A0A096MVS4_PAPAN Loading...

Polyprenal reductase

Plays a key role in early steps of protein N-linked glycosylation by being involved in the conversion of polyprenol into dolichol. Acts as a polyprenal reductase that mediates the reduction of polyprenal into dolichal in a NADP-dependent mechanism. Dolichols are required for the synthesis of dolichol-linked monosaccharides and the oligosaccharide precursor used for N-glycosylation. Also able to convert testosterone (T) into 5-alpha-dihydrotestosterone (DHT).

AlphaFold DB , UniProt , Accession A0A096MVS4, Species PAPAN (Papio anubis, Olive baboon), Gene SRD5A3, Length 318 aa.

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(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	41.2	Very low	42.5	Very low	224 Å²	224	110.5 Å²	110.5	100%	1.103	62%	0.621	S	S	*	*				0	131.6	0	-82.7	165.1	174.8	0	0	107.6
2	A	34.9	Very low	45.1	Very low	39 Å²	39	111.1 Å²	111.1	32%	0.322	62%	0.621	S	S	.	*			trans	-69.9	123.9	-176.3	0	0	0	0	0	110.2	W4 A5	A2-W4 HydrophobicContact CB-CD2 3.99Å; A2-W4 VanDerWaalsContact CB-CE2 3.47Å; A2-W4 HydrophobicContact CB-CG 3.95Å; A2-W4 HydrophobicContact CB-CZ2 4.11Å; A2-W4 PolarHBondContact O-N 3.04Å; A2-A5 WeakPolarHBondContact O-CB 3.3Å; A2-A5 PolarHBondContact O-N 3.09Å
3	P	38.5	Very low	48.1	Very low	98 Å²	98	104.2 Å²	104.2	64%	0.636	58%	0.582	S	S	*	*	H	α-helix	trans	-62.2	-7.3	-177.9	19.4	-29.3	0	0	0	114.9
4	W	39.8	Very low	51.2	Low	204 Å²	204	101.6 Å²	101.6	77%	0.773	57%	0.572	S	S	*	*	H	α-helix	trans	-82.7	-26.1	177.2	24	-50.7	0	0	0	111.5	A2 E8	A2-W4 HydrophobicContact CB-CD2 3.99Å; A2-W4 VanDerWaalsContact CB-CE2 3.47Å; A2-W4 HydrophobicContact CB-CG 3.95Å; A2-W4 HydrophobicContact CB-CZ2 4.11Å; A2-W4 PolarHBondContact O-N 3.04Å; W4-E8 PolarHBondContact O-N 2.75Å
5	A	37.1	Very low	53.8	Low	55 Å²	55	94.9 Å²	94.9	46%	0.455	53%	0.534	S	S	.	.	H	α-helix	trans	-74.2	-31	174.4	0	0	0	0	0	112.6	A2	A2-A5 WeakPolarHBondContact O-CB 3.3Å; A2-A5 PolarHBondContact O-N 3.09Å
6	E	33.2	Very low	56.1	Low	138 Å²	138	90.1 Å²	90.1	65%	0.645	51%	0.505	S	S	*	.	H	α-helix	trans	-75.5	-31.7	175.4	-73.1	-179.9	166.3	0	0	112.1
7	A	43	Very low	58.3	Low	62 Å²	62	87 Å²	87	51%	0.512	49%	0.493	S	S	.	.	H	α-helix	trans	-69.6	-37.4	175.5	0	0	0	0	0	112.5	L9 S10	A7-L9 VanDerWaalsContact C-N 3.32Å; A7-L9 PolarHBondContact O-N 2.99Å; A7-S10 PolarHBondContact O-N 3.1Å; A7-S10 PolarHBondContact O-OG 3.33Å
8	E	47.3	Very low	60.3	Low	91 Å²	91	85.5 Å²	85.5	43%	0.425	49%	0.486	S	S	.	.	H	α-helix	trans	-68.4	-27.6	179	-82	-154.7	131.4	0	0	114.2	W4 R16	W4-E8 PolarHBondContact O-N 2.75Å; E8-R16 PolarHBondContact O-NH1 2.89Å
9	L	44.8	Very low	62.1	Low	140 Å²	140	81 Å²	81	73%	0.733	46%	0.461	S	S	*	.	H	α-helix	trans	-78.3	-19.6	177.5	-108.5	128.5	0	0	0	113.2	A7	A7-L9 VanDerWaalsContact C-N 3.32Å; A7-L9 PolarHBondContact O-N 2.99Å
10	S	46.7	Very low	63.8	Low	100 Å²	100	80.5 Å²	80.5	70%	0.699	46%	0.456	S	S	*	.	S	Bend	trans	-82.7	-13.4	-168.9	71.5	0	0	0	0	115.3	A7	A7-S10 PolarHBondContact O-N 3.1Å; A7-S10 PolarHBondContact O-OG 3.33Å
11	A	60.6	Low	65.2	Low	64 Å²	64	81.1 Å²	81.1	53%	0.529	46%	0.462	S	S	.	.			trans	-117.6	85.3	171.6	0	0	0	0	0	110.7	N13 R16	A11-N13 PolarHBondContact O-N 3.37Å; A11-R16 PolarHBondContact O-NH1 2.68Å
12	L	74.8	Confident	67.8	Low	118 Å²	118	72.3 Å²	72.3	62%	0.618	42%	0.419	S	S	*	.			trans	-63.1	88.7	161.3	-83.8	164.7	0	0	0	108.3	L20	L12-L20 HydrophobicContact CD2-CD1 3.54Å
13	N	83.9	Confident	70.6	Confident	21 Å²	21	71 Å²	71	11%	0.112	41%	0.407	C	S	.	.			trans	-66.2	155.5	171.8	71.2	15.5	0	0	0	110.3	A11 L15 R16 A17 G116	A11-N13 PolarHBondContact O-N 3.37Å; N13-L15 PolarHBondContact O-N 3.44Å; N13-L15 VanDerWaalsContact O-N 3.1Å; N13-R16 PolarHBondContact O-N 3.32Å; N13-R16 VanDerWaalsContact O-N 3.11Å; N13-R16 WeakPolarHBondContact OD1-CB 3.33Å; N13-R16 WeakPolarHBondContact OD1-CD 2.84Å; N13-R16 WeakPolarHBondContact OD1-CG 3.37Å; N13-R16 PolarHBondContact OD1-N 2.76Å; N13-A17 PolarHBondContact O-N 2.56Å; N13-G116 PolarHBondContact ND2-O 2.92Å
14	P	90.5	Very high	73.3	Confident	69 Å²	69	69.1 Å²	69.1	45%	0.448	40%	0.399	S	S	.	.	H	α-helix	trans	-54.4	-35.9	-176.2	-30.6	38.7	0	0	0	113.1	A17 V18 I114	P14-A17 PolarHBondContact O-N 3.13Å; P14-V18 WeakPolarHBondContact O-CG2 3.09Å; P14-V18 PolarHBondContact O-N 3.05Å; P14-I114 WeakPolarHBondContact CG-O 3.29Å
15	L	90.6	Very high	75.8	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-65	-46.8	178.9	-171.7	64.8	0	0	0	113.1	N13 A17 V18 W19 L115 L172 T176 S179 T276	N13-L15 PolarHBondContact O-N 3.44Å; N13-L15 VanDerWaalsContact O-N 3.1Å; L15-A17 VanDerWaalsContact C-N 3.3Å; L15-A17 PolarHBondContact O-N 3.02Å; L15-V18 PolarHBondContact O-N 3.31Å; L15-W19 PolarHBondContact O-N 3.03Å; L15-L115 HydrophobicContact CB-CB 4.49Å; L15-L115 WeakPolarHBondContact CB-O 3.42Å; L15-L115 PolarHBondContact N-O 3.37Å; L15-L172 HydrophobicContact CD1-CD1 3.54Å; L15-L172 HydrophobicContact CD1-CG 4.25Å; L15-T176 WeakPolarHBondContact CD1-OG1 3.45Å; L15-T176 HydrophobicContact CD2-CG2 3.99Å; L15-S179 WeakPolarHBondContact CD2-OG 3.44Å; L15-T276 HydrophobicContact CD2-CG2 4.02Å; L15-T276 HydrophobicContact CG-CG2 4.4Å
16	R	91.6	Very high	78.4	Confident	19 Å²	19	61.2 Å²	61.2	7%	0.072	37%	0.37	C	S	.	.	H	α-helix	trans	-61.5	-40.8	175	-73	166.9	-179.2	-168.9	-3.7	110.6	E8 A11 N13 V18 W19 L20 T276 L279	E8-R16 PolarHBondContact O-NH1 2.89Å; A11-R16 PolarHBondContact O-NH1 2.68Å; N13-R16 PolarHBondContact O-N 3.32Å; N13-R16 VanDerWaalsContact O-N 3.11Å; N13-R16 WeakPolarHBondContact OD1-CB 3.33Å; N13-R16 WeakPolarHBondContact OD1-CD 2.84Å; N13-R16 WeakPolarHBondContact OD1-CG 3.37Å; N13-R16 PolarHBondContact OD1-N 2.76Å; R16-V18 PolarHBondContact O-N 3.39Å; R16-W19 PolarHBondContact O-N 2.96Å; R16-L20 WeakPolarHBondContact O-CB 3.25Å; R16-L20 WeakPolarHBondContact O-CG 3.47Å; R16-L20 PolarHBondContact O-N 3.3Å; R16-T276 HydrophobicContact CG-CG2 4.15Å; R16-T276 PolarHBondContact NE-OG1 2.75Å; R16-L279 HydrophobicContact CB-CD1 3.81Å; R16-L279 HydrophobicContact CG-CD1 3.85Å
17	A	92.8	Very high	81.3	Confident	37 Å²	37	57.4 Å²	57.4	31%	0.306	35%	0.354	S	S	.	.	H	α-helix	trans	-62	-41.8	176.6	0	0	0	0	0	112.3	N13 P14 L15 L20 T21	N13-A17 PolarHBondContact O-N 2.56Å; P14-A17 PolarHBondContact O-N 3.13Å; L15-A17 VanDerWaalsContact C-N 3.3Å; L15-A17 PolarHBondContact O-N 3.02Å; A17-L20 PolarHBondContact O-N 3.15Å; A17-T21 WeakPolarHBondContact O-CB 3.44Å; A17-T21 PolarHBondContact O-N 3.43Å; A17-T21 PolarHBondContact O-OG1 2.84Å
18	V	94.1	Very high	83.7	Confident	60 Å²	60	59.4 Å²	59.4	36%	0.364	36%	0.355	S	S	.	.	H	α-helix	trans	-60.8	-50.6	174.4	171.3	0	0	0	0	110.6	P14 L15 R16 L20 T21 L22 L172	P14-V18 WeakPolarHBondContact O-CG2 3.09Å; P14-V18 PolarHBondContact O-N 3.05Å; L15-V18 PolarHBondContact O-N 3.31Å; R16-V18 PolarHBondContact O-N 3.39Å; V18-L20 PolarHBondContact O-N 2.9Å; V18-T21 PolarHBondContact O-N 3.37Å; V18-L22 HydrophobicContact CG1-CD1 4.04Å; V18-L22 HydrophobicContact CG1-CG 4.4Å; V18-L22 WeakPolarHBondContact O-CG 3.46Å; V18-L22 PolarHBondContact O-N 3.34Å; V18-L172 HydrophobicContact CG1-CD2 3.55Å
19	W	95.3	Very high	85.6	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-63.1	-40.2	-179.5	-71.7	120.2	0	0	0	113	L15 R16 L22 T23 Y169 L172 V173 T176 L279 V280 N283	L15-W19 PolarHBondContact O-N 3.03Å; R16-W19 PolarHBondContact O-N 2.96Å; W19-L22 HydrophobicContact CE3-CD1 4.09Å; W19-L22 HydrophobicContact CZ3-CD1 4.08Å; W19-L22 PolarHBondContact O-N 3.46Å; W19-T23 VanDerWaalsContact O-CB 3.29Å; W19-T23 WeakPolarHBondContact O-CB 3.26Å; W19-T23 PolarHBondContact O-N 2.9Å; W19-T23 PolarHBondContact O-OG1 3.48Å; W19-Y169 AromaticContact CH2-CD2 3.91Å; W19-Y169 HydrophobicContact CH2-CD2 3.91Å; W19-Y169 AromaticContact CH2-CE2 3.65Å; W19-Y169 HydrophobicContact CH2-CE2 3.65Å; W19-Y169 AromaticContact CZ3-CD2 3.97Å; W19-Y169 HydrophobicContact CZ3-CD2 3.97Å; W19-Y169 AromaticContact CZ3-CE2 3.6Å; W19-Y169 HydrophobicContact CZ3-CE2 3.6Å; W19-L172 HydrophobicContact CD2-CD2 4.42Å; W19-L172 HydrophobicContact CH2-CD2 3.85Å; W19-L172 HydrophobicContact CH2-CG 4.19Å; W19-L172 HydrophobicContact CZ2-CB 4.29Å; W19-L172 HydrophobicContact CZ2-CD2 3.63Å; W19-L172 HydrophobicContact CZ2-CG 3.63Å; W19-L172 HydrophobicContact CZ3-CD2 4.33Å; W19-V173 HydrophobicContact CH2-CG2 3.59Å; W19-V173 HydrophobicContact CZ2-CG2 3.95Å; W19-T176 WeakPolarHBondContact CZ2-OG1 3.37Å; W19-T176 PolarHBondContact NE1-OG1 3.35Å; W19-L279 HydrophobicContact CB-CB 3.72Å; W19-L279 HydrophobicContact CB-CD1 4.31Å; W19-L279 HydrophobicContact CG-CB 4.44Å; W19-V280 HydrophobicContact CD2-CG2 3.94Å; W19-V280 HydrophobicContact CE3-CG2 4.46Å; W19-V280 HydrophobicContact CG-CG2 4.32Å; W19-V280 HydrophobicContact CH2-CG1 4.33Å; W19-V280 HydrophobicContact CH2-CG2 4.47Å; W19-V280 HydrophobicContact CZ2-CG1 4.47Å; W19-V280 HydrophobicContact CZ2-CG2 3.9Å; W19-N283 HydrophobicContact CE3-CB 4.12Å; W19-N283 HydrophobicContact CZ3-CB 4.45Å
20	L	95.3	Very high	87.8	Confident	70 Å²	70	50 Å²	50	37%	0.366	31%	0.309	S	S	.	.	H	α-helix	trans	-62	-44.7	174.3	-77.9	167.4	0	0	0	111.8	L12 R16 A17 V18 T23 A24 L279	L12-L20 HydrophobicContact CD2-CD1 3.54Å; R16-L20 WeakPolarHBondContact O-CB 3.25Å; R16-L20 WeakPolarHBondContact O-CG 3.47Å; R16-L20 PolarHBondContact O-N 3.3Å; A17-L20 PolarHBondContact O-N 3.15Å; V18-L20 PolarHBondContact O-N 2.9Å; L20-T23 WeakPolarHBondContact O-CB 3.43Å; L20-T23 PolarHBondContact O-N 2.97Å; L20-A24 WeakPolarHBondContact O-CB 3.35Å; L20-A24 PolarHBondContact O-N 3.49Å; L20-L279 HydrophobicContact CD2-CD2 3.56Å; L20-L279 HydrophobicContact CG-CD1 4.11Å; L20-L279 HydrophobicContact CG-CD2 3.97Å
21	T	94.4	Very high	89.8	Confident	95 Å²	95	49.6 Å²	49.6	58%	0.583	30%	0.299	S	S	*	.	H	α-helix	trans	-62.7	-45.4	179.3	-57.3	0	0	0	0	111.2	A17 V18 A24 A25	A17-T21 WeakPolarHBondContact O-CB 3.44Å; A17-T21 PolarHBondContact O-N 3.43Å; A17-T21 PolarHBondContact O-OG1 2.84Å; V18-T21 PolarHBondContact O-N 3.37Å; T21-A24 PolarHBondContact O-N 2.93Å; T21-A25 WeakPolarHBondContact O-CB 3.3Å; T21-A25 PolarHBondContact O-N 2.84Å
22	L	94	Very high	91.1	Very high	38 Å²	38	48.4 Å²	48.4	20%	0.199	28%	0.283	C	S	.	.	H	α-helix	trans	-62.9	-43.7	176.6	-67.2	178.7	0	0	0	111.7	V18 W19 A24 A25 F26 F165 L172 N283	V18-L22 HydrophobicContact CG1-CD1 4.04Å; V18-L22 HydrophobicContact CG1-CG 4.4Å; V18-L22 WeakPolarHBondContact O-CG 3.46Å; V18-L22 PolarHBondContact O-N 3.34Å; W19-L22 HydrophobicContact CE3-CD1 4.09Å; W19-L22 HydrophobicContact CZ3-CD1 4.08Å; W19-L22 PolarHBondContact O-N 3.46Å; L22-A24 PolarHBondContact O-N 2.93Å; L22-A25 PolarHBondContact O-N 3.35Å; L22-F26 VanDerWaalsContact O-CD2 3.22Å; L22-F26 WeakPolarHBondContact O-CD2 3.17Å; L22-F26 PolarHBondContact O-N 2.95Å; L22-F165 HydrophobicContact CD1-CE2 3.96Å; L22-F165 HydrophobicContact CD1-CZ 4.4Å; L22-F165 HydrophobicContact CD2-CD2 4.43Å; L22-F165 HydrophobicContact CD2-CE2 3.6Å; L22-F165 HydrophobicContact CD2-CZ 4.41Å; L22-F165 HydrophobicContact CG-CE2 4.37Å; L22-L172 HydrophobicContact CD1-CD2 4.44Å; L22-N283 VanDerWaalsContact CB-OD1 3.22Å; L22-N283 WeakPolarHBondContact CB-OD1 3.27Å
23	T	94.7	Very high	91.6	Very high	13 Å²	13	44.2 Å²	44.2	8%	0.08	26%	0.26	C	S	.	.	H	α-helix	trans	-59.3	-49	177	-59.1	0	0	0	0	111.1	W19 L20 A25 F26 L27 T282 N283 F286	W19-T23 VanDerWaalsContact O-CB 3.29Å; W19-T23 WeakPolarHBondContact O-CB 3.26Å; W19-T23 PolarHBondContact O-N 2.9Å; W19-T23 PolarHBondContact O-OG1 3.48Å; L20-T23 WeakPolarHBondContact O-CB 3.43Å; L20-T23 PolarHBondContact O-N 2.97Å; T23-A25 VanDerWaalsContact C-N 3.31Å; T23-A25 PolarHBondContact O-N 3.26Å; T23-F26 PolarHBondContact O-N 3.49Å; T23-L27 WeakPolarHBondContact O-CB 3.35Å; T23-L27 PolarHBondContact O-N 2.83Å; T23-T282 HydrophobicContact CG2-CG2 3.58Å; T23-N283 PolarHBondContact N-OD1 3.01Å; T23-N283 WeakPolarHBondContact OG1-CB 3.37Å; T23-F286 HydrophobicContact CG2-CD2 3.64Å; T23-F286 HydrophobicContact CG2-CE2 3.95Å
24	A	94.6	Very high	91.7	Very high	57 Å²	57	47.4 Å²	47.4	47%	0.471	28%	0.277	S	S	.	.	H	α-helix	trans	-61.1	-40.3	178.2	0	0	0	0	0	111.6	L20 T21 L22 L27 L28	L20-A24 WeakPolarHBondContact O-CB 3.35Å; L20-A24 PolarHBondContact O-N 3.49Å; T21-A24 PolarHBondContact O-N 2.93Å; L22-A24 PolarHBondContact O-N 2.93Å; A24-L27 PolarHBondContact O-N 3.36Å; A24-L28 WeakPolarHBondContact O-CB 3.27Å; A24-L28 PolarHBondContact O-N 3.43Å
25	A	92.3	Very high	91.3	Very high	49 Å²	49	47.7 Å²	47.7	41%	0.405	27%	0.274	S	S	.	.	H	α-helix	trans	-62.6	-46	176.8	0	0	0	0	0	112.3	T21 L22 T23 T29	T21-A25 WeakPolarHBondContact O-CB 3.3Å; T21-A25 PolarHBondContact O-N 2.84Å; L22-A25 PolarHBondContact O-N 3.35Å; T23-A25 VanDerWaalsContact C-N 3.31Å; T23-A25 PolarHBondContact O-N 3.26Å; A25-T29 VanDerWaalsContact O-CB 3.3Å; A25-T29 WeakPolarHBondContact O-CB 3.02Å; A25-T29 PolarHBondContact O-N 3.45Å; A25-T29 PolarHBondContact O-OG1 3Å
26	F	93	Very high	90.6	Very high	44 Å²	44	51.5 Å²	51.5	19%	0.193	30%	0.299	C	S	.	.	H	α-helix	trans	-67.7	-41.3	177	-76.9	-64.1	0	0	0	112.7	L22 T23 T29 L30 F165 N283 F286 L290	L22-F26 VanDerWaalsContact O-CD2 3.22Å; L22-F26 WeakPolarHBondContact O-CD2 3.17Å; L22-F26 PolarHBondContact O-N 2.95Å; T23-F26 PolarHBondContact O-N 3.49Å; F26-T29 PolarHBondContact O-N 3.02Å; F26-L30 WeakPolarHBondContact O-CB 3.44Å; F26-L30 PolarHBondContact O-N 3.39Å; F26-F165 HydrophobicContact CE2-CE1 4.14Å; F26-F165 AromaticContact CE2-CZ 3.77Å; F26-F165 HydrophobicContact CE2-CZ 3.77Å; F26-F165 AromaticContact CZ-CE1 3.8Å; F26-F165 HydrophobicContact CZ-CE1 3.8Å; F26-F165 AromaticContact CZ-CZ 3.89Å; F26-F165 HydrophobicContact CZ-CZ 3.89Å; F26-N283 WeakPolarHBondContact CD2-OD1 3.38Å; F26-F286 HydrophobicContact CB-CB 3.84Å; F26-L290 HydrophobicContact CD1-CD2 4.05Å
