE2-CD1 3.55Å; F176-Y186 HydrophobicContact CE2-CD1 3.55Å; F176-Y186 HydrophobicContact CE2-CD2 4.17Å; F176-Y186 AromaticContact CE2-CE1 3.48Å; F176-Y186 HydrophobicContact CE2-CE1 3.48Å; F176-Y186 VanDerWaalsContact CE2-CE1 3.48Å; F176-Y186 HydrophobicContact CE2-CE2 4.1Å; F176-Y186 AromaticContact CE2-CG 3.9Å; F176-Y186 HydrophobicContact CE2-CG 3.9Å; F176-Y186 AromaticContact CE2-CZ 3.78Å; F176-Y186 HydrophobicContact CZ-CE1 4.46Å; F176-H254 PolarHBondContact O-ND1 3.07Å
177	T	93.4	Very high	94.9	Very high	43 Å²	43	36.4 Å²	36.4	26%	0.264	18%	0.175	S	C	.	.	S	Bend	trans	-65.4	-11.1	176.6	64	0	0	0	0	115.2	Q84 K87 F257	Q84-T177 PolarHBondContact NE2-O 2.89Å; K87-T177 PolarHBondContact NZ-OG1 3.32Å; T177-F257 HydrophobicContact CG2-CE1 4.31Å; T177-F257 HydrophobicContact CG2-CE2 4.43Å; T177-F257 HydrophobicContact CG2-CZ 3.59Å
178	A	94.2	Very high	94.9	Very high	20 Å²	20	33.4 Å²	33.4	17%	0.165	16%	0.162	C	C	.	.	S	Bend	trans	-124	98.4	171.4	0	0	0	0	0	106.9	Q84 K87 F176	Q84-A178 HydrophobicContact CB-CB 4.15Å; Q84-A178 HydrophobicContact CG-CB 4.47Å; K87-A178 HydrophobicContact CB-CB 3.76Å; K87-A178 HydrophobicContact CD-CB 3.74Å; K87-A178 HydrophobicContact CG-CB 4.45Å; F176-A178 PolarHBondContact O-N 3.37Å; F176-A178 VanDerWaalsContact O-N 3.11Å
179	P	93.6	Very high	94.9	Very high	1 Å²	1	28 Å²	28	1%	0.006	15%	0.145	C	C	.	.			trans	-73.1	156.4	-172.5	29.7	-35.8	0	0	0	113.2	H228 G230 D251 H254	P179-H228 CarbonylContact C-O 3.26Å; P179-H228 VanDerWaalsContact C-O 3.26Å; P179-H228 HydrophobicContact CB-CB 4.38Å; P179-G230 VanDerWaalsContact O-CA 3.27Å; P179-G230 WeakPolarHBondContact O-CA 3.34Å; P179-D251 WeakPolarHBondContact CD-OD2 3.42Å; P179-D251 HydrophobicContact CG-CB 4.38Å; P179-H254 HydrophobicContact CG-CB 4.39Å
180	F	94.5	Very high	94.9	Very high	18 Å²	18	31 Å²	31	8%	0.079	16%	0.161	C	C	.	.			trans	-139	151.6	170.4	58.4	-81.2	0	0	0	108.9	E89 Q94 C97 F176 M182 Q183 H228	E89-F180 HydrophobicContact CG-CB 3.96Å; E89-F180 HydrophobicContact CG-CD1 4.3Å; E89-F180 HydrophobicContact CG-CG 4.14Å; Q94-F180 HydrophobicContact CG-CE2 3.97Å; Q94-F180 HydrophobicContact CG-CZ 4.21Å; C97-F180 HydrophobicContact CB-CE2 4.21Å; C97-F180 HydrophobicContact CB-CZ 3.73Å; F176-F180 AromaticContact CD1-CE1 3.8Å; F176-F180 HydrophobicContact CD1-CE1 3.8Å; F176-F180 HydrophobicContact CE1-CE1 4.02Å; F176-F180 HydrophobicContact CE1-CZ 4.31Å; F176-F180 HydrophobicContact CG-CE1 4.17Å; F180-M182 VanDerWaalsContact C-N 3.26Å; F180-M182 HydrophobicContact CD2-CB 3.99Å; F180-M182 HydrophobicContact CE2-CB 3.88Å; F180-M182 PolarHBondContact O-N 2.91Å; F180-Q183 HydrophobicContact CE1-CB 4.43Å; F180-Q183 WeakPolarHBondContact O-CB 3.39Å; F180-Q183 PolarHBondContact O-N 2.74Å; F180-H228 CarbonylContact C-O 3Å; F180-H228 WeakPolarHBondContact CA-O 3.28Å; F180-H228 PolarHBondContact N-O 3.09Å; F180-H228 VanDerWaalsContact N-O 3.09Å
181	G	92	Very high	94.9	Very high	6 Å²	6	31.3 Å²	31.3	6%	0.062	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-50.2	-37.5	-164.5	0	0	0	0	0	116.2	Q183 A184 H228	G181-Q183 PolarHBondContact O-N 3.34Å; G181-A184 VanDerWaalsContact O-CB 3.27Å; G181-A184 WeakPolarHBondContact O-CB 3.46Å; G181-A184 PolarHBondContact O-N 3.12Å; G181-A184 VanDerWaalsContact O-N 3.11Å; G181-H228 PolarHBondContact N-O 3.15Å
182	M	94.2	Very high	94.9	Very high	32 Å²	32	26.6 Å²	26.6	16%	0.158	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-65.6	-22.5	178.8	-172.6	-174.5	-62	0	0	113.8	Y62 F98 L101 F180 A184	Y62-M182 PolarHBondContact OH-O 3.45Å; F98-M182 HydrophobicContact CB-SD 3.88Å; F98-M182 HydrophobicContact CD2-CE 4.37Å; F98-M182 HydrophobicContact CD2-SD 3.91Å; F98-M182 HydrophobicContact CG-SD 4.39Å; L101-M182 HydrophobicContact CD2-CG 3.75Å; L101-M182 HydrophobicContact CD2-SD 4.44Å; F180-M182 VanDerWaalsContact C-N 3.26Å; F180-M182 HydrophobicContact CD2-CB 3.99Å; F180-M182 HydrophobicContact CE2-CB 3.88Å; F180-M182 PolarHBondContact O-N 2.91Å; M182-A184 PolarHBondContact O-N 3.36Å
183	Q	94.1	Very high	94.9	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-71.8	-13.4	175.6	-172.7	-165.3	-27.1	0	0	112.7	H173 F176 F180 G181 E185 Y186 H254	H173-Q183 PolarHBondContact O-NE2 2.99Å; F176-Q183 VanDerWaalsContact CB-CD 3.44Å; F176-Q183 HydrophobicContact CB-CG 4.47Å; F176-Q183 VanDerWaalsContact CD2-CD 3.48Å; F176-Q183 HydrophobicContact CD2-CG 3.63Å; F176-Q183 HydrophobicContact CE2-CG 4.22Å; F176-Q183 HydrophobicContact CG-CG 4.32Å; F176-Q183 PolarHBondContact O-NE2 3.48Å; F180-Q183 HydrophobicContact CE1-CB 4.43Å; F180-Q183 WeakPolarHBondContact O-CB 3.39Å; F180-Q183 PolarHBondContact O-N 2.74Å; G181-Q183 PolarHBondContact O-N 3.34Å; Q183-E185 PolarHBondContact O-N 3.34Å; Q183-Y186 HydrophobicContact CG-CD1 4.49Å; Q183-Y186 HydrophobicContact CG-CG 4.49Å; Q183-Y186 WeakPolarHBondContact O-CA 3.21Å; Q183-Y186 WeakPolarHBondContact O-CB 3.33Å; Q183-Y186 PolarHBondContact O-N 3.37Å; Q183-H254 PolarHBondContact NE2-CE1 3.45Å
184	A	94	Very high	95	Very high	10 Å²	10	31 Å²	31	8%	0.083	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-54.7	-29.5	-174	0	0	0	0	0	113.6	G181 M182 T224 I225 H228	G181-A184 VanDerWaalsContact O-CB 3.27Å; G181-A184 WeakPolarHBondContact O-CB 3.46Å; G181-A184 PolarHBondContact O-N 3.12Å; G181-A184 VanDerWaalsContact O-N 3.11Å; M182-A184 PolarHBondContact O-N 3.36Å; A184-T224 HydrophobicContact CB-CG2 3.91Å; A184-T224 WeakPolarHBondContact CB-O 3.5Å; A184-I225 HydrophobicContact CB-CG1 4.17Å; A184-H228 HydrophobicContact CB-CB 4Å
185	E	95.9	Very high	95.1	Very high	31 Å²	31	31.5 Å²	31.5	15%	0.145	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-112.1	14.5	173.6	-66.9	-178.3	163.9	0	0	114	H58 Y62 L101 N104 H105 Q109 Q183 A187 L221	H58-E185 IonicContact CE1-OE2 3.91Å; H58-E185 IonicContact NE2-OE1 3.53Å; H58-E185 PolarHBondContact NE2-OE1 3.04Å; H58-E185 IonicContact NE2-OE2 3.41Å; H58-E185 PolarHBondContact NE2-OE2 3.15Å; Y62-E185 HydrophobicContact CD2-CG 4.39Å; Y62-E185 HydrophobicContact CE2-CB 3.99Å; Y62-E185 HydrophobicContact CE2-CG 3.58Å; Y62-E185 WeakPolarHBondContact CE2-OE2 3.1Å; Y62-E185 PolarHBondContact OH-N 3.09Å; L101-E185 HydrophobicContact CD1-CB 3.73Å; N104-E185 PolarHBondContact ND2-O 3.28Å; N104-E185 VanDerWaalsContact ND2-O 3.1Å; H105-E185 IonicContact CD2-OE2 3.19Å; H105-E185 IonicContact CE1-OE2 3.53Å; H105-E185 IonicContact NE2-OE2 2.93Å; H105-E185 PolarHBondContact NE2-OE2 3.42Å; Q109-E185 PolarHBondContact NE2-OE2 3.32Å; Q183-E185 PolarHBondContact O-N 3.34Å; E185-A187 PolarHBondContact O-N 3.42Å; E185-L221 WeakPolarHBondContact OE1-CD2 3.13Å
186	Y	95.4	Very high	95.1	Very high	8 Å²	8	27.3 Å²	27.3	3%	0.031	16%	0.155	C	C	.	.			trans	-78	94.2	165.5	-174.6	-92.1	0	0	0	109.6	C97 M100 V172 H173 E175 F176 Q183	C97-Y186 HydrophobicContact CB-CD2 4.25Å; M100-Y186 HydrophobicContact CB-CD2 3.7Å; M100-Y186 HydrophobicContact CB-CE2 3.43Å; M100-Y186 VanDerWaalsContact CB-CE2 3.43Å; M100-Y186 HydrophobicContact CG-CD2 3.85Å; M100-Y186 HydrophobicContact CG-CE2 3.69Å; M100-Y186 HydrophobicContact SD-CD2 4.06Å; M100-Y186 HydrophobicContact SD-CE1 4.45Å; M100-Y186 HydrophobicContact SD-CE2 3.46Å; M100-Y186 WeakPolarHBondContact SD-CE2 3.19Å; V172-Y186 HydrophobicContact CG1-CD1 4.33Å; V172-Y186 HydrophobicContact CG1-CE1 3.76Å; V172-Y186 WeakPolarHBondContact O-CE1 3.44Å; H173-Y186 WeakPolarHBondContact CA-O 3.19Å; H173-Y186 PolarHBondContact ND1-O 3.45Å; E175-Y186 HydrophobicContact CB-CE1 4.15Å; E175-Y186 PolarHBondContact OE2-OH 3.13Å; F176-Y186 AromaticContact CD2-CD1 3.99Å; F176-Y186 HydrophobicContact CD2-CD1 3.99Å; F176-Y186 HydrophobicContact CD2-CE1 4.09Å; F176-Y186 AromaticContact CE2-CD1 3.55Å; F176-Y186 HydrophobicContact CE2-CD1 3.55Å; F176-Y186 HydrophobicContact CE2-CD2 4.17Å; F176-Y186 AromaticContact CE2-CE1 3.48Å; F176-Y186 HydrophobicContact CE2-CE1 3.48Å; F176-Y186 VanDerWaalsContact CE2-CE1 3.48Å; F176-Y186 HydrophobicContact CE2-CE2 4.1Å; F176-Y186 AromaticContact CE2-CG 3.9Å; F176-Y186 HydrophobicContact CE2-CG 3.9Å; F176-Y186 AromaticContact CE2-CZ 3.78Å; F176-Y186 HydrophobicContact CZ-CE1 4.46Å; Q183-Y186 HydrophobicContact CG-CD1 4.49Å; Q183-Y186 HydrophobicContact CG-CG 4.49Å; Q183-Y186 WeakPolarHBondContact O-CA 3.21Å; Q183-Y186 WeakPolarHBondContact O-CB 3.33Å; Q183-Y186 PolarHBondContact O-N 3.37Å
187	A	96.1	Very high	95.3	Very high	7 Å²	7	28.1 Å²	28.1	6%	0.058	16%	0.164	C	C	.	.	S	Bend	trans	-149.7	162	-178.8	0	0	0	0	0	111.4	M100 N104 H173 E185 E191	M100-A187 WeakPolarHBondContact CE-O 3.44Å; N104-A187 PolarHBondContact ND2-O 3.07Å; H173-A187 HydrophobicContact CB-CB 4.46Å; E185-A187 PolarHBondContact O-N 3.42Å; A187-E191 HydrophobicContact CB-CB 4.21Å; A187-E191 HydrophobicContact CB-CG 4.18Å
188	H	96.9	Very high	95.5	Very high	55 Å²	55	26 Å²	26	26%	0.255	15%	0.151	S	C	.	.			trans	-63.9	140.9	171.1	-176.1	-83	0	0	0	110.1	I169 V172 L190 E191 T192	I169-H188 HydrophobicContact CG2-CB 4.4Å; I169-H188 WeakPolarHBondContact O-CB 3.45Å; V172-H188 HydrophobicContact CB-CB 4.26Å; V172-H188 HydrophobicContact CG2-CB 4.15Å; H188-L190 VanDerWaalsContact C-N 3.27Å; H188-L190 WeakPolarHBondContact ND1-CB 3.37Å; H188-L190 PolarHBondContact ND1-N 3.06Å; H188-L190 VanDerWaalsContact ND1-N 3.15Å; H188-L190 PolarHBondContact O-N 3.19Å; H188-L190 VanDerWaalsContact O-N 3.09Å; H188-E191 HydrophobicContact CB-CB 4.44Å; H188-E191 WeakPolarHBondContact O-CA 3.34Å; H188-E191 WeakPolarHBondContact O-CB 3.27Å; H188-E191 PolarHBondContact O-N 3.15Å; H188-T192 PolarHBondContact O-N 2.92Å
189	P	96.2	Very high	95.6	Very high	31 Å²	31	26.8 Å²	26.8	20%	0.201	15%	0.151	C	C	.	.	H	α-helix	trans	-50.7	-40.7	-177.9	-34.2	38.4	0	0	0	115.5	F103 I108 E191 T192 I193	F103-P189 HydrophobicContact CE1-CG 4.34Å; I108-P189 HydrophobicContact CD1-CB 3.7Å; I108-P189 HydrophobicContact CD1-CG 4.18Å; I108-P189 HydrophobicContact CG1-CB 3.99Å; I108-P189 HydrophobicContact CG1-CG 4.27Å; P189-E191 VanDerWaalsContact C-N 3.31Å; P189-E191 PolarHBondContact O-N 2.83Å; P189-T192 WeakPolarHBondContact O-CB 3.48Å; P189-T192 PolarHBondContact O-N 3.13Å; P189-I193 WeakPolarHBondContact O-CG1 3.49Å; P189-I193 PolarHBondContact O-N 2.84Å; P189-I193 VanDerWaalsContact O-N 3.09Å
190	L	96.8	Very high	95.6	Very high	87 Å²	87	30.3 Å²	30.3	46%	0.455	17%	0.166	S	C	.	.	H	α-helix	trans	-63.5	-35.3	175.4	-68.3	176.3	0	0	0	112.9	I169 H188 I193 I194	I169-L190 HydrophobicContact CD1-CB 4.25Å; I169-L190 HydrophobicContact CD1-CD1 4.12Å; I169-L190 HydrophobicContact CG1-CD1 4.42Å; I169-L190 HydrophobicContact CG2-CB 4.4Å; H188-L190 VanDerWaalsContact C-N 3.27Å; H188-L190 WeakPolarHBondContact ND1-CB 3.37Å; H188-L190 PolarHBondContact ND1-N 3.06Å; H188-L190 VanDerWaalsContact ND1-N 3.15Å; H188-L190 PolarHBondContact O-N 3.19Å; H188-L190 VanDerWaalsContact O-N 3.09Å; L190-I193 PolarHBondContact O-N 2.91Å; L190-I194 HydrophobicContact CB-CD1 4.35Å; L190-I194 VanDerWaalsContact O-CB 3.23Å; L190-I194 WeakPolarHBondContact O-CB 3.21Å; L190-I194 WeakPolarHBondContact O-CD1 3.37Å; L190-I194 WeakPolarHBondContact O-CG1 3.23Å; L190-I194 PolarHBondContact O-N 3.38Å
191	E	96.6	Very high	95.7	Very high	6 Å²	6	32.2 Å²	32.2	3%	0.028	18%	0.177	C	C	.	.	H	α-helix	trans	-64.5	-47.1	175.4	-177.8	172.3	161.1	0	0	110.9	L160 I169 H170 H173 A187 H188 P189 I193 I194 L195	L160-E191 HydrophobicContact CD1-CG 3.94Å; I169-E191 HydrophobicContact CG2-CB 3.71Å; H170-E191 WeakPolarHBondContact CA-OE2 3.19Å; H170-E191 IonicContact CE1-OE1 2.87Å; H170-E191 PolarHBondContact CE1-OE1 2.97Å; H170-E191 IonicContact CE1-OE2 3.87Å; H170-E191 IonicContact CG-OE2 3.57Å; H170-E191 IonicContact ND1-OE1 3.7Å; H170-E191 PolarHBondContact ND1-OE1 3.13Å; H170-E191 IonicContact ND1-OE2 4Å; H170-E191 PolarHBondContact ND1-OE2 3.01Å; H173-E191 WeakPolarHBondContact CB-OE1 3.38Å; H173-E191 IonicContact CD2-OE1 2.84Å; H173-E191 IonicContact CG-OE1 3.69Å; A187-E191 HydrophobicContact CB-CB 4.21Å; A187-E191 HydrophobicContact CB-CG 4.18Å; H188-E191 HydrophobicContact CB-CB 4.44Å; H188-E191 WeakPolarHBondContact O-CA 3.34Å; H188-E191 WeakPolarHBondContact O-CB 3.27Å; H188-E191 PolarHBondContact O-N 3.15Å; P189-E191 VanDerWaalsContact C-N 3.31Å; P189-E191 PolarHBondContact O-N 2.83Å; E191-I193 VanDerWaalsContact C-N 3.25Å; E191-I193 PolarHBondContact O-N 2.79Å; E191-I194 PolarHBondContact O-N 3.23Å; E191-L195 HydrophobicContact CG-CD1 3.66Å; E191-L195 HydrophobicContact CG-CG 4.14Å; E191-L195 WeakPolarHBondContact O-CB 3.48Å; E191-L195 PolarHBondContact O-N 2.95Å
192	T	95.6	Very high	96	Very high	27 Å²	27	31.9 Å²	31.9	17%	0.166	17%	0.174	C	C	.	.	H	α-helix	trans	-55.2	-42.5	176.4	-51.8	0	0	0	0	111.4	I108 H188 P189 G196	I108-T192 HydrophobicContact CG2-CG2 4.01Å; H188-T192 PolarHBondContact O-N 2.92Å; P189-T192 WeakPolarHBondContact O-CB 3.48Å; P189-T192 PolarHBondContact O-N 3.13Å; T192-G196 WeakPolarHBondContact O-CA 3.27Å; T192-G196 PolarHBondContact O-N 3.3Å
193	I	96.6	Very high	96.1	Very high	88 Å²	88	30.6 Å²	30.6	45%	0.451	17%	0.167	S	C	.	.	H	α-helix	trans	-71	-46.5	178	-65.1	166.1	0	0	0	111.4	I108 P189 L190 E191 A197	I108-I193 HydrophobicContact CG2-CG1 4.17Å; P189-I193 WeakPolarHBondContact O-CG1 3.49Å; P189-I193 PolarHBondContact O-N 2.84Å; P189-I193 VanDerWaalsContact O-N 3.09Å; L190-I193 PolarHBondContact O-N 2.91Å; E191-I193 VanDerWaalsContact C-N 3.25Å; E191-I193 PolarHBondContact O-N 2.79Å; I193-A197 PolarHBondContact O-N 3.2Å
194	I	97.4	Very high	96.2	Very high	51 Å²	51	36.2 Å²	36.2	26%	0.262	20%	0.195	S	C	.	.	H	α-helix	trans	-65.8	-50.7	-175.6	-72.5	167.1	0	0	0	110.9	W152 L156 L160 I169 L190 E191 A197	W152-I194 PolarHBondContact NE1-O 2.83Å; L156-I194 HydrophobicContact CB-CG2 4.34Å; L156-I194 HydrophobicContact CD1-CG2 3.38Å; L156-I194 HydrophobicContact CG-CG2 4.47Å; L160-I194 HydrophobicContact CD2-CD1 4.42Å; I169-I194 HydrophobicContact CD1-CD1 4.39Å; L190-I194 HydrophobicContact CB-CD1 4.35Å; L190-I194 VanDerWaalsContact O-CB 3.23Å; L190-I194 WeakPolarHBondContact O-CB 3.21Å; L190-I194 WeakPolarHBondContact O-CD1 3.37Å; L190-I194 WeakPolarHBondContact O-CG1 3.23Å; L190-I194 PolarHBondContact O-N 3.38Å; E191-I194 PolarHBondContact O-N 3.23Å; I194-A197 WeakPolarHBondContact O-CB 3.23Å
195	L	96.6	Very high	96.3	Very high	16 Å²	16	40.6 Å²	40.6	8%	0.084	22%	0.216	C	C	.	.	H	α-helix	trans	-74.5	-39.9	179.2	-61.1	-177.7	0	0	0	110.8	L156 H157 L160 E191 A197 G198	L156-L195 HydrophobicContact CB-CD2 3.78Å; H157-L195 HydrophobicContact CB-CD2 4.41Å; L160-L195 HydrophobicContact CD1-CD1 4.03Å; L160-L195 HydrophobicContact CD1-CD2 3.89Å; L160-L195 HydrophobicContact CD1-CG 3.9Å; E191-L195 HydrophobicContact CG-CD1 3.66Å; E191-L195 HydrophobicContact CG-CG 4.14Å; E191-L195 WeakPolarHBondContact O-CB 3.48Å; E191-L195 PolarHBondContact O-N 2.95Å; L195-A197 PolarHBondContact O-N 3.19Å; L195-A197 VanDerWaalsContact O-N 3.15Å; L195-G198 PolarHBondContact O-N 3.47Å
196	G	95.3	Very high	96.3	Very high	25 Å²	25	41.8 Å²	41.8	26%	0.258	22%	0.221	S	C	.	.	H	α-helix	trans	-61.4	-21.6	176.4	0	0	0	0	0	114.3	T192 G198 F199 F200	T192-G196 WeakPolarHBondContact O-CA 3.27Å; T192-G196 PolarHBondContact O-N 3.3Å; G196-G198 PolarHBondContact O-N 3.46Å; G196-F199 VanDerWaalsContact O-CB 3.28Å; G196-F199 WeakPolarHBondContact O-CB 3.42Å; G196-F199 PolarHBondContact O-N 2.89Å; G196-F199 VanDerWaalsContact O-N 3.07Å; G196-F200 WeakPolarHBondContact O-CD2 3.41Å; G196-F200 PolarHBondContact O-N 2.83Å
197	A	96.7	Very high	96.4	Very high	28 Å²	28	42.2 Å²	42.2	23%	0.231	23%	0.225	C	C	.	.	H	α-helix	trans	-55.5	-32	171.5	0	0	0	0	0	112.9	W152 I193 I194 L195 F199 F200 I201	W152-A197 HydrophobicContact CZ2-CB 3.67Å; I193-A197 PolarHBondContact O-N 3.2Å; I194-A197 WeakPolarHBondContact O-CB 3.23Å; L195-A197 PolarHBondContact O-N 3.19Å; L195-A197 VanDerWaalsContact O-N 3.15Å; A197-F199 VanDerWaalsContact C-N 3.32Å; A197-F199 PolarHBondContact O-N 3.49Å; A197-F200 PolarHBondContact O-N 3.35Å; A197-F200 VanDerWaalsContact O-N 3.13Å; A197-I201 WeakPolarHBondContact O-CG1 3.32Å; A197-I201 PolarHBondContact O-N 3.37Å
198	G	96.6	Very high	96.3	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-60.9	-39.5	175.9	0	0	0	0	0	112.9	W152 L195 G196 F200 I201 G202	W152-G198 VanDerWaalsContact CD1-N 3.28Å; L195-G198 PolarHBondContact O-N 3.47Å; G196-G198 PolarHBondContact O-N 3.46Å; G198-F200 VanDerWaalsContact C-N 3.33Å; G198-F200 PolarHBondContact O-N 3.3Å; G198-I201 PolarHBondContact O-N 3.49Å; G198-G202 PolarHBondContact O-N 2.89Å
199	F	95.9	Very high	96.3	Very high	35 Å²	35	41.2 Å²	41.2	15%	0.154	22%	0.22	C	C	.	.	H	α-helix	trans	-58.6	-45.8	173.1	176.9	-82.1	0	0	0	111.1	G196 A197 G202 I203 W216 V217 R220	G196-F199 VanDerWaalsContact O-CB 3.28Å; G196-F199 WeakPolarHBondContact O-CB 3.42Å; G196-F199 PolarHBondContact O-N 2.89Å; G196-F199 VanDerWaalsContact O-N 3.07Å; A197-F199 VanDerWaalsContact C-N 3.32Å; A197-F199 PolarHBondContact O-N 3.49Å; F199-G202 PolarHBondContact O-N 3.43Å; F199-I203 HydrophobicContact CD1-CG2 4.45Å; F199-I203 HydrophobicContact CE1-CD1 4.11Å; F199-I203 HydrophobicContact CE1-CG2 3.95Å; F199-I203 HydrophobicContact CZ-CG2 4.15Å; F199-I203 PolarHBondContact O-N 2.92Å; F199-I203 VanDerWaalsContact O-N 3.09Å; F199-W216 AromaticContact CD2-CD1 3.63Å; F199-W216 AromaticContact CD2-CE2 3.84Å; F199-W216 HydrophobicContact CD2-CZ2 4.34Å; F199-W216 AromaticContact CD2-NE1 3.07Å; F199-W216 AromaticContact CE2-CD1 3.09Å; F199-W216 HydrophobicContact CE2-CD2 4.49Å; F199-W216 AromaticContact CE2-CE2 3.96Å; F199-W216 AromaticContact CE2-CG 3.99Å; F199-W216 HydrophobicContact CE2-CG 3.99Å; F199-W216 AromaticContact CE2-NE1 3.1Å; F199-W216 AromaticContact CG-NE1 3.74Å; F199-W216 AromaticContact CZ-CD1 3.4Å; F199-W216 VanDerWaalsContact CZ-CD1 3.4Å; F199-W216 HydrophobicContact CZ-CG 4.43Å; F199-W216 AromaticContact CZ-NE1 3.76Å; F199-V217 HydrophobicContact CE2-CG2 3.9Å; F199-V217 HydrophobicContact CZ-CG2 3.49Å; F199-V217 VanDerWaalsContact CZ-CG2 3.49Å; F199-R220 HydrophobicContact CD2-CB 4.4Å; F199-R220 HydrophobicContact CD2-CG 4.16Å; F199-R220 HydrophobicContact CE2-CB 4.47Å
200	F	95.1	Very high	96.4	Very high	75 Å²	75	39.7 Å²	39.7	33%	0.329	21%	0.21	S	C	.	.	H	α-helix	trans	-65.8	-41.3	-179.9	-67.9	-71.6	0	0	0	112.4	L112 G196 A197 G198 G202 I203 M204	L112-F200 HydrophobicContact CB-CZ 4.12Å; L112-F200 HydrophobicContact CD1-CE2 4.35Å; L112-F200 HydrophobicContact CD1-CZ 4.43Å; L112-F200 HydrophobicContact CD2-CE2 4.37Å; L112-F200 HydrophobicContact CD2-CZ 4.26Å; G196-F200 WeakPolarHBondContact O-CD2 3.41Å; G196-F200 PolarHBondContact O-N 2.83Å; A197-F200 PolarHBondContact O-N 3.35Å; A197-F200 VanDerWaalsContact O-N 3.13Å; G198-F200 VanDerWaalsContact C-N 3.33Å; G198-F200 PolarHBondContact O-N 3.3Å; F200-G202 VanDerWaalsContact C-N 3.29Å; F200-G202 PolarHBondContact O-N 3.4Å; F200-I203 HydrophobicContact CD1-CD1 3.97Å; F200-I203 WeakPolarHBondContact O-CG1 3.32Å; F200-I203 PolarHBondContact O-N 3.37Å; F200-M204 WeakPolarHBondContact O-CB 3.33Å; F200-M204 VanDerWaalsContact O-CG 3.27Å; F200-M204 WeakPolarHBondContact O-CG 3.02Å; F200-M204 PolarHBondContact O-N 3.22Å
201	I	96.7	Very high	96.4	Very high	58 Å²	58	37.1 Å²	37.1	30%	0.297	20%	0.195	S	C	.	.	H	α-helix	trans	-60.2	-43.1	175.2	-63.3	164.2	0	0	0	110	V148 W152 A197 G198 M204 I205	V148-I201 HydrophobicContact CG1-CB 4.21Å; V148-I201 HydrophobicContact CG1-CG2 3.65Å; W152-I201 HydrophobicContact CD2-CD1 3.85Å; W152-I201 HydrophobicContact CE3-CD1 3.44Å; W152-I201 VanDerWaalsContact CE3-CD1 3.44Å; W152-I201 HydrophobicContact CH2-CD1 4.18Å; W152-I201 HydrophobicContact CZ3-CD1 3.62Å; A197-I201 WeakPolarHBondContact O-CG1 3.32Å; A197-I201 PolarHBondContact O-N 3.37Å; G198-I201 PolarHBondContact O-N 3.49Å; I201-M204 PolarHBondContact O-N 3.22Å; I201-I205 HydrophobicContact CG2-CD1 4.03Å; I201-I205 WeakPolarHBondContact O-CG1 3.46Å; I201-I205 PolarHBondContact O-N 2.97Å
202	G	96.6	Very high	96.4	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-57.2	-53.2	175.5	0	0	0	0	0	112.6	C145 G198 F199 F200 M204 I205 F206	C145-G202 VanDerWaalsContact SG-C 3.51Å; C145-G202 PolarHBondContact SG-O 3.41Å; G198-G202 PolarHBondContact O-N 2.89Å; F199-G202 PolarHBondContact O-N 3.43Å; F200-G202 VanDerWaalsContact C-N 3.29Å; F200-G202 PolarHBondContact O-N 3.4Å; G202-M204 VanDerWaalsContact C-N 3.31Å; G202-M204 PolarHBondContact O-N 2.87Å; G202-I205 PolarHBondContact O-N 3.19Å; G202-I205 VanDerWaalsContact O-N 3.13Å; G202-F206 WeakPolarHBondContact O-CD2 3.42Å; G202-F206 PolarHBondContact O-N 2.81Å
203	I	96.5	Very high	96.4	Very high	5 Å²	5	35.8 Å²	35.8	3%	0.026	19%	0.188	C	C	.	.	H	α-helix	trans	-67.2	-29.7	-179.3	65.3	169.2	0	0	0	112.9	F119 F199 F200 I205 C207 L213 W216	F119-I203 HydrophobicContact CE1-CD1 4.25Å; F119-I203 HydrophobicContact CE2-CD1 4.22Å; F119-I203 HydrophobicContact CE2-CG1 4.32Å; F119-I203 HydrophobicContact CZ-CB 4.4Å; F119-I203 HydrophobicContact CZ-CD1 4.08Å; F119-I203 HydrophobicContact CZ-CG1 4.15Å; F199-I203 HydrophobicContact CD1-CG2 4.45Å; F199-I203 HydrophobicContact CE1-CD1 4.11Å; F199-I203 HydrophobicContact CE1-CG2 3.95Å; F199-I203 HydrophobicContact CZ-CG2 4.15Å; F199-I203 PolarHBondContact O-N 2.92Å; F199-I203 VanDerWaalsContact O-N 3.09Å; F200-I203 HydrophobicContact CD1-CD1 3.97Å; F200-I203 WeakPolarHBondContact O-CG1 3.32Å; F200-I203 PolarHBondContact O-N 3.37Å; I203-I205 PolarHBondContact O-N 3.2Å; I203-C207 HydrophobicContact CB-CB 4.02Å; I203-C207 WeakPolarHBondContact O-CA 3.41Å; I203-C207 WeakPolarHBondContact O-CB 3.43Å; I203-C207 PolarHBondContact O-N 3.39Å; I203-L213 HydrophobicContact CD1-CD1 3.79Å; I203-W216 HydrophobicContact CG2-CG 4.38Å
204	M	96.4	Very high	96.5	Very high	118 Å²	118	33 Å²	33	58%	0.581	17%	0.171	S	C	*	.	H	α-helix	trans	-63.6	-29.7	174.6	-76.8	178	66.4	0	0	112.5	F119 F123 F200 I201 G202	F119-M204 HydrophobicContact CE2-CG 4.13Å; F123-M204 HydrophobicContact CZ-CE 4.46Å; F200-M204 WeakPolarHBondContact O-CB 3.33Å; F200-M204 VanDerWaalsContact O-CG 3.27Å; F200-M204 WeakPolarHBondContact O-CG 3.02Å; F200-M204 PolarHBondContact O-N 3.22Å; I201-M204 PolarHBondContact O-N 3.22Å; G202-M204 VanDerWaalsContact C-N 3.31Å; G202-M204 PolarHBondContact O-N 2.87Å
205	I	96.1	Very high	96.5	Very high	102 Å²	102	31.6 Å²	31.6	52%	0.523	17%	0.168	S	C	.	.	H	α-helix	trans	-88.2	-42.3	-179.2	-61.9	165.6	0	0	0	110.9	V148 I201 G202 I203	V148-I205 HydrophobicContact CG1-CD1 4.41Å; V148-I205 HydrophobicContact CG2-CD1 4.27Å; I201-I205 HydrophobicContact CG2-CD1 4.03Å; I201-I205 WeakPolarHBondContact O-CG1 3.46Å; I201-I205 PolarHBondContact O-N 2.97Å; G202-I205 PolarHBondContact O-N 3.19Å; G202-I205 VanDerWaalsContact O-N 3.13Å; I203-I205 PolarHBondContact O-N 3.2Å
206	F	96.4	Very high	96.5	Very high	55 Å²	55	30.9 Å²	30.9	24%	0.241	16%	0.164	C	C	.	.	H	α-helix	trans	-112.4	-13.7	-165.6	-63.8	-73.2	0	0	0	115.3	R141 G144 V148 G202 N208 F212	R141-F206 HydrophobicContact CB-CB 4.22Å; R141-F206 HydrophobicContact CG-CB 4.47Å; R141-F206 HydrophobicContact CG-CD1 4.43Å; R141-F206 PolarHBondContact NH1-O 2.61Å; G144-F206 WeakPolarHBondContact O-CE2 3.29Å; V148-F206 HydrophobicContact CG2-CE2 4.03Å; G202-F206 WeakPolarHBondContact O-CD2 3.42Å; G202-F206 PolarHBondContact O-N 2.81Å; F206-N208 PolarHBondContact O-N 2.77Å; F206-F212 HydrophobicContact CB-CE1 4.29Å; F206-F212 HydrophobicContact CB-CZ 4.01Å