27	L	93.8	Very high	89.4	Confident	59 Å²	59	57 Å²	57	31%	0.309	34%	0.337	S	S	.	.	H	α-helix	trans	-62.1	-50.5	176.1	171.1	59.2	0	0	0	111.1	T23 A24 T29 L30 L31 F286	T23-L27 WeakPolarHBondContact O-CB 3.35Å; T23-L27 PolarHBondContact O-N 2.83Å; A24-L27 PolarHBondContact O-N 3.36Å; L27-T29 VanDerWaalsContact C-N 3.26Å; L27-T29 PolarHBondContact O-N 2.93Å; L27-L30 PolarHBondContact O-N 3.35Å; L27-L30 VanDerWaalsContact O-N 3.13Å; L27-L31 HydrophobicContact CD1-CD1 3.91Å; L27-L31 HydrophobicContact CD1-CD2 4.36Å; L27-L31 HydrophobicContact CD1-CG 3.88Å; L27-L31 HydrophobicContact CG-CD1 4.03Å; L27-L31 HydrophobicContact CG-CG 4.41Å; L27-L31 WeakPolarHBondContact O-CG 3.46Å; L27-L31 PolarHBondContact O-N 3.41Å; L27-F286 HydrophobicContact CB-CD1 4.21Å; L27-F286 HydrophobicContact CB-CD2 4.16Å; L27-F286 HydrophobicContact CB-CE1 4.43Å; L27-F286 HydrophobicContact CB-CE2 4.33Å; L27-F286 HydrophobicContact CB-CG 4.09Å; L27-F286 HydrophobicContact CB-CZ 4.47Å; L27-F286 HydrophobicContact CD1-CD1 3.91Å; L27-F286 HydrophobicContact CD1-CE1 3.54Å; L27-F286 HydrophobicContact CD1-CZ 3.9Å; L27-F286 HydrophobicContact CD2-CE2 4.38Å; L27-F286 HydrophobicContact CD2-CZ 4.22Å; L27-F286 HydrophobicContact CG-CE1 4.41Å; L27-F286 HydrophobicContact CG-CZ 4.42Å
28	L	92.3	Very high	87.9	Confident	104 Å²	104	59 Å²	59	55%	0.545	36%	0.361	S	S	.	.	H	α-helix	trans	-56.4	-45.7	177	178.4	62	0	0	0	110.3	A24 L30 L31 L32	A24-L28 WeakPolarHBondContact O-CB 3.27Å; A24-L28 PolarHBondContact O-N 3.43Å; L28-L30 PolarHBondContact O-N 2.96Å; L28-L31 PolarHBondContact O-N 2.94Å; L28-L32 HydrophobicContact CD1-CD1 4.2Å; L28-L32 HydrophobicContact CD1-CG 4.27Å; L28-L32 HydrophobicContact CG-CD1 3.97Å; L28-L32 HydrophobicContact CG-CG 4.46Å; L28-L32 WeakPolarHBondContact O-CB 3.38Å; L28-L32 WeakPolarHBondContact O-CG 3.3Å; L28-L32 PolarHBondContact O-N 3.16Å
29	T	88.3	Confident	86.3	Confident	21 Å²	21	62.2 Å²	62.2	13%	0.129	38%	0.375	C	S	.	.	H	α-helix	trans	-60.1	-44.6	177.3	-59.5	0	0	0	0	112.3	A25 F26 L27 L32 Q33 I50 L290	A25-T29 VanDerWaalsContact O-CB 3.3Å; A25-T29 WeakPolarHBondContact O-CB 3.02Å; A25-T29 PolarHBondContact O-N 3.45Å; A25-T29 PolarHBondContact O-OG1 3Å; F26-T29 PolarHBondContact O-N 3.02Å; L27-T29 VanDerWaalsContact C-N 3.26Å; L27-T29 PolarHBondContact O-N 2.93Å; T29-L32 PolarHBondContact O-N 3.41Å; T29-Q33 VanDerWaalsContact O-CG 3.29Å; T29-Q33 WeakPolarHBondContact O-CG 3.46Å; T29-Q33 PolarHBondContact O-N 3.17Å; T29-I50 HydrophobicContact CG2-CB 4.38Å; T29-I50 HydrophobicContact CG2-CD1 3.46Å; T29-I50 VanDerWaalsContact CG2-CD1 3.46Å; T29-I50 HydrophobicContact CG2-CG1 3.56Å; T29-I50 HydrophobicContact CG2-CG2 3.89Å; T29-L290 HydrophobicContact CG2-CD1 3.95Å; T29-L290 HydrophobicContact CG2-CD2 3.49Å; T29-L290 VanDerWaalsContact CG2-CD2 3.49Å; T29-L290 HydrophobicContact CG2-CG 4.39Å
30	L	89.3	Confident	84.5	Confident	12 Å²	12	64.4 Å²	64.4	6%	0.063	39%	0.387	C	S	.	.	H	α-helix	trans	-62.4	-46.1	176.6	175.5	63.3	0	0	0	111.7	F26 L27 L28 L32 Q33 L34 F286 A289 L290 F293 F318	F26-L30 WeakPolarHBondContact O-CB 3.44Å; F26-L30 PolarHBondContact O-N 3.39Å; L27-L30 PolarHBondContact O-N 3.35Å; L27-L30 VanDerWaalsContact O-N 3.13Å; L28-L30 PolarHBondContact O-N 2.96Å; L30-L32 VanDerWaalsContact C-N 3.32Å; L30-L32 PolarHBondContact O-N 3.11Å; L30-Q33 PolarHBondContact O-N 2.88Å; L30-Q33 VanDerWaalsContact O-N 3.14Å; L30-L34 HydrophobicContact CD1-CD1 4.3Å; L30-L34 HydrophobicContact CD1-CG 4.42Å; L30-L34 HydrophobicContact CG-CD1 4.14Å; L30-L34 WeakPolarHBondContact O-CG 3.3Å; L30-L34 PolarHBondContact O-N 2.95Å; L30-F286 HydrophobicContact CD2-CD1 4.15Å; L30-A289 HydrophobicContact CD2-CB 3.9Å; L30-L290 HydrophobicContact CB-CB 4.45Å; L30-L290 HydrophobicContact CB-CD1 4.41Å; L30-L290 HydrophobicContact CD1-CB 4.49Å; L30-L290 HydrophobicContact CD1-CD1 4.44Å; L30-F293 HydrophobicContact CD1-CB 4.3Å; L30-F318 HydrophobicContact CD1-CZ 4.17Å
31	L	90.6	Very high	82.5	Confident	92 Å²	92	66.4 Å²	66.4	48%	0.482	40%	0.404	S	S	.	.	H	α-helix	trans	-60.1	-43.7	177.7	-68.9	174.6	0	0	0	111.2	L27 L28 Q33 L34 L35	L27-L31 HydrophobicContact CD1-CD1 3.91Å; L27-L31 HydrophobicContact CD1-CD2 4.36Å; L27-L31 HydrophobicContact CD1-CG 3.88Å; L27-L31 HydrophobicContact CG-CD1 4.03Å; L27-L31 HydrophobicContact CG-CG 4.41Å; L27-L31 WeakPolarHBondContact O-CG 3.46Å; L27-L31 PolarHBondContact O-N 3.41Å; L28-L31 PolarHBondContact O-N 2.94Å; L31-Q33 VanDerWaalsContact C-N 3.32Å; L31-Q33 PolarHBondContact O-N 3.48Å; L31-L34 PolarHBondContact O-N 3.23Å; L31-L34 VanDerWaalsContact O-N 3.14Å; L31-L35 PolarHBondContact O-N 3.29Å
32	L	87.2	Confident	80.6	Confident	39 Å²	39	65.5 Å²	65.5	20%	0.204	41%	0.414	C	S	.	.	H	α-helix	trans	-60.9	-41.6	175.5	-65.7	167.4	0	0	0	111	L28 T29 L30 L34 L35 L40 F46	L28-L32 HydrophobicContact CD1-CD1 4.2Å; L28-L32 HydrophobicContact CD1-CG 4.27Å; L28-L32 HydrophobicContact CG-CD1 3.97Å; L28-L32 HydrophobicContact CG-CG 4.46Å; L28-L32 WeakPolarHBondContact O-CB 3.38Å; L28-L32 WeakPolarHBondContact O-CG 3.3Å; L28-L32 PolarHBondContact O-N 3.16Å; T29-L32 PolarHBondContact O-N 3.41Å; L30-L32 VanDerWaalsContact C-N 3.32Å; L30-L32 PolarHBondContact O-N 3.11Å; L32-L34 VanDerWaalsContact C-N 3.25Å; L32-L34 PolarHBondContact O-N 3.41Å; L32-L35 HydrophobicContact CD2-CD1 4.25Å; L32-L35 WeakPolarHBondContact O-CB 3.33Å; L32-L35 PolarHBondContact O-N 3.32Å; L32-L40 HydrophobicContact CB-CD1 4.23Å; L32-L40 HydrophobicContact CB-CD2 4.26Å; L32-L40 HydrophobicContact CD2-CD2 3.44Å; L32-L40 VanDerWaalsContact CD2-CD2 3.44Å; L32-L40 HydrophobicContact CG-CD2 4.38Å; L32-L40 WeakPolarHBondContact O-CD1 3.36Å; L32-F46 HydrophobicContact CD1-CE1 3.77Å; L32-F46 HydrophobicContact CD1-CZ 3.51Å
33	Q	84.6	Confident	78.8	Confident	30 Å²	30	67.4 Å²	67.4	14%	0.14	43%	0.429	C	S	.	.	H	α-helix	trans	-70.6	-18	177.6	-67	-68.4	-31.7	0	0	114.1	T29 L30 L31 I50 L290 F293 L294	T29-Q33 VanDerWaalsContact O-CG 3.29Å; T29-Q33 WeakPolarHBondContact O-CG 3.46Å; T29-Q33 PolarHBondContact O-N 3.17Å; L30-Q33 PolarHBondContact O-N 2.88Å; L30-Q33 VanDerWaalsContact O-N 3.14Å; L31-Q33 VanDerWaalsContact C-N 3.32Å; L31-Q33 PolarHBondContact O-N 3.48Å; Q33-I50 HydrophobicContact CG-CG2 4.39Å; Q33-L290 HydrophobicContact CB-CD1 4.44Å; Q33-L290 HydrophobicContact CG-CD1 4.01Å; Q33-F293 HydrophobicContact CB-CD1 4.26Å; Q33-F293 HydrophobicContact CB-CE1 4.02Å; Q33-F293 WeakPolarHBondContact O-CE1 3.46Å; Q33-L294 HydrophobicContact CG-CD2 4.46Å
34	L	85.9	Confident	76.9	Confident	87 Å²	87	70.5 Å²	70.5	46%	0.455	46%	0.456	S	S	.	.	H	α-helix	trans	-84.6	-16.5	173.7	-70.6	168.3	0	0	0	112.8	L30 L31 L32 F293 F318	L30-L34 HydrophobicContact CD1-CD1 4.3Å; L30-L34 HydrophobicContact CD1-CG 4.42Å; L30-L34 HydrophobicContact CG-CD1 4.14Å; L30-L34 WeakPolarHBondContact O-CG 3.3Å; L30-L34 PolarHBondContact O-N 2.95Å; L31-L34 PolarHBondContact O-N 3.23Å; L31-L34 VanDerWaalsContact O-N 3.14Å; L32-L34 VanDerWaalsContact C-N 3.25Å; L32-L34 PolarHBondContact O-N 3.41Å; L34-F293 HydrophobicContact CD2-CD2 4.02Å; L34-F293 HydrophobicContact CD2-CE2 3.57Å; L34-F293 HydrophobicContact CD2-CZ 3.88Å; L34-F318 HydrophobicContact CD2-CE2 4.25Å
35	L	83.4	Confident	74.9	Confident	76 Å²	76	74.4 Å²	74.4	40%	0.398	47%	0.468	S	S	.	.	S	Bend	trans	-71.7	151.6	177	-68.4	173.2	0	0	0	111.7	L31 L32 L40	L31-L35 PolarHBondContact O-N 3.29Å; L32-L35 HydrophobicContact CD2-CD1 4.25Å; L32-L35 WeakPolarHBondContact O-CB 3.33Å; L32-L35 PolarHBondContact O-N 3.32Å; L35-L40 HydrophobicContact CD1-CD2 4.24Å
36	P	75.8	Confident	73.4	Confident	80 Å²	80	75.4 Å²	75.4	52%	0.519	46%	0.463	S	S	.	.			trans	-58	145	174.5	-22	32.4	0	0	0	111.8	G38 L39	P36-G38 PolarHBondContact O-N 2.87Å; P36-L39 PolarHBondContact O-N 3.37Å; P36-L39 VanDerWaalsContact O-N 3.17Å
37	P	64.9	Low	71.8	Confident	135 Å²	135	75.4 Å²	75.4	88%	0.877	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-12.9	-175.7	-24.7	32.2	0	0	0	116.3
38	G	61.3	Low	70	Confident	77 Å²	77	73.2 Å²	73.2	79%	0.794	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-9	-178.2	0	0	0	0	0	116	P36	P36-G38 PolarHBondContact O-N 2.87Å
39	L	61.2	Low	68.4	Low	128 Å²	128	71.6 Å²	71.6	67%	0.67	44%	0.444	S	S	*	.	S	Bend	trans	-95.3	-10.1	-176.3	-115.4	102.2	0	0	0	114.5	P36	P36-L39 PolarHBondContact O-N 3.37Å; P36-L39 VanDerWaalsContact O-N 3.17Å
40	L	58.1	Low	66.9	Low	46 Å²	46	71.5 Å²	71.5	24%	0.241	44%	0.443	C	S	.	.	S	Bend	trans	-102.7	131.5	-176.6	-66.8	177.7	0	0	0	111.1	L32 L35 G42	L32-L40 HydrophobicContact CB-CD1 4.23Å; L32-L40 HydrophobicContact CB-CD2 4.26Å; L32-L40 HydrophobicContact CD2-CD2 3.44Å; L32-L40 VanDerWaalsContact CD2-CD2 3.44Å; L32-L40 HydrophobicContact CG-CD2 4.38Å; L32-L40 WeakPolarHBondContact O-CD1 3.36Å; L35-L40 HydrophobicContact CD1-CD2 4.24Å; L40-G42 PolarHBondContact O-N 3.39Å; L40-G42 VanDerWaalsContact O-N 3.13Å
41	P	52.6	Low	65.5	Low	113 Å²	113	73.7 Å²	73.7	73%	0.734	45%	0.45	S	S	*	.			trans	-59	120.9	163.1	3.2	3.5	0	0	0	108	C43	P41-C43 PolarHBondContact O-N 2.87Å
42	G	54.1	Low	63.7	Low	76 Å²	76	71.6 Å²	71.6	78%	0.784	44%	0.436	S	S	*	.			trans	-68.6	66.3	-178.4	0	0	0	0	0	112.7	L40 A44	L40-G42 PolarHBondContact O-N 3.39Å; L40-G42 VanDerWaalsContact O-N 3.13Å; G42-A44 PolarHBondContact O-N 2.88Å
43	C	55.8	Low	62.2	Low	77 Å²	77	69.8 Å²	69.8	52%	0.52	43%	0.427	S	S	.	.			trans	-71.9	100.4	171.3	-81.3	0	0	0	0	108.9	P41 I45 F46 Q47	P41-C43 PolarHBondContact O-N 2.87Å; C43-I45 PolarHBondContact O-N 2.87Å; C43-I45 VanDerWaalsContact O-N 3.1Å; C43-F46 HydrophobicContact CB-CB 4.02Å; C43-F46 WeakPolarHBondContact O-CB 3.46Å; C43-F46 PolarHBondContact O-N 3.26Å; C43-Q47 PolarHBondContact O-N 3.46Å; C43-Q47 VanDerWaalsContact O-N 3.17Å
44	A	55.7	Low	60.3	Low	79 Å²	79	70.7 Å²	70.7	65%	0.653	43%	0.43	S	S	*	.	H	α-helix	trans	-52	-33.3	178.7	0	0	0	0	0	112.9	G42 D48	G42-A44 PolarHBondContact O-N 2.88Å; A44-D48 VanDerWaalsContact O-CB 3.31Å; A44-D48 WeakPolarHBondContact O-CB 3.38Å; A44-D48 PolarHBondContact O-N 3.25Å
45	I	53.5	Low	58.5	Low	139 Å²	139	67.8 Å²	67.8	71%	0.713	42%	0.416	S	S	*	.	H	α-helix	trans	-66.2	-41.9	177.5	-59.4	171.9	0	0	0	111.6	C43 D48 L49	C43-I45 PolarHBondContact O-N 2.87Å; C43-I45 VanDerWaalsContact O-N 3.1Å; I45-D48 PolarHBondContact O-N 2.84Å; I45-L49 WeakPolarHBondContact O-CB 3.33Å; I45-L49 PolarHBondContact O-N 3.24Å
46	F	59.4	Low	57	Low	70 Å²	70	65.8 Å²	65.8	31%	0.307	41%	0.405	S	S	.	.	H	α-helix	trans	-69	-44.7	179.6	-175.7	-110.1	0	0	0	111	L32 C43 D48 L49 I50	L32-F46 HydrophobicContact CD1-CE1 3.77Å; L32-F46 HydrophobicContact CD1-CZ 3.51Å; C43-F46 HydrophobicContact CB-CB 4.02Å; C43-F46 WeakPolarHBondContact O-CB 3.46Å; C43-F46 PolarHBondContact O-N 3.26Å; F46-D48 VanDerWaalsContact C-N 3.26Å; F46-D48 PolarHBondContact O-N 2.92Å; F46-L49 PolarHBondContact O-N 3.46Å; F46-I50 HydrophobicContact CD1-CD1 3.46Å; F46-I50 VanDerWaalsContact CD1-CD1 3.46Å; F46-I50 HydrophobicContact CD2-CD1 4.02Å; F46-I50 HydrophobicContact CE1-CD1 3.21Å; F46-I50 HydrophobicContact CE2-CD1 3.8Å; F46-I50 HydrophobicContact CG-CD1 3.88Å; F46-I50 HydrophobicContact CZ-CD1 3.4Å; F46-I50 VanDerWaalsContact CZ-CD1 3.4Å; F46-I50 VanDerWaalsContact O-CD1 3.28Å; F46-I50 WeakPolarHBondContact O-CD1 3.45Å; F46-I50 WeakPolarHBondContact O-CG1 3.19Å; F46-I50 PolarHBondContact O-N 2.9Å; F46-I50 VanDerWaalsContact O-N 3.16Å
47	Q	59.7	Low	55.3	Low	44 Å²	44	66.6 Å²	66.6	21%	0.206	41%	0.411	C	S	.	.	H	α-helix	trans	-62	-35.2	174.9	-70.8	-69.8	-23.3	0	0	112	C43 I50 R51	C43-Q47 PolarHBondContact O-N 3.46Å; C43-Q47 VanDerWaalsContact O-N 3.17Å; Q47-I50 PolarHBondContact O-N 3.48Å; Q47-R51 WeakPolarHBondContact O-CB 3.44Å; Q47-R51 VanDerWaalsContact O-CG 3.3Å; Q47-R51 WeakPolarHBondContact O-CG 3.41Å; Q47-R51 PolarHBondContact O-N 2.5Å
48	D	55.8	Low	54.3	Low	13 Å²	13	64.1 Å²	64.1	7%	0.07	41%	0.41	C	S	.	.	H	α-helix	trans	-74	-33.7	177.3	-158.5	8.4	0	0	0	113.5	A44 I45 F46 I50 K56 R62	A44-D48 VanDerWaalsContact O-CB 3.31Å; A44-D48 WeakPolarHBondContact O-CB 3.38Å; A44-D48 PolarHBondContact O-N 3.25Å; I45-D48 PolarHBondContact O-N 2.84Å; F46-D48 VanDerWaalsContact C-N 3.26Å; F46-D48 PolarHBondContact O-N 2.92Å; D48-I50 VanDerWaalsContact C-N 3.26Å; D48-I50 PolarHBondContact O-N 3.26Å; D48-K56 WeakPolarHBondContact OD1-CE 3.42Å; D48-K56 IonicContact OD1-NZ 3.94Å; D48-K56 PolarHBondContact OD1-NZ 2.92Å; D48-R62 VanDerWaalsContact CG-NH1 3.27Å; D48-R62 IonicContact OD1-CZ 3.61Å; D48-R62 IonicContact OD1-NH1 3.02Å; D48-R62 PolarHBondContact OD1-NH1 3.26Å; D48-R62 IonicContact OD1-NH2 3.06Å; D48-R62 PolarHBondContact OD1-NH2 2.97Å; D48-R62 IonicContact OD2-CZ 3.39Å; D48-R62 IonicContact OD2-NH1 3.99Å; D48-R62 PolarHBondContact OD2-NH1 3.25Å; D48-R62 VanDerWaalsContact OD2-NH1 3.17Å; D48-R62 IonicContact OD2-NH2 3.67Å
49	L	59.2	Low	53.6	Low	70 Å²	70	66.7 Å²	66.7	37%	0.366	40%	0.401	S	S	.	.	H	α-helix	trans	-68.5	-26.2	174.5	-171.6	67.9	0	0	0	112.6	I45 F46 V161 Q162	I45-L49 WeakPolarHBondContact O-CB 3.33Å; I45-L49 PolarHBondContact O-N 3.24Å; F46-L49 PolarHBondContact O-N 3.46Å; L49-V161 HydrophobicContact CD1-CB 3.82Å; L49-V161 HydrophobicContact CD1-CG1 3.88Å; L49-V161 HydrophobicContact CD1-CG2 4.37Å; L49-Q162 PolarHBondContact O-NE2 3.32Å
50	I	57.7	Low	52.7	Low	19 Å²	19	65.7 Å²	65.7	10%	0.097	40%	0.402	C	S	.	.	H	α-helix	trans	-93.6	-41.4	-176.4	-64.7	163.1	0	0	0	111.6	T29 Q33 F46 Q47 D48 Y52 L290 L294	T29-I50 HydrophobicContact CG2-CB 4.38Å; T29-I50 HydrophobicContact CG2-CD1 3.46Å; T29-I50 VanDerWaalsContact CG2-CD1 3.46Å; T29-I50 HydrophobicContact CG2-CG1 3.56Å; T29-I50 HydrophobicContact CG2-CG2 3.89Å; Q33-I50 HydrophobicContact CG-CG2 4.39Å; F46-I50 HydrophobicContact CD1-CD1 3.46Å; F46-I50 VanDerWaalsContact CD1-CD1 3.46Å; F46-I50 HydrophobicContact CD2-CD1 4.02Å; F46-I50 HydrophobicContact CE1-CD1 3.21Å; F46-I50 HydrophobicContact CE2-CD1 3.8Å; F46-I50 HydrophobicContact CG-CD1 3.88Å; F46-I50 HydrophobicContact CZ-CD1 3.4Å; F46-I50 VanDerWaalsContact CZ-CD1 3.4Å; F46-I50 VanDerWaalsContact O-CD1 3.28Å; F46-I50 WeakPolarHBondContact O-CD1 3.45Å; F46-I50 WeakPolarHBondContact O-CG1 3.19Å; F46-I50 PolarHBondContact O-N 2.9Å; F46-I50 VanDerWaalsContact O-N 3.16Å; Q47-I50 PolarHBondContact O-N 3.48Å; D48-I50 VanDerWaalsContact C-N 3.26Å; D48-I50 PolarHBondContact O-N 3.26Å; I50-Y52 PolarHBondContact O-N 3.36Å; I50-L290 HydrophobicContact CG2-CD1 4.3Å; I50-L290 HydrophobicContact CG2-CD2 4.42Å; I50-L294 HydrophobicContact CG2-CD1 3.85Å
51	R	58.4	Low	52.1	Low	58 Å²	58	69.6 Å²	69.6	22%	0.219	43%	0.43	C	S	.	.			trans	-76.4	127.7	-178.4	-67.7	176.9	-175.3	-169.8	-1.3	109.2	Q47 K56 E59	Q47-R51 WeakPolarHBondContact O-CB 3.44Å; Q47-R51 VanDerWaalsContact O-CG 3.3Å; Q47-R51 WeakPolarHBondContact O-CG 3.41Å; Q47-R51 PolarHBondContact O-N 2.5Å; R51-K56 HydrophobicContact CB-CG 4.13Å; R51-K56 WeakPolarHBondContact O-CE 3.35Å; R51-E59 IonicContact CZ-OE1 3.93Å; R51-E59 VanDerWaalsContact NH1-CD 3.27Å; R51-E59 IonicContact NH1-OE1 2.89Å; R51-E59 PolarHBondContact NH1-OE1 3.47Å; R51-E59 IonicContact NH1-OE2 3.18Å; R51-E59 PolarHBondContact NH1-OE2 2.88Å; R51-E59 VanDerWaalsContact NH1-OE2 3.15Å
52	Y	52.6	Low	52.1	Low	47 Å²	47	67 Å²	67	18%	0.184	41%	0.406	C	S	.	.			trans	-136.8	149.2	172	173.9	-124.5	0	0	0	111.1	I50 K54 T55 K73 M157 I158	I50-Y52 PolarHBondContact O-N 3.36Å; Y52-K54 PolarHBondContact O-N 3.07Å; Y52-T55 PolarHBondContact N-OG1 3.4Å; Y52-T55 VanDerWaalsContact N-OG1 3.12Å; Y52-T55 PolarHBondContact O-OG1 2.99Å; Y52-K73 HydrophobicContact CE1-CD 4.01Å; Y52-K73 HydrophobicContact CE1-CG 4.49Å; Y52-K73 HydrophobicContact CE2-CD 4.48Å; Y52-K73 VanDerWaalsContact OH-CA 3.24Å; Y52-K73 WeakPolarHBondContact OH-CA 3.36Å; Y52-K73 WeakPolarHBondContact OH-CB 3.4Å; Y52-K73 VanDerWaalsContact OH-CD 3.26Å; Y52-K73 WeakPolarHBondContact OH-CD 3.31Å; Y52-K73 WeakPolarHBondContact OH-CG 3.24Å; Y52-M157 WeakPolarHBondContact CD2-O 3.42Å; Y52-M157 WeakPolarHBondContact CE2-O 3.22Å; Y52-I158 HydrophobicContact CD1-CG2 3.85Å; Y52-I158 HydrophobicContact CD2-CB 3.82Å; Y52-I158 HydrophobicContact CD2-CG2 3.32Å; Y52-I158 HydrophobicContact CE1-CG2 3.55Å; Y52-I158 HydrophobicContact CE2-CB 3.37Å; Y52-I158 HydrophobicContact CE2-CG1 3.94Å; Y52-I158 HydrophobicContact CE2-CG2 3.06Å; Y52-I158 HydrophobicContact CG-CG2 3.7Å; Y52-I158 WeakPolarHBondContact OH-CG1 3.4Å; Y52-I158 WeakPolarHBondContact OH-CG2 3.44Å
53	G	56.8	Low	52.2	Low	2 Å²	2	67.6 Å²	67.6	2%	0.021	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	77.3	-128.1	169.1	0	0	0	0	0	110.5	T55 K56 V156	G53-T55 PolarHBondContact O-N 2.88Å; G53-K56 PolarHBondContact O-N 3.35Å; G53-V156 VanDerWaalsContact C-CG1 3.41Å; G53-V156 VanDerWaalsContact O-CG1 3.23Å; G53-V156 WeakPolarHBondContact O-CG1 3.23Å
54	K	44.9	Very low	52	Low	48 Å²	48	67.4 Å²	67.4	21%	0.209	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-66.8	-22.9	-174.4	-44.4	-176.4	-178.4	-177.3	0	112.5	Y52 K56 C57 H240 F298 Y299	Y52-K54 PolarHBondContact O-N 3.07Å; K54-K56 PolarHBondContact O-N 3.48Å; K54-C57 PolarHBondContact O-N 3.49Å; K54-H240 WeakPolarHBondContact CD-CD2 3.28Å; K54-H240 WeakPolarHBondContact CD-NE2 3.41Å; K54-H240 WeakPolarHBondContact CE-CD2 3.47Å; K54-H240 WeakPolarHBondContact CE-NE2 3.31Å; K54-H240 VanDerWaalsContact CG-CE1 3.49Å; K54-H240 WeakPolarHBondContact CG-CE1 3.18Å; K54-H240 VanDerWaalsContact CG-NE2 3.26Å; K54-H240 WeakPolarHBondContact CG-NE2 3.16Å; K54-H240 PolarHBondContact NZ-CD2 3.47Å; K54-H240 VanDerWaalsContact NZ-CD2 3.27Å; K54-F298 HydrophobicContact CB-CD1 4.04Å; K54-F298 HydrophobicContact CB-CD2 4.06Å; K54-F298 HydrophobicContact CB-CE1 3.89Å; K54-F298 HydrophobicContact CB-CE2 3.9Å; K54-F298 HydrophobicContact CB-CG 4.11Å; K54-F298 HydrophobicContact CB-CZ 3.8Å; K54-F298 HydrophobicContact CD-CD1 4.26Å; K54-F298 HydrophobicContact CD-CE1 3.91Å; K54-F298 HydrophobicContact CD-CZ 4.44Å; K54-F298 VanDerWaalsContact O-CD2 3.22Å; K54-F298 WeakPolarHBondContact O-CD2 3.33Å; K54-F298 WeakPolarHBondContact O-CE2 3.2Å; K54-Y299 PolarHBondContact NZ-OH 3.07Å
55	T	47.3	Very low	51.8	Low	27 Å²	27	66.8 Å²	66.8	17%	0.166	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-80.4	-5.6	-177.6	60.4	0	0	0	0	112.9	Y52 G53 L294 F298	Y52-T55 PolarHBondContact N-OG1 3.4Å; Y52-T55 VanDerWaalsContact N-OG1 3.12Å; Y52-T55 PolarHBondContact O-OG1 2.99Å; G53-T55 PolarHBondContact O-N 2.88Å; T55-L294 HydrophobicContact CG2-CB 3.74Å; T55-L294 WeakPolarHBondContact CG2-O 3.34Å; T55-F298 HydrophobicContact CG2-CB 4.34Å
56	K	52.4	Low	51.7	Low	34 Å²	34	61.9 Å²	61.9	15%	0.148	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-91.6	-9.8	171.5	-66	-170.8	169.5	-168	0	113.8	D48 R51 G53 K54 G58 D70	D48-K56 WeakPolarHBondContact OD1-CE 3.42Å; D48-K56 IonicContact OD1-NZ 3.94Å; D48-K56 PolarHBondContact OD1-NZ 2.92Å; R51-K56 HydrophobicContact CB-CG 4.13Å; R51-K56 WeakPolarHBondContact O-CE 3.35Å; G53-K56 PolarHBondContact O-N 3.35Å; K54-K56 PolarHBondContact O-N 3.48Å; K56-G58 PolarHBondContact O-N 2.98Å; K56-D70 IonicContact NZ-OD1 2.81Å; K56-D70 PolarHBondContact NZ-OD1 3.44Å
57	C	40.1	Very low	51.6	Low	97 Å²	97	65.5 Å²	65.5	66%	0.655	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	106.6	-177.8	-99	0	0	0	0	111.3	K54	K54-C57 PolarHBondContact O-N 3.49Å
58	G	43.8	Very low	51.6	Low	82 Å²	82	67.1 Å²	67.1	85%	0.845	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	146.2	0.6	169.4	0	0	0	0	0	117.7	K56	K56-G58 PolarHBondContact O-N 2.98Å
59	E	46.3	Very low	51.9	Low	132 Å²	132	72 Å²	72	62%	0.617	43%	0.426	S	S	*	.	S	Bend	trans	-116.4	160.6	-176.7	-89	175.8	-170.9	0	0	112.5	R51	R51-E59 IonicContact CZ-OE1 3.93Å; R51-E59 VanDerWaalsContact NH1-CD 3.27Å; R51-E59 IonicContact NH1-OE1 2.89Å; R51-E59 PolarHBondContact NH1-OE1 3.47Å; R51-E59 IonicContact NH1-OE2 3.18Å; R51-E59 PolarHBondContact NH1-OE2 2.88Å; R51-E59 VanDerWaalsContact NH1-OE2 3.15Å
60	P	43.2	Very low	52.4	Low	107 Å²	107	70 Å²	70	70%	0.695	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-55.5	158.4	-174.5	19	-31.8	0	0	0	114.3	R62	P60-R62 PolarHBondContact O-N 3.47Å
61	P	45.8	Very low	52.9	Low	127 Å²	127	70.2 Å²	70.2	83%	0.825	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-58.4	124.6	-173.5	22	-31.6	0	0	0	111.7
62	R	51.3	Low	53.5	Low	58 Å²	58	68.8 Å²	68.8	22%	0.219	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-68.1	153.1	-175.3	-67.6	175.3	174.5	-155.8	-17.5	113	D48 P60 R67	D48-R62 VanDerWaalsContact CG-NH1 3.27Å; D48-R62 IonicContact OD1-CZ 3.61Å; D48-R62 IonicContact OD1-NH1 3.02Å; D48-R62 PolarHBondContact OD1-NH1 3.26Å; D48-R62 IonicContact OD1-NH2 3.06Å; D48-R62 PolarHBondContact OD1-NH2 2.97Å; D48-R62 IonicContact OD2-CZ 3.39Å; D48-R62 IonicContact OD2-NH1 3.99Å; D48-R62 PolarHBondContact OD2-NH1 3.25Å; D48-R62 VanDerWaalsContact OD2-NH1 3.17Å; D48-R62 IonicContact OD2-NH2 3.67Å; P60-R62 PolarHBondContact O-N 3.47Å; R62-R67 HydrophobicContact CB-CG 4.4Å; R62-R67 PolarHBondContact O-NE 3.2Å; R62-R67 VanDerWaalsContact O-NE 3.14Å; R62-R67 PolarHBondContact O-NH2 2.84Å
63	P	55.8	Low	54.3	Low	89 Å²	89	69 Å²	69	58%	0.578	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-53	141.5	168.8	-22.6	33.4	0	0	0	111.1	A65 C66	P63-A65 PolarHBondContact O-N 2.71Å; P63-C66 PolarHBondContact O-N 3.27Å; P63-C66 VanDerWaalsContact O-N 3.15Å
64	A	51.5	Low	55.2	Low	74 Å²	74	75.8 Å²	75.8	61%	0.612	44%	0.443	S	S	*	.	H	α-helix	trans	-58.5	-32.5	-177.2	0	0	0	0	0	112.9	C66 R67 A68	A64-C66 PolarHBondContact O-N 3.44Å; A64-R67 PolarHBondContact O-N 2.87Å; A64-A68 PolarHBondContact O-N 2.84Å
65	A	51.9	Low	56.8	Low	66 Å²	66	77.7 Å²	77.7	55%	0.545	45%	0.449	S	S	.	.	H	α-helix	trans	-62	-37.9	177.1	0	0	0	0	0	113.4	P63 R67 A68 F69	P63-A65 PolarHBondContact O-N 2.71Å; A65-R67 VanDerWaalsContact C-N 3.31Å; A65-R67 PolarHBondContact O-N 3.43Å; A65-A68 PolarHBondContact O-N 3.46Å; A65-F69 VanDerWaalsContact O-CD2 3.24Å; A65-F69 WeakPolarHBondContact O-CD2 3.29Å
66	C	51.9	Low	58.4	Low	36 Å²	36	78.9 Å²	78.9	24%	0.243	45%	0.453	C	S	.	.	H	α-helix	trans	-72	-26.8	177.5	-59.6	0	0	0	0	112.5	P63 A64	P63-C66 PolarHBondContact O-N 3.27Å; P63-C66 VanDerWaalsContact O-N 3.15Å; A64-C66 PolarHBondContact O-N 3.44Å
67	R	57.5	Low	60	Low	145 Å²	145	78.1 Å²	78.1	55%	0.547	45%	0.451	S	S	.	.	H	α-helix	trans	-77.7	-21.1	176.5	-72.3	-176.6	-88.3	164	-7.1	113.2	R62 A64 A65 F69 D70	R62-R67 HydrophobicContact CB-CG 4.4Å; R62-R67 PolarHBondContact O-NE 3.2Å; R62-R67 VanDerWaalsContact O-NE 3.14Å; R62-R67 PolarHBondContact O-NH2 2.84Å; A64-R67 PolarHBondContact O-N 2.87Å; A65-R67 VanDerWaalsContact C-N 3.31Å; A65-R67 PolarHBondContact O-N 3.43Å; R67-F69 PolarHBondContact O-N 2.83Å; R67-D70 PolarHBondContact O-N 3Å
68	A	58.7	Low	62.5	Low	79 Å²	79	76.2 Å²	76.2	65%	0.653	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-23	176.4	0	0	0	0	0	112.8	A64 A65	A64-A68 PolarHBondContact O-N 2.84Å; A65-A68 PolarHBondContact O-N 3.46Å
69	F	62.4	Low	64.8	Low	114 Å²	114	72.7 Å²	72.7	50%	0.5	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	14.3	-178.6	-61	-69.1	0	0	0	113.6	A65 R67 H159 V160	A65-F69 VanDerWaalsContact O-CD2 3.24Å; A65-F69 WeakPolarHBondContact O-CD2 3.29Å; R67-F69 PolarHBondContact O-N 2.83Å; F69-H159 CarbonylContact O-C 3.52Å; F69-V160 HydrophobicContact CB-CB 4.39Å; F69-V160 HydrophobicContact CB-CG1 3.87Å; F69-V160 HydrophobicContact CD1-CG1 3.88Å; F69-V160 HydrophobicContact CG-CG1 4.25Å; F69-V160 WeakPolarHBondContact O-CB 3.44Å; F69-V160 PolarHBondContact O-N 2.94Å
70	D	69.5	Low	67.1	Low	30 Å²	30	66.7 Å²	66.7	16%	0.16	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	124.2	179.9	-93.7	-25.8	0	0	0	110.4	K56 R67 M157 I158	K56-D70 IonicContact NZ-OD1 2.81Å; K56-D70 PolarHBondContact NZ-OD1 3.44Å; R67-D70 PolarHBondContact O-N 3Å; D70-M157 HydrophobicContact CB-CB 3.59Å; D70-M157 HydrophobicContact CB-CE 3.98Å; D70-M157 HydrophobicContact CB-CG 4.09Å; D70-M157 VanDerWaalsContact O-CE 3.27Å; D70-M157 WeakPolarHBondContact O-CE 3.33Å; D70-I158 CarbonylContact C-O 3.5Å; D70-I158 WeakPolarHBondContact CA-O 3.49Å
71	V	68.1	Low	69.6	Low	22 Å²	22	65.1 Å²	65.1	13%	0.133	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	139.7	179	179.5	0	0	0	0	109.6	K73 Y75 M157 I158 V160 Y163	V71-K73 PolarHBondContact O-N 2.97Å; V71-Y75 HydrophobicContact CG1-CD2 3.25Å; V71-Y75 HydrophobicContact CG1-CE2 3.91Å; V71-Y75 HydrophobicContact CG1-CG 4.05Å; V71-M157 CarbonylContact O-C 3.6Å; V71-M157 VanDerWaalsContact O-CA 3.3Å; V71-M157 WeakPolarHBondContact O-CA 3.21Å; V71-I158 HydrophobicContact CB-CG1 4.07Å; V71-I158 HydrophobicContact CG1-CD1 4.47Å; V71-I158 HydrophobicContact CG1-CG1 4.45Å; V71-I158 PolarHBondContact N-O 2.95Å; V71-I158 WeakPolarHBondContact O-CG1 3.14Å; V71-I158 PolarHBondContact O-N 2.86Å; V71-V160 HydrophobicContact CG2-CB 4.27Å; V71-V160 HydrophobicContact CG2-CG2 4.29Å; V71-Y163 HydrophobicContact CG1-CD2 4.1Å; V71-Y163 HydrophobicContact CG1-CE2 4.46Å; V71-Y163 HydrophobicContact CG1-CG 4.29Å
72	P	71.9	Confident	72.1	Confident	28 Å²	28	62.1 Å²	62.1	18%	0.182	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	134.3	179.5	-25.5	35.1	0	0	0	113.3	R74 Y75 M157	P72-R74 HydrophobicContact CB-CG 3.61Å; P72-R74 PolarHBondContact O-N 3.13Å; P72-Y75 HydrophobicContact CG-CE2 4.47Å; P72-Y75 WeakPolarHBondContact O-CB 3.34Å; P72-Y75 PolarHBondContact O-N 2.96Å; P72-M157 HydrophobicContact CB-SD 4.38Å; P72-M157 HydrophobicContact CG-CE 4.03Å; P72-M157 HydrophobicContact CG-SD 4.34Å
73	K	70.1	Confident	74.2	Confident	53 Å²	53	59.4 Å²	59.4	23%	0.23	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-56.1	-25.5	176.6	178.3	156.8	-166.2	171.2	0	114.5	Y52 V71 Y75 F76 F153 V156	Y52-K73 HydrophobicContact CE1-CD 4.01Å; Y52-K73 HydrophobicContact CE1-CG 4.49Å; Y52-K73 HydrophobicContact CE2-CD 4.48Å; Y52-K73 VanDerWaalsContact OH-CA 3.24Å; Y52-K73 WeakPolarHBondContact OH-CA 3.36Å; Y52-K73 WeakPolarHBondContact OH-CB 3.4Å; Y52-K73 VanDerWaalsContact OH-CD 3.26Å; Y52-K73 WeakPolarHBondContact OH-CD 3.31Å; Y52-K73 WeakPolarHBondContact OH-CG 3.24Å; V71-K73 PolarHBondContact O-N 2.97Å; K73-Y75 PolarHBondContact O-N 3.16Å; K73-Y75 VanDerWaalsContact O-N 3.14Å; K73-F76 VanDerWaalsContact O-CB 3.22Å; K73-F76 WeakPolarHBondContact O-CB 3.29Å; K73-F76 PolarHBondContact O-N 2.95Å; K73-F153 HydrophobicContact CG-CD1 3.91Å; K73-F153 HydrophobicContact CG-CE1 4.45Å; K73-V156 WeakPolarHBondContact CB-O 3.44Å; K73-V156 PolarHBondContact N-O 3.29Å
74	R	73.7	Confident	76.2	Confident	143 Å²	143	56.2 Å²	56.2	54%	0.54	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-58.2	-21.9	173.4	55.1	177.2	174.5	-147	-0.3	113.7	P72 F76 S77 F153	P72-R74 HydrophobicContact CB-CG 3.61Å; P72-R74 PolarHBondContact O-N 3.13Å; R74-F76 PolarHBondContact O-N 3.47Å; R74-S77 PolarHBondContact O-N 2.98Å; R74-S77 PolarHBondContact O-OG 3.44Å; R74-F153 HydrophobicContact CB-CB 4.32Å; R74-F153 HydrophobicContact CB-CD2 4.41Å; R74-F153 HydrophobicContact CB-CG 4.49Å
75	Y	80.1	Confident	78.4	Confident	88 Å²	88	57.5 Å²	57.5	35%	0.345	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-74.8	1.3	175.9	-65.6	0.5	0	0	0	113.1	V71 P72 K73 S77 H78	V71-Y75 HydrophobicContact CG1-CD2 3.25Å; V71-Y75 HydrophobicContact CG1-CE2 3.91Å; V71-Y75 HydrophobicContact CG1-CG 4.05Å; P72-Y75 HydrophobicContact CG-CE2 4.47Å; P72-Y75 WeakPolarHBondContact O-CB 3.34Å; P72-Y75 PolarHBondContact O-N 2.96Å; K73-Y75 PolarHBondContact O-N 3.16Å; K73-Y75 VanDerWaalsContact O-N 3.14Å; Y75-S77 PolarHBondContact O-N 3.23Å; Y75-H78 AromaticContact CD1-CE1 3.51Å; Y75-H78 AromaticContact CD1-NE2 3.81Å; Y75-H78 AromaticContact CD2-CE1 3.71Å; Y75-H78 AromaticContact CG-CE1 3.38Å; Y75-H78 AromaticContact CG-ND1 3.74Å; Y75-H78 VanDerWaalsContact O-CB 3.24Å; Y75-H78 WeakPolarHBondContact O-CB 3.27Å; Y75-H78 PolarHBondContact O-N 3.3Å