207	C	96.5	Very high	96.7	Very high	17 Å²	17	30.7 Å²	30.7	12%	0.115	16%	0.157	C	C	.	.			trans	-70.5	125.7	-176.9	-169.9	0	0	0	0	111.5	F119 I203 F212	F119-C207 HydrophobicContact CE1-CB 4.17Å; F119-C207 HydrophobicContact CZ-CB 4.07Å; I203-C207 HydrophobicContact CB-CB 4.02Å; I203-C207 WeakPolarHBondContact O-CA 3.41Å; I203-C207 WeakPolarHBondContact O-CB 3.43Å; I203-C207 PolarHBondContact O-N 3.39Å; C207-F212 HydrophobicContact CB-CD1 3.94Å; C207-F212 HydrophobicContact CB-CE1 4.14Å
208	N	94.5	Very high	96.7	Very high	41 Å²	41	30.5 Å²	30.5	22%	0.219	16%	0.156	C	C	.	.			trans	-130.5	-1.4	177.5	65.3	-31.9	0	0	0	113.4	P126 R141 F206	P126-N208 WeakPolarHBondContact CD-O 3.47Å; P126-N208 WeakPolarHBondContact CG-O 3.42Å; R141-N208 VanDerWaalsContact CZ-CG 3.49Å; F206-N208 PolarHBondContact O-N 2.77Å
209	H	97.4	Very high	96.8	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.167	C	C	.	.	S	Bend	trans	-163.3	148.3	-178.5	-167.1	-92	0	0	0	109.8	W37 P126 D128 S131 M132 P133 F211 F212 L213	W37-H209 AromaticContact CZ2-CE1 3.65Å; P126-H209 PolarHBondContact O-CD2 2.99Å; P126-H209 VanDerWaalsContact O-CD2 3.3Å; D128-H209 PolarHBondContact O-NE2 2.91Å; S131-H209 PolarHBondContact O-CD2 3.34Å; M132-H209 VanDerWaalsContact SD-CE1 3.57Å; P133-H209 HydrophobicContact CG-CB 4.16Å; H209-F211 VanDerWaalsContact C-N 3.26Å; H209-F211 WeakPolarHBondContact ND1-CB 3.42Å; H209-F211 PolarHBondContact ND1-N 3.33Å; H209-F211 PolarHBondContact O-N 2.86Å; H209-F212 HydrophobicContact CB-CB 4.49Å; H209-F212 WeakPolarHBondContact O-CB 3.49Å; H209-F212 PolarHBondContact O-N 3.46Å; H209-L213 PolarHBondContact O-N 2.88Å
210	V	97.3	Very high	96.8	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-60.8	-35.7	178.3	67.4	0	0	0	0	112.6	W37 P126 Y127 F212 L213 W214	W37-V210 HydrophobicContact CH2-CG1 3.78Å; W37-V210 HydrophobicContact CZ2-CG1 3.52Å; P126-V210 PolarHBondContact O-N 3.4Å; Y127-V210 HydrophobicContact CD1-CB 4.13Å; Y127-V210 HydrophobicContact CD1-CG1 3.63Å; Y127-V210 HydrophobicContact CD1-CG2 4.38Å; Y127-V210 HydrophobicContact CD2-CB 4.42Å; Y127-V210 HydrophobicContact CD2-CG1 4.37Å; Y127-V210 HydrophobicContact CE1-CB 3.93Å; Y127-V210 HydrophobicContact CE1-CG1 3.92Å; Y127-V210 HydrophobicContact CE1-CG2 3.79Å; Y127-V210 HydrophobicContact CE2-CB 4.23Å; Y127-V210 HydrophobicContact CG-CB 4.34Å; Y127-V210 HydrophobicContact CG-CG1 3.85Å; V210-F212 VanDerWaalsContact C-N 3.29Å; V210-F212 PolarHBondContact O-N 3.2Å; V210-L213 WeakPolarHBondContact O-CB 3.27Å; V210-L213 PolarHBondContact O-N 2.94Å; V210-L213 VanDerWaalsContact O-N 3.12Å; V210-W214 HydrophobicContact CG2-CZ2 4.45Å; V210-W214 PolarHBondContact O-N 3.48Å; V210-W214 VanDerWaalsContact O-N 3.11Å
211	F	96.5	Very high	96.9	Very high	32 Å²	32	29 Å²	29	14%	0.14	15%	0.149	C	C	.	.	H	α-helix	trans	-61.5	-36.3	173.7	-175.1	-100.5	0	0	0	112.6	W37 M132 W135 L138 H209 L213 W214 A215	W37-F211 HydrophobicContact CE3-CD2 4.36Å; W37-F211 HydrophobicContact CH2-CB 3.86Å; W37-F211 HydrophobicContact CH2-CD2 4.1Å; W37-F211 HydrophobicContact CH2-CG 4.49Å; W37-F211 HydrophobicContact CZ2-CB 4.28Å; W37-F211 HydrophobicContact CZ3-CB 4.36Å; W37-F211 AromaticContact CZ3-CD2 3.73Å; W37-F211 HydrophobicContact CZ3-CD2 3.73Å; M132-F211 HydrophobicContact CE-CB 4.02Å; M132-F211 HydrophobicContact CE-CD2 4.32Å; M132-F211 HydrophobicContact CE-CG 4.12Å; M132-F211 HydrophobicContact SD-CB 3.3Å; M132-F211 WeakPolarHBondContact SD-CB 3Å; M132-F211 HydrophobicContact SD-CD1 3.52Å; M132-F211 VanDerWaalsContact SD-CD1 3.52Å; M132-F211 HydrophobicContact SD-CD2 4.12Å; M132-F211 HydrophobicContact SD-CE1 4.36Å; M132-F211 HydrophobicContact SD-CG 3.38Å; M132-F211 WeakPolarHBondContact SD-CG 3.47Å; W135-F211 HydrophobicContact CH2-CE1 4.13Å; W135-F211 AromaticContact CH2-CZ 3.88Å; W135-F211 HydrophobicContact CH2-CZ 3.88Å; W135-F211 HydrophobicContact CZ3-CE1 4.17Å; W135-F211 HydrophobicContact CZ3-CZ 4.25Å; L138-F211 HydrophobicContact CD1-CD1 4.39Å; L138-F211 HydrophobicContact CD2-CE1 3.93Å; H209-F211 VanDerWaalsContact C-N 3.26Å; H209-F211 WeakPolarHBondContact ND1-CB 3.42Å; H209-F211 PolarHBondContact ND1-N 3.33Å; H209-F211 PolarHBondContact O-N 2.86Å; F211-L213 VanDerWaalsContact C-N 3.31Å; F211-L213 PolarHBondContact O-N 3.34Å; F211-W214 PolarHBondContact O-N 3.49Å; F211-A215 WeakPolarHBondContact O-CB 3.29Å; F211-A215 PolarHBondContact O-N 3.07Å
212	F	97.1	Very high	97	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-62.2	-42.8	174.1	168.7	-90	0	0	0	110.8	P133 L138 R141 F206 C207 H209 V210 W214 A215 W216	P133-F212 HydrophobicContact CG-CB 4.31Å; L138-F212 HydrophobicContact CD1-CB 3.94Å; L138-F212 HydrophobicContact CD1-CD2 3.56Å; L138-F212 HydrophobicContact CD1-CE2 4.5Å; L138-F212 HydrophobicContact CD1-CG 4.21Å; R141-F212 HydrophobicContact CB-CD2 3.96Å; R141-F212 HydrophobicContact CB-CE2 3.22Å; R141-F212 HydrophobicContact CB-CZ 3.77Å; R141-F212 HydrophobicContact CG-CE2 4.4Å; F206-F212 HydrophobicContact CB-CE1 4.29Å; F206-F212 HydrophobicContact CB-CZ 4.01Å; C207-F212 HydrophobicContact CB-CD1 3.94Å; C207-F212 HydrophobicContact CB-CE1 4.14Å; H209-F212 HydrophobicContact CB-CB 4.49Å; H209-F212 WeakPolarHBondContact O-CB 3.49Å; H209-F212 PolarHBondContact O-N 3.46Å; V210-F212 VanDerWaalsContact C-N 3.29Å; V210-F212 PolarHBondContact O-N 3.2Å; F212-W214 VanDerWaalsContact C-N 3.31Å; F212-W214 PolarHBondContact O-N 3.45Å; F212-A215 PolarHBondContact O-N 3.35Å; F212-W216 HydrophobicContact CE1-CB 4.3Å; F212-W216 HydrophobicContact CZ-CB 4.29Å; F212-W216 WeakPolarHBondContact O-CB 3.2Å; F212-W216 PolarHBondContact O-N 2.9Å
213	L	96.8	Very high	97	Very high	6 Å²	6	28.9 Å²	28.9	3%	0.031	15%	0.149	C	C	.	.	H	α-helix	trans	-58.1	-44.8	176.7	-174.1	131.2	0	0	0	111	T116 F119 I203 H209 V210 F211 W216 V217	T116-L213 HydrophobicContact CG2-CD1 4.2Å; T116-L213 HydrophobicContact CG2-CD2 3.8Å; F119-L213 HydrophobicContact CD1-CD1 4.39Å; F119-L213 HydrophobicContact CE1-CD1 4.28Å; I203-L213 HydrophobicContact CD1-CD1 3.79Å; H209-L213 PolarHBondContact O-N 2.88Å; V210-L213 WeakPolarHBondContact O-CB 3.27Å; V210-L213 PolarHBondContact O-N 2.94Å; V210-L213 VanDerWaalsContact O-N 3.12Å; F211-L213 VanDerWaalsContact C-N 3.31Å; F211-L213 PolarHBondContact O-N 3.34Å; L213-W216 PolarHBondContact O-N 3.27Å; L213-V217 WeakPolarHBondContact O-CG2 3.47Å; L213-V217 PolarHBondContact O-N 3.41Å
214	W	97.9	Very high	97	Very high	29 Å²	29	29.5 Å²	29.5	11%	0.11	15%	0.153	C	C	.	.	H	α-helix	trans	-65	-41	175.5	-67	-6.9	0	0	0	113.4	W37 M40 I49 S54 V57 V210 F211 F212 W216 V217 A218	W37-W214 HydrophobicContact CH2-CE3 4Å; W37-W214 HydrophobicContact CH2-CH2 4.3Å; W37-W214 AromaticContact CH2-CZ3 3.74Å; W37-W214 HydrophobicContact CH2-CZ3 3.74Å; W37-W214 AromaticContact CZ3-CE3 3.84Å; W37-W214 HydrophobicContact CZ3-CE3 3.84Å; W37-W214 HydrophobicContact CZ3-CH2 4.32Å; W37-W214 AromaticContact CZ3-CZ3 3.46Å; W37-W214 HydrophobicContact CZ3-CZ3 3.46Å; W37-W214 VanDerWaalsContact CZ3-CZ3 3.46Å; M40-W214 HydrophobicContact CE-CH2 4Å; M40-W214 HydrophobicContact CE-CZ3 4.23Å; M40-W214 HydrophobicContact SD-CH2 3.72Å; M40-W214 HydrophobicContact SD-CZ3 4.17Å; I49-W214 HydrophobicContact CG2-CH2 3.85Å; I49-W214 HydrophobicContact CG2-CZ2 3.82Å; S54-W214 PolarHBondContact OG-NE1 3.48Å; V57-W214 HydrophobicContact CB-CG 4.47Å; V57-W214 HydrophobicContact CG1-CB 4.07Å; V57-W214 HydrophobicContact CG1-CG 4.19Å; V57-W214 HydrophobicContact CG2-CD2 3.84Å; V57-W214 HydrophobicContact CG2-CE3 3.95Å; V57-W214 HydrophobicContact CG2-CG 4.14Å; V57-W214 HydrophobicContact CG2-CZ3 4.37Å; V210-W214 HydrophobicContact CG2-CZ2 4.45Å; V210-W214 PolarHBondContact O-N 3.48Å; V210-W214 VanDerWaalsContact O-N 3.11Å; F211-W214 PolarHBondContact O-N 3.49Å; F212-W214 VanDerWaalsContact C-N 3.31Å; F212-W214 PolarHBondContact O-N 3.45Å; W214-W216 VanDerWaalsContact C-N 3.32Å; W214-W216 PolarHBondContact O-N 3.45Å; W214-V217 PolarHBondContact O-N 2.82Å; W214-A218 WeakPolarHBondContact O-CB 2.92Å; W214-A218 PolarHBondContact O-N 3.35Å
215	A	97.4	Very high	97	Very high	22 Å²	22	24.2 Å²	24.2	18%	0.182	13%	0.127	C	C	.	.	H	α-helix	trans	-64.6	-37.8	175.5	0	0	0	0	0	112.1	L138 F211 F212 A218 F219	L138-A215 HydrophobicContact CD1-CB 3.65Å; L138-A215 HydrophobicContact CD2-CB 3.88Å; L138-A215 HydrophobicContact CG-CB 4.07Å; F211-A215 WeakPolarHBondContact O-CB 3.29Å; F211-A215 PolarHBondContact O-N 3.07Å; F212-A215 PolarHBondContact O-N 3.35Å; A215-A218 WeakPolarHBondContact O-CB 3.2Å; A215-A218 PolarHBondContact O-N 3Å; A215-F219 PolarHBondContact O-N 3Å
216	W	97.9	Very high	97.1	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-69.1	-43.5	176	175.2	-123	0	0	0	112	C142 C145 A146 E149 F199 I203 F212 L213 W214 A218 F219 R220	C142-W216 HydrophobicContact CB-CE3 4.14Å; C142-W216 VanDerWaalsContact O-CZ3 3.27Å; C142-W216 WeakPolarHBondContact O-CZ3 3.45Å; C145-W216 HydrophobicContact CB-CD2 3.52Å; C145-W216 VanDerWaalsContact CB-CE2 3.46Å; C145-W216 HydrophobicContact CB-CE3 3.6Å; C145-W216 HydrophobicContact CB-CG 4.28Å; C145-W216 HydrophobicContact CB-CH2 3.71Å; C145-W216 HydrophobicContact CB-CZ2 3.59Å; C145-W216 HydrophobicContact CB-CZ3 3.68Å; A146-W216 HydrophobicContact CB-CH2 3.97Å; A146-W216 HydrophobicContact CB-CZ3 3.98Å; E149-W216 HydrophobicContact CB-CZ2 4.14Å; E149-W216 HydrophobicContact CG-CZ2 4.44Å; F199-W216 AromaticContact CD2-CD1 3.63Å; F199-W216 AromaticContact CD2-CE2 3.84Å; F199-W216 HydrophobicContact CD2-CZ2 4.34Å; F199-W216 AromaticContact CD2-NE1 3.07Å; F199-W216 AromaticContact CE2-CD1 3.09Å; F199-W216 HydrophobicContact CE2-CD2 4.49Å; F199-W216 AromaticContact CE2-CE2 3.96Å; F199-W216 AromaticContact CE2-CG 3.99Å; F199-W216 HydrophobicContact CE2-CG 3.99Å; F199-W216 AromaticContact CE2-NE1 3.1Å; F199-W216 AromaticContact CG-NE1 3.74Å; F199-W216 AromaticContact CZ-CD1 3.4Å; F199-W216 VanDerWaalsContact CZ-CD1 3.4Å; F199-W216 HydrophobicContact CZ-CG 4.43Å; F199-W216 AromaticContact CZ-NE1 3.76Å; I203-W216 HydrophobicContact CG2-CG 4.38Å; F212-W216 HydrophobicContact CE1-CB 4.3Å; F212-W216 HydrophobicContact CZ-CB 4.29Å; F212-W216 WeakPolarHBondContact O-CB 3.2Å; F212-W216 PolarHBondContact O-N 2.9Å; L213-W216 PolarHBondContact O-N 3.27Å; W214-W216 VanDerWaalsContact C-N 3.32Å; W214-W216 PolarHBondContact O-N 3.45Å; W216-A218 VanDerWaalsContact C-N 3.28Å; W216-A218 PolarHBondContact O-N 3.19Å; W216-F219 HydrophobicContact CE3-CB 4.4Å; W216-F219 HydrophobicContact CE3-CD1 4.05Å; W216-F219 HydrophobicContact CH2-CD1 4.29Å; W216-F219 AromaticContact CZ3-CD1 3.45Å; W216-F219 HydrophobicContact CZ3-CD1 3.45Å; W216-F219 VanDerWaalsContact CZ3-CD1 3.45Å; W216-F219 HydrophobicContact CZ3-CE1 4.04Å; W216-F219 HydrophobicContact CZ3-CG 4.38Å; W216-F219 PolarHBondContact O-N 2.83Å; W216-R220 HydrophobicContact CH2-CB 4.43Å; W216-R220 HydrophobicContact CZ2-CB 4.29Å; W216-R220 WeakPolarHBondContact O-CB 3.23Å; W216-R220 PolarHBondContact O-N 3.45Å
217	V	97.9	Very high	97.1	Very high	21 Å²	21	17.9 Å²	17.9	13%	0.127	10%	0.097	C	C	.	.	H	α-helix	trans	-54.2	-48.9	169.3	170.3	0	0	0	0	109.9	H58 F199 L213 W214 F219 R220 L221	H58-V217 HydrophobicContact CB-CG1 4.29Å; F199-V217 HydrophobicContact CE2-CG2 3.9Å; F199-V217 HydrophobicContact CZ-CG2 3.49Å; F199-V217 VanDerWaalsContact CZ-CG2 3.49Å; L213-V217 WeakPolarHBondContact O-CG2 3.47Å; L213-V217 PolarHBondContact O-N 3.41Å; W214-V217 PolarHBondContact O-N 2.82Å; V217-F219 PolarHBondContact O-N 3.28Å; V217-R220 PolarHBondContact O-N 3.03Å; V217-L221 HydrophobicContact CG1-CD1 3.74Å; V217-L221 HydrophobicContact CG1-CG 4.07Å; V217-L221 WeakPolarHBondContact O-CB 3.28Å; V217-L221 VanDerWaalsContact O-CG 3.27Å; V217-L221 WeakPolarHBondContact O-CG 3.34Å; V217-L221 PolarHBondContact O-N 3.44Å
218	A	98.1	Very high	97.1	Very high	24 Å²	24	17.5 Å²	17.5	20%	0.198	9%	0.093	C	C	.	.	H	α-helix	trans	-57.4	-48	-179.1	0	0	0	0	0	112.8	I61 W214 A215 W216 L222	I61-A218 HydrophobicContact CD1-CB 3.37Å; W214-A218 WeakPolarHBondContact O-CB 2.92Å; W214-A218 PolarHBondContact O-N 3.35Å; A215-A218 WeakPolarHBondContact O-CB 3.2Å; A215-A218 PolarHBondContact O-N 3Å; W216-A218 VanDerWaalsContact C-N 3.28Å; W216-A218 PolarHBondContact O-N 3.19Å; A218-L222 WeakPolarHBondContact O-CB 3.34Å; A218-L222 PolarHBondContact O-N 2.8Å
219	F	96.9	Very high	97.1	Very high	52 Å²	52	16.2 Å²	16.2	23%	0.228	9%	0.087	C	C	.	.	H	α-helix	trans	-64.5	-45.8	179	-179.2	-90.7	0	0	0	111.7	A146 A215 W216 V217 L221 L222 E223 I241	A146-F219 HydrophobicContact CB-CE1 4.02Å; A215-F219 PolarHBondContact O-N 3Å; W216-F219 HydrophobicContact CE3-CB 4.4Å; W216-F219 HydrophobicContact CE3-CD1 4.05Å; W216-F219 HydrophobicContact CH2-CD1 4.29Å; W216-F219 AromaticContact CZ3-CD1 3.45Å; W216-F219 HydrophobicContact CZ3-CD1 3.45Å; W216-F219 VanDerWaalsContact CZ3-CD1 3.45Å; W216-F219 HydrophobicContact CZ3-CE1 4.04Å; W216-F219 HydrophobicContact CZ3-CG 4.38Å; W216-F219 PolarHBondContact O-N 2.83Å; V217-F219 PolarHBondContact O-N 3.28Å; F219-L221 VanDerWaalsContact C-N 3.34Å; F219-L221 PolarHBondContact O-N 2.95Å; F219-L222 PolarHBondContact O-N 2.97Å; F219-E223 WeakPolarHBondContact O-CB 3.08Å; F219-E223 PolarHBondContact O-N 3.13Å; F219-I241 HydrophobicContact CE2-CD1 4.29Å; F219-I241 HydrophobicContact CZ-CD1 4.22Å
220	R	97.1	Very high	97	Very high	23 Å²	23	16.4 Å²	16.4	9%	0.087	9%	0.089	C	C	.	.	H	α-helix	trans	-62.9	-41.2	179.3	-178.2	66.3	-130.7	140.3	17.1	111.7	E149 F199 W216 V217 E223 T224 S263 T264	E149-R220 IonicContact OE2-CZ 2.64Å; E149-R220 IonicContact OE2-NE 3.02Å; E149-R220 IonicContact OE2-NH1 3.87Å; E149-R220 PolarHBondContact OE2-NH1 3.2Å; F199-R220 HydrophobicContact CD2-CB 4.4Å; F199-R220 HydrophobicContact CD2-CG 4.16Å; F199-R220 HydrophobicContact CE2-CB 4.47Å; W216-R220 HydrophobicContact CH2-CB 4.43Å; W216-R220 HydrophobicContact CZ2-CB 4.29Å; W216-R220 WeakPolarHBondContact O-CB 3.23Å; W216-R220 PolarHBondContact O-N 3.45Å; V217-R220 PolarHBondContact O-N 3.03Å; R220-E223 IonicContact CZ-OE2 2.68Å; R220-E223 IonicContact NH1-OE1 3.4Å; R220-E223 IonicContact NH1-OE2 3.84Å; R220-E223 PolarHBondContact NH1-OE2 2.87Å; R220-E223 IonicContact NH2-OE2 2.97Å; R220-E223 PolarHBondContact NH2-OE2 3.17Å; R220-T224 PolarHBondContact NH2-OG1 3.44Å; R220-T224 VanDerWaalsContact NH2-OG1 3.09Å; R220-T224 VanDerWaalsContact O-CB 3.32Å; R220-T224 WeakPolarHBondContact O-CB 3.2Å; R220-T224 PolarHBondContact O-N 3.02Å; R220-S263 PolarHBondContact NH1-OG 3.29Å; R220-S263 PolarHBondContact NH2-OG 3.15Å; R220-T264 PolarHBondContact NH1-OG1 3.3Å
221	L	97.8	Very high	96.9	Very high	5 Å²	5	16.6 Å²	16.6	3%	0.026	9%	0.09	C	C	.	.	H	α-helix	trans	-67.5	-44.6	176.6	-70.5	-175.2	0	0	0	112.1	H58 I61 Y62 E185 V217 F219 E223 T224 I225	H58-L221 WeakPolarHBondContact O-CD1 3.18Å; I61-L221 HydrophobicContact CB-CD1 4.11Å; I61-L221 HydrophobicContact CG2-CB 3.99Å; I61-L221 HydrophobicContact CG2-CD1 3.96Å; Y62-L221 HydrophobicContact CD2-CD2 3.96Å; E185-L221 WeakPolarHBondContact OE1-CD2 3.13Å; V217-L221 HydrophobicContact CG1-CD1 3.74Å; V217-L221 HydrophobicContact CG1-CG 4.07Å; V217-L221 WeakPolarHBondContact O-CB 3.28Å; V217-L221 VanDerWaalsContact O-CG 3.27Å; V217-L221 WeakPolarHBondContact O-CG 3.34Å; V217-L221 PolarHBondContact O-N 3.44Å; F219-L221 VanDerWaalsContact C-N 3.34Å; F219-L221 PolarHBondContact O-N 2.95Å; L221-E223 VanDerWaalsContact C-N 3.31Å; L221-E223 PolarHBondContact O-N 3.43Å; L221-T224 HydrophobicContact CD2-CG2 4.47Å; L221-T224 WeakPolarHBondContact O-CG2 3.41Å; L221-T224 PolarHBondContact O-N 3.3Å; L221-I225 WeakPolarHBondContact O-CB 3.05Å; L221-I225 WeakPolarHBondContact O-CD1 3.25Å; L221-I225 WeakPolarHBondContact O-CG1 3.49Å; L221-I225 PolarHBondContact O-N 2.81Å
222	L	97	Very high	96.8	Very high	54 Å²	54	16.8 Å²	16.8	28%	0.283	9%	0.092	S	C	.	.	H	α-helix	trans	-55.2	-50.9	175.6	175.7	58.7	0	0	0	111	F65 A218 F219 D226 L238	F65-L222 HydrophobicContact CD1-CD1 3.99Å; F65-L222 HydrophobicContact CD2-CB 3.76Å; F65-L222 HydrophobicContact CD2-CD1 3.9Å; F65-L222 HydrophobicContact CD2-CG 4.42Å; F65-L222 HydrophobicContact CE1-CD1 4.02Å; F65-L222 HydrophobicContact CE2-CB 3.53Å; F65-L222 HydrophobicContact CE2-CD1 3.92Å; F65-L222 HydrophobicContact CE2-CG 4.18Å; F65-L222 HydrophobicContact CG-CD1 3.95Å; F65-L222 HydrophobicContact CZ-CB 4.24Å; F65-L222 HydrophobicContact CZ-CD1 4Å; F65-L222 HydrophobicContact CZ-CD2 4.49Å; F65-L222 HydrophobicContact CZ-CG 4.46Å; A218-L222 WeakPolarHBondContact O-CB 3.34Å; A218-L222 PolarHBondContact O-N 2.8Å; F219-L222 PolarHBondContact O-N 2.97Å; L222-D226 VanDerWaalsContact O-CB 3.28Å; L222-D226 WeakPolarHBondContact O-CB 3.3Å; L222-D226 PolarHBondContact O-N 3.09Å; L222-L238 HydrophobicContact CD2-CD2 4.16Å; L222-L238 HydrophobicContact CG-CD1 4.19Å
223	E	96.6	Very high	96.5	Very high	1 Å²	1	19.1 Å²	19.1	1%	0.005	10%	0.104	C	C	.	.	H	α-helix	trans	-63	-48.6	-178.4	-169.5	-81.8	-175.3	0	0	111.4	F219 R220 L221 I225 D226 V227 Y244 T264	F219-E223 WeakPolarHBondContact O-CB 3.08Å; F219-E223 PolarHBondContact O-N 3.13Å; R220-E223 IonicContact CZ-OE2 2.68Å; R220-E223 IonicContact NH1-OE1 3.4Å; R220-E223 IonicContact NH1-OE2 3.84Å; R220-E223 PolarHBondContact NH1-OE2 2.87Å; R220-E223 IonicContact NH2-OE2 2.97Å; R220-E223 PolarHBondContact NH2-OE2 3.17Å; L221-E223 VanDerWaalsContact C-N 3.31Å; L221-E223 PolarHBondContact O-N 3.43Å; E223-I225 VanDerWaalsContact C-N 3.28Å; E223-I225 PolarHBondContact O-N 3.23Å; E223-D226 PolarHBondContact O-N 2.75Å; E223-D226 VanDerWaalsContact O-N 3.15Å; E223-V227 PolarHBondContact O-N 3.49Å; E223-Y244 HydrophobicContact CG-CE2 3.85Å; E223-T264 HydrophobicContact CG-CG2 4.09Å; E223-T264 WeakPolarHBondContact OE1-CA 3.39Å; E223-T264 WeakPolarHBondContact OE1-CB 3.41Å; E223-T264 PolarHBondContact OE1-N 3.47Å; E223-T264 PolarHBondContact OE1-OG1 3.45Å
224	T	96.7	Very high	96	Very high	18 Å²	18	23.1 Å²	23.1	11%	0.11	13%	0.13	C	C	.	.	H	α-helix	trans	-65	-36.4	-175.6	-148.4	0	0	0	0	111.1	A184 R220 L221 V227 H228	A184-T224 HydrophobicContact CB-CG2 3.91Å; A184-T224 WeakPolarHBondContact CB-O 3.5Å; R220-T224 PolarHBondContact NH2-OG1 3.44Å; R220-T224 VanDerWaalsContact NH2-OG1 3.09Å; R220-T224 VanDerWaalsContact O-CB 3.32Å; R220-T224 WeakPolarHBondContact O-CB 3.2Å; R220-T224 PolarHBondContact O-N 3.02Å; L221-T224 HydrophobicContact CD2-CG2 4.47Å; L221-T224 WeakPolarHBondContact O-CG2 3.41Å; L221-T224 PolarHBondContact O-N 3.3Å; T224-V227 WeakPolarHBondContact O-CG2 3.15Å; T224-H228 PolarHBondContact O-N 3.29Å; T224-H228 PolarHBondContact O-ND1 3.34Å
225	I	97.6	Very high	95.5	Very high	6 Å²	6	29.4 Å²	29.4	3%	0.031	17%	0.165	C	C	.	.	H	α-helix	trans	-72.8	-38.8	177	-67.6	164.5	0	0	0	110.7	Y62 F65 A184 L221 E223 H228 S229	Y62-I225 HydrophobicContact CD2-CD1 3.82Å; Y62-I225 HydrophobicContact CD2-CG1 4.38Å; Y62-I225 HydrophobicContact CE2-CD1 4.03Å; Y62-I225 HydrophobicContact CE2-CG1 4.11Å; Y62-I225 HydrophobicContact CG-CD1 4.26Å; Y62-I225 WeakPolarHBondContact O-CD1 3.38Å; F65-I225 HydrophobicContact CB-CB 4.49Å; F65-I225 HydrophobicContact CB-CD1 3.74Å; F65-I225 HydrophobicContact CB-CG2 4.28Å; F65-I225 WeakPolarHBondContact O-CG2 3.19Å; A184-I225 HydrophobicContact CB-CG1 4.17Å; L221-I225 WeakPolarHBondContact O-CB 3.05Å; L221-I225 WeakPolarHBondContact O-CD1 3.25Å; L221-I225 WeakPolarHBondContact O-CG1 3.49Å; L221-I225 PolarHBondContact O-N 2.81Å; E223-I225 VanDerWaalsContact C-N 3.28Å; E223-I225 PolarHBondContact O-N 3.23Å; I225-H228 CarbonylContact O-C 3.56Å; I225-H228 PolarHBondContact O-N 3.33Å; I225-S229 WeakPolarHBondContact O-CA 3.17Å; I225-S229 PolarHBondContact O-N 3.35Å
226	D	97.1	Very high	95.1	Very high	24 Å²	24	29.5 Å²	29.5	13%	0.128	16%	0.163	C	C	.	.	H	α-helix	trans	-62.8	-48.5	179.9	-177.1	74.3	0	0	0	112	L222 E223 H228 S229 N236 L238 Y244 A247	L222-D226 VanDerWaalsContact O-CB 3.28Å; L222-D226 WeakPolarHBondContact O-CB 3.3Å; L222-D226 PolarHBondContact O-N 3.09Å; E223-D226 PolarHBondContact O-N 2.75Å; E223-D226 VanDerWaalsContact O-N 3.15Å; D226-H228 PolarHBondContact O-N 3.19Å; D226-S229 VanDerWaalsContact O-CB 3.23Å; D226-S229 WeakPolarHBondContact O-CB 3.36Å; D226-S229 PolarHBondContact O-N 3.34Å; D226-S229 PolarHBondContact O-OG 3.05Å; D226-N236 PolarHBondContact OD1-ND2 3.1Å; D226-N236 PolarHBondContact OD2-ND2 3.3Å; D226-L238 HydrophobicContact CB-CD1 3.6Å; D226-Y244 WeakPolarHBondContact OD2-CE1 3.37Å; D226-Y244 PolarHBondContact OD2-OH 2.89Å; D226-A247 WeakPolarHBondContact O-CB 3.33Å
227	V	96.3	Very high	94.8	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.006	19%	0.191	C	C	.	.	H	α-helix	trans	-65.1	-23.8	178.7	-57.1	0	0	0	0	112.6	E223 T224 Y244 A247 H250	E223-V227 PolarHBondContact O-N 3.49Å; T224-V227 WeakPolarHBondContact O-CG2 3.15Å; V227-Y244 HydrophobicContact CG1-CE2 4.09Å; V227-Y244 VanDerWaalsContact CG1-OH 3.29Å; V227-Y244 WeakPolarHBondContact CG1-OH 3.45Å; V227-A247 WeakPolarHBondContact O-CA 3.1Å; V227-H250 HydrophobicContact CB-CB 4.03Å; V227-H250 WeakPolarHBondContact O-CB 3.46Å
228	H	97.1	Very high	94.5	Very high	8 Å²	8	33.3 Å²	33.3	4%	0.037	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	0.3	174.5	-70	86.5	0	0	0	114	H173 P179 F180 G181 A184 T224 I225 D226 G230 H250 H254	H173-H228 AromaticContact CE1-NE2 3.18Å; H173-H228 PolarHBondContact CE1-NE2 2.86Å; H173-H228 AromaticContact NE2-NE2 3.35Å; H173-H228 PolarHBondContact NE2-NE2 3.42Å; P179-H228 CarbonylContact C-O 3.26Å; P179-H228 VanDerWaalsContact C-O 3.26Å; P179-H228 HydrophobicContact CB-CB 4.38Å; F180-H228 CarbonylContact C-O 3Å; F180-H228 WeakPolarHBondContact CA-O 3.28Å; F180-H228 PolarHBondContact N-O 3.09Å; F180-H228 VanDerWaalsContact N-O 3.09Å; G181-H228 PolarHBondContact N-O 3.15Å; A184-H228 HydrophobicContact CB-CB 4Å; T224-H228 PolarHBondContact O-N 3.29Å; T224-H228 PolarHBondContact O-ND1 3.34Å; I225-H228 CarbonylContact O-C 3.56Å; I225-H228 PolarHBondContact O-N 3.33Å; D226-H228 PolarHBondContact O-N 3.19Å; H228-G230 PolarHBondContact O-N 3.39Å; H228-H250 AromaticContact CD2-CD2 3.73Å; H228-H250 AromaticContact CD2-NE2 3.68Å; H228-H250 AromaticContact CE1-CD2 3.64Å; H228-H250 AromaticContact CE1-NE2 3.26Å; H228-H250 PolarHBondContact CE1-NE2 3.34Å; H228-H250 VanDerWaalsContact CE1-NE2 3.26Å; H228-H250 AromaticContact NE2-CD2 3.48Å; H228-H250 PolarHBondContact NE2-CD2 2.96Å; H228-H250 AromaticContact NE2-NE2 2.96Å; H228-H250 PolarHBondContact NE2-NE2 2.85Å; H228-H254 AromaticContact CD2-NE2 3.66Å; H228-H254 AromaticContact NE2-NE2 3.5Å; H228-H254 PolarHBondContact NE2-NE2 3Å
229	S	95.3	Very high	94.2	Very high	14 Å²	14	36.1 Å²	36.1	10%	0.098	20%	0.196	C	C	.	.	S	Bend	trans	-60.9	-27.6	-165.9	63.4	0	0	0	0	113.7	I225 D226 Y231	I225-S229 WeakPolarHBondContact O-CA 3.17Å; I225-S229 PolarHBondContact O-N 3.35Å; D226-S229 VanDerWaalsContact O-CB 3.23Å; D226-S229 WeakPolarHBondContact O-CB 3.36Å; D226-S229 PolarHBondContact O-N 3.34Å; D226-S229 PolarHBondContact O-OG 3.05Å; S229-Y231 VanDerWaalsContact O-CD2 3.28Å; S229-Y231 WeakPolarHBondContact O-CD2 3.42Å; S229-Y231 PolarHBondContact OG-N 2.99Å; S229-Y231 PolarHBondContact OG-O 3.02Å
230	G	94.9	Very high	93.8	Very high	4 Å²	4	40.9 Å²	40.9	4%	0.041	22%	0.223	C	C	.	.	S	Bend	trans	79.6	2.5	-173.5	0	0	0	0	0	113.6	I83 P179 H228	I83-G230 PolarHBondContact N-O 3.11Å; P179-G230 VanDerWaalsContact O-CA 3.27Å; P179-G230 WeakPolarHBondContact O-CA 3.34Å; H228-G230 PolarHBondContact O-N 3.39Å