76	F	79.8	Confident	80.6	Confident	53 Å²	53	56.8 Å²	56.8	23%	0.232	28%	0.279	C	S	.	.	H	α-helix	trans	-57.7	-27.1	168.3	-157.4	-106.6	0	0	0	112.4	K73 R74 H78 F79 Y80 F153	K73-F76 VanDerWaalsContact O-CB 3.22Å; K73-F76 WeakPolarHBondContact O-CB 3.29Å; K73-F76 PolarHBondContact O-N 2.95Å; R74-F76 PolarHBondContact O-N 3.47Å; F76-H78 VanDerWaalsContact C-N 3.27Å; F76-H78 PolarHBondContact O-N 2.95Å; F76-F79 AromaticContact CD2-CD2 3.44Å; F76-F79 HydrophobicContact CD2-CD2 3.44Å; F76-F79 VanDerWaalsContact CD2-CD2 3.44Å; F76-F79 AromaticContact CD2-CE2 3.3Å; F76-F79 HydrophobicContact CD2-CE2 3.3Å; F76-F79 HydrophobicContact CD2-CZ 4.46Å; F76-F79 AromaticContact CE2-CD2 3.62Å; F76-F79 HydrophobicContact CE2-CD2 3.62Å; F76-F79 AromaticContact CE2-CE2 3.59Å; F76-F79 HydrophobicContact CE2-CE2 3.59Å; F76-F79 HydrophobicContact CG-CD2 4.03Å; F76-F79 HydrophobicContact CG-CE2 4.22Å; F76-F79 HydrophobicContact CZ-CD2 4.36Å; F76-F79 WeakPolarHBondContact O-CB 3.27Å; F76-F79 PolarHBondContact O-N 3.42Å; F76-Y80 HydrophobicContact CD1-CD2 4.36Å; F76-Y80 AromaticContact CD1-CE2 3.55Å; F76-Y80 HydrophobicContact CD1-CE2 3.55Å; F76-Y80 AromaticContact CE1-CE2 3.36Å; F76-Y80 HydrophobicContact CE1-CE2 3.36Å; F76-Y80 AromaticContact CE1-CZ 3.72Å; F76-Y80 VanDerWaalsContact CE1-OH 3.29Å; F76-Y80 WeakPolarHBondContact CE1-OH 3.46Å; F76-Y80 HydrophobicContact CZ-CE2 4.27Å; F76-Y80 WeakPolarHBondContact O-CD2 3.43Å; F76-F153 HydrophobicContact CB-CE1 4.29Å; F76-F153 HydrophobicContact CB-CZ 4.4Å
77	S	86.9	Confident	82.8	Confident	17 Å²	17	55 Å²	55	12%	0.119	27%	0.267	C	S	.	.	H	α-helix	trans	-59.8	-34.3	170.9	54.6	0	0	0	0	112.8	R74 Y75 F79 Y80 I81	R74-S77 PolarHBondContact O-N 2.98Å; R74-S77 PolarHBondContact O-OG 3.44Å; Y75-S77 PolarHBondContact O-N 3.23Å; S77-F79 VanDerWaalsContact C-N 3.26Å; S77-F79 PolarHBondContact O-N 3.44Å; S77-Y80 PolarHBondContact O-N 2.92Å; S77-Y80 VanDerWaalsContact O-N 3.12Å; S77-I81 WeakPolarHBondContact O-CG1 3.36Å; S77-I81 PolarHBondContact O-N 2.89Å
78	H	92.3	Very high	84.7	Confident	57 Å²	57	49 Å²	49	26%	0.264	25%	0.251	S	S	.	.	H	α-helix	trans	-62.2	-35.3	-179.5	-58.4	173.8	0	0	0	112.1	Y75 F76 Y80 I81 I82 Y163	Y75-H78 AromaticContact CD1-CE1 3.51Å; Y75-H78 AromaticContact CD1-NE2 3.81Å; Y75-H78 AromaticContact CD2-CE1 3.71Å; Y75-H78 AromaticContact CG-CE1 3.38Å; Y75-H78 AromaticContact CG-ND1 3.74Å; Y75-H78 VanDerWaalsContact O-CB 3.24Å; Y75-H78 WeakPolarHBondContact O-CB 3.27Å; Y75-H78 PolarHBondContact O-N 3.3Å; F76-H78 VanDerWaalsContact C-N 3.27Å; F76-H78 PolarHBondContact O-N 2.95Å; H78-Y80 VanDerWaalsContact C-N 3.28Å; H78-Y80 PolarHBondContact O-N 3.33Å; H78-I81 PolarHBondContact O-N 3.49Å; H78-I82 PolarHBondContact O-N 2.94Å; H78-Y163 HydrophobicContact CB-CE2 4.4Å; H78-Y163 AromaticContact ND1-CZ 3.91Å; H78-Y163 PolarHBondContact ND1-OH 2.87Å
79	F	92.6	Very high	86.6	Confident	9 Å²	9	48.8 Å²	48.8	4%	0.039	24%	0.235	C	C	.	.	H	α-helix	trans	-58.1	-44.9	176.6	-55.6	-20.1	0	0	0	110.9	F76 S77 S83 I158 Y163 L167 Y170	F76-F79 AromaticContact CD2-CD2 3.44Å; F76-F79 HydrophobicContact CD2-CD2 3.44Å; F76-F79 VanDerWaalsContact CD2-CD2 3.44Å; F76-F79 AromaticContact CD2-CE2 3.3Å; F76-F79 HydrophobicContact CD2-CE2 3.3Å; F76-F79 HydrophobicContact CD2-CZ 4.46Å; F76-F79 AromaticContact CE2-CD2 3.62Å; F76-F79 HydrophobicContact CE2-CD2 3.62Å; F76-F79 AromaticContact CE2-CE2 3.59Å; F76-F79 HydrophobicContact CE2-CE2 3.59Å; F76-F79 HydrophobicContact CG-CD2 4.03Å; F76-F79 HydrophobicContact CG-CE2 4.22Å; F76-F79 HydrophobicContact CZ-CD2 4.36Å; F76-F79 WeakPolarHBondContact O-CB 3.27Å; F76-F79 PolarHBondContact O-N 3.42Å; S77-F79 VanDerWaalsContact C-N 3.26Å; S77-F79 PolarHBondContact O-N 3.44Å; F79-S83 VanDerWaalsContact O-CB 3.27Å; F79-S83 WeakPolarHBondContact O-CB 3.39Å; F79-S83 PolarHBondContact O-N 3.44Å; F79-I158 HydrophobicContact CZ-CD1 4.12Å; F79-Y163 HydrophobicContact CD1-CD2 4.33Å; F79-Y163 HydrophobicContact CD1-CE2 4.19Å; F79-Y163 AromaticContact CE1-CD2 3.23Å; F79-Y163 HydrophobicContact CE1-CD2 3.23Å; F79-Y163 AromaticContact CE1-CE2 3.47Å; F79-Y163 HydrophobicContact CE1-CE2 3.47Å; F79-Y163 VanDerWaalsContact CE1-CE2 3.47Å; F79-Y163 AromaticContact CE1-CG 3.98Å; F79-Y163 HydrophobicContact CE1-CG 3.98Å; F79-Y163 VanDerWaalsContact CE1-O 3.27Å; F79-Y163 WeakPolarHBondContact CE1-O 3.25Å; F79-Y163 AromaticContact CZ-CD2 3.6Å; F79-Y163 HydrophobicContact CZ-CD2 3.6Å; F79-Y163 HydrophobicContact CZ-CE2 4.21Å; F79-Y163 HydrophobicContact CZ-CG 4.34Å; F79-L167 HydrophobicContact CD1-CD2 3.63Å; F79-L167 HydrophobicContact CD1-CG 4.03Å; F79-L167 HydrophobicContact CE1-CD2 4.2Å; F79-L167 HydrophobicContact CE1-CG 4.14Å; F79-Y170 HydrophobicContact CB-CD2 3.86Å; F79-Y170 HydrophobicContact CB-CE2 3.7Å
80	Y	94.3	Very high	88.2	Confident	5 Å²	5	43.4 Å²	43.4	2%	0.02	21%	0.211	C	C	.	.	H	α-helix	trans	-78.2	-30.7	179.8	-59.5	-66.4	0	0	0	113.1	F76 S77 H78 S83 V84 R143 C147 Y170	F76-Y80 HydrophobicContact CD1-CD2 4.36Å; F76-Y80 AromaticContact CD1-CE2 3.55Å; F76-Y80 HydrophobicContact CD1-CE2 3.55Å; F76-Y80 AromaticContact CE1-CE2 3.36Å; F76-Y80 HydrophobicContact CE1-CE2 3.36Å; F76-Y80 AromaticContact CE1-CZ 3.72Å; F76-Y80 VanDerWaalsContact CE1-OH 3.29Å; F76-Y80 WeakPolarHBondContact CE1-OH 3.46Å; F76-Y80 HydrophobicContact CZ-CE2 4.27Å; F76-Y80 WeakPolarHBondContact O-CD2 3.43Å; S77-Y80 PolarHBondContact O-N 2.92Å; S77-Y80 VanDerWaalsContact O-N 3.12Å; H78-Y80 VanDerWaalsContact C-N 3.28Å; H78-Y80 PolarHBondContact O-N 3.33Å; Y80-S83 PolarHBondContact O-N 3.26Å; Y80-V84 WeakPolarHBondContact O-CB 3.29Å; Y80-V84 WeakPolarHBondContact O-CG2 3.41Å; Y80-V84 PolarHBondContact O-N 3.48Å; Y80-R143 HydrophobicContact CD1-CB 3.41Å; Y80-R143 VanDerWaalsContact CD1-CB 3.41Å; Y80-R143 HydrophobicContact CD1-CG 4.28Å; Y80-R143 HydrophobicContact CD2-CB 4.05Å; Y80-R143 HydrophobicContact CE1-CB 3.24Å; Y80-R143 HydrophobicContact CE1-CG 3.71Å; Y80-R143 HydrophobicContact CE2-CB 3.89Å; Y80-R143 HydrophobicContact CG-CB 3.82Å; Y80-R143 PolarHBondContact OH-NE 3.04Å; Y80-R143 PolarHBondContact OH-NH2 3.13Å; Y80-C147 VanDerWaalsContact CD2-SG 3.57Å; Y80-C147 VanDerWaalsContact CE2-SG 3.55Å; Y80-Y170 HydrophobicContact CD1-CE2 4.42Å; Y80-Y170 HydrophobicContact CE1-CE1 4.27Å; Y80-Y170 HydrophobicContact CE1-CE2 4.2Å; Y80-Y170 AromaticContact CE1-CZ 3.59Å; Y80-Y170 WeakPolarHBondContact CE1-OH 3.35Å; Y80-Y170 PolarHBondContact OH-OH 3.39Å
81	I	96.3	Very high	89.5	Confident	75 Å²	75	43 Å²	43	39%	0.385	21%	0.209	S	C	.	.	H	α-helix	trans	-58.7	-52.5	170.4	-67.7	169.5	0	0	0	109.5	S77 H78 S83 V84 V85 L144	S77-I81 WeakPolarHBondContact O-CG1 3.36Å; S77-I81 PolarHBondContact O-N 2.89Å; H78-I81 PolarHBondContact O-N 3.49Å; I81-S83 VanDerWaalsContact C-N 3.31Å; I81-S83 PolarHBondContact O-N 3.47Å; I81-V84 PolarHBondContact O-N 2.92Å; I81-V85 WeakPolarHBondContact O-CG2 3.35Å; I81-V85 PolarHBondContact O-N 2.78Å; I81-L144 HydrophobicContact CD1-CD1 4.45Å; I81-L144 HydrophobicContact CG1-CD1 3.62Å; I81-L144 HydrophobicContact CG1-CD2 4.1Å
82	I	96.6	Very high	90.8	Very high	64 Å²	64	49.6 Å²	49.6	33%	0.328	23%	0.232	S	C	.	.	H	α-helix	trans	-62.6	-42.1	179.3	-77.4	166.6	0	0	0	110.6	H78 V84 V85 W86 L167 V171	H78-I82 PolarHBondContact O-N 2.94Å; I82-V84 PolarHBondContact O-N 3.32Å; I82-V85 PolarHBondContact O-N 2.88Å; I82-W86 WeakPolarHBondContact O-CB 3.4Å; I82-W86 PolarHBondContact O-N 3.46Å; I82-L167 HydrophobicContact CB-CD2 4.45Å; I82-L167 HydrophobicContact CD1-CD1 4.49Å; I82-L167 HydrophobicContact CD1-CD2 3.38Å; I82-L167 HydrophobicContact CD1-CG 4.47Å; I82-L167 HydrophobicContact CG1-CD2 4.43Å; I82-V171 HydrophobicContact CG2-CG2 4.19Å
83	S	96.6	Very high	91.8	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-61	-44.4	175.9	-166.4	0	0	0	0	113.1	F79 Y80 I81 N87 S140 Y170	F79-S83 VanDerWaalsContact O-CB 3.27Å; F79-S83 WeakPolarHBondContact O-CB 3.39Å; F79-S83 PolarHBondContact O-N 3.44Å; Y80-S83 PolarHBondContact O-N 3.26Å; I81-S83 VanDerWaalsContact C-N 3.31Å; I81-S83 PolarHBondContact O-N 3.47Å; S83-N87 WeakPolarHBondContact O-CB 3.47Å; S83-N87 PolarHBondContact O-N 2.83Å; S83-N87 PolarHBondContact O-ND2 2.93Å; S83-N87 PolarHBondContact OG-ND2 3.47Å; S83-S140 WeakPolarHBondContact OG-CB 3.44Å; S83-S140 PolarHBondContact OG-OG 2.92Å; S83-Y170 WeakPolarHBondContact OG-CD1 3.38Å
84	V	98	Very high	92.8	Very high	23 Å²	23	46.2 Å²	46.2	14%	0.139	22%	0.215	C	C	.	.	H	α-helix	trans	-64.8	-45.7	178.7	167.7	0	0	0	0	110.9	Y80 I81 I82 G88 W137 L141 L144	Y80-V84 WeakPolarHBondContact O-CB 3.29Å; Y80-V84 WeakPolarHBondContact O-CG2 3.41Å; Y80-V84 PolarHBondContact O-N 3.48Å; I81-V84 PolarHBondContact O-N 2.92Å; I82-V84 PolarHBondContact O-N 3.32Å; V84-G88 WeakPolarHBondContact O-CA 3.27Å; V84-G88 PolarHBondContact O-N 3.02Å; V84-W137 PolarHBondContact O-NE1 3.38Å; V84-W137 VanDerWaalsContact O-NE1 3.13Å; V84-L141 HydrophobicContact CG1-CD1 4.38Å; V84-L141 HydrophobicContact CG2-CB 4.22Å; V84-L141 HydrophobicContact CG2-CD1 4.38Å; V84-L144 HydrophobicContact CG2-CB 4.49Å; V84-L144 HydrophobicContact CG2-CD2 4.18Å
85	V	98.3	Very high	93.6	Very high	100 Å²	100	41.2 Å²	41.2	61%	0.606	20%	0.201	S	C	*	.	H	α-helix	trans	-66.5	-51.8	180	172.8	0	0	0	0	110.7	I81 I82 F89	I81-V85 WeakPolarHBondContact O-CG2 3.35Å; I81-V85 PolarHBondContact O-N 2.78Å; I82-V85 PolarHBondContact O-N 2.88Å; V85-F89 WeakPolarHBondContact O-CB 3.32Å; V85-F89 PolarHBondContact O-N 2.93Å
86	W	97.9	Very high	94	Very high	51 Å²	51	39.2 Å²	39.2	19%	0.193	20%	0.195	C	C	.	.	H	α-helix	trans	-66.8	-52.9	-176.9	177.6	-108.2	0	0	0	112.5	I82 G88 F89 L90 W107 V171 L175	I82-W86 WeakPolarHBondContact O-CB 3.4Å; I82-W86 PolarHBondContact O-N 3.46Å; W86-G88 VanDerWaalsContact C-N 3.27Å; W86-G88 PolarHBondContact O-N 3.23Å; W86-F89 HydrophobicContact CE3-CD1 4.48Å; W86-F89 HydrophobicContact CZ3-CD1 4.37Å; W86-F89 WeakPolarHBondContact O-CB 3.36Å; W86-F89 PolarHBondContact O-N 3.35Å; W86-F89 VanDerWaalsContact O-N 3.16Å; W86-L90 HydrophobicContact CD2-CG 4.47Å; W86-L90 HydrophobicContact CH2-CD2 4.38Å; W86-L90 HydrophobicContact CZ2-CD1 4.25Å; W86-L90 HydrophobicContact CZ2-CD2 3.99Å; W86-L90 HydrophobicContact CZ2-CG 4.36Å; W86-L90 WeakPolarHBondContact O-CG 3.36Å; W86-L90 PolarHBondContact O-N 3.21Å; W86-W107 AromaticContact CH2-CH2 3.73Å; W86-W107 HydrophobicContact CH2-CH2 3.73Å; W86-W107 AromaticContact CH2-CZ3 3.97Å; W86-W107 HydrophobicContact CH2-CZ3 3.97Å; W86-W107 AromaticContact CZ3-CH2 3.98Å; W86-W107 HydrophobicContact CZ3-CH2 3.98Å; W86-V171 HydrophobicContact CD2-CG1 4.43Å; W86-V171 HydrophobicContact CG-CG2 4.31Å; W86-V171 HydrophobicContact CZ2-CG1 4.03Å; W86-V171 PolarHBondContact NE1-O 3.04Å; W86-V171 VanDerWaalsContact NE1-O 3.13Å; W86-L175 HydrophobicContact CZ2-CD1 4.15Å; W86-L175 HydrophobicContact CZ2-CD2 3.85Å; W86-L175 HydrophobicContact CZ2-CG 3.92Å
87	N	97.8	Very high	94.3	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-70.8	-27.2	-178.9	-62.9	-57.3	0	0	0	111.7	S83 L90 L91 L133 L136 Y170 G174	S83-N87 WeakPolarHBondContact O-CB 3.47Å; S83-N87 PolarHBondContact O-N 2.83Å; S83-N87 PolarHBondContact O-ND2 2.93Å; S83-N87 PolarHBondContact OG-ND2 3.47Å; N87-L90 PolarHBondContact O-N 3.38Å; N87-L91 WeakPolarHBondContact O-CB 3.4Å; N87-L91 PolarHBondContact O-N 3.13Å; N87-L133 HydrophobicContact CB-CD1 4.42Å; N87-L136 HydrophobicContact CB-CD2 4.37Å; N87-Y170 PolarHBondContact ND2-O 2.84Å; N87-G174 WeakPolarHBondContact OD1-CA 3.42Å
88	G	97.9	Very high	94.1	Very high	19 Å²	19	36.6 Å²	36.6	20%	0.196	18%	0.182	C	C	.	.	H	α-helix	trans	-65.7	-42	169.9	0	0	0	0	0	112	V84 W86 L91 W92 W137	V84-G88 WeakPolarHBondContact O-CA 3.27Å; V84-G88 PolarHBondContact O-N 3.02Å; W86-G88 VanDerWaalsContact C-N 3.27Å; W86-G88 PolarHBondContact O-N 3.23Å; G88-L91 PolarHBondContact O-N 3.4Å; G88-W92 WeakPolarHBondContact O-CB 3.35Å; G88-W92 PolarHBondContact O-N 2.93Å; G88-W137 VanDerWaalsContact CA-CD1 3.43Å; G88-W137 VanDerWaalsContact N-CD1 3.33Å
89	F	97.6	Very high	93.7	Very high	74 Å²	74	39.2 Å²	39.2	33%	0.325	19%	0.193	S	C	.	.	H	α-helix	trans	-62.9	-45.2	172.5	169.8	-100	0	0	0	112.4	V85 W86 L91 W92 C93 P105 W107 L108	V85-F89 WeakPolarHBondContact O-CB 3.32Å; V85-F89 PolarHBondContact O-N 2.93Å; W86-F89 HydrophobicContact CE3-CD1 4.48Å; W86-F89 HydrophobicContact CZ3-CD1 4.37Å; W86-F89 WeakPolarHBondContact O-CB 3.36Å; W86-F89 PolarHBondContact O-N 3.35Å; W86-F89 VanDerWaalsContact O-N 3.16Å; F89-L91 VanDerWaalsContact C-N 3.33Å; F89-L91 PolarHBondContact O-N 3.06Å; F89-W92 WeakPolarHBondContact O-CB 3.42Å; F89-W92 PolarHBondContact O-N 2.86Å; F89-C93 WeakPolarHBondContact CZ-SG 3.44Å; F89-C93 PolarHBondContact O-N 3.39Å; F89-C93 PolarHBondContact O-SG 3.14Å; F89-P105 HydrophobicContact CZ-CG 4.38Å; F89-W107 AromaticContact CE1-CH2 3.77Å; F89-W107 HydrophobicContact CE1-CH2 3.77Å; F89-W107 AromaticContact CE1-CZ2 3.59Å; F89-W107 HydrophobicContact CE1-CZ2 3.59Å; F89-W107 HydrophobicContact CZ-CH2 4.39Å; F89-W107 AromaticContact CZ-CZ2 3.73Å; F89-W107 HydrophobicContact CZ-CZ2 3.73Å; F89-L108 HydrophobicContact CE1-CD2 4.49Å
90	L	96.5	Very high	93.3	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-62.7	-41.1	175.6	-64.1	-174.9	0	0	0	111.7	W86 N87 C93 L94 L108 L133 G174 L178	W86-L90 HydrophobicContact CD2-CG 4.47Å; W86-L90 HydrophobicContact CH2-CD2 4.38Å; W86-L90 HydrophobicContact CZ2-CD1 4.25Å; W86-L90 HydrophobicContact CZ2-CD2 3.99Å; W86-L90 HydrophobicContact CZ2-CG 4.36Å; W86-L90 WeakPolarHBondContact O-CG 3.36Å; W86-L90 PolarHBondContact O-N 3.21Å; N87-L90 PolarHBondContact O-N 3.38Å; L90-C93 PolarHBondContact O-N 3.45Å; L90-L94 WeakPolarHBondContact O-CB 3.21Å; L90-L94 PolarHBondContact O-N 3.42Å; L90-L108 HydrophobicContact CD2-CD1 3.9Å; L90-L108 HydrophobicContact CD2-CD2 3.96Å; L90-L133 HydrophobicContact CB-CD2 4.1Å; L90-G174 VanDerWaalsContact CD1-C 3.45Å; L90-L178 HydrophobicContact CD2-CD2 3.91Å