231	Y	94.6	Very high	93.6	Very high	4 Å²	4	41.7 Å²	41.7	2%	0.016	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-124.9	138.2	-178.5	-67.7	-92.7	0	0	0	111.1	F72 Q73 Y81 K82 S229 A247	F72-Y231 HydrophobicContact CB-CD1 4.25Å; F72-Y231 HydrophobicContact CB-CE1 3.73Å; F72-Y231 HydrophobicContact CB-CE2 4.06Å; F72-Y231 HydrophobicContact CD2-CD1 4.33Å; F72-Y231 HydrophobicContact CD2-CD2 4.19Å; F72-Y231 HydrophobicContact CD2-CG 4.12Å; Q73-Y231 WeakPolarHBondContact CA-OH 3.17Å; Q73-Y231 PolarHBondContact N-OH 3.12Å; Y81-Y231 WeakPolarHBondContact O-CA 3.46Å; K82-Y231 HydrophobicContact CB-CD1 4.09Å; K82-Y231 HydrophobicContact CB-CE1 3.81Å; K82-Y231 HydrophobicContact CG-CE1 4.45Å; S229-Y231 VanDerWaalsContact O-CD2 3.28Å; S229-Y231 WeakPolarHBondContact O-CD2 3.42Å; S229-Y231 PolarHBondContact OG-N 2.99Å; S229-Y231 PolarHBondContact OG-O 3.02Å; Y231-A247 WeakPolarHBondContact O-CB 3.47Å
232	D	94	Very high	93.2	Very high	37 Å²	37	45.8 Å²	45.8	20%	0.198	26%	0.256	C	S	.	.			trans	-107.6	98.4	170.5	176.1	37.9	0	0	0	109.7	Y81 I83 H239 R248	Y81-D232 PolarHBondContact O-N 3.16Å; I83-D232 HydrophobicContact CD1-CB 4.37Å; I83-D232 HydrophobicContact CG1-CB 4.08Å; D232-H239 IonicContact OD1-CE1 3.52Å; D232-R248 HydrophobicContact CB-CG 4.03Å; D232-R248 VanDerWaalsContact CG-NE 3.35Å; D232-R248 IonicContact OD2-CZ 2.95Å; D232-R248 IonicContact OD2-NE 3.54Å; D232-R248 PolarHBondContact OD2-NE 3.4Å; D232-R248 IonicContact OD2-NH2 3.37Å; D232-R248 PolarHBondContact OD2-NH2 3.01Å
233	I	92.4	Very high	93	Very high	49 Å²	49	48.5 Å²	48.5	25%	0.251	27%	0.266	S	S	.	.			trans	-99.2	126.8	-171.7	-55.2	179.6	0	0	0	109.9	F72 M78 L235 N236	F72-I233 HydrophobicContact CD2-CD1 3.96Å; F72-I233 HydrophobicContact CE2-CD1 3.2Å; F72-I233 HydrophobicContact CZ-CD1 3.76Å; M78-I233 HydrophobicContact CE-CD1 3.99Å; M78-I233 HydrophobicContact CE-CG1 4.28Å; I233-L235 PolarHBondContact O-N 2.89Å; I233-L235 VanDerWaalsContact O-N 3.08Å; I233-N236 WeakPolarHBondContact O-CB 3.45Å; I233-N236 PolarHBondContact O-N 2.75Å
234	P	84.8	Confident	93	Very high	89 Å²	89	49.6 Å²	49.6	58%	0.578	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-27	-175.4	-27.7	33.7	0	0	0	116.1	Y81	Y81-P234 HydrophobicContact CD1-CG 4.14Å; Y81-P234 HydrophobicContact CE1-CG 3.48Å; Y81-P234 VanDerWaalsContact CE1-CG 3.48Å
235	L	87.1	Confident	92.9	Very high	161 Å²	161	49.3 Å²	49.3	84%	0.843	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.5	24.3	-176.5	-62.5	178.7	0	0	0	112.8	I233 P237	I233-L235 PolarHBondContact O-N 2.89Å; I233-L235 VanDerWaalsContact O-N 3.08Å; L235-P237 VanDerWaalsContact O-CD 3.26Å; L235-P237 WeakPolarHBondContact O-CD 3.3Å
236	N	90.8	Very high	92.8	Very high	24 Å²	24	49.2 Å²	49.2	13%	0.128	27%	0.27	C	S	.	.			trans	-68.1	113.9	174.6	-175.4	-2.3	0	0	0	110.5	D226 I233 L238 H239	D226-N236 PolarHBondContact OD1-ND2 3.1Å; D226-N236 PolarHBondContact OD2-ND2 3.3Å; I233-N236 WeakPolarHBondContact O-CB 3.45Å; I233-N236 PolarHBondContact O-N 2.75Å; N236-L238 PolarHBondContact O-N 2.93Å; N236-L238 WeakPolarHBondContact OD1-CB 3.43Å; N236-L238 PolarHBondContact OD1-N 3.01Å; N236-L238 VanDerWaalsContact OD1-N 3.1Å; N236-H239 PolarHBondContact ND2-NE2 2.94Å; N236-H239 WeakPolarHBondContact O-CB 3.02Å; N236-H239 PolarHBondContact O-N 3.46Å
237	P	90.6	Very high	92.7	Very high	90 Å²	90	48.2 Å²	48.2	58%	0.584	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-66	-21.5	-177.8	28.3	-35.8	0	0	0	113.3	L235 H239 L240	L235-P237 VanDerWaalsContact O-CD 3.26Å; L235-P237 WeakPolarHBondContact O-CD 3.3Å; P237-H239 PolarHBondContact O-N 2.89Å; P237-L240 VanDerWaalsContact O-CB 3.26Å; P237-L240 WeakPolarHBondContact O-CB 3.21Å; P237-L240 WeakPolarHBondContact O-CG 3.18Å; P237-L240 PolarHBondContact O-N 3.46Å
238	L	92.3	Very high	92.7	Very high	12 Å²	12	52.4 Å²	52.4	6%	0.063	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-65.2	-23.7	178.1	-62.3	177.9	0	0	0	112.3	L222 D226 N236 L240 I241 Y244	L222-L238 HydrophobicContact CD2-CD2 4.16Å; L222-L238 HydrophobicContact CG-CD1 4.19Å; D226-L238 HydrophobicContact CB-CD1 3.6Å; N236-L238 PolarHBondContact O-N 2.93Å; N236-L238 WeakPolarHBondContact OD1-CB 3.43Å; N236-L238 PolarHBondContact OD1-N 3.01Å; N236-L238 VanDerWaalsContact OD1-N 3.1Å; L238-L240 PolarHBondContact O-N 3.42Å; L238-L240 VanDerWaalsContact O-N 3.15Å; L238-I241 HydrophobicContact CD2-CD1 3.98Å; L238-I241 VanDerWaalsContact O-CB 3.28Å; L238-I241 WeakPolarHBondContact O-CB 3.39Å; L238-I241 WeakPolarHBondContact O-CG1 3.47Å; L238-I241 PolarHBondContact O-N 2.84Å; L238-Y244 HydrophobicContact CB-CD1 3.98Å; L238-Y244 HydrophobicContact CB-CE1 3.53Å; L238-Y244 HydrophobicContact CD1-CE1 4.33Å; L238-Y244 WeakPolarHBondContact CD1-OH 3.4Å; L238-Y244 WeakPolarHBondContact O-CD1 3.43Å
239	H	90.2	Very high	92.6	Very high	83 Å²	83	52.3 Å²	52.3	38%	0.384	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-67.1	-11.9	174.7	-67.1	-170.8	0	0	0	113.1	D232 N236 P237 I241 Y244	D232-H239 IonicContact OD1-CE1 3.52Å; N236-H239 PolarHBondContact ND2-NE2 2.94Å; N236-H239 WeakPolarHBondContact O-CB 3.02Å; N236-H239 PolarHBondContact O-N 3.46Å; P237-H239 PolarHBondContact O-N 2.89Å; H239-I241 VanDerWaalsContact C-N 3.26Å; H239-Y244 AromaticContact CD2-CD1 3.71Å; H239-Y244 AromaticContact CD2-CE1 3.84Å
240	L	90.4	Very high	92.7	Very high	151 Å²	151	51.9 Å²	51.9	79%	0.791	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-75	-17.7	170.8	-59.1	175.3	0	0	0	112.3	P237 L238 P242	P237-L240 VanDerWaalsContact O-CB 3.26Å; P237-L240 WeakPolarHBondContact O-CB 3.21Å; P237-L240 WeakPolarHBondContact O-CG 3.18Å; P237-L240 PolarHBondContact O-N 3.46Å; L238-L240 PolarHBondContact O-N 3.42Å; L238-L240 VanDerWaalsContact O-N 3.15Å; L240-P242 WeakPolarHBondContact O-CD 3.41Å
241	I	91.6	Very high	92.8	Very high	41 Å²	41	52 Å²	52	21%	0.21	28%	0.276	C	S	.	.	S	Bend	trans	-74.2	121.2	176.1	-58.5	173.8	0	0	0	108.1	F219 L238 H239 F243 Y244 F265	F219-I241 HydrophobicContact CE2-CD1 4.29Å; F219-I241 HydrophobicContact CZ-CD1 4.22Å; L238-I241 HydrophobicContact CD2-CD1 3.98Å; L238-I241 VanDerWaalsContact O-CB 3.28Å; L238-I241 WeakPolarHBondContact O-CB 3.39Å; L238-I241 WeakPolarHBondContact O-CG1 3.47Å; L238-I241 PolarHBondContact O-N 2.84Å; H239-I241 VanDerWaalsContact C-N 3.26Å; I241-F243 PolarHBondContact O-N 3.44Å; I241-Y244 VanDerWaalsContact O-CB 3.29Å; I241-Y244 WeakPolarHBondContact O-CB 3.17Å; I241-Y244 PolarHBondContact O-N 2.97Å; I241-F265 HydrophobicContact CG2-CE1 3.7Å
242	P	90.1	Very high	92.9	Very high	91 Å²	91	52.2 Å²	52.2	59%	0.591	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	136.3	180	-25.5	35.1	0	0	0	111.8	L240 Y244	L240-P242 WeakPolarHBondContact O-CD 3.41Å; P242-Y244 PolarHBondContact O-N 3.31Å
243	F	93.6	Very high	93.1	Very high	110 Å²	110	50.4 Å²	50.4	48%	0.482	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.8	14.8	178.5	-52.1	-85.6	0	0	0	115.7	I241 A245 T266 W267	I241-F243 PolarHBondContact O-N 3.44Å; F243-A245 PolarHBondContact O-N 2.93Å; F243-T266 PolarHBondContact O-N 3.14Å; F243-T266 PolarHBondContact O-OG1 2.89Å; F243-W267 AromaticContact CD2-CD1 3.89Å; F243-W267 AromaticContact CD2-NE1 3.23Å; F243-W267 AromaticContact CG-CD1 3.54Å; F243-W267 AromaticContact CG-NE1 3.29Å; F243-W267 VanDerWaalsContact CG-NE1 3.29Å
244	Y	96.3	Very high	93.3	Very high	24 Å²	24	48.1 Å²	48.1	9%	0.094	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-56	130.3	173.4	-176.3	-123.5	0	0	0	111.4	E223 D226 V227 L238 H239 I241 P242 T264	E223-Y244 HydrophobicContact CG-CE2 3.85Å; D226-Y244 WeakPolarHBondContact OD2-CE1 3.37Å; D226-Y244 PolarHBondContact OD2-OH 2.89Å; V227-Y244 HydrophobicContact CG1-CE2 4.09Å; V227-Y244 VanDerWaalsContact CG1-OH 3.29Å; V227-Y244 WeakPolarHBondContact CG1-OH 3.45Å; L238-Y244 HydrophobicContact CB-CD1 3.98Å; L238-Y244 HydrophobicContact CB-CE1 3.53Å; L238-Y244 HydrophobicContact CD1-CE1 4.33Å; L238-Y244 WeakPolarHBondContact CD1-OH 3.4Å; L238-Y244 WeakPolarHBondContact O-CD1 3.43Å; H239-Y244 AromaticContact CD2-CD1 3.71Å; H239-Y244 AromaticContact CD2-CE1 3.84Å; I241-Y244 VanDerWaalsContact O-CB 3.29Å; I241-Y244 WeakPolarHBondContact O-CB 3.17Å; I241-Y244 PolarHBondContact O-N 2.97Å; P242-Y244 PolarHBondContact O-N 3.31Å; Y244-T264 CarbonylContact C-O 3.57Å; Y244-T264 WeakPolarHBondContact CA-O 3.16Å; Y244-T264 HydrophobicContact CD2-CG2 4.16Å; Y244-T264 WeakPolarHBondContact CD2-O 3.33Å; Y244-T264 HydrophobicContact CE2-CG2 4.39Å
245	A	94.2	Very high	93.8	Very high	13 Å²	13	47 Å²	47	11%	0.107	24%	0.244	C	C	.	.			trans	-68.4	-49.2	-179.2	0	0	0	0	0	111.4	F243 F249 A262 T264 T266	F243-A245 PolarHBondContact O-N 2.93Å; A245-F249 HydrophobicContact CB-CB 4.15Å; A245-F249 HydrophobicContact CB-CD1 3.78Å; A245-F249 HydrophobicContact CB-CE1 4.39Å; A245-F249 HydrophobicContact CB-CG 4.09Å; A245-F249 WeakPolarHBondContact O-CB 3.39Å; A245-A262 HydrophobicContact CB-CB 4.36Å; A245-T264 PolarHBondContact N-O 3.32Å; A245-T266 HydrophobicContact CB-CG2 3.85Å
246	G	94.8	Very high	94.1	Very high	4 Å²	4	41.5 Å²	41.5	4%	0.041	22%	0.215	C	C	.	.	H	α-helix	trans	66.8	176.8	178	0	0	0	0	0	114.8	R248 F249 H250	G246-R248 PolarHBondContact O-N 3.17Å; G246-F249 PolarHBondContact O-N 2.84Å; G246-H250 PolarHBondContact O-N 3.37Å
247	A	95.6	Very high	94.2	Very high	2 Å²	2	43.6 Å²	43.6	2%	0.017	22%	0.223	C	C	.	.	H	α-helix	trans	-59.7	-41.2	-171.4	0	0	0	0	0	113.9	I83 D226 V227 Y231 F249 H250 D251	I83-A247 HydrophobicContact CD1-CB 3.75Å; D226-A247 WeakPolarHBondContact O-CB 3.33Å; V227-A247 WeakPolarHBondContact O-CA 3.1Å; Y231-A247 WeakPolarHBondContact O-CB 3.47Å; A247-F249 VanDerWaalsContact C-N 3.34Å; A247-F249 PolarHBondContact O-N 3.36Å; A247-H250 PolarHBondContact O-N 3.34Å; A247-D251 WeakPolarHBondContact O-CB 3.33Å; A247-D251 PolarHBondContact O-N 3.33Å
248	R	95.4	Very high	94.3	Very high	90 Å²	90	43 Å²	43	34%	0.34	22%	0.218	S	C	.	.	H	α-helix	trans	-64	-37.5	-178.8	-71.7	-170.1	179.2	-88	-12.7	113.6	I83 D232 G246 F252 Y278	I83-R248 HydrophobicContact CD1-CG 4.1Å; I83-R248 HydrophobicContact CG1-CG 4.32Å; D232-R248 HydrophobicContact CB-CG 4.03Å; D232-R248 VanDerWaalsContact CG-NE 3.35Å; D232-R248 IonicContact OD2-CZ 2.95Å; D232-R248 IonicContact OD2-NE 3.54Å; D232-R248 PolarHBondContact OD2-NE 3.4Å; D232-R248 IonicContact OD2-NH2 3.37Å; D232-R248 PolarHBondContact OD2-NH2 3.01Å; G246-R248 PolarHBondContact O-N 3.17Å; R248-F252 WeakPolarHBondContact O-CB 3.4Å; R248-F252 PolarHBondContact O-N 2.89Å; R248-F252 VanDerWaalsContact O-N 3.15Å; R248-Y278 WeakPolarHBondContact CB-OH 3.49Å
249	F	96.6	Very high	94.4	Very high	6 Å²	6	42.7 Å²	42.7	3%	0.026	22%	0.217	C	C	.	.	H	α-helix	trans	-69.3	-44	-177.4	-172.6	-90.3	0	0	0	110.2	A245 G246 A247 H253 N260 A262 T266 D269 D275 Y278	A245-F249 HydrophobicContact CB-CB 4.15Å; A245-F249 HydrophobicContact CB-CD1 3.78Å; A245-F249 HydrophobicContact CB-CE1 4.39Å; A245-F249 HydrophobicContact CB-CG 4.09Å; A245-F249 WeakPolarHBondContact O-CB 3.39Å; G246-F249 PolarHBondContact O-N 2.84Å; A247-F249 VanDerWaalsContact C-N 3.34Å; A247-F249 PolarHBondContact O-N 3.36Å; F249-H253 PolarHBondContact O-N 3.24Å; F249-N260 HydrophobicContact CD1-CB 3.86Å; F249-N260 WeakPolarHBondContact CD2-ND2 3.11Å; F249-N260 HydrophobicContact CE1-CB 3.45Å; F249-N260 VanDerWaalsContact CE1-CB 3.45Å; F249-N260 WeakPolarHBondContact CE1-ND2 3.47Å; F249-N260 HydrophobicContact CE2-CB 4.42Å; F249-N260 WeakPolarHBondContact CE2-ND2 3.32Å; F249-N260 WeakPolarHBondContact CG-ND2 3.37Å; F249-N260 HydrophobicContact CZ-CB 3.77Å; F249-N260 WeakPolarHBondContact CZ-ND2 3.33Å; F249-A262 HydrophobicContact CE1-CB 4.04Å; F249-T266 HydrophobicContact CD2-CG2 4.09Å; F249-T266 HydrophobicContact CE1-CG2 4.34Å; F249-T266 HydrophobicContact CE2-CG2 3.84Å; F249-T266 HydrophobicContact CG-CG2 4.44Å; F249-T266 HydrophobicContact CZ-CG2 3.98Å; F249-D269 HydrophobicContact CZ-CB 3.9Å; F249-D275 HydrophobicContact CE2-CB 3.9Å; F249-D275 HydrophobicContact CZ-CB 4.17Å; F249-Y278 AromaticContact CD2-CD1 3.69Å; F249-Y278 HydrophobicContact CD2-CD1 3.69Å; F249-Y278 AromaticContact CD2-CE1 3.72Å; F249-Y278 HydrophobicContact CD2-CE1 3.72Å; F249-Y278 HydrophobicContact CD2-CG 4.29Å; F249-Y278 HydrophobicContact CE2-CD1 4.09Å; F249-Y278 HydrophobicContact CE2-CE1 4.5Å