91	L	96.3	Very high	92.6	Very high	23 Å²	23	45 Å²	45	12%	0.12	23%	0.229	C	C	.	.	H	α-helix	trans	-62.9	-43.2	176.3	179.7	59.9	0	0	0	111.3	N87 G88 F89 L94 T95 F130 L133 V134 W137	N87-L91 WeakPolarHBondContact O-CB 3.4Å; N87-L91 PolarHBondContact O-N 3.13Å; G88-L91 PolarHBondContact O-N 3.4Å; F89-L91 VanDerWaalsContact C-N 3.33Å; F89-L91 PolarHBondContact O-N 3.06Å; L91-L94 PolarHBondContact O-N 2.98Å; L91-T95 WeakPolarHBondContact O-CB 3.41Å; L91-T95 PolarHBondContact O-N 3.37Å; L91-T95 PolarHBondContact O-OG1 3.13Å; L91-F130 HydrophobicContact CD1-CD2 3.97Å; L91-F130 HydrophobicContact CD1-CE2 3.74Å; L91-L133 HydrophobicContact CB-CD2 4.08Å; L91-L133 HydrophobicContact CB-CG 4.08Å; L91-L133 HydrophobicContact CD1-CB 4.3Å; L91-L133 HydrophobicContact CD1-CD2 4.32Å; L91-L133 HydrophobicContact CD1-CG 4.25Å; L91-V134 HydrophobicContact CD1-CG2 3.71Å; L91-V134 HydrophobicContact CD2-CG2 4.05Å; L91-W137 HydrophobicContact CD2-CB 4.3Å; L91-W137 HydrophobicContact CD2-CD2 4.46Å; L91-W137 HydrophobicContact CD2-CG 4.38Å
92	W	95.4	Very high	92	Very high	159 Å²	159	43 Å²	43	60%	0.602	22%	0.223	S	C	*	.	H	α-helix	trans	-57.3	-50.7	173	174.2	-100.4	0	0	0	110.9	G88 F89 L94 T95 Q96	G88-W92 WeakPolarHBondContact O-CB 3.35Å; G88-W92 PolarHBondContact O-N 2.93Å; F89-W92 WeakPolarHBondContact O-CB 3.42Å; F89-W92 PolarHBondContact O-N 2.86Å; W92-L94 VanDerWaalsContact C-N 3.34Å; W92-L94 PolarHBondContact O-N 3.21Å; W92-T95 WeakPolarHBondContact O-CB 3.41Å; W92-T95 PolarHBondContact O-N 2.73Å; W92-T95 VanDerWaalsContact O-N 3.15Å; W92-Q96 HydrophobicContact CD2-CG 4.2Å; W92-Q96 HydrophobicContact CG-CG 4.46Å; W92-Q96 HydrophobicContact CZ2-CG 4.13Å; W92-Q96 VanDerWaalsContact O-CG 3.26Å; W92-Q96 WeakPolarHBondContact O-CG 3.45Å; W92-Q96 PolarHBondContact O-N 3Å
93	C	92.7	Very high	91.4	Very high	10 Å²	10	44.9 Å²	44.9	7%	0.068	24%	0.239	C	C	.	.	H	α-helix	trans	-59.6	-43.9	178.9	-66.6	0	0	0	0	112.3	F89 L90 T95 Q96 S97 F104 L108	F89-C93 WeakPolarHBondContact CZ-SG 3.44Å; F89-C93 PolarHBondContact O-N 3.39Å; F89-C93 PolarHBondContact O-SG 3.14Å; L90-C93 PolarHBondContact O-N 3.45Å; C93-T95 VanDerWaalsContact C-N 3.34Å; C93-Q96 PolarHBondContact O-N 2.8Å; C93-S97 VanDerWaalsContact O-CB 3.3Å; C93-S97 WeakPolarHBondContact O-CB 3.49Å; C93-S97 PolarHBondContact O-N 2.69Å; C93-F104 HydrophobicContact CB-CD1 3.85Å; C93-F104 HydrophobicContact CB-CE1 3.91Å; C93-L108 HydrophobicContact CB-CD2 4.39Å
94	L	90.4	Very high	90.9	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-65.7	-37.9	177.3	-177.2	61	0	0	0	111.5	L90 L91 W92 S97 L98 F104 F130 L133 L178 V181	L90-L94 WeakPolarHBondContact O-CB 3.21Å; L90-L94 PolarHBondContact O-N 3.42Å; L91-L94 PolarHBondContact O-N 2.98Å; W92-L94 VanDerWaalsContact C-N 3.34Å; W92-L94 PolarHBondContact O-N 3.21Å; L94-S97 PolarHBondContact O-N 2.97Å; L94-L98 HydrophobicContact CD1-CD1 3.8Å; L94-L98 HydrophobicContact CD1-CD2 4.34Å; L94-L98 HydrophobicContact CD1-CG 3.82Å; L94-L98 HydrophobicContact CD2-CD1 4.38Å; L94-L98 HydrophobicContact CG-CD1 3.77Å; L94-L98 HydrophobicContact CG-CG 4.16Å; L94-L98 WeakPolarHBondContact O-CB 3.12Å; L94-L98 VanDerWaalsContact O-CG 3.27Å; L94-L98 WeakPolarHBondContact O-CG 3.26Å; L94-L98 PolarHBondContact O-N 3.43Å; L94-F104 HydrophobicContact CB-CE1 4.46Å; L94-F104 HydrophobicContact CD1-CZ 3.93Å; L94-F130 HydrophobicContact CD2-CB 4.08Å; L94-F130 HydrophobicContact CD2-CD2 4.3Å; L94-F130 HydrophobicContact CG-CD2 4.44Å; L94-L133 HydrophobicContact CB-CD2 4.35Å; L94-L133 HydrophobicContact CD2-CD2 3.93Å; L94-L178 HydrophobicContact CB-CD1 4.17Å; L94-L178 HydrophobicContact CD1-CD1 4.06Å; L94-L178 HydrophobicContact CD2-CD1 4.33Å; L94-L178 HydrophobicContact CG-CD1 4.42Å; L94-V181 HydrophobicContact CD1-CG1 4.26Å; L94-V181 HydrophobicContact CD1-CG2 4.05Å
95	T	90.8	Very high	90.5	Very high	39 Å²	39	46.9 Å²	46.9	24%	0.239	25%	0.251	C	S	.	.	H	α-helix	trans	-63.1	-48.4	175.7	-56.2	0	0	0	0	110.8	L91 W92 C93 S97 L98 F99	L91-T95 WeakPolarHBondContact O-CB 3.41Å; L91-T95 PolarHBondContact O-N 3.37Å; L91-T95 PolarHBondContact O-OG1 3.13Å; W92-T95 WeakPolarHBondContact O-CB 3.41Å; W92-T95 PolarHBondContact O-N 2.73Å; W92-T95 VanDerWaalsContact O-N 3.15Å; C93-T95 VanDerWaalsContact C-N 3.34Å; T95-S97 PolarHBondContact O-N 2.79Å; T95-L98 PolarHBondContact O-N 2.9Å; T95-F99 HydrophobicContact CG2-CD2 3.65Å; T95-F99 HydrophobicContact CG2-CE2 4.16Å; T95-F99 WeakPolarHBondContact O-CB 3.37Å; T95-F99 WeakPolarHBondContact O-CD2 3.14Å; T95-F99 PolarHBondContact O-N 3.41Å
96	Q	89.3	Confident	90.1	Very high	45 Å²	45	47.2 Å²	47.2	21%	0.21	26%	0.257	C	S	.	.	H	α-helix	trans	-58.7	-40	176.1	-66	-66.4	-45.9	0	0	111	W92 C93 L100 G101 A102	W92-Q96 HydrophobicContact CD2-CG 4.2Å; W92-Q96 HydrophobicContact CG-CG 4.46Å; W92-Q96 HydrophobicContact CZ2-CG 4.13Å; W92-Q96 VanDerWaalsContact O-CG 3.26Å; W92-Q96 WeakPolarHBondContact O-CG 3.45Å; W92-Q96 PolarHBondContact O-N 3Å; C93-Q96 PolarHBondContact O-N 2.8Å; Q96-L100 CarbonylContact O-C 3.6Å; Q96-L100 WeakPolarHBondContact O-CA 3.42Å; Q96-L100 WeakPolarHBondContact O-CB 3.1Å; Q96-L100 PolarHBondContact O-N 2.9Å; Q96-L100 VanDerWaalsContact O-N 3.09Å; Q96-G101 PolarHBondContact O-N 2.96Å; Q96-G101 VanDerWaalsContact O-N 3.1Å; Q96-A102 HydrophobicContact CB-CB 3.92Å; Q96-A102 PolarHBondContact O-N 3.39Å
97	S	85.6	Confident	89.8	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.007	27%	0.271	C	S	.	.	H	α-helix	trans	-67.6	-47.7	177.9	-172.3	0	0	0	0	113.5	C93 L94 T95 G101 A102 Y189	C93-S97 VanDerWaalsContact O-CB 3.3Å; C93-S97 WeakPolarHBondContact O-CB 3.49Å; C93-S97 PolarHBondContact O-N 2.69Å; L94-S97 PolarHBondContact O-N 2.97Å; T95-S97 PolarHBondContact O-N 2.79Å; S97-G101 WeakPolarHBondContact O-CA 3.27Å; S97-G101 PolarHBondContact O-N 3.19Å; S97-A102 WeakPolarHBondContact CA-O 3.27Å; S97-A102 WeakPolarHBondContact CB-O 3.36Å; S97-Y189 WeakPolarHBondContact OG-CD2 3.44Å; S97-Y189 VanDerWaalsContact OG-CE2 3.3Å; S97-Y189 WeakPolarHBondContact OG-CE2 3.29Å
98	L	83.7	Confident	89.4	Confident	15 Å²	15	50.9 Å²	50.9	8%	0.079	27%	0.271	C	S	.	.	H	α-helix	trans	-77	-36.5	-175.6	-68.1	179	0	0	0	114.1	L94 T95 A126 F130	L94-L98 HydrophobicContact CD1-CD1 3.8Å; L94-L98 HydrophobicContact CD1-CD2 4.34Å; L94-L98 HydrophobicContact CD1-CG 3.82Å; L94-L98 HydrophobicContact CD2-CD1 4.38Å; L94-L98 HydrophobicContact CG-CD1 3.77Å; L94-L98 HydrophobicContact CG-CG 4.16Å; L94-L98 WeakPolarHBondContact O-CB 3.12Å; L94-L98 VanDerWaalsContact O-CG 3.27Å; L94-L98 WeakPolarHBondContact O-CG 3.26Å; L94-L98 PolarHBondContact O-N 3.43Å; T95-L98 PolarHBondContact O-N 2.9Å; L98-A126 HydrophobicContact CD2-CB 3.88Å; L98-F130 HydrophobicContact CD1-CB 3.85Å; L98-F130 HydrophobicContact CD1-CD2 4.1Å; L98-F130 HydrophobicContact CD1-CG 4.2Å
99	F	84	Confident	88.8	Confident	111 Å²	111	53.2 Å²	53.2	49%	0.487	28%	0.277	S	S	.	.	H	α-helix	trans	-104.8	-28.2	-172.2	-63.1	-77.1	0	0	0	113.7	T95 F130 V195	T95-F99 HydrophobicContact CG2-CD2 3.65Å; T95-F99 HydrophobicContact CG2-CE2 4.16Å; T95-F99 WeakPolarHBondContact O-CB 3.37Å; T95-F99 WeakPolarHBondContact O-CD2 3.14Å; T95-F99 PolarHBondContact O-N 3.41Å; F99-F130 HydrophobicContact CE2-CD2 4.42Å; F99-F130 AromaticContact CE2-CE2 3.9Å; F99-F130 HydrophobicContact CE2-CE2 3.9Å; F99-F130 AromaticContact CE2-CZ 3.97Å; F99-F130 HydrophobicContact CE2-CZ 3.97Å; F99-F130 HydrophobicContact CZ-CZ 4.37Å; F99-V195 HydrophobicContact CE1-CG2 4.41Å
100	L	84.2	Confident	88.4	Confident	117 Å²	117	51.2 Å²	51.2	61%	0.613	28%	0.277	S	S	*	.	H	α-helix	trans	-113.4	-3.3	-176.6	-60.8	170.2	0	0	0	112.7	Q96 A102	Q96-L100 CarbonylContact O-C 3.6Å; Q96-L100 WeakPolarHBondContact O-CA 3.42Å; Q96-L100 WeakPolarHBondContact O-CB 3.1Å; Q96-L100 PolarHBondContact O-N 2.9Å; Q96-L100 VanDerWaalsContact O-N 3.09Å; L100-A102 PolarHBondContact O-N 2.94Å
101	G	78.9	Confident	88	Confident	20 Å²	20	53.9 Å²	53.9	21%	0.206	29%	0.291	C	S	.	.			trans	60.7	32.4	-177.1	0	0	0	0	0	112.2	Q96 S97 A188	Q96-G101 PolarHBondContact O-N 2.96Å; Q96-G101 VanDerWaalsContact O-N 3.1Å; S97-G101 WeakPolarHBondContact O-CA 3.27Å; S97-G101 PolarHBondContact O-N 3.19Å; G101-A188 WeakPolarHBondContact O-CB 3.48Å
102	A	83.8	Confident	87.7	Confident	31 Å²	31	52.8 Å²	52.8	26%	0.256	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-84	133.2	173.7	0	0	0	0	0	110	Q96 S97 L100	Q96-A102 HydrophobicContact CB-CB 3.92Å; Q96-A102 PolarHBondContact O-N 3.39Å; S97-A102 WeakPolarHBondContact CA-O 3.27Å; S97-A102 WeakPolarHBondContact CB-O 3.36Å; L100-A102 PolarHBondContact O-N 2.94Å
103	P	83.7	Confident	87.2	Confident	104 Å²	104	54.6 Å²	54.6	68%	0.675	29%	0.292	S	S	*	.	P	Polyproline II helix	trans	-65.9	152.6	174.4	28.8	-34.4	0	0	0	111.2
104	F	85.9	Confident	86.9	Confident	20 Å²	20	60.1 Å²	60.1	9%	0.088	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-61.9	150.3	169.6	-71.3	-66.4	0	0	0	111.1	C93 L94 S106 L108 L178 M183 Y189	C93-F104 HydrophobicContact CB-CD1 3.85Å; C93-F104 HydrophobicContact CB-CE1 3.91Å; L94-F104 HydrophobicContact CB-CE1 4.46Å; L94-F104 HydrophobicContact CD1-CZ 3.93Å; F104-S106 PolarHBondContact O-N 3.08Å; F104-L108 HydrophobicContact CD1-CD2 4.05Å; F104-L178 HydrophobicContact CE1-CD1 4.01Å; F104-L178 HydrophobicContact CE1-CD2 4.31Å; F104-L178 HydrophobicContact CZ-CD1 3.77Å; F104-M183 HydrophobicContact CD2-CE 3.48Å; F104-M183 VanDerWaalsContact CD2-CE 3.48Å; F104-M183 HydrophobicContact CD2-SD 3.8Å; F104-M183 HydrophobicContact CE2-CE 4Å; F104-M183 HydrophobicContact CE2-SD 3.69Å; F104-M183 HydrophobicContact CG-CE 4.31Å; F104-Y189 HydrophobicContact CE2-CE2 4.07Å
105	P	90.6	Very high	86.7	Confident	45 Å²	45	61.4 Å²	61.4	29%	0.292	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-50.6	137.7	168.5	-25.6	33.9	0	0	0	111.3	F89 W107 L108 H109	F89-P105 HydrophobicContact CZ-CG 4.38Å; P105-W107 VanDerWaalsContact C-N 3.29Å; P105-W107 HydrophobicContact CB-CG 4.48Å; P105-W107 PolarHBondContact O-N 3.5Å; P105-L108 HydrophobicContact CB-CB 4.23Å; P105-L108 WeakPolarHBondContact O-CB 3.38Å; P105-L108 PolarHBondContact O-N 3.31Å; P105-H109 PolarHBondContact O-N 2.95Å
106	S	88.4	Confident	85.9	Confident	107 Å²	107	60.5 Å²	60.5	75%	0.748	33%	0.325	S	S	*	.	H	α-helix	trans	-56.2	-41	-173.6	53.9	0	0	0	0	113.2	F104 L108 H109 G110	F104-S106 PolarHBondContact O-N 3.08Å; S106-L108 VanDerWaalsContact C-N 3.33Å; S106-L108 PolarHBondContact O-N 3.43Å; S106-H109 PolarHBondContact O-N 3.04Å; S106-G110 PolarHBondContact O-N 3.3Å
107	W	91.4	Very high	85	Confident	128 Å²	128	59.1 Å²	59.1	49%	0.485	32%	0.321	S	S	.	.	H	α-helix	trans	-63.1	-38.4	176.1	68.8	-98	0	0	0	112.3	W86 F89 P105 G110 L111	W86-W107 AromaticContact CH2-CH2 3.73Å; W86-W107 HydrophobicContact CH2-CH2 3.73Å; W86-W107 AromaticContact CH2-CZ3 3.97Å; W86-W107 HydrophobicContact CH2-CZ3 3.97Å; W86-W107 AromaticContact CZ3-CH2 3.98Å; W86-W107 HydrophobicContact CZ3-CH2 3.98Å; F89-W107 AromaticContact CE1-CH2 3.77Å; F89-W107 HydrophobicContact CE1-CH2 3.77Å; F89-W107 AromaticContact CE1-CZ2 3.59Å; F89-W107 HydrophobicContact CE1-CZ2 3.59Å; F89-W107 HydrophobicContact CZ-CH2 4.39Å; F89-W107 AromaticContact CZ-CZ2 3.73Å; F89-W107 HydrophobicContact CZ-CZ2 3.73Å; P105-W107 VanDerWaalsContact C-N 3.29Å; P105-W107 HydrophobicContact CB-CG 4.48Å; P105-W107 PolarHBondContact O-N 3.5Å; W107-G110 PolarHBondContact O-N 3.07Å; W107-L111 HydrophobicContact CZ3-CD2 4.37Å; W107-L111 WeakPolarHBondContact O-CB 3.41Å; W107-L111 PolarHBondContact O-N 3.29Å
108	L	90.6	Very high	83.6	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-71.6	-42.1	-179.1	179.8	59.8	0	0	0	109.9	F89 L90 C93 F104 P105 S106 L111 L112 L175 L178	F89-L108 HydrophobicContact CE1-CD2 4.49Å; L90-L108 HydrophobicContact CD2-CD1 3.9Å; L90-L108 HydrophobicContact CD2-CD2 3.96Å; C93-L108 HydrophobicContact CB-CD2 4.39Å; F104-L108 HydrophobicContact CD1-CD2 4.05Å; P105-L108 HydrophobicContact CB-CB 4.23Å; P105-L108 WeakPolarHBondContact O-CB 3.38Å; P105-L108 PolarHBondContact O-N 3.31Å; S106-L108 VanDerWaalsContact C-N 3.33Å; S106-L108 PolarHBondContact O-N 3.43Å; L108-L111 PolarHBondContact O-N 2.89Å; L108-L112 HydrophobicContact CD1-CD1 4.46Å; L108-L112 HydrophobicContact CD1-CG 4.41Å; L108-L112 HydrophobicContact CG-CD1 4.22Å; L108-L112 VanDerWaalsContact O-CG 3.27Å; L108-L112 WeakPolarHBondContact O-CG 3.47Å; L108-L112 PolarHBondContact O-N 3.21Å; L108-L175 HydrophobicContact CD1-CD2 3.98Å; L108-L178 HydrophobicContact CD1-CD2 4.26Å; L108-L178 HydrophobicContact CD2-CD2 3.92Å; L108-L178 HydrophobicContact CG-CD2 4.29Å
109	H	85.9	Confident	82.2	Confident	68 Å²	68	67.8 Å²	67.8	32%	0.315	37%	0.367	S	S	.	.	H	α-helix	trans	-60.7	-45.4	173.3	-174.1	-164.3	0	0	0	111.7	P105 S106 L111 L112 R113 M183	P105-H109 PolarHBondContact O-N 2.95Å; S106-H109 PolarHBondContact O-N 3.04Å; H109-L111 PolarHBondContact O-N 3.29Å; H109-L112 PolarHBondContact O-N 2.84Å; H109-R113 WeakPolarHBondContact O-CB 3.36Å; H109-R113 PolarHBondContact O-N 3.27Å; H109-M183 HydrophobicContact CB-CE 4.13Å; H109-M183 WeakPolarHBondContact CD2-CE 3.24Å
110	G	87.2	Confident	80.6	Confident	32 Å²	32	66.5 Å²	66.5	33%	0.33	36%	0.362	S	S	.	.	H	α-helix	trans	-59.2	-44.3	175	0	0	0	0	0	112.6	S106 W107 R113 I114	S106-G110 PolarHBondContact O-N 3.3Å; W107-G110 PolarHBondContact O-N 3.07Å; G110-R113 WeakPolarHBondContact O-CB 3.48Å; G110-R113 PolarHBondContact O-N 2.91Å; G110-I114 WeakPolarHBondContact O-CG1 3.45Å; G110-I114 PolarHBondContact O-N 2.78Å
111	L	90	Very high	78.7	Confident	57 Å²	57	70.9 Å²	70.9	30%	0.298	38%	0.379	S	S	.	.	H	α-helix	trans	-61.6	-47.8	176.7	179.3	61.7	0	0	0	112.2	W107 L108 H109 R113 I114 L115 L175	W107-L111 HydrophobicContact CZ3-CD2 4.37Å; W107-L111 WeakPolarHBondContact O-CB 3.41Å; W107-L111 PolarHBondContact O-N 3.29Å; L108-L111 PolarHBondContact O-N 2.89Å; H109-L111 PolarHBondContact O-N 3.29Å; L111-R113 VanDerWaalsContact C-N 3.26Å; L111-R113 PolarHBondContact O-N 2.94Å; L111-I114 PolarHBondContact O-N 2.96Å; L111-I114 VanDerWaalsContact O-N 3.16Å; L111-L115 HydrophobicContact CD1-CD1 4.31Å; L111-L115 HydrophobicContact CD1-CG 4.4Å; L111-L115 HydrophobicContact CG-CD1 4.16Å; L111-L115 WeakPolarHBondContact O-CG 3.49Å; L111-L115 PolarHBondContact O-N 3.18Å; L111-L175 HydrophobicContact CD2-CD1 3.9Å; L111-L175 HydrophobicContact CD2-CD2 3.89Å
112	L	88.2	Confident	77.4	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-61.2	-37.2	178.1	-69.2	169.3	0	0	0	111.7	L108 H109 L115 G116 A117 L175 L178 M183	L108-L112 HydrophobicContact CD1-CD1 4.46Å; L108-L112 HydrophobicContact CD1-CG 4.41Å; L108-L112 HydrophobicContact CG-CD1 4.22Å; L108-L112 VanDerWaalsContact O-CG 3.27Å; L108-L112 WeakPolarHBondContact O-CG 3.47Å; L108-L112 PolarHBondContact O-N 3.21Å; H109-L112 PolarHBondContact O-N 2.84Å; L112-L115 PolarHBondContact O-N 3.15Å; L112-G116 PolarHBondContact O-N 3.07Å; L112-A117 HydrophobicContact CB-CB 4.14Å; L112-A117 WeakPolarHBondContact O-CB 3.04Å; L112-A117 PolarHBondContact O-N 2.92Å; L112-L175 HydrophobicContact CD2-CD2 4.15Å; L112-L178 HydrophobicContact CD1-CD2 3.77Å; L112-L178 HydrophobicContact CD1-CG 3.82Å; L112-L178 HydrophobicContact CD2-CB 4.09Å; L112-L178 HydrophobicContact CD2-CD2 4.34Å; L112-L178 HydrophobicContact CD2-CG 4.2Å; L112-M183 HydrophobicContact CD1-CE 3.74Å; L112-M183 HydrophobicContact CD1-SD 4.21Å
113	R	85	Confident	76.1	Confident	197 Å²	197	72.3 Å²	72.3	74%	0.743	40%	0.397	S	S	*	.	H	α-helix	trans	-64.6	-42.8	174.5	-171	176.5	-178	169.9	0.9	112	H109 G110 L111 L115 G116	H109-R113 WeakPolarHBondContact O-CB 3.36Å; H109-R113 PolarHBondContact O-N 3.27Å; G110-R113 WeakPolarHBondContact O-CB 3.48Å; G110-R113 PolarHBondContact O-N 2.91Å; L111-R113 VanDerWaalsContact C-N 3.26Å; L111-R113 PolarHBondContact O-N 2.94Å; R113-L115 VanDerWaalsContact C-N 3.33Å; R113-G116 WeakPolarHBondContact O-CA 3.34Å; R113-G116 PolarHBondContact O-N 3.4Å; R113-G116 VanDerWaalsContact O-N 3.08Å
114	I	87.4	Confident	75.2	Confident	126 Å²	126	72.9 Å²	72.9	65%	0.646	39%	0.39	S	S	*	.	H	α-helix	trans	-63.4	-40	175.9	-68.2	164.7	0	0	0	111	P14 G110 L111 G116	P14-I114 WeakPolarHBondContact CG-O 3.29Å; G110-I114 WeakPolarHBondContact O-CG1 3.45Å; G110-I114 PolarHBondContact O-N 2.78Å; L111-I114 PolarHBondContact O-N 2.96Å; L111-I114 VanDerWaalsContact O-N 3.16Å; I114-G116 PolarHBondContact O-N 2.99Å; I114-G116 VanDerWaalsContact O-N 3.12Å
115	L	85.8	Confident	74.8	Confident	26 Å²	26	73.8 Å²	73.8	14%	0.136	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-6	176.2	-66.9	174.3	0	0	0	113.2	L15 L111 L112 R113 L175	L15-L115 HydrophobicContact CB-CB 4.49Å; L15-L115 WeakPolarHBondContact CB-O 3.42Å; L15-L115 PolarHBondContact N-O 3.37Å; L111-L115 HydrophobicContact CD1-CD1 4.31Å; L111-L115 HydrophobicContact CD1-CG 4.4Å; L111-L115 HydrophobicContact CG-CD1 4.16Å; L111-L115 WeakPolarHBondContact O-CG 3.49Å; L111-L115 PolarHBondContact O-N 3.18Å; L112-L115 PolarHBondContact O-N 3.15Å; R113-L115 VanDerWaalsContact C-N 3.33Å; L115-L175 HydrophobicContact CD1-CB 4Å; L115-L175 HydrophobicContact CD1-CD1 4.02Å; L115-L175 HydrophobicContact CD1-CG 4.42Å
116	G	75.2	Confident	74.5	Confident	20 Å²	20	72 Å²	72	21%	0.206	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.4	41.2	179.1	0	0	0	0	0	112.6	N13 L112 R113 I114 A118	N13-G116 PolarHBondContact ND2-O 2.92Å; L112-G116 PolarHBondContact O-N 3.07Å; R113-G116 WeakPolarHBondContact O-CA 3.34Å; R113-G116 PolarHBondContact O-N 3.4Å; R113-G116 VanDerWaalsContact O-N 3.08Å; I114-G116 PolarHBondContact O-N 2.99Å; I114-G116 VanDerWaalsContact O-N 3.12Å; G116-A118 PolarHBondContact O-N 3.17Å
117	A	69.2	Low	74.5	Confident	16 Å²	16	67.2 Å²	67.2	13%	0.132	35%	0.351	C	S	.	.			trans	-50.4	109	161.1	0	0	0	0	0	107.8	L112	L112-A117 HydrophobicContact CB-CB 4.14Å; L112-A117 WeakPolarHBondContact O-CB 3.04Å; L112-A117 PolarHBondContact O-N 2.92Å
118	A	57.3	Low	74.6	Confident	35 Å²	35	61.3 Å²	61.3	29%	0.289	33%	0.329	S	S	.	.			trans	-68.6	137.7	-174.8	0	0	0	0	0	109	G116 F120	G116-A118 PolarHBondContact O-N 3.17Å; A118-F120 HydrophobicContact CB-CD2 3.41Å; A118-F120 VanDerWaalsContact CB-CD2 3.41Å; A118-F120 HydrophobicContact CB-CE2 3.4Å; A118-F120 HydrophobicContact CB-CG 4.36Å; A118-F120 HydrophobicContact CB-CZ 4.35Å; A118-F120 PolarHBondContact O-N 3Å
119	Q	54.4	Low	74.7	Confident	164 Å²	164	61.3 Å²	61.3	77%	0.766	33%	0.329	S	S	*	.			trans	-72	65.3	168.5	-70.3	178	-37.8	0	0	108.9	Q121	Q119-Q121 PolarHBondContact O-N 3.32Å
120	F	49.7	Very low	75	Confident	84 Å²	84	59.9 Å²	59.9	37%	0.368	32%	0.322	S	S	.	.			trans	-69	114	172.5	-84.3	-74.3	0	0	0	108.3	A118 G122 P182	A118-F120 HydrophobicContact CB-CD2 3.41Å; A118-F120 VanDerWaalsContact CB-CD2 3.41Å; A118-F120 HydrophobicContact CB-CE2 3.4Å; A118-F120 HydrophobicContact CB-CG 4.36Å; A118-F120 HydrophobicContact CB-CZ 4.35Å; A118-F120 PolarHBondContact O-N 3Å; F120-G122 PolarHBondContact O-N 3.2Å; F120-P182 VanDerWaalsContact O-CB 3.25Å; F120-P182 WeakPolarHBondContact O-CB 3.28Å; F120-P182 WeakPolarHBondContact O-CG 3.29Å
121	Q	44.1	Very low	75.4	Confident	208 Å²	208	59.7 Å²	59.7	97%	0.972	31%	0.313	S	S	*	.			trans	-71.1	93.6	168.7	-74.6	-173.7	-18	0	0	108.7	Q119	Q119-Q121 PolarHBondContact O-N 3.32Å
122	G	51.2	Low	75.8	Confident	33 Å²	33	57 Å²	57	34%	0.34	30%	0.299	S	S	.	.			trans	172	106.3	174.7	0	0	0	0	0	112.4	F120 E124 P182	F120-G122 PolarHBondContact O-N 3.2Å; G122-E124 PolarHBondContact O-N 3.08Å; G122-P182 VanDerWaalsContact O-CG 3.27Å; G122-P182 WeakPolarHBondContact O-CG 3.49Å
123	G	56.7	Low	76.2	Confident	48 Å²	48	57 Å²	57	50%	0.495	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	1.1	177	0	0	0	0	0	115.2	L125 Q198	G123-L125 VanDerWaalsContact C-N 3.32Å; G123-L125 PolarHBondContact O-N 2.97Å; G123-Q198 VanDerWaalsContact O-CD 3.3Å; G123-Q198 PolarHBondContact O-NE2 3.39Å; G123-Q198 PolarHBondContact O-OE1 3Å
124	E	64.8	Low	76.8	Confident	116 Å²	116	49.2 Å²	49.2	54%	0.542	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-21.1	-174.5	-54.3	-161.5	157	0	0	114.2	G122 R200	G122-E124 PolarHBondContact O-N 3.08Å; E124-R200 IonicContact OE1-NH2 2.95Å; E124-R200 PolarHBondContact OE1-NH2 3.04Å; E124-R200 IonicContact OE2-CZ 3.47Å; E124-R200 IonicContact OE2-NH1 3.41Å; E124-R200 PolarHBondContact OE2-NH1 3.4Å; E124-R200 IonicContact OE2-NH2 2.88Å; E124-R200 PolarHBondContact OE2-NH2 2.87Å
125	L	77.6	Confident	77.4	Confident	40 Å²	40	43.3 Å²	43.3	21%	0.209	24%	0.243	C	C	.	.	H	α-helix	trans	-88.3	-9.8	-177.7	-79.2	154.7	0	0	0	113.9	G123 S128 A129 F270	G123-L125 VanDerWaalsContact C-N 3.32Å; G123-L125 PolarHBondContact O-N 2.97Å; L125-S128 PolarHBondContact O-N 3.39Å; L125-A129 WeakPolarHBondContact O-CB 3.48Å; L125-A129 PolarHBondContact O-N 2.93Å; L125-F270 HydrophobicContact CD2-CD1 4.11Å
126	A	85.4	Confident	77.9	Confident	6 Å²	6	42.1 Å²	42.1	5%	0.05	24%	0.237	C	C	.	.	H	α-helix	trans	-64.9	-50.1	-173.4	0	0	0	0	0	112.2	L98 S128 A129 F130	L98-A126 HydrophobicContact CD2-CB 3.88Å; A126-S128 VanDerWaalsContact C-N 3.35Å; A126-S128 PolarHBondContact O-N 3.31Å; A126-A129 PolarHBondContact O-N 2.93Å; A126-F130 WeakPolarHBondContact O-CB 3.4Å; A126-F130 PolarHBondContact O-N 2.82Å
127	L	88.3	Confident	79.1	Confident	8 Å²	8	44.8 Å²	44.8	4%	0.042	24%	0.241	C	C	.	.	H	α-helix	trans	-61.5	-42.6	174.6	177.4	65.9	0	0	0	111.6	F130 L131 V195 Q198 A199	L127-F130 PolarHBondContact O-N 3.39Å; L127-L131 HydrophobicContact CD1-CD1 3.99Å; L127-L131 HydrophobicContact CD1-CG 4Å; L127-L131 HydrophobicContact CD2-CD1 4.49Å; L127-L131 HydrophobicContact CG-CD1 3.93Å; L127-L131 HydrophobicContact CG-CG 4.32Å; L127-L131 WeakPolarHBondContact O-CB 3.32Å; L127-L131 WeakPolarHBondContact O-CG 3.18Å; L127-L131 PolarHBondContact O-N 3.42Å; L127-V195 HydrophobicContact CB-CG1 3.86Å; L127-V195 HydrophobicContact CD1-CG1 3.91Å; L127-V195 HydrophobicContact CG-CG1 4.44Å; L127-Q198 HydrophobicContact CB-CB 3.98Å; L127-Q198 HydrophobicContact CD2-CB 3.99Å; L127-A199 HydrophobicContact CD2-CB 4.08Å
128	S	92.4	Very high	80.5	Confident	3 Å²	3	47.7 Å²	47.7	2%	0.021	25%	0.253	C	S	.	.	H	α-helix	trans	-61.4	-47.7	179.8	-49.4	0	0	0	0	111.6	L125 A126 L131 V132 H203 T269	L125-S128 PolarHBondContact O-N 3.39Å; A126-S128 VanDerWaalsContact C-N 3.35Å; A126-S128 PolarHBondContact O-N 3.31Å; S128-L131 PolarHBondContact O-N 2.95Å; S128-V132 WeakPolarHBondContact O-CB 3.46Å; S128-V132 VanDerWaalsContact O-CG2 3.27Å; S128-V132 WeakPolarHBondContact O-CG2 3.42Å; S128-V132 PolarHBondContact O-N 3.27Å; S128-H203 PolarHBondContact OG-NE2 3.11Å; S128-T269 VanDerWaalsContact CB-O 3.29Å; S128-T269 WeakPolarHBondContact CB-O 3.33Å; S128-T269 PolarHBondContact OG-O 2.8Å
129	A	92.3	Very high	82.4	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.9	-41	177.8	0	0	0	0	0	112	L125 A126 V132 L133 V177 V181 F270	L125-A129 WeakPolarHBondContact O-CB 3.48Å; L125-A129 PolarHBondContact O-N 2.93Å; A126-A129 PolarHBondContact O-N 2.93Å; A129-V132 PolarHBondContact O-N 2.93Å; A129-L133 VanDerWaalsContact O-CB 3.29Å; A129-L133 WeakPolarHBondContact O-CB 3.34Å; A129-L133 PolarHBondContact O-N 2.83Å; A129-V177 HydrophobicContact CB-CG1 4.38Å; A129-V177 VanDerWaalsContact O-CG1 3.31Å; A129-V177 WeakPolarHBondContact O-CG1 3Å; A129-V181 HydrophobicContact CB-CG2 3.5Å; A129-F270 HydrophobicContact CB-CE1 4.03Å; A129-F270 HydrophobicContact CB-CZ 4.5Å
130	F	93.5	Very high	84.4	Confident	38 Å²	38	38.2 Å²	38.2	17%	0.167	20%	0.203	C	C	.	.	H	α-helix	trans	-59.2	-51	174	176.7	-99.7	0	0	0	111.7	L91 L94 L98 F99 A126 L127 V132 L133 V134	L91-F130 HydrophobicContact CD1-CD2 3.97Å; L91-F130 HydrophobicContact CD1-CE2 3.74Å; L94-F130 HydrophobicContact CD2-CB 4.08Å; L94-F130 HydrophobicContact CD2-CD2 4.3Å; L94-F130 HydrophobicContact CG-CD2 4.44Å; L98-F130 HydrophobicContact CD1-CB 3.85Å; L98-F130 HydrophobicContact CD1-CD2 4.1Å; L98-F130 HydrophobicContact CD1-CG 4.2Å; F99-F130 HydrophobicContact CE2-CD2 4.42Å; F99-F130 AromaticContact CE2-CE2 3.9Å; F99-F130 HydrophobicContact CE2-CE2 3.9Å; F99-F130 AromaticContact CE2-CZ 3.97Å; F99-F130 HydrophobicContact CE2-CZ 3.97Å; F99-F130 HydrophobicContact CZ-CZ 4.37Å; A126-F130 WeakPolarHBondContact O-CB 3.4Å; A126-F130 PolarHBondContact O-N 2.82Å; L127-F130 PolarHBondContact O-N 3.39Å; F130-V132 PolarHBondContact O-N 3.49Å; F130-L133 PolarHBondContact O-N 2.78Å; F130-V134 HydrophobicContact CD1-CG2 4.41Å; F130-V134 HydrophobicContact CE1-CG2 4.03Å; F130-V134 HydrophobicContact CE2-CG2 4.38Å; F130-V134 HydrophobicContact CZ-CG2 4.02Å; F130-V134 WeakPolarHBondContact O-CG2 3.45Å; F130-V134 PolarHBondContact O-N 2.83Å
131	L	95.9	Very high	86.7	Confident	28 Å²	28	37.7 Å²	37.7	15%	0.147	20%	0.204	C	C	.	.	H	α-helix	trans	-62.7	-42.5	178.9	-71.4	175.1	0	0	0	112.3	L127 S128 L133 V134 F135 H203 M207 T269	L127-L131 HydrophobicContact CD1-CD1 3.99Å; L127-L131 HydrophobicContact CD1-CG 4Å; L127-L131 HydrophobicContact CD2-CD1 4.49Å; L127-L131 HydrophobicContact CG-CD1 3.93Å; L127-L131 HydrophobicContact CG-CG 4.32Å; L127-L131 WeakPolarHBondContact O-CB 3.32Å; L127-L131 WeakPolarHBondContact O-CG 3.18Å; L127-L131 PolarHBondContact O-N 3.42Å; S128-L131 PolarHBondContact O-N 2.95Å; L131-L133 VanDerWaalsContact C-N 3.32Å; L131-L133 PolarHBondContact O-N 3.43Å; L131-V134 WeakPolarHBondContact O-CB 3.27Å; L131-V134 PolarHBondContact O-N 3.41Å; L131-F135 VanDerWaalsContact O-CD1 3.29Å; L131-F135 WeakPolarHBondContact O-CD1 3.49Å; L131-F135 VanDerWaalsContact O-CG 3.24Å; L131-F135 WeakPolarHBondContact O-CG 3.39Å; L131-F135 PolarHBondContact O-N 3.36Å; L131-H203 HydrophobicContact CD1-CB 4Å; L131-M207 HydrophobicContact CD2-CE 4.44Å; L131-T269 HydrophobicContact CB-CG2 3.82Å; L131-T269 HydrophobicContact CD1-CG2 4.33Å
132	V	97.2	Very high	89.3	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.7	-39.3	176.5	170.7	0	0	0	0	111.1	S128 A129 F130 V134 F135 L136 V177 M266 T269 F270 W277	S128-V132 WeakPolarHBondContact O-CB 3.46Å; S128-V132 VanDerWaalsContact O-CG2 3.27Å; S128-V132 WeakPolarHBondContact O-CG2 3.42Å; S128-V132 PolarHBondContact O-N 3.27Å; A129-V132 PolarHBondContact O-N 2.93Å; F130-V132 PolarHBondContact O-N 3.49Å; V132-V134 VanDerWaalsContact C-N 3.35Å; V132-F135 PolarHBondContact O-N 3.03Å; V132-L136 WeakPolarHBondContact O-CB 3.36Å; V132-L136 PolarHBondContact O-N 2.71Å; V132-V177 HydrophobicContact CB-CG1 4.23Å; V132-V177 HydrophobicContact CG1-CG1 4.04Å; V132-V177 HydrophobicContact CG1-CG2 3.71Å; V132-M266 HydrophobicContact CG1-CB 3.88Å; V132-M266 HydrophobicContact CG1-CG 3.97Å; V132-M266 HydrophobicContact CG1-SD 4.03Å; V132-M266 HydrophobicContact CG2-CB 4.01Å; V132-M266 HydrophobicContact CG2-CG 4.43Å; V132-T269 HydrophobicContact CG2-CG2 3.75Å; V132-F270 HydrophobicContact CB-CE2 3.97Å; V132-F270 HydrophobicContact CB-CZ 3.93Å; V132-F270 HydrophobicContact CG1-CE2 3.73Å; V132-F270 HydrophobicContact CG1-CZ 4.02Å; V132-F270 HydrophobicContact CG2-CD2 3.9Å; V132-F270 HydrophobicContact CG2-CE1 4.32Å; V132-F270 HydrophobicContact CG2-CE2 3.7Å; V132-F270 HydrophobicContact CG2-CG 4.3Å; V132-F270 HydrophobicContact CG2-CZ 3.92Å; V132-W277 HydrophobicContact CG1-CH2 4.03Å; V132-W277 HydrophobicContact CG1-CZ2 4.18Å; V132-W277 HydrophobicContact CG1-CZ3 4.37Å