250	H	97.3	Very high	94.8	Very high	5 Å²	5	38.7 Å²	38.7	2%	0.023	20%	0.199	C	C	.	.	H	α-helix	trans	-77.2	-34.6	179.6	-160.7	70.9	0	0	0	112.8	V227 H228 G246 A247 F252 H253 H254	V227-H250 HydrophobicContact CB-CB 4.03Å; V227-H250 WeakPolarHBondContact O-CB 3.46Å; H228-H250 AromaticContact CD2-CD2 3.73Å; H228-H250 AromaticContact CD2-NE2 3.68Å; H228-H250 AromaticContact CE1-CD2 3.64Å; H228-H250 AromaticContact CE1-NE2 3.26Å; H228-H250 PolarHBondContact CE1-NE2 3.34Å; H228-H250 VanDerWaalsContact CE1-NE2 3.26Å; H228-H250 AromaticContact NE2-CD2 3.48Å; H228-H250 PolarHBondContact NE2-CD2 2.96Å; H228-H250 AromaticContact NE2-NE2 2.96Å; H228-H250 PolarHBondContact NE2-NE2 2.85Å; G246-H250 PolarHBondContact O-N 3.37Å; A247-H250 PolarHBondContact O-N 3.34Å; H250-F252 VanDerWaalsContact C-N 3.32Å; H250-F252 PolarHBondContact O-N 3.4Å; H250-H253 WeakPolarHBondContact O-CA 3.49Å; H250-H253 WeakPolarHBondContact O-CB 3.41Å; H250-H253 PolarHBondContact O-N 3.47Å; H250-H254 AromaticContact CD2-CD2 3.42Å; H250-H254 PolarHBondContact CD2-CD2 2.86Å; H250-H254 VanDerWaalsContact CD2-CD2 3.42Å; H250-H254 AromaticContact CD2-NE2 3.45Å; H250-H254 PolarHBondContact CD2-NE2 3.46Å; H250-H254 AromaticContact CE1-NE2 3.9Å; H250-H254 AromaticContact NE2-CD2 3.32Å; H250-H254 PolarHBondContact NE2-CD2 3.3Å; H250-H254 VanDerWaalsContact NE2-CD2 3.32Å; H250-H254 AromaticContact NE2-NE2 2.93Å; H250-H254 PolarHBondContact NE2-NE2 3.5Å; H250-H254 PolarHBondContact O-CD2 3.3Å; H250-H254 PolarHBondContact O-N 3.48Å
251	D	97	Very high	95.1	Very high	5 Å²	5	32.4 Å²	32.4	3%	0.027	16%	0.164	C	C	.	.	H	α-helix	trans	-59.6	-43.3	171.2	-177.9	-76.8	0	0	0	111.4	I83 Q84 P179 A247 H253 H254 M255	I83-D251 HydrophobicContact CD1-CB 3.98Å; I83-D251 HydrophobicContact CG2-CB 4.12Å; I83-D251 WeakPolarHBondContact CG2-OD1 3.35Å; Q84-D251 WeakPolarHBondContact CG-OD1 3.35Å; Q84-D251 PolarHBondContact NE2-OD1 2.83Å; Q84-D251 PolarHBondContact NE2-OD2 3.47Å; P179-D251 WeakPolarHBondContact CD-OD2 3.42Å; P179-D251 HydrophobicContact CG-CB 4.38Å; A247-D251 WeakPolarHBondContact O-CB 3.33Å; A247-D251 PolarHBondContact O-N 3.33Å; D251-H253 VanDerWaalsContact C-N 3.28Å; D251-H253 PolarHBondContact O-N 3.3Å; D251-H254 PolarHBondContact O-N 3.43Å; D251-M255 PolarHBondContact O-N 2.94Å
252	F	96.9	Very high	95.3	Very high	9 Å²	9	30.4 Å²	30.4	4%	0.039	15%	0.154	C	C	.	.	H	α-helix	trans	-62.1	-36.3	172.9	-178.6	-94.1	0	0	0	112.2	R248 H250 M255 N256 N260 Q277 Y278 Y281	R248-F252 WeakPolarHBondContact O-CB 3.4Å; R248-F252 PolarHBondContact O-N 2.89Å; R248-F252 VanDerWaalsContact O-N 3.15Å; H250-F252 VanDerWaalsContact C-N 3.32Å; H250-F252 PolarHBondContact O-N 3.4Å; F252-M255 HydrophobicContact CD2-CE 3.43Å; F252-M255 VanDerWaalsContact CD2-CE 3.43Å; F252-M255 HydrophobicContact CE2-CE 3.64Å; F252-M255 HydrophobicContact CG-CE 4.4Å; F252-M255 PolarHBondContact O-N 3.12Å; F252-N256 HydrophobicContact CD1-CB 4.1Å; F252-N256 HydrophobicContact CE1-CB 3.71Å; F252-N256 HydrophobicContact CE2-CB 4.43Å; F252-N256 HydrophobicContact CZ-CB 3.89Å; F252-N256 WeakPolarHBondContact O-CB 3.45Å; F252-N256 PolarHBondContact O-N 3.48Å; F252-N260 WeakPolarHBondContact CD1-OD1 3.47Å; F252-Q277 HydrophobicContact CE1-CB 4.01Å; F252-Q277 HydrophobicContact CZ-CB 4.03Å; F252-Y278 HydrophobicContact CB-CD2 3.6Å; F252-Y278 HydrophobicContact CB-CE2 3.89Å; F252-Y278 AromaticContact CD1-CD2 3.74Å; F252-Y278 HydrophobicContact CD1-CD2 3.74Å; F252-Y278 HydrophobicContact CD1-CG 4.26Å; F252-Y278 HydrophobicContact CD2-CD2 4.07Å; F252-Y278 HydrophobicContact CE1-CD2 4.45Å; F252-Y278 AromaticContact CG-CD2 3.53Å; F252-Y278 HydrophobicContact CG-CD2 3.53Å; F252-Y278 HydrophobicContact CG-CE2 4.28Å; F252-Y278 HydrophobicContact CG-CG 4.46Å; F252-Y281 AromaticContact CD2-CD1 3.95Å; F252-Y281 HydrophobicContact CD2-CD1 3.95Å; F252-Y281 HydrophobicContact CD2-CD2 4.16Å; F252-Y281 HydrophobicContact CD2-CE1 4.29Å; F252-Y281 HydrophobicContact CD2-CE2 4.45Å; F252-Y281 AromaticContact CD2-CG 3.87Å; F252-Y281 HydrophobicContact CD2-CG 3.87Å; F252-Y281 HydrophobicContact CE2-CD1 4.16Å; F252-Y281 AromaticContact CE2-CD2 3.8Å; F252-Y281 HydrophobicContact CE2-CD2 3.8Å; F252-Y281 HydrophobicContact CE2-CE2 4.45Å; F252-Y281 AromaticContact CE2-CG 3.6Å; F252-Y281 HydrophobicContact CE2-CG 3.6Å
253	H	97.5	Very high	95.4	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-59.2	-49.5	173.7	174.7	74.7	0	0	0	112	H157 H161 H174 F249 H250 D251 M255 N256 F257 G259 N260 Y261	H157-H253 AromaticContact CE1-CD2 3.85Å; H157-H253 AromaticContact CE1-CE1 3.62Å; H157-H253 AromaticContact CE1-NE2 3.27Å; H157-H253 PolarHBondContact CE1-NE2 3.44Å; H157-H253 VanDerWaalsContact CE1-NE2 3.27Å; H157-H253 AromaticContact NE2-CE1 3.57Å; H157-H253 AromaticContact NE2-NE2 3.07Å; H157-H253 PolarHBondContact NE2-NE2 3.01Å; H161-H253 AromaticContact CD2-CE1 3.77Å; H161-H253 AromaticContact CE1-CE1 3.49Å; H161-H253 PolarHBondContact CE1-CE1 3.09Å; H161-H253 VanDerWaalsContact CE1-CE1 3.49Å; H161-H253 AromaticContact CE1-NE2 3.5Å; H161-H253 AromaticContact NE2-CE1 2.99Å; H161-H253 PolarHBondContact NE2-CE1 3.3Å; H161-H253 AromaticContact NE2-NE2 2.95Å; H161-H253 PolarHBondContact NE2-NE2 3.35Å; H174-H253 AromaticContact CE1-CD2 3.41Å; H174-H253 PolarHBondContact CE1-CD2 3.2Å; H174-H253 VanDerWaalsContact CE1-CD2 3.41Å; H174-H253 AromaticContact CE1-NE2 3.13Å; H174-H253 PolarHBondContact CE1-NE2 3.35Å; H174-H253 AromaticContact NE2-CD2 3.74Å; H174-H253 AromaticContact NE2-NE2 3.13Å; H174-H253 PolarHBondContact NE2-NE2 3.42Å; H174-H253 VanDerWaalsContact NE2-NE2 3.13Å; F249-H253 PolarHBondContact O-N 3.24Å; H250-H253 WeakPolarHBondContact O-CA 3.49Å; H250-H253 WeakPolarHBondContact O-CB 3.41Å; H250-H253 PolarHBondContact O-N 3.47Å; D251-H253 VanDerWaalsContact C-N 3.28Å; D251-H253 PolarHBondContact O-N 3.3Å; H253-M255 PolarHBondContact O-N 2.81Å; H253-N256 PolarHBondContact O-N 2.75Å; H253-F257 WeakPolarHBondContact O-CA 3.33Å; H253-F257 PolarHBondContact O-N 2.94Å; H253-G259 PolarHBondContact CE1-O 3.46Å; H253-G259 PolarHBondContact ND1-O 2.96Å; H253-N260 HydrophobicContact CB-CB 3.84Å; H253-N260 PolarHBondContact ND1-O 3.44Å; H253-Y261 AromaticContact CE1-CD1 3.85Å; H253-Y261 AromaticContact CE1-CE1 3.94Å
254	H	96.6	Very high	95.5	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-62.6	-29.5	176.4	-82.8	-90.2	0	0	0	113.2	H173 H174 F176 P179 Q183 H228 H250 D251	H173-H254 AromaticContact CD2-CE1 3.51Å; H173-H254 AromaticContact CD2-NE2 3.97Å; H173-H254 AromaticContact CE1-CE1 3.9Å; H173-H254 AromaticContact NE2-CE1 3.23Å; H173-H254 PolarHBondContact NE2-CE1 3Å; H173-H254 AromaticContact NE2-NE2 3.3Å; H173-H254 PolarHBondContact NE2-NE2 2.76Å; H174-H254 AromaticContact ND1-ND1 3.96Å; F176-H254 PolarHBondContact O-ND1 3.07Å; P179-H254 HydrophobicContact CG-CB 4.39Å; Q183-H254 PolarHBondContact NE2-CE1 3.45Å; H228-H254 AromaticContact CD2-NE2 3.66Å; H228-H254 AromaticContact NE2-NE2 3.5Å; H228-H254 PolarHBondContact NE2-NE2 3Å; H250-H254 AromaticContact CD2-CD2 3.42Å; H250-H254 PolarHBondContact CD2-CD2 2.86Å; H250-H254 VanDerWaalsContact CD2-CD2 3.42Å; H250-H254 AromaticContact CD2-NE2 3.45Å; H250-H254 PolarHBondContact CD2-NE2 3.46Å; H250-H254 AromaticContact CE1-NE2 3.9Å; H250-H254 AromaticContact NE2-CD2 3.32Å; H250-H254 PolarHBondContact NE2-CD2 3.3Å; H250-H254 VanDerWaalsContact NE2-CD2 3.32Å; H250-H254 AromaticContact NE2-NE2 2.93Å; H250-H254 PolarHBondContact NE2-NE2 3.5Å; H250-H254 PolarHBondContact O-CD2 3.3Å; H250-H254 PolarHBondContact O-N 3.48Å; D251-H254 PolarHBondContact O-N 3.43Å
255	M	94.4	Very high	95.5	Very high	66 Å²	66	20 Å²	20	33%	0.325	10%	0.101	S	C	.	.	H	α-helix	trans	-79.7	-39.2	175.8	-175.6	-171.2	65.2	0	0	112.8	D251 F252 H253 F257 Y281	D251-M255 PolarHBondContact O-N 2.94Å; F252-M255 HydrophobicContact CD2-CE 3.43Å; F252-M255 VanDerWaalsContact CD2-CE 3.43Å; F252-M255 HydrophobicContact CE2-CE 3.64Å; F252-M255 HydrophobicContact CG-CE 4.4Å; F252-M255 PolarHBondContact O-N 3.12Å; H253-M255 PolarHBondContact O-N 2.81Å; M255-F257 WeakPolarHBondContact O-CD2 3.31Å; M255-F257 WeakPolarHBondContact O-CE2 3.13Å; M255-Y281 HydrophobicContact CE-CE2 4.22Å
256	N	93.6	Very high	95.6	Very high	46 Å²	46	20 Å²	20	25%	0.246	10%	0.099	C	C	.	.	H	α-helix	trans	-96.7	-20.9	-170.6	-165	60.1	0	0	0	113.7	F252 H253 V258 Q277	F252-N256 HydrophobicContact CD1-CB 4.1Å; F252-N256 HydrophobicContact CE1-CB 3.71Å; F252-N256 HydrophobicContact CE2-CB 4.43Å; F252-N256 HydrophobicContact CZ-CB 3.89Å; F252-N256 WeakPolarHBondContact O-CB 3.45Å; F252-N256 PolarHBondContact O-N 3.48Å; H253-N256 PolarHBondContact O-N 2.75Å; N256-V258 PolarHBondContact ND2-O 2.81Å; N256-V258 PolarHBondContact O-N 3.23Å; N256-Q277 VanDerWaalsContact ND2-CD 3.3Å; N256-Q277 PolarHBondContact ND2-OE1 3.01Å; N256-Q277 PolarHBondContact OD1-OE1 3.44Å
257	F	92.4	Very high	95.7	Very high	68 Å²	68	23.1 Å²	23.1	30%	0.298	11%	0.11	S	C	.	.			trans	59.6	-4	-178.4	-51.2	-89.7	0	0	0	116.1	H161 Y166 H174 T177 H253 M255	H161-F257 PolarHBondContact CE1-O 2.78Å; H161-F257 PolarHBondContact ND1-O 2.64Å; Y166-F257 WeakPolarHBondContact OH-CD1 3.27Å; H174-F257 HydrophobicContact CB-CD1 4.1Å; H174-F257 HydrophobicContact CB-CE1 3.92Å; H174-F257 AromaticContact CG-CD1 3.91Å; H174-F257 AromaticContact ND1-CD1 3.36Å; H174-F257 WeakPolarHBondContact ND1-CD1 3.38Å; H174-F257 AromaticContact ND1-CE1 3.74Å; T177-F257 HydrophobicContact CG2-CE1 4.31Å; T177-F257 HydrophobicContact CG2-CE2 4.43Å; T177-F257 HydrophobicContact CG2-CZ 3.59Å; H253-F257 WeakPolarHBondContact O-CA 3.33Å; H253-F257 PolarHBondContact O-N 2.94Å; M255-F257 WeakPolarHBondContact O-CD2 3.31Å; M255-F257 WeakPolarHBondContact O-CE2 3.13Å
258	V	93	Very high	95.8	Very high	78 Å²	78	26.1 Å²	26.1	47%	0.473	12%	0.121	S	C	.	.	S	Bend	trans	-137.4	128.7	-175.5	-176.8	0	0	0	0	110.2	N256	N256-V258 PolarHBondContact ND2-O 2.81Å; N256-V258 PolarHBondContact O-N 3.23Å
259	G	95.6	Very high	96	Very high	4 Å²	4	21.9 Å²	21.9	4%	0.041	10%	0.104	C	C	.	.	S	Bend	trans	87	-176.8	-173.7	0	0	0	0	0	112.4	H253 Y261 T274	H253-G259 PolarHBondContact CE1-O 3.46Å; H253-G259 PolarHBondContact ND1-O 2.96Å; G259-Y261 VanDerWaalsContact N-CZ 3.29Å; G259-Y261 PolarHBondContact N-OH 2.91Å; G259-Y261 VanDerWaalsContact N-OH 3.14Å; G259-Y261 PolarHBondContact O-N 2.84Å; G259-T274 CarbonylContact C-O 3.45Å; G259-T274 WeakPolarHBondContact CA-O 3.2Å
260	N	97.4	Very high	96	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.126	C	C	.	.			trans	54.7	54.1	174.8	-60.9	80.3	0	0	0	112.9	F249 F252 H253 D269 T274 Y278	F249-N260 HydrophobicContact CD1-CB 3.86Å; F249-N260 WeakPolarHBondContact CD2-ND2 3.11Å; F249-N260 HydrophobicContact CE1-CB 3.45Å; F249-N260 VanDerWaalsContact CE1-CB 3.45Å; F249-N260 WeakPolarHBondContact CE1-ND2 3.47Å; F249-N260 HydrophobicContact CE2-CB 4.42Å; F249-N260 WeakPolarHBondContact CE2-ND2 3.32Å; F249-N260 WeakPolarHBondContact CG-ND2 3.37Å; F249-N260 HydrophobicContact CZ-CB 3.77Å; F249-N260 WeakPolarHBondContact CZ-ND2 3.33Å; F252-N260 WeakPolarHBondContact CD1-OD1 3.47Å; H253-N260 HydrophobicContact CB-CB 3.84Å; H253-N260 PolarHBondContact ND1-O 3.44Å; N260-D269 WeakPolarHBondContact CA-OD1 3.42Å; N260-D269 PolarHBondContact N-OD1 3.22Å; N260-T274 PolarHBondContact N-O 2.93Å; N260-Y278 VanDerWaalsContact ND2-CB 3.27Å; N260-Y278 WeakPolarHBondContact ND2-CB 3.48Å
261	Y	97.6	Very high	96	Very high	18 Å²	18	32.8 Å²	32.8	7%	0.071	16%	0.157	C	C	.	.			trans	-89.4	-9	-171.8	-59.1	-66.2	0	0	0	114.3	Y154 H157 R158 H161 H253 G259 D269 T274	Y154-Y261 HydrophobicContact CE2-CD2 4.36Å; H157-Y261 PolarHBondContact ND1-O 2.99Å; R158-Y261 HydrophobicContact CB-CD1 4.31Å; R158-Y261 HydrophobicContact CB-CD2 3.99Å; R158-Y261 HydrophobicContact CB-CE2 4.26Å; R158-Y261 HydrophobicContact CB-CG 4.01Å; R158-Y261 HydrophobicContact CG-CD2 3.96Å; R158-Y261 HydrophobicContact CG-CE2 3.8Å; R158-Y261 HydrophobicContact CG-CG 4.44Å; H161-Y261 HydrophobicContact CB-CE1 3.9Å; H161-Y261 AromaticContact CD2-CD1 3.75Å; H161-Y261 AromaticContact CD2-CE1 3.43Å; H161-Y261 VanDerWaalsContact CD2-CE1 3.43Å; H161-Y261 WeakPolarHBondContact CD2-CE1 3.37Å; H161-Y261 AromaticContact CG-CE1 3.7Å; H253-Y261 AromaticContact CE1-CD1 3.85Å; H253-Y261 AromaticContact CE1-CE1 3.94Å; G259-Y261 VanDerWaalsContact N-CZ 3.29Å; G259-Y261 PolarHBondContact N-OH 2.91Å; G259-Y261 VanDerWaalsContact N-OH 3.14Å; G259-Y261 PolarHBondContact O-N 2.84Å; Y261-D269 PolarHBondContact N-OD1 3.16Å; Y261-D269 PolarHBondContact N-OD2 2.96Å; Y261-D269 VanDerWaalsContact N-OD2 3.14Å; Y261-T274 HydrophobicContact CD2-CG2 4.15Å; Y261-T274 HydrophobicContact CE2-CG2 4Å
262	A	95.3	Very high	96	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.174	C	C	.	.			trans	-55	139.7	176.6	0	0	0	0	0	111.4	A245 F249 F265 D269	A245-A262 HydrophobicContact CB-CB 4.36Å; F249-A262 HydrophobicContact CE1-CB 4.04Å; A262-F265 WeakPolarHBondContact CB-O 3.44Å; A262-D269 WeakPolarHBondContact CA-OD2 3.48Å; A262-D269 WeakPolarHBondContact CB-OD2 3.39Å; A262-D269 PolarHBondContact N-OD2 3.01Å
263	S	92.1	Very high	96.1	Very high	4 Å²	4	40.1 Å²	40.1	3%	0.028	20%	0.197	C	C	.	.	S	Bend	trans	-81.2	-60.5	163.6	-175	0	0	0	0	108.4	D150 R220	D150-S263 PolarHBondContact OD1-N 2.82Å; R220-S263 PolarHBondContact NH1-OG 3.29Å; R220-S263 PolarHBondContact NH2-OG 3.15Å
264	T	95.3	Very high	96.1	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.202	C	C	.	.	S	Bend	trans	-113.3	-51	-170	-54.5	0	0	0	0	112.3	D150 R220 E223 Y244 A245	D150-T264 PolarHBondContact OD1-N 3.49Å; R220-T264 PolarHBondContact NH1-OG1 3.3Å; E223-T264 HydrophobicContact CG-CG2 4.09Å; E223-T264 WeakPolarHBondContact OE1-CA 3.39Å; E223-T264 WeakPolarHBondContact OE1-CB 3.41Å; E223-T264 PolarHBondContact OE1-N 3.47Å; E223-T264 PolarHBondContact OE1-OG1 3.45Å; Y244-T264 CarbonylContact C-O 3.57Å; Y244-T264 WeakPolarHBondContact CA-O 3.16Å; Y244-T264 HydrophobicContact CD2-CG2 4.16Å; Y244-T264 WeakPolarHBondContact CD2-O 3.33Å; Y244-T264 HydrophobicContact CE2-CG2 4.39Å; A245-T264 PolarHBondContact N-O 3.32Å
265	F	97.5	Very high	96.1	Very high	3 Å²	3	41.5 Å²	41.5	1%	0.013	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-111.4	129.4	-172.3	-54.6	-72.3	0	0	0	111.7	F143 A146 V147 D150 I241 A262 W267	F143-F265 HydrophobicContact CD2-CZ 4.17Å; F143-F265 HydrophobicContact CE2-CE1 4.18Å; F143-F265 AromaticContact CE2-CZ 3.77Å; F143-F265 HydrophobicContact CE2-CZ 3.77Å; A146-F265 HydrophobicContact CB-CE2 3.91Å; A146-F265 HydrophobicContact CB-CZ 4.2Å; V147-F265 HydrophobicContact CG2-CE2 4.21Å; D150-F265 HydrophobicContact CB-CD2 3.88Å; D150-F265 PolarHBondContact OD1-N 2.87Å; I241-F265 HydrophobicContact CG2-CE1 3.7Å; A262-F265 WeakPolarHBondContact CB-O 3.44Å; F265-W267 HydrophobicContact CB-CD2 3.6Å; F265-W267 HydrophobicContact CB-CE3 3.92Å; F265-W267 HydrophobicContact CB-CG 3.92Å; F265-W267 HydrophobicContact CB-CH2 4.45Å; F265-W267 HydrophobicContact CB-CZ2 4.18Å; F265-W267 HydrophobicContact CB-CZ3 4.34Å; F265-W267 AromaticContact CD1-CE2 3.96Å; F265-W267 HydrophobicContact CD1-CH2 4.06Å; F265-W267 AromaticContact CD1-CZ2 3.65Å; F265-W267 HydrophobicContact CD1-CZ2 3.65Å; F265-W267 HydrophobicContact CD2-CE3 4.25Å; F265-W267 AromaticContact CD2-CH2 3.86Å; F265-W267 HydrophobicContact CD2-CH2 3.86Å; F265-W267 HydrophobicContact CD2-CZ2 4.25Å; F265-W267 AromaticContact CD2-CZ3 3.87Å; F265-W267 HydrophobicContact CD2-CZ3 3.87Å; F265-W267 HydrophobicContact CE1-CH2 4.23Å; F265-W267 HydrophobicContact CE1-CZ2 4.04Å; F265-W267 HydrophobicContact CE2-CH2 4.05Å; F265-W267 HydrophobicContact CE2-CZ3 4.35Å; F265-W267 HydrophobicContact CG-CD2 4.08Å; F265-W267 AromaticContact CG-CE2 3.87Å; F265-W267 HydrophobicContact CG-CE3 4.16Å; F265-W267 AromaticContact CG-CH2 3.87Å; F265-W267 HydrophobicContact CG-CH2 3.87Å; F265-W267 AromaticContact CG-CZ2 3.77Å; F265-W267 HydrophobicContact CG-CZ2 3.77Å; F265-W267 HydrophobicContact CG-CZ3 4.07Å; F265-W267 HydrophobicContact CZ-CH2 4.24Å; F265-W267 HydrophobicContact CZ-CZ2 4.5Å; F265-W267 PolarHBondContact O-N 3.37Å
266	T	96.8	Very high	96.1	Very high	11 Å²	11	41.4 Å²	41.4	7%	0.067	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	8.4	177.4	55.4	0	0	0	0	114.2	F243 A245 F249 D269 K270	F243-T266 PolarHBondContact O-N 3.14Å; F243-T266 PolarHBondContact O-OG1 2.89Å; A245-T266 HydrophobicContact CB-CG2 3.85Å; F249-T266 HydrophobicContact CD2-CG2 4.09Å; F249-T266 HydrophobicContact CE1-CG2 4.34Å; F249-T266 HydrophobicContact CE2-CG2 3.84Å; F249-T266 HydrophobicContact CG-CG2 4.44Å; F249-T266 HydrophobicContact CZ-CG2 3.98Å; T266-D269 PolarHBondContact O-N 3.04Å; T266-K270 WeakPolarHBondContact O-CB 3.27Å; T266-K270 WeakPolarHBondContact O-CG 3.37Å; T266-K270 PolarHBondContact O-N 3.29Å
267	W	96.4	Very high	96.2	Very high	71 Å²	71	43.5 Å²	43.5	27%	0.269	21%	0.214	S	C	.	.	H	α-helix	trans	-59.2	-53.2	-175.3	-57.4	-24	0	0	0	111.9	F143 V147 F243 F265 D269 K270 L271	F143-W267 HydrophobicContact CE2-CH2 4.45Å; F143-W267 HydrophobicContact CZ-CH2 4.07Å; V147-W267 HydrophobicContact CB-CZ3 4.41Å; V147-W267 HydrophobicContact CG1-CZ3 4.1Å; V147-W267 HydrophobicContact CG2-CH2 3.75Å; V147-W267 HydrophobicContact CG2-CZ3 3.75Å; F243-W267 AromaticContact CD2-CD1 3.89Å; F243-W267 AromaticContact CD2-NE1 3.23Å; F243-W267 AromaticContact CG-CD1 3.54Å; F243-W267 AromaticContact CG-NE1 3.29Å; F243-W267 VanDerWaalsContact CG-NE1 3.29Å; F265-W267 HydrophobicContact CB-CD2 3.6Å; F265-W267 HydrophobicContact CB-CE3 3.92Å; F265-W267 HydrophobicContact CB-CG 3.92Å; F265-W267 HydrophobicContact CB-CH2 4.45Å; F265-W267 HydrophobicContact CB-CZ2 4.18Å; F265-W267 HydrophobicContact CB-CZ3 4.34Å; F265-W267 AromaticContact CD1-CE2 3.96Å; F265-W267 HydrophobicContact CD1-CH2 4.06Å; F265-W267 AromaticContact CD1-CZ2 3.65Å; F265-W267 HydrophobicContact CD1-CZ2 3.65Å; F265-W267 HydrophobicContact CD2-CE3 4.25Å; F265-W267 AromaticContact CD2-CH2 3.86Å; F265-W267 HydrophobicContact CD2-CH2 3.86Å; F265-W267 HydrophobicContact CD2-CZ2 4.25Å; F265-W267 AromaticContact CD2-CZ3 3.87Å; F265-W267 HydrophobicContact CD2-CZ3 3.87Å; F265-W267 HydrophobicContact CE1-CH2 4.23Å; F265-W267 HydrophobicContact CE1-CZ2 4.04Å; F265-W267 HydrophobicContact CE2-CH2 4.05Å; F265-W267 HydrophobicContact CE2-CZ3 4.35Å; F265-W267 HydrophobicContact CG-CD2 4.08Å; F265-W267 AromaticContact CG-CE2 3.87Å; F265-W267 HydrophobicContact CG-CE3 4.16Å; F265-W267 AromaticContact CG-CH2 3.87Å; F265-W267 HydrophobicContact CG-CH2 3.87Å; F265-W267 AromaticContact CG-CZ2 3.77Å; F265-W267 HydrophobicContact CG-CZ2 3.77Å; F265-W267 HydrophobicContact CG-CZ3 4.07Å; F265-W267 HydrophobicContact CZ-CH2 4.24Å; F265-W267 HydrophobicContact CZ-CZ2 4.5Å; F265-W267 PolarHBondContact O-N 3.37Å; W267-D269 VanDerWaalsContact C-N 3.34Å; W267-D269 PolarHBondContact O-N 2.99Å; W267-K270 PolarHBondContact O-N 3Å; W267-L271 WeakPolarHBondContact O-CB 3.48Å; W267-L271 VanDerWaalsContact O-CG 3.22Å; W267-L271 WeakPolarHBondContact O-CG 3.15Å; W267-L271 PolarHBondContact O-N 3.47Å
268	W	98.1	Very high	96.4	Very high	65 Å²	65	41.5 Å²	41.5	25%	0.246	21%	0.205	C	C	.	.	H	α-helix	trans	-66.6	-38.1	-177.8	-66.2	113.8	0	0	0	111.9	T151 Y154 F155 L271 L272	T151-W268 HydrophobicContact CG2-CH2 4.44Å; T151-W268 HydrophobicContact CG2-CZ2 3.54Å; T151-W268 PolarHBondContact OG1-NE1 2.83Å; T151-W268 VanDerWaalsContact OG1-NE1 3.12Å; Y154-W268 HydrophobicContact CD1-CB 3.57Å; Y154-W268 AromaticContact CD1-CG 3.99Å; Y154-W268 HydrophobicContact CD1-CG 3.99Å; Y154-W268 HydrophobicContact CD2-CB 3.35Å; Y154-W268 HydrophobicContact CD2-CG 4.27Å; Y154-W268 HydrophobicContact CE1-CB 3.81Å; Y154-W268 HydrophobicContact CE2-CB 3.54Å; Y154-W268 HydrophobicContact CG-CB 3.37Å; Y154-W268 AromaticContact CG-CG 3.87Å; Y154-W268 HydrophobicContact CG-CG 3.87Å; F155-W268 HydrophobicContact CE2-CD2 4.24Å; F155-W268 HydrophobicContact CE2-CE3 4.15Å; F155-W268 HydrophobicContact CE2-CH2 4.22Å; F155-W268 HydrophobicContact CE2-CZ2 4.31Å; F155-W268 HydrophobicContact CE2-CZ3 4.14Å; F155-W268 HydrophobicContact CZ-CD2 4.38Å; F155-W268 AromaticContact CZ-CE3 3.89Å; F155-W268 HydrophobicContact CZ-CE3 3.89Å; F155-W268 HydrophobicContact CZ-CH2 4.39Å; F155-W268 AromaticContact CZ-CZ3 3.9Å; F155-W268 HydrophobicContact CZ-CZ3 3.9Å; W268-L271 HydrophobicContact CE3-CD1 4.32Å; W268-L271 HydrophobicContact CZ3-CD1 4.5Å; W268-L271 PolarHBondContact O-N 2.88Å; W268-L272 HydrophobicContact CE3-CD1 4.49Å; W268-L272 VanDerWaalsContact O-CB 3.32Å; W268-L272 WeakPolarHBondContact O-CB 3.42Å; W268-L272 PolarHBondContact O-N 2.96Å
269	D	98.1	Very high	96.5	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62.3	-44	175.4	-81.2	-70.2	0	0	0	112.5	Y154 F249 N260 Y261 A262 T266 W267 N273 T274 D275	Y154-D269 HydrophobicContact CE2-CB 4.41Å; F249-D269 HydrophobicContact CZ-CB 3.9Å; N260-D269 WeakPolarHBondContact CA-OD1 3.42Å; N260-D269 PolarHBondContact N-OD1 3.22Å; Y261-D269 PolarHBondContact N-OD1 3.16Å; Y261-D269 PolarHBondContact N-OD2 2.96Å; Y261-D269 VanDerWaalsContact N-OD2 3.14Å; A262-D269 WeakPolarHBondContact CA-OD2 3.48Å; A262-D269 WeakPolarHBondContact CB-OD2 3.39Å; A262-D269 PolarHBondContact N-OD2 3.01Å; T266-D269 PolarHBondContact O-N 3.04Å; W267-D269 VanDerWaalsContact C-N 3.34Å; W267-D269 PolarHBondContact O-N 2.99Å; D269-N273 CarbonylContact O-C 3.52Å; D269-N273 VanDerWaalsContact O-CA 3.3Å; D269-N273 WeakPolarHBondContact O-CA 3.22Å; D269-N273 PolarHBondContact O-N 2.88Å; D269-T274 VanDerWaalsContact CA-OG1 3.3Å; D269-T274 WeakPolarHBondContact CA-OG1 3.18Å; D269-T274 PolarHBondContact O-N 3.29Å; D269-T274 VanDerWaalsContact OD1-CB 3.3Å; D269-T274 WeakPolarHBondContact OD1-CB 3.46Å; D269-T274 PolarHBondContact OD1-OG1 2.85Å; D269-D275 HydrophobicContact CB-CB 4.15Å
270	K	96.8	Very high	96.5	Very high	108 Å²	108	46.5 Å²	46.5	47%	0.47	22%	0.222	S	C	.	.	H	α-helix	trans	-65.6	-44.5	176.2	-72.4	177.2	-178.7	-171	0	112	T266 W267 L272 N273 D275	T266-K270 WeakPolarHBondContact O-CB 3.27Å; T266-K270 WeakPolarHBondContact O-CG 3.37Å; T266-K270 PolarHBondContact O-N 3.29Å; W267-K270 PolarHBondContact O-N 3Å; K270-L272 VanDerWaalsContact C-N 3.35Å; K270-L272 PolarHBondContact O-N 2.89Å; K270-N273 PolarHBondContact O-N 3.43Å; K270-D275 WeakPolarHBondContact CG-OD2 3.44Å
271	L	97.9	Very high	96.3	Very high	132 Å²	132	49.7 Å²	49.7	69%	0.691	23%	0.234	S	C	*	.	H	α-helix	trans	-65.4	-37.9	-179.1	-73.1	172.4	0	0	0	112.5	W267 W268	W267-L271 WeakPolarHBondContact O-CB 3.48Å; W267-L271 VanDerWaalsContact O-CG 3.22Å; W267-L271 WeakPolarHBondContact O-CG 3.15Å; W267-L271 PolarHBondContact O-N 3.47Å; W268-L271 HydrophobicContact CE3-CD1 4.32Å; W268-L271 HydrophobicContact CZ3-CD1 4.5Å; W268-L271 PolarHBondContact O-N 2.88Å