133	L	96.9	Very high	91.4	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-67.6	-37	176.8	-164.2	55.5	0	0	0	111.7	N87 L90 L91 L94 A129 F130 L131 L136 W137 V177	N87-L133 HydrophobicContact CB-CD1 4.42Å; L90-L133 HydrophobicContact CB-CD2 4.1Å; L91-L133 HydrophobicContact CB-CD2 4.08Å; L91-L133 HydrophobicContact CB-CG 4.08Å; L91-L133 HydrophobicContact CD1-CB 4.3Å; L91-L133 HydrophobicContact CD1-CD2 4.32Å; L91-L133 HydrophobicContact CD1-CG 4.25Å; L94-L133 HydrophobicContact CB-CD2 4.35Å; L94-L133 HydrophobicContact CD2-CD2 3.93Å; A129-L133 VanDerWaalsContact O-CB 3.29Å; A129-L133 WeakPolarHBondContact O-CB 3.34Å; A129-L133 PolarHBondContact O-N 2.83Å; F130-L133 PolarHBondContact O-N 2.78Å; L131-L133 VanDerWaalsContact C-N 3.32Å; L131-L133 PolarHBondContact O-N 3.43Å; L133-L136 HydrophobicContact CD1-CD2 4.23Å; L133-L136 PolarHBondContact O-N 2.95Å; L133-W137 WeakPolarHBondContact O-CB 3.41Å; L133-W137 PolarHBondContact O-N 2.98Å; L133-V177 HydrophobicContact CB-CG1 3.88Å; L133-V177 HydrophobicContact CD1-CB 4.33Å; L133-V177 HydrophobicContact CD1-CG1 4.28Å
134	V	98.3	Very high	93.3	Very high	35 Å²	35	28 Å²	28	21%	0.212	14%	0.135	C	C	.	.	H	α-helix	trans	-61	-47	169.6	170.5	0	0	0	0	110.8	L91 F130 L131 V132 L136 W137 L138	L91-V134 HydrophobicContact CD1-CG2 3.71Å; L91-V134 HydrophobicContact CD2-CG2 4.05Å; F130-V134 HydrophobicContact CD1-CG2 4.41Å; F130-V134 HydrophobicContact CE1-CG2 4.03Å; F130-V134 HydrophobicContact CE2-CG2 4.38Å; F130-V134 HydrophobicContact CZ-CG2 4.02Å; F130-V134 WeakPolarHBondContact O-CG2 3.45Å; F130-V134 PolarHBondContact O-N 2.83Å; L131-V134 WeakPolarHBondContact O-CB 3.27Å; L131-V134 PolarHBondContact O-N 3.41Å; V132-V134 VanDerWaalsContact C-N 3.35Å; V134-L136 VanDerWaalsContact C-N 3.35Å; V134-L136 PolarHBondContact O-N 2.85Å; V134-W137 PolarHBondContact O-N 3.14Å; V134-L138 HydrophobicContact CG1-CD1 3.79Å; V134-L138 HydrophobicContact CG1-CG 4.25Å; V134-L138 WeakPolarHBondContact O-CB 3.35Å; V134-L138 WeakPolarHBondContact O-CG 3.41Å; V134-L138 PolarHBondContact O-N 2.89Å
135	F	98.6	Very high	94.8	Very high	2 Å²	2	27 Å²	27	1%	0.009	13%	0.129	C	C	.	.	H	α-helix	trans	-61.7	-43.6	178.4	-66.9	-6.1	0	0	0	111.7	L131 V132 H139 M207 F210 M266 T269	L131-F135 VanDerWaalsContact O-CD1 3.29Å; L131-F135 WeakPolarHBondContact O-CD1 3.49Å; L131-F135 VanDerWaalsContact O-CG 3.24Å; L131-F135 WeakPolarHBondContact O-CG 3.39Å; L131-F135 PolarHBondContact O-N 3.36Å; V132-F135 PolarHBondContact O-N 3.03Å; F135-H139 WeakPolarHBondContact O-CB 3.36Å; F135-H139 PolarHBondContact O-N 3.13Å; F135-M207 HydrophobicContact CD1-SD 4.44Å; F135-M207 HydrophobicContact CE1-CE 3.41Å; F135-M207 VanDerWaalsContact CE1-CE 3.41Å; F135-M207 HydrophobicContact CE1-SD 3.3Å; F135-M207 WeakPolarHBondContact CE1-SD 3.38Å; F135-M207 HydrophobicContact CZ-CB 3.92Å; F135-M207 HydrophobicContact CZ-CE 3.56Å; F135-M207 HydrophobicContact CZ-CG 4.31Å; F135-M207 HydrophobicContact CZ-SD 3.46Å; F135-M207 WeakPolarHBondContact CZ-SD 3.44Å; F135-F210 HydrophobicContact CB-CD2 3.88Å; F135-F210 HydrophobicContact CB-CE1 4.37Å; F135-F210 HydrophobicContact CB-CE2 3.7Å; F135-F210 HydrophobicContact CB-CG 4.29Å; F135-F210 HydrophobicContact CB-CZ 3.97Å; F135-F210 HydrophobicContact CD1-CD1 4.06Å; F135-F210 HydrophobicContact CD1-CE1 4.22Å; F135-F210 HydrophobicContact CD1-CG 4.33Å; F135-F210 HydrophobicContact CD2-CB 4.15Å; F135-F210 HydrophobicContact CD2-CD2 4.19Å; F135-F210 HydrophobicContact CD2-CG 4.05Å; F135-F210 HydrophobicContact CE1-CD1 4.46Å; F135-F210 HydrophobicContact CE2-CB 4.19Å; F135-F210 HydrophobicContact CE2-CG 4.48Å; F135-F210 HydrophobicContact CG-CD1 4.14Å; F135-F210 HydrophobicContact CG-CD2 4.04Å; F135-F210 HydrophobicContact CG-CE1 4.37Å; F135-F210 HydrophobicContact CG-CE2 4.27Å; F135-F210 AromaticContact CG-CG 3.97Å; F135-F210 HydrophobicContact CG-CG 3.97Å; F135-F210 HydrophobicContact CG-CZ 4.43Å; F135-F210 WeakPolarHBondContact O-CE2 3.47Å; F135-F210 VanDerWaalsContact O-CZ 3.27Å; F135-F210 WeakPolarHBondContact O-CZ 3.39Å; F135-M266 HydrophobicContact CB-CE 3.81Å; F135-M266 HydrophobicContact CB-CG 4.26Å; F135-M266 HydrophobicContact CD2-CG 4.26Å; F135-T269 HydrophobicContact CE2-CG2 4.13Å; F135-T269 WeakPolarHBondContact CE2-OG1 3.24Å
136	L	98.1	Very high	95.5	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-61.3	-45.1	176.1	-178.1	65.4	0	0	0	111	N87 V132 L133 V134 H139 S140 V173 V177 M266	N87-L136 HydrophobicContact CB-CD2 4.37Å; V132-L136 WeakPolarHBondContact O-CB 3.36Å; V132-L136 PolarHBondContact O-N 2.71Å; L133-L136 HydrophobicContact CD1-CD2 4.23Å; L133-L136 PolarHBondContact O-N 2.95Å; V134-L136 VanDerWaalsContact C-N 3.35Å; V134-L136 PolarHBondContact O-N 2.85Å; L136-H139 PolarHBondContact O-N 3.41Å; L136-S140 WeakPolarHBondContact O-CB 3.48Å; L136-S140 PolarHBondContact O-N 3.32Å; L136-S140 PolarHBondContact O-OG 3.24Å; L136-V173 HydrophobicContact CD1-CG1 3.8Å; L136-V173 HydrophobicContact CD2-CB 4.49Å; L136-V173 HydrophobicContact CD2-CG1 3.72Å; L136-V173 HydrophobicContact CG-CG1 4.42Å; L136-V177 HydrophobicContact CD2-CG2 4.41Å; L136-M266 HydrophobicContact CB-CE 4.42Å
137	W	98.4	Very high	95.8	Very high	77 Å²	77	25.1 Å²	25.1	29%	0.292	12%	0.118	S	C	.	.	H	α-helix	trans	-65.9	-46.4	179.3	-174.4	74.3	0	0	0	112.3	V84 G88 L91 L133 V134 H139 S140 L141	V84-W137 PolarHBondContact O-NE1 3.38Å; V84-W137 VanDerWaalsContact O-NE1 3.13Å; G88-W137 VanDerWaalsContact CA-CD1 3.43Å; G88-W137 VanDerWaalsContact N-CD1 3.33Å; L91-W137 HydrophobicContact CD2-CB 4.3Å; L91-W137 HydrophobicContact CD2-CD2 4.46Å; L91-W137 HydrophobicContact CD2-CG 4.38Å; L133-W137 WeakPolarHBondContact O-CB 3.41Å; L133-W137 PolarHBondContact O-N 2.98Å; V134-W137 PolarHBondContact O-N 3.14Å; W137-H139 VanDerWaalsContact C-N 3.34Å; W137-H139 PolarHBondContact O-N 3.32Å; W137-S140 PolarHBondContact O-N 3.13Å; W137-L141 HydrophobicContact CH2-CD2 4.15Å; W137-L141 HydrophobicContact CZ3-CD2 4.33Å; W137-L141 WeakPolarHBondContact O-CB 3.38Å; W137-L141 PolarHBondContact O-N 3.09Å
138	L	98.5	Very high	95.9	Very high	76 Å²	76	29.4 Å²	29.4	40%	0.398	14%	0.141	S	C	.	.	H	α-helix	trans	-63.1	-40.6	175.8	-71.9	175.8	0	0	0	112	V134 L141 R142 F210	V134-L138 HydrophobicContact CG1-CD1 3.79Å; V134-L138 HydrophobicContact CG1-CG 4.25Å; V134-L138 WeakPolarHBondContact O-CB 3.35Å; V134-L138 WeakPolarHBondContact O-CG 3.41Å; V134-L138 PolarHBondContact O-N 2.89Å; L138-L141 PolarHBondContact O-N 3.34Å; L138-R142 WeakPolarHBondContact O-CB 3.4Å; L138-R142 PolarHBondContact O-N 3.35Å; L138-F210 HydrophobicContact CB-CZ 4.41Å
139	H	98.2	Very high	95.8	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-57.7	-52	173.1	171.8	75.9	0	0	0	110.4	F135 L136 W137 L141 R142 R143 F210 E259	F135-H139 WeakPolarHBondContact O-CB 3.36Å; F135-H139 PolarHBondContact O-N 3.13Å; L136-H139 PolarHBondContact O-N 3.41Å; W137-H139 VanDerWaalsContact C-N 3.34Å; W137-H139 PolarHBondContact O-N 3.32Å; H139-L141 PolarHBondContact O-N 2.7Å; H139-R142 PolarHBondContact ND1-NH2 3.24Å; H139-R142 PolarHBondContact O-N 3.35Å; H139-R143 WeakPolarHBondContact O-CB 3.3Å; H139-R143 VanDerWaalsContact O-CG 3.23Å; H139-R143 WeakPolarHBondContact O-CG 3.28Å; H139-R143 PolarHBondContact O-N 3.5Å; H139-F210 HydrophobicContact CB-CE2 4.12Å; H139-F210 HydrophobicContact CB-CZ 4.19Å; H139-E259 IonicContact CE1-OE1 3.65Å; H139-E259 IonicContact CE1-OE2 3.67Å; H139-E259 PolarHBondContact CE1-OE2 2.92Å; H139-E259 IonicContact NE2-OE1 3.53Å; H139-E259 PolarHBondContact NE2-OE1 3.01Å; H139-E259 IonicContact NE2-OE2 2.7Å
140	S	97.3	Very high	95.7	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-62.3	-40.1	179.5	-65	0	0	0	0	113	S83 L136 W137 R143 L144	S83-S140 WeakPolarHBondContact OG-CB 3.44Å; S83-S140 PolarHBondContact OG-OG 2.92Å; L136-S140 WeakPolarHBondContact O-CB 3.48Å; L136-S140 PolarHBondContact O-N 3.32Å; L136-S140 PolarHBondContact O-OG 3.24Å; W137-S140 PolarHBondContact O-N 3.13Å; S140-R143 PolarHBondContact O-N 3.36Å; S140-L144 WeakPolarHBondContact O-CB 3.49Å; S140-L144 PolarHBondContact O-N 2.88Å
141	L	97.7	Very high	95.3	Very high	73 Å²	73	37.2 Å²	37.2	38%	0.382	18%	0.176	S	C	.	.	H	α-helix	trans	-63.4	-46.2	176.8	-175.9	64.5	0	0	0	111.3	V84 W137 L138 H139 L144 F145	V84-L141 HydrophobicContact CG1-CD1 4.38Å; V84-L141 HydrophobicContact CG2-CB 4.22Å; V84-L141 HydrophobicContact CG2-CD1 4.38Å; W137-L141 HydrophobicContact CH2-CD2 4.15Å; W137-L141 HydrophobicContact CZ3-CD2 4.33Å; W137-L141 WeakPolarHBondContact O-CB 3.38Å; W137-L141 PolarHBondContact O-N 3.09Å; L138-L141 PolarHBondContact O-N 3.34Å; H139-L141 PolarHBondContact O-N 2.7Å; L141-L144 WeakPolarHBondContact O-CB 3.46Å; L141-L144 PolarHBondContact O-N 2.66Å; L141-F145 PolarHBondContact O-N 3.37Å
142	R	97.4	Very high	94.7	Very high	43 Å²	43	36.9 Å²	36.9	16%	0.162	18%	0.175	C	C	.	.	H	α-helix	trans	-60.6	-46.9	175.1	-173	-165.1	66.6	-129	11.2	111	L138 H139 L144 F145 E146 S214	L138-R142 WeakPolarHBondContact O-CB 3.4Å; L138-R142 PolarHBondContact O-N 3.35Å; H139-R142 PolarHBondContact ND1-NH2 3.24Å; H139-R142 PolarHBondContact O-N 3.35Å; R142-L144 VanDerWaalsContact C-N 3.3Å; R142-L144 PolarHBondContact O-N 2.73Å; R142-F145 WeakPolarHBondContact O-CB 3.46Å; R142-F145 PolarHBondContact O-N 2.95Å; R142-E146 WeakPolarHBondContact CD-OE1 3.38Å; R142-E146 HydrophobicContact CG-CG 4.37Å; R142-E146 VanDerWaalsContact CG-OE1 3.26Å; R142-E146 WeakPolarHBondContact CG-OE1 3.12Å; R142-E146 IonicContact NE-OE1 2.88Å; R142-E146 PolarHBondContact NE-OE1 3.39Å; R142-E146 WeakPolarHBondContact O-CB 3.13Å; R142-E146 VanDerWaalsContact O-CG 3.3Å; R142-E146 WeakPolarHBondContact O-CG 3.47Å; R142-E146 PolarHBondContact O-N 3.27Å; R142-S214 PolarHBondContact NH1-OG 3.06Å
143	R	95.9	Very high	93.8	Very high	18 Å²	18	39.6 Å²	39.6	7%	0.068	19%	0.187	C	C	.	.	H	α-helix	trans	-63.9	-36	179.6	-68.7	-65	-65.8	132.9	-4.2	112.3	Y80 H139 S140 E146 C147 H221	Y80-R143 HydrophobicContact CD1-CB 3.41Å; Y80-R143 VanDerWaalsContact CD1-CB 3.41Å; Y80-R143 HydrophobicContact CD1-CG 4.28Å; Y80-R143 HydrophobicContact CD2-CB 4.05Å; Y80-R143 HydrophobicContact CE1-CB 3.24Å; Y80-R143 HydrophobicContact CE1-CG 3.71Å; Y80-R143 HydrophobicContact CE2-CB 3.89Å; Y80-R143 HydrophobicContact CG-CB 3.82Å; Y80-R143 PolarHBondContact OH-NE 3.04Å; Y80-R143 PolarHBondContact OH-NH2 3.13Å; H139-R143 WeakPolarHBondContact O-CB 3.3Å; H139-R143 VanDerWaalsContact O-CG 3.23Å; H139-R143 WeakPolarHBondContact O-CG 3.28Å; H139-R143 PolarHBondContact O-N 3.5Å; S140-R143 PolarHBondContact O-N 3.36Å; R143-E146 WeakPolarHBondContact CD-OE2 2.98Å; R143-E146 IonicContact CZ-OE2 3.35Å; R143-E146 IonicContact NE-OE2 2.95Å; R143-E146 IonicContact NH1-OE2 3.62Å; R143-E146 PolarHBondContact NH1-OE2 3.21Å; R143-E146 PolarHBondContact O-N 3.16Å; R143-C147 WeakPolarHBondContact O-CB 3.37Å; R143-C147 PolarHBondContact O-N 3.48Å; R143-C147 PolarHBondContact O-SG 3.49Å; R143-H221 PolarHBondContact NH1-CE1 2.67Å; R143-H221 PolarHBondContact NH1-ND1 3.2Å
144	L	96	Very high	92.6	Very high	24 Å²	24	40.4 Å²	40.4	13%	0.126	19%	0.193	C	C	.	.	H	α-helix	trans	-61.3	-50.8	171.6	-179.7	54.8	0	0	0	110.8	I81 V84 S140 L141 R142 E146 C147 L148	I81-L144 HydrophobicContact CD1-CD1 4.45Å; I81-L144 HydrophobicContact CG1-CD1 3.62Å; I81-L144 HydrophobicContact CG1-CD2 4.1Å; V84-L144 HydrophobicContact CG2-CB 4.49Å; V84-L144 HydrophobicContact CG2-CD2 4.18Å; S140-L144 WeakPolarHBondContact O-CB 3.49Å; S140-L144 PolarHBondContact O-N 2.88Å; L141-L144 WeakPolarHBondContact O-CB 3.46Å; L141-L144 PolarHBondContact O-N 2.66Å; R142-L144 VanDerWaalsContact C-N 3.3Å; R142-L144 PolarHBondContact O-N 2.73Å; L144-E146 VanDerWaalsContact C-N 3.32Å; L144-E146 PolarHBondContact O-N 2.83Å; L144-C147 WeakPolarHBondContact O-CB 3.44Å; L144-C147 PolarHBondContact O-N 3.45Å; L144-C147 VanDerWaalsContact O-N 3.08Å; L144-L148 HydrophobicContact CD1-CD1 3.98Å; L144-L148 HydrophobicContact CD1-CG 4.13Å; L144-L148 HydrophobicContact CG-CD1 4.06Å; L144-L148 WeakPolarHBondContact O-CG 3.34Å; L144-L148 PolarHBondContact O-N 3.34Å
145	F	95.9	Very high	91	Very high	96 Å²	96	46.2 Å²	46.2	42%	0.421	22%	0.223	S	C	.	.	H	α-helix	trans	-55.2	-47.7	175.2	169.5	-93.3	0	0	0	111.8	L141 R142 C147 L148 Y149 V150 Y218	L141-F145 PolarHBondContact O-N 3.37Å; R142-F145 WeakPolarHBondContact O-CB 3.46Å; R142-F145 PolarHBondContact O-N 2.95Å; F145-C147 VanDerWaalsContact C-N 3.27Å; F145-C147 PolarHBondContact O-N 2.95Å; F145-L148 PolarHBondContact O-N 3.47Å; F145-L148 VanDerWaalsContact O-N 3.17Å; F145-Y149 AromaticContact CD2-CD2 3.37Å; F145-Y149 HydrophobicContact CD2-CD2 3.37Å; F145-Y149 AromaticContact CD2-CE2 3.9Å; F145-Y149 HydrophobicContact CD2-CE2 3.9Å; F145-Y149 HydrophobicContact CD2-CG 4.3Å; F145-Y149 AromaticContact CE2-CD2 3.52Å; F145-Y149 HydrophobicContact CE2-CD2 3.52Å; F145-Y149 HydrophobicContact CE2-CE2 4.21Å; F145-Y149 HydrophobicContact CE2-CG 4.04Å; F145-Y149 HydrophobicContact CG-CD2 4.15Å; F145-Y149 HydrophobicContact CZ-CD2 4.41Å; F145-Y149 WeakPolarHBondContact O-CD2 3.5Å; F145-Y149 PolarHBondContact O-N 2.93Å; F145-V150 HydrophobicContact CE1-CG2 4.04Å; F145-Y218 HydrophobicContact CE1-CE2 4.32Å