272	L	97.8	Very high	96	Very high	73 Å²	73	52 Å²	52	38%	0.382	25%	0.247	S	C	.	.	H	α-helix	trans	-102.5	7.8	-176.9	-60.9	171.5	0	0	0	113	Y154 F155 W268 K270 T274	Y154-L272 HydrophobicContact CD1-CD1 4.44Å; Y154-L272 HydrophobicContact CE1-CD1 3.38Å; Y154-L272 WeakPolarHBondContact OH-CB 3.24Å; Y154-L272 WeakPolarHBondContact OH-CD1 3.46Å; F155-L272 HydrophobicContact CE1-CD1 4.02Å; F155-L272 HydrophobicContact CZ-CD1 4.36Å; W268-L272 HydrophobicContact CE3-CD1 4.49Å; W268-L272 VanDerWaalsContact O-CB 3.32Å; W268-L272 WeakPolarHBondContact O-CB 3.42Å; W268-L272 PolarHBondContact O-N 2.96Å; K270-L272 VanDerWaalsContact C-N 3.35Å; K270-L272 PolarHBondContact O-N 2.89Å; L272-T274 VanDerWaalsContact C-N 3.3Å; L272-T274 PolarHBondContact O-N 3.27Å
273	N	97.1	Very high	95.8	Very high	96 Å²	96	58.6 Å²	58.6	51%	0.513	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.5	35	172	-151.7	22.4	0	0	0	113.7	D269 K270 N276	D269-N273 CarbonylContact O-C 3.52Å; D269-N273 VanDerWaalsContact O-CA 3.3Å; D269-N273 WeakPolarHBondContact O-CA 3.22Å; D269-N273 PolarHBondContact O-N 2.88Å; K270-N273 PolarHBondContact O-N 3.43Å; N273-N276 PolarHBondContact ND2-ND2 3.3Å; N273-N276 PolarHBondContact O-ND2 3.2Å; N273-N276 PolarHBondContact OD1-ND2 3.42Å; N273-N276 PolarHBondContact OD1-OD1 3.48Å
274	T	97.4	Very high	95.6	Very high	19 Å²	19	65.9 Å²	65.9	12%	0.117	31%	0.31	C	S	.	.			trans	-94.8	3.6	-178.9	48.8	0	0	0	0	113.9	Y154 G259 N260 Y261 D269 L272	Y154-T274 PolarHBondContact OH-OG1 3.19Å; G259-T274 CarbonylContact C-O 3.45Å; G259-T274 WeakPolarHBondContact CA-O 3.2Å; N260-T274 PolarHBondContact N-O 2.93Å; Y261-T274 HydrophobicContact CD2-CG2 4.15Å; Y261-T274 HydrophobicContact CE2-CG2 4Å; D269-T274 VanDerWaalsContact CA-OG1 3.3Å; D269-T274 WeakPolarHBondContact CA-OG1 3.18Å; D269-T274 PolarHBondContact O-N 3.29Å; D269-T274 VanDerWaalsContact OD1-CB 3.3Å; D269-T274 WeakPolarHBondContact OD1-CB 3.46Å; D269-T274 PolarHBondContact OD1-OG1 2.85Å; L272-T274 VanDerWaalsContact C-N 3.3Å; L272-T274 PolarHBondContact O-N 3.27Å
275	D	96.9	Very high	95	Very high	10 Å²	10	69.5 Å²	69.5	5%	0.053	33%	0.326	C	S	.	.			trans	-101.8	0	172.6	63.8	-17.7	0	0	0	114.2	F249 D269 K270 Q277 Y278 N279	F249-D275 HydrophobicContact CE2-CB 3.9Å; F249-D275 HydrophobicContact CZ-CB 4.17Å; D269-D275 HydrophobicContact CB-CB 4.15Å; K270-D275 WeakPolarHBondContact CG-OD2 3.44Å; D275-Q277 VanDerWaalsContact C-N 3.28Å; D275-Q277 PolarHBondContact O-N 2.97Å; D275-Q277 VanDerWaalsContact O-N 3.15Å; D275-Y278 WeakPolarHBondContact O-CA 3.24Å; D275-Y278 WeakPolarHBondContact O-CB 3.45Å; D275-Y278 PolarHBondContact O-N 3.18Å; D275-N279 VanDerWaalsContact CG-ND2 3.34Å; D275-N279 PolarHBondContact O-N 3.34Å; D275-N279 PolarHBondContact O-ND2 2.89Å; D275-N279 PolarHBondContact OD2-ND2 3.22Å; D275-N279 VanDerWaalsContact OD2-ND2 3.15Å
276	N	95.8	Very high	93.6	Very high	64 Å²	64	71 Å²	71	34%	0.342	34%	0.343	S	S	.	.	H	α-helix	trans	-50.8	-41.4	-178.3	-84.7	-41.3	0	0	0	115.5	N273 Y278 N279 K280	N273-N276 PolarHBondContact ND2-ND2 3.3Å; N273-N276 PolarHBondContact O-ND2 3.2Å; N273-N276 PolarHBondContact OD1-ND2 3.42Å; N273-N276 PolarHBondContact OD1-OD1 3.48Å; N276-Y278 VanDerWaalsContact C-N 3.31Å; N276-N279 PolarHBondContact O-N 3.28Å; N276-K280 WeakPolarHBondContact O-CG 3.44Å; N276-K280 PolarHBondContact O-N 2.9Å; N276-K280 VanDerWaalsContact O-N 3.09Å
277	Q	95.8	Very high	91.7	Very high	89 Å²	89	72.1 Å²	72.1	42%	0.416	36%	0.356	S	S	.	.	H	α-helix	trans	-69.3	-36.9	-178.3	-66.3	-173.2	64.7	0	0	110.8	F252 N256 D275 Y281	F252-Q277 HydrophobicContact CE1-CB 4.01Å; F252-Q277 HydrophobicContact CZ-CB 4.03Å; N256-Q277 VanDerWaalsContact ND2-CD 3.3Å; N256-Q277 PolarHBondContact ND2-OE1 3.01Å; N256-Q277 PolarHBondContact OD1-OE1 3.44Å; D275-Q277 VanDerWaalsContact C-N 3.28Å; D275-Q277 PolarHBondContact O-N 2.97Å; D275-Q277 VanDerWaalsContact O-N 3.15Å; Q277-Y281 WeakPolarHBondContact O-CB 3.38Å; Q277-Y281 PolarHBondContact O-N 3.38Å
278	Y	95.9	Very high	89.6	Confident	26 Å²	26	76.6 Å²	76.6	10%	0.102	38%	0.378	C	S	.	.	H	α-helix	trans	-66.6	-44.8	174.6	-178.9	-111.5	0	0	0	111.7	R248 F249 F252 N260 D275 N276 K280 Y281 L282	R248-Y278 WeakPolarHBondContact CB-OH 3.49Å; F249-Y278 AromaticContact CD2-CD1 3.69Å; F249-Y278 HydrophobicContact CD2-CD1 3.69Å; F249-Y278 AromaticContact CD2-CE1 3.72Å; F249-Y278 HydrophobicContact CD2-CE1 3.72Å; F249-Y278 HydrophobicContact CD2-CG 4.29Å; F249-Y278 HydrophobicContact CE2-CD1 4.09Å; F249-Y278 HydrophobicContact CE2-CE1 4.5Å; F252-Y278 HydrophobicContact CB-CD2 3.6Å; F252-Y278 HydrophobicContact CB-CE2 3.89Å; F252-Y278 AromaticContact CD1-CD2 3.74Å; F252-Y278 HydrophobicContact CD1-CD2 3.74Å; F252-Y278 HydrophobicContact CD1-CG 4.26Å; F252-Y278 HydrophobicContact CD2-CD2 4.07Å; F252-Y278 HydrophobicContact CE1-CD2 4.45Å; F252-Y278 AromaticContact CG-CD2 3.53Å; F252-Y278 HydrophobicContact CG-CD2 3.53Å; F252-Y278 HydrophobicContact CG-CE2 4.28Å; F252-Y278 HydrophobicContact CG-CG 4.46Å; N260-Y278 VanDerWaalsContact ND2-CB 3.27Å; N260-Y278 WeakPolarHBondContact ND2-CB 3.48Å; D275-Y278 WeakPolarHBondContact O-CA 3.24Å; D275-Y278 WeakPolarHBondContact O-CB 3.45Å; D275-Y278 PolarHBondContact O-N 3.18Å; N276-Y278 VanDerWaalsContact C-N 3.31Å; Y278-K280 PolarHBondContact O-N 3.5Å; Y278-Y281 HydrophobicContact CD2-CD1 4.45Å; Y278-Y281 WeakPolarHBondContact O-CA 3.43Å; Y278-Y281 WeakPolarHBondContact O-CB 3.34Å; Y278-Y281 PolarHBondContact O-N 3.36Å; Y278-L282 HydrophobicContact CD1-CD1 4.01Å; Y278-L282 HydrophobicContact CD1-CG 4.42Å; Y278-L282 HydrophobicContact CE1-CD1 3.49Å; Y278-L282 VanDerWaalsContact CE1-CD1 3.49Å; Y278-L282 HydrophobicContact CE1-CG 4.08Å; Y278-L282 HydrophobicContact CE2-CD2 4.27Å; Y278-L282 HydrophobicContact CE2-CG 4.33Å; Y278-L282 WeakPolarHBondContact O-CG 3.42Å; Y278-L282 PolarHBondContact O-N 2.81Å
279	N	95	Very high	87.2	Confident	59 Å²	59	82.2 Å²	82.2	32%	0.316	40%	0.404	S	S	.	.	H	α-helix	trans	-59.3	-45.4	176.7	-66.7	-30.7	0	0	0	111.5	D275 N276 Y281 L282 E283	D275-N279 VanDerWaalsContact CG-ND2 3.34Å; D275-N279 PolarHBondContact O-N 3.34Å; D275-N279 PolarHBondContact O-ND2 2.89Å; D275-N279 PolarHBondContact OD2-ND2 3.22Å; D275-N279 VanDerWaalsContact OD2-ND2 3.15Å; N276-N279 PolarHBondContact O-N 3.28Å; N279-Y281 VanDerWaalsContact C-N 3.3Å; N279-Y281 PolarHBondContact O-N 2.96Å; N279-L282 PolarHBondContact O-N 3.38Å; N279-E283 WeakPolarHBondContact O-CG 3.4Å; N279-E283 PolarHBondContact O-N 2.97Å
280	K	94.5	Very high	84.6	Confident	129 Å²	129	90.6 Å²	90.6	56%	0.561	44%	0.443	S	S	*	.	H	α-helix	trans	-63.1	-34	173.6	-71.7	176.5	-178.1	179.4	0	113.3	N276 Y278 K284	N276-K280 WeakPolarHBondContact O-CG 3.44Å; N276-K280 PolarHBondContact O-N 2.9Å; N276-K280 VanDerWaalsContact O-N 3.09Å; Y278-K280 PolarHBondContact O-N 3.5Å; K280-K284 WeakPolarHBondContact O-CG 3.36Å; K280-K284 PolarHBondContact O-N 3.46Å
281	Y	93.2	Very high	81.6	Confident	66 Å²	66	96.3 Å²	96.3	26%	0.259	47%	0.472	S	S	.	.	H	α-helix	trans	-66.3	-44.3	175.2	168.5	-93.8	0	0	0	111.1	F252 M255 Q277 Y278 N279 K284 Q285	F252-Y281 AromaticContact CD2-CD1 3.95Å; F252-Y281 HydrophobicContact CD2-CD1 3.95Å; F252-Y281 HydrophobicContact CD2-CD2 4.16Å; F252-Y281 HydrophobicContact CD2-CE1 4.29Å; F252-Y281 HydrophobicContact CD2-CE2 4.45Å; F252-Y281 AromaticContact CD2-CG 3.87Å; F252-Y281 HydrophobicContact CD2-CG 3.87Å; F252-Y281 HydrophobicContact CE2-CD1 4.16Å; F252-Y281 AromaticContact CE2-CD2 3.8Å; F252-Y281 HydrophobicContact CE2-CD2 3.8Å; F252-Y281 HydrophobicContact CE2-CE2 4.45Å; F252-Y281 AromaticContact CE2-CG 3.6Å; F252-Y281 HydrophobicContact CE2-CG 3.6Å; M255-Y281 HydrophobicContact CE-CE2 4.22Å; Q277-Y281 WeakPolarHBondContact O-CB 3.38Å; Q277-Y281 PolarHBondContact O-N 3.38Å; Y278-Y281 HydrophobicContact CD2-CD1 4.45Å; Y278-Y281 WeakPolarHBondContact O-CA 3.43Å; Y278-Y281 WeakPolarHBondContact O-CB 3.34Å; Y278-Y281 PolarHBondContact O-N 3.36Å; N279-Y281 VanDerWaalsContact C-N 3.3Å; N279-Y281 PolarHBondContact O-N 2.96Å; Y281-K284 PolarHBondContact O-N 3.41Å; Y281-Q285 HydrophobicContact CE1-CG 4.23Å; Y281-Q285 HydrophobicContact CE2-CG 4.42Å; Y281-Q285 PolarHBondContact O-N 3.02Å; Y281-Q285 PolarHBondContact OH-NE2 2.98Å
282	L	91.6	Very high	80.8	Confident	66 Å²	66	94.6 Å²	94.6	35%	0.346	46%	0.461	S	S	.	.	H	α-helix	trans	-62.5	-44	176.5	-68.9	-178.4	0	0	0	112.2	Y278 N279 K284 Q285 G286	Y278-L282 HydrophobicContact CD1-CD1 4.01Å; Y278-L282 HydrophobicContact CD1-CG 4.42Å; Y278-L282 HydrophobicContact CE1-CD1 3.49Å; Y278-L282 VanDerWaalsContact CE1-CD1 3.49Å; Y278-L282 HydrophobicContact CE1-CG 4.08Å; Y278-L282 HydrophobicContact CE2-CD2 4.27Å; Y278-L282 HydrophobicContact CE2-CG 4.33Å; Y278-L282 WeakPolarHBondContact O-CG 3.42Å; Y278-L282 PolarHBondContact O-N 2.81Å; N279-L282 PolarHBondContact O-N 3.38Å; L282-K284 VanDerWaalsContact C-N 3.31Å; L282-K284 PolarHBondContact O-N 3.04Å; L282-Q285 PolarHBondContact O-N 2.89Å; L282-Q285 VanDerWaalsContact O-N 3.11Å; L282-G286 PolarHBondContact O-N 3.09Å
283	E	91.4	Very high	79.9	Confident	140 Å²	140	95.7 Å²	95.7	65%	0.654	47%	0.465	S	S	*	.	H	α-helix	trans	-56.5	-45.2	175.5	-73	170.5	-177.9	0	0	111.8	N279 Q285 G286 G287	N279-E283 WeakPolarHBondContact O-CG 3.4Å; N279-E283 PolarHBondContact O-N 2.97Å; E283-Q285 VanDerWaalsContact C-N 3.31Å; E283-Q285 PolarHBondContact O-N 3.08Å; E283-G286 PolarHBondContact O-N 2.87Å; E283-G287 PolarHBondContact O-N 3.19Å
284	K	88.8	Confident	78.9	Confident	157 Å²	157	95.7 Å²	95.7	68%	0.683	46%	0.462	S	S	*	.	H	α-helix	trans	-65.6	-32.2	177.3	-73.7	177.4	-179.3	-178.3	0	113.1	K280 Y281 L282 K288	K280-K284 WeakPolarHBondContact O-CG 3.36Å; K280-K284 PolarHBondContact O-N 3.46Å; Y281-K284 PolarHBondContact O-N 3.41Å; L282-K284 VanDerWaalsContact C-N 3.31Å; L282-K284 PolarHBondContact O-N 3.04Å; K284-K288 WeakPolarHBondContact O-CG 3.29Å
285	Q	81.3	Confident	77.8	Confident	75 Å²	75	100.2 Å²	100.2	35%	0.35	48%	0.482	S	S	.	.	H	α-helix	trans	-78	-37.8	176.1	-72.1	-146.2	-15.4	0	0	112.7	Y281 L282 E283 K288 K289	Y281-Q285 HydrophobicContact CE1-CG 4.23Å; Y281-Q285 HydrophobicContact CE2-CG 4.42Å; Y281-Q285 PolarHBondContact O-N 3.02Å; Y281-Q285 PolarHBondContact OH-NE2 2.98Å; L282-Q285 PolarHBondContact O-N 2.89Å; L282-Q285 VanDerWaalsContact O-N 3.11Å; E283-Q285 VanDerWaalsContact C-N 3.31Å; E283-Q285 PolarHBondContact O-N 3.08Å; Q285-K288 PolarHBondContact O-N 2.87Å; Q285-K289 PolarHBondContact O-N 3.22Å
286	G	69.1	Low	76.7	Confident	35 Å²	35	105.8 Å²	105.8	36%	0.361	51%	0.509	S	S	.	.	H	α-helix	trans	-61.5	-48.3	174.6	0	0	0	0	0	111.6	L282 E283 K288 K289	L282-G286 PolarHBondContact O-N 3.09Å; E283-G286 PolarHBondContact O-N 2.87Å; G286-K288 PolarHBondContact O-N 2.78Å; G286-K289 PolarHBondContact O-N 3.13Å
287	G	56.1	Low	75.4	Confident	34 Å²	34	108.6 Å²	108.6	35%	0.351	52%	0.52	S	S	.	.	H	α-helix	trans	-65.5	-18.4	177.7	0	0	0	0	0	115	E283	E283-G287 PolarHBondContact O-N 3.19Å
288	K	53.8	Low	73.9	Confident	166 Å²	166	110 Å²	110	72%	0.722	53%	0.528	S	S	*	.	H	α-helix	trans	-83.4	-16.4	173.1	-81.1	-177.5	177.3	-172.7	0	114	K284 Q285 G286	K284-K288 WeakPolarHBondContact O-CG 3.29Å; Q285-K288 PolarHBondContact O-N 2.87Å; G286-K288 PolarHBondContact O-N 2.78Å
289	K	46	Very low	72.2	Confident	182 Å²	182	116.5 Å²	116.5	79%	0.791	56%	0.56	S	S	*	*	H	α-helix	trans	-88.4	-15.3	175.2	-75.2	-177	176.4	179	0	112.8	Q285 G286	Q285-K289 PolarHBondContact O-N 3.22Å; G286-K289 PolarHBondContact O-N 3.13Å
290	E	43.5	Very low	70.3	Confident	176 Å²	176	121.3 Å²	121.3	82%	0.822	58%	0.581	S	S	*	*			trans	-97.6	1.1	-179.4	-66.9	179.7	169.4	0	0	113.7
291	Q	34.8	Very low	68.1	Low	229 Å²	229	120.5 Å²	120.5	100%	1.07	58%	0.583	S	S	*	*			trans	-111.4	0	172.1	-69.7	-177.8	5.2	0	0	110.5

Retrieved 291 of 291 residues in 256.4 ms (Link to these results)

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