146	E	93.8	Very high	89.6	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.23	C	C	.	.	I	π-helix	trans	-62	-33.5	177.7	-71.4	168.7	-163.5	0	0	112.3	R142 R143 L144 V150 S151 Y218 H221	R142-E146 WeakPolarHBondContact CD-OE1 3.38Å; R142-E146 HydrophobicContact CG-CG 4.37Å; R142-E146 VanDerWaalsContact CG-OE1 3.26Å; R142-E146 WeakPolarHBondContact CG-OE1 3.12Å; R142-E146 IonicContact NE-OE1 2.88Å; R142-E146 PolarHBondContact NE-OE1 3.39Å; R142-E146 WeakPolarHBondContact O-CB 3.13Å; R142-E146 VanDerWaalsContact O-CG 3.3Å; R142-E146 WeakPolarHBondContact O-CG 3.47Å; R142-E146 PolarHBondContact O-N 3.27Å; R143-E146 WeakPolarHBondContact CD-OE2 2.98Å; R143-E146 IonicContact CZ-OE2 3.35Å; R143-E146 IonicContact NE-OE2 2.95Å; R143-E146 IonicContact NH1-OE2 3.62Å; R143-E146 PolarHBondContact NH1-OE2 3.21Å; R143-E146 PolarHBondContact O-N 3.16Å; L144-E146 VanDerWaalsContact C-N 3.32Å; L144-E146 PolarHBondContact O-N 2.83Å; E146-V150 HydrophobicContact CB-CB 4.36Å; E146-V150 HydrophobicContact CB-CG2 4.48Å; E146-V150 HydrophobicContact CG-CG2 4.4Å; E146-V150 CarbonylContact O-C 3.58Å; E146-V150 WeakPolarHBondContact O-CB 3.45Å; E146-V150 PolarHBondContact O-N 3.18Å; E146-V150 VanDerWaalsContact O-N 3.15Å; E146-S151 VanDerWaalsContact O-CB 3.28Å; E146-S151 WeakPolarHBondContact O-CB 3.27Å; E146-S151 PolarHBondContact O-N 3.36Å; E146-S151 PolarHBondContact O-OG 3.08Å; E146-Y218 HydrophobicContact CG-CD2 3.74Å; E146-Y218 HydrophobicContact CG-CE2 4.08Å; E146-Y218 WeakPolarHBondContact OE1-CD2 3.37Å; E146-H221 IonicContact OE2-CE1 3.76Å; E146-H221 IonicContact OE2-CG 3.04Å; E146-H221 IonicContact OE2-ND1 3.02Å; E146-H221 PolarHBondContact OE2-ND1 2.93Å
147	C	91.7	Very high	88.4	Confident	6 Å²	6	50.2 Å²	50.2	4%	0.041	24%	0.244	C	C	.	.	I	π-helix	trans	-69.7	-41.1	175	-71.3	0	0	0	0	111.8	Y80 R143 L144 F145 F153	Y80-C147 VanDerWaalsContact CD2-SG 3.57Å; Y80-C147 VanDerWaalsContact CE2-SG 3.55Å; R143-C147 WeakPolarHBondContact O-CB 3.37Å; R143-C147 PolarHBondContact O-N 3.48Å; R143-C147 PolarHBondContact O-SG 3.49Å; L144-C147 WeakPolarHBondContact O-CB 3.44Å; L144-C147 PolarHBondContact O-N 3.45Å; L144-C147 VanDerWaalsContact O-N 3.08Å; F145-C147 VanDerWaalsContact C-N 3.27Å; F145-C147 PolarHBondContact O-N 2.95Å; C147-F153 HydrophobicContact CB-CE2 4.25Å; C147-F153 HydrophobicContact CB-CZ 4.07Å; C147-F153 VanDerWaalsContact O-CE2 3.29Å; C147-F153 WeakPolarHBondContact O-CE2 3.43Å
148	L	90.4	Very high	87.2	Confident	98 Å²	98	46.7 Å²	46.7	51%	0.513	23%	0.231	S	C	.	.	I	π-helix	trans	-75.7	-39.5	-176	-65.2	174.7	0	0	0	112.6	L144 F145	L144-L148 HydrophobicContact CD1-CD1 3.98Å; L144-L148 HydrophobicContact CD1-CG 4.13Å; L144-L148 HydrophobicContact CG-CD1 4.06Å; L144-L148 WeakPolarHBondContact O-CG 3.34Å; L144-L148 PolarHBondContact O-N 3.34Å; F145-L148 PolarHBondContact O-N 3.47Å; F145-L148 VanDerWaalsContact O-N 3.17Å
149	Y	89.9	Confident	86.2	Confident	160 Å²	160	44.5 Å²	44.5	63%	0.627	22%	0.218	S	C	*	.	I	π-helix	trans	-117.6	-31	-166.9	-59.2	-73.7	0	0	0	114.6	F145 K229	F145-Y149 AromaticContact CD2-CD2 3.37Å; F145-Y149 HydrophobicContact CD2-CD2 3.37Å; F145-Y149 AromaticContact CD2-CE2 3.9Å; F145-Y149 HydrophobicContact CD2-CE2 3.9Å; F145-Y149 HydrophobicContact CD2-CG 4.3Å; F145-Y149 AromaticContact CE2-CD2 3.52Å; F145-Y149 HydrophobicContact CE2-CD2 3.52Å; F145-Y149 HydrophobicContact CE2-CE2 4.21Å; F145-Y149 HydrophobicContact CE2-CG 4.04Å; F145-Y149 HydrophobicContact CG-CD2 4.15Å; F145-Y149 HydrophobicContact CZ-CD2 4.41Å; F145-Y149 WeakPolarHBondContact O-CD2 3.5Å; F145-Y149 PolarHBondContact O-N 2.93Å; Y149-K229 PolarHBondContact O-NZ 3.19Å
150	V	89.5	Confident	85.3	Confident	14 Å²	14	46.6 Å²	46.6	9%	0.085	23%	0.231	C	C	.	.	I	π-helix	trans	-93.3	-49.3	-174.6	-179.1	0	0	0	0	111	F145 E146 Y218 V222 K229	F145-V150 HydrophobicContact CE1-CG2 4.04Å; E146-V150 HydrophobicContact CB-CB 4.36Å; E146-V150 HydrophobicContact CB-CG2 4.48Å; E146-V150 HydrophobicContact CG-CG2 4.4Å; E146-V150 CarbonylContact O-C 3.58Å; E146-V150 WeakPolarHBondContact O-CB 3.45Å; E146-V150 PolarHBondContact O-N 3.18Å; E146-V150 VanDerWaalsContact O-N 3.15Å; V150-Y218 HydrophobicContact CG2-CE2 4.1Å; V150-V222 HydrophobicContact CG1-CB 4.42Å; V150-V222 HydrophobicContact CG1-CG2 3.84Å; V150-K229 PolarHBondContact O-NZ 2.95Å
151	S	86.3	Confident	84.5	Confident	31 Å²	31	50.2 Å²	50.2	22%	0.217	25%	0.253	C	S	.	.			trans	-74.2	134.4	-170.2	-60.7	0	0	0	0	111.8	E146	E146-S151 VanDerWaalsContact O-CB 3.28Å; E146-S151 WeakPolarHBondContact O-CB 3.27Å; E146-S151 PolarHBondContact O-N 3.36Å; E146-S151 PolarHBondContact O-OG 3.08Å
152	V	83.2	Confident	83.7	Confident	21 Å²	21	48.7 Å²	48.7	13%	0.127	24%	0.244	C	C	.	.			trans	-104	108.3	170.2	-178.9	0	0	0	0	107.4	R228 K229 V235	V152-R228 HydrophobicContact CB-CB 4.05Å; V152-R228 HydrophobicContact CG1-CB 4.07Å; V152-R228 HydrophobicContact CG2-CB 4.18Å; V152-R228 PolarHBondContact O-NH1 3.31Å; V152-K229 HydrophobicContact CG2-CD 4.25Å; V152-K229 HydrophobicContact CG2-CG 4.01Å; V152-V235 HydrophobicContact CG1-CB 4.48Å; V152-V235 HydrophobicContact CG1-CG1 3.73Å; V152-V235 HydrophobicContact CG1-CG2 3.84Å; V152-V235 HydrophobicContact CG2-CG2 3.9Å
153	F	78.8	Confident	83.1	Confident	58 Å²	58	48.5 Å²	48.5	25%	0.254	24%	0.243	S	C	.	.			trans	-84.7	137	177.7	-61.7	-71.4	0	0	0	111.2	K73 R74 F76 C147	K73-F153 HydrophobicContact CG-CD1 3.91Å; K73-F153 HydrophobicContact CG-CE1 4.45Å; R74-F153 HydrophobicContact CB-CB 4.32Å; R74-F153 HydrophobicContact CB-CD2 4.41Å; R74-F153 HydrophobicContact CB-CG 4.49Å; F76-F153 HydrophobicContact CB-CE1 4.29Å; F76-F153 HydrophobicContact CB-CZ 4.4Å; C147-F153 HydrophobicContact CB-CE2 4.25Å; C147-F153 HydrophobicContact CB-CZ 4.07Å; C147-F153 VanDerWaalsContact O-CE2 3.29Å; C147-F153 WeakPolarHBondContact O-CE2 3.43Å
154	S	69.8	Low	82.7	Confident	17 Å²	17	50.7 Å²	50.7	12%	0.119	26%	0.261	C	S	.	.			trans	-92.6	167.6	171.3	48.6	0	0	0	0	110.2	V156	S154-V156 PolarHBondContact O-N 3.05Å; S154-V156 WeakPolarHBondContact OG-CG2 3.45Å
155	N	66.3	Low	82.4	Confident	157 Å²	157	52.8 Å²	52.8	84%	0.84	27%	0.269	S	S	*	.	S	Bend	trans	-68.7	35	177.7	-69.5	-18.8	0	0	0	114.5
156	V	68.3	Low	82	Confident	25 Å²	25	48.7 Å²	48.7	15%	0.152	25%	0.254	C	S	.	.			trans	-92	145.2	-176.6	-172.4	0	0	0	0	109.4	G53 K73 S154	G53-V156 VanDerWaalsContact C-CG1 3.41Å; G53-V156 VanDerWaalsContact O-CG1 3.23Å; G53-V156 WeakPolarHBondContact O-CG1 3.23Å; K73-V156 WeakPolarHBondContact CB-O 3.44Å; K73-V156 PolarHBondContact N-O 3.29Å; S154-V156 PolarHBondContact O-N 3.05Å; S154-V156 WeakPolarHBondContact OG-CG2 3.45Å
157	M	72.6	Confident	81.9	Confident	60 Å²	60	50.3 Å²	50.3	30%	0.296	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	138.2	-168.4	-51.7	-61.4	-80.2	0	0	113.1	Y52 D70 V71 P72	Y52-M157 WeakPolarHBondContact CD2-O 3.42Å; Y52-M157 WeakPolarHBondContact CE2-O 3.22Å; D70-M157 HydrophobicContact CB-CB 3.59Å; D70-M157 HydrophobicContact CB-CE 3.98Å; D70-M157 HydrophobicContact CB-CG 4.09Å; D70-M157 VanDerWaalsContact O-CE 3.27Å; D70-M157 WeakPolarHBondContact O-CE 3.33Å; V71-M157 CarbonylContact O-C 3.6Å; V71-M157 VanDerWaalsContact O-CA 3.3Å; V71-M157 WeakPolarHBondContact O-CA 3.21Å; P72-M157 HydrophobicContact CB-SD 4.38Å; P72-M157 HydrophobicContact CG-CE 4.03Å; P72-M157 HydrophobicContact CG-SD 4.34Å
158	I	73.6	Confident	82.1	Confident	4 Å²	4	54.4 Å²	54.4	2%	0.021	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	145.9	174.6	14	178.1	0	0	0	108	Y52 D70 V71 F79 Q162 Y163	Y52-I158 HydrophobicContact CD1-CG2 3.85Å; Y52-I158 HydrophobicContact CD2-CB 3.82Å; Y52-I158 HydrophobicContact CD2-CG2 3.32Å; Y52-I158 HydrophobicContact CE1-CG2 3.55Å; Y52-I158 HydrophobicContact CE2-CB 3.37Å; Y52-I158 HydrophobicContact CE2-CG1 3.94Å; Y52-I158 HydrophobicContact CE2-CG2 3.06Å; Y52-I158 HydrophobicContact CG-CG2 3.7Å; Y52-I158 WeakPolarHBondContact OH-CG1 3.4Å; Y52-I158 WeakPolarHBondContact OH-CG2 3.44Å; D70-I158 CarbonylContact C-O 3.5Å; D70-I158 WeakPolarHBondContact CA-O 3.49Å; V71-I158 HydrophobicContact CB-CG1 4.07Å; V71-I158 HydrophobicContact CG1-CD1 4.47Å; V71-I158 HydrophobicContact CG1-CG1 4.45Å; V71-I158 PolarHBondContact N-O 2.95Å; V71-I158 WeakPolarHBondContact O-CG1 3.14Å; V71-I158 PolarHBondContact O-N 2.86Å; F79-I158 HydrophobicContact CZ-CD1 4.12Å; I158-Q162 HydrophobicContact CG2-CB 4.14Å; I158-Q162 VanDerWaalsContact CG2-OE1 3.31Å; I158-Y163 HydrophobicContact CD1-CD2 3.83Å; I158-Y163 HydrophobicContact CD1-CG 4.44Å
159	H	76.8	Confident	82.3	Confident	29 Å²	29	50.9 Å²	50.9	13%	0.134	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	141.8	167.7	-164.5	-99	0	0	0	110.4	F69 V161 Q162 Y163	F69-H159 CarbonylContact O-C 3.52Å; H159-V161 PolarHBondContact ND1-N 3.04Å; H159-V161 PolarHBondContact O-N 2.9Å; H159-Q162 HydrophobicContact CB-CG 4.29Å; H159-Q162 WeakPolarHBondContact O-CB 3.33Å; H159-Q162 PolarHBondContact O-N 2.86Å; H159-Y163 PolarHBondContact O-N 3.46Å
160	V	79.8	Confident	82.5	Confident	44 Å²	44	44 Å²	44	27%	0.267	24%	0.24	S	C	.	.	H	α-helix	trans	-57.2	-34.1	-178	72.3	0	0	0	0	112.6	F69 V71 Q162 Y163 C164	F69-V160 HydrophobicContact CB-CB 4.39Å; F69-V160 HydrophobicContact CB-CG1 3.87Å; F69-V160 HydrophobicContact CD1-CG1 3.88Å; F69-V160 HydrophobicContact CG-CG1 4.25Å; F69-V160 WeakPolarHBondContact O-CB 3.44Å; F69-V160 PolarHBondContact O-N 2.94Å; V71-V160 HydrophobicContact CG2-CB 4.27Å; V71-V160 HydrophobicContact CG2-CG2 4.29Å; V160-Q162 VanDerWaalsContact C-N 3.34Å; V160-Q162 PolarHBondContact O-N 3.02Å; V160-Y163 CarbonylContact O-C 3.5Å; V160-Y163 WeakPolarHBondContact O-CA 3.36Å; V160-Y163 WeakPolarHBondContact O-CB 3.2Å; V160-Y163 PolarHBondContact O-N 3.18Å; V160-Y163 VanDerWaalsContact O-N 3.12Å; V160-C164 PolarHBondContact O-N 2.93Å; V160-C164 PolarHBondContact O-SG 2.89Å; V160-C164 VanDerWaalsContact O-SG 3.38Å
161	V	80	Confident	82.8	Confident	77 Å²	77	45.4 Å²	45.4	47%	0.467	25%	0.249	S	C	.	.	H	α-helix	trans	-63.7	-41.2	176.8	176.4	0	0	0	0	111	L49 H159 Y163 C164 F165	L49-V161 HydrophobicContact CD1-CB 3.82Å; L49-V161 HydrophobicContact CD1-CG1 3.88Å; L49-V161 HydrophobicContact CD1-CG2 4.37Å; H159-V161 PolarHBondContact ND1-N 3.04Å; H159-V161 PolarHBondContact O-N 2.9Å; V161-Y163 VanDerWaalsContact C-N 3.29Å; V161-Y163 PolarHBondContact O-N 3.47Å; V161-C164 PolarHBondContact O-N 3.15Å; V161-F165 VanDerWaalsContact O-CB 3.23Å; V161-F165 WeakPolarHBondContact O-CB 3.5Å; V161-F165 PolarHBondContact O-N 3.39Å
162	Q	81.3	Confident	83.3	Confident	40 Å²	40	45 Å²	45	19%	0.187	24%	0.244	C	C	.	.	H	α-helix	trans	-66.5	-35.6	174.4	-63.3	171.8	-14.6	0	0	111	L49 I158 H159 V160 G166	L49-Q162 PolarHBondContact O-NE2 3.32Å; I158-Q162 HydrophobicContact CG2-CB 4.14Å; I158-Q162 VanDerWaalsContact CG2-OE1 3.31Å; H159-Q162 HydrophobicContact CB-CG 4.29Å; H159-Q162 WeakPolarHBondContact O-CB 3.33Å; H159-Q162 PolarHBondContact O-N 2.86Å; V160-Q162 VanDerWaalsContact C-N 3.34Å; V160-Q162 PolarHBondContact O-N 3.02Å; Q162-G166 PolarHBondContact O-N 3.08Å
163	Y	84.6	Confident	83.9	Confident	39 Å²	39	44 Å²	44	15%	0.153	24%	0.238	C	C	.	.	H	α-helix	trans	-63.2	-52.7	175.1	179.6	-100.2	0	0	0	111.9	V71 H78 F79 I158 H159 V160 V161 F165 G166 L167	V71-Y163 HydrophobicContact CG1-CD2 4.1Å; V71-Y163 HydrophobicContact CG1-CE2 4.46Å; V71-Y163 HydrophobicContact CG1-CG 4.29Å; H78-Y163 HydrophobicContact CB-CE2 4.4Å; H78-Y163 AromaticContact ND1-CZ 3.91Å; H78-Y163 PolarHBondContact ND1-OH 2.87Å; F79-Y163 HydrophobicContact CD1-CD2 4.33Å; F79-Y163 HydrophobicContact CD1-CE2 4.19Å; F79-Y163 AromaticContact CE1-CD2 3.23Å; F79-Y163 HydrophobicContact CE1-CD2 3.23Å; F79-Y163 AromaticContact CE1-CE2 3.47Å; F79-Y163 HydrophobicContact CE1-CE2 3.47Å; F79-Y163 VanDerWaalsContact CE1-CE2 3.47Å; F79-Y163 AromaticContact CE1-CG 3.98Å; F79-Y163 HydrophobicContact CE1-CG 3.98Å; F79-Y163 VanDerWaalsContact CE1-O 3.27Å; F79-Y163 WeakPolarHBondContact CE1-O 3.25Å; F79-Y163 AromaticContact CZ-CD2 3.6Å; F79-Y163 HydrophobicContact CZ-CD2 3.6Å; F79-Y163 HydrophobicContact CZ-CE2 4.21Å; F79-Y163 HydrophobicContact CZ-CG 4.34Å; I158-Y163 HydrophobicContact CD1-CD2 3.83Å; I158-Y163 HydrophobicContact CD1-CG 4.44Å; H159-Y163 PolarHBondContact O-N 3.46Å; V160-Y163 CarbonylContact O-C 3.5Å; V160-Y163 WeakPolarHBondContact O-CA 3.36Å; V160-Y163 WeakPolarHBondContact O-CB 3.2Å; V160-Y163 PolarHBondContact O-N 3.18Å; V160-Y163 VanDerWaalsContact O-N 3.12Å; V161-Y163 VanDerWaalsContact C-N 3.29Å; V161-Y163 PolarHBondContact O-N 3.47Å; Y163-F165 VanDerWaalsContact C-N 3.31Å; Y163-F165 PolarHBondContact O-N 3.02Å; Y163-G166 PolarHBondContact O-N 3.12Å; Y163-L167 HydrophobicContact CD1-CD1 4.15Å; Y163-L167 HydrophobicContact CE1-CD1 3.57Å; Y163-L167 HydrophobicContact CE1-CG 4.39Å; Y163-L167 WeakPolarHBondContact O-CG 3.45Å; Y163-L167 PolarHBondContact O-N 3.33Å; Y163-L167 VanDerWaalsContact O-N 3.16Å
164	C	88.1	Confident	84.8	Confident	65 Å²	65	41.2 Å²	41.2	44%	0.439	23%	0.226	S	C	.	.	H	α-helix	trans	-60.8	-40.9	176.2	-65.9	0	0	0	0	111.8	V160 V161 G166 L167 V168	V160-C164 PolarHBondContact O-N 2.93Å; V160-C164 PolarHBondContact O-SG 2.89Å; V160-C164 VanDerWaalsContact O-SG 3.38Å; V161-C164 PolarHBondContact O-N 3.15Å; C164-G166 PolarHBondContact O-N 2.98Å; C164-L167 WeakPolarHBondContact O-CB 3.45Å; C164-L167 PolarHBondContact O-N 2.94Å; C164-V168 WeakPolarHBondContact O-CG2 3.47Å; C164-V168 PolarHBondContact O-N 3.32Å
165	F	89.1	Confident	86	Confident	67 Å²	67	41 Å²	41	29%	0.294	22%	0.223	S	C	.	.	H	α-helix	trans	-58.2	-47.5	175	175.9	-99.8	0	0	0	111.7	L22 F26 V161 Y163 L167 V168 Y169	L22-F165 HydrophobicContact CD1-CE2 3.96Å; L22-F165 HydrophobicContact CD1-CZ 4.4Å; L22-F165 HydrophobicContact CD2-CD2 4.43Å; L22-F165 HydrophobicContact CD2-CE2 3.6Å; L22-F165 HydrophobicContact CD2-CZ 4.41Å; L22-F165 HydrophobicContact CG-CE2 4.37Å; F26-F165 HydrophobicContact CE2-CE1 4.14Å; F26-F165 AromaticContact CE2-CZ 3.77Å; F26-F165 HydrophobicContact CE2-CZ 3.77Å; F26-F165 AromaticContact CZ-CE1 3.8Å; F26-F165 HydrophobicContact CZ-CE1 3.8Å; F26-F165 AromaticContact CZ-CZ 3.89Å; F26-F165 HydrophobicContact CZ-CZ 3.89Å; V161-F165 VanDerWaalsContact O-CB 3.23Å; V161-F165 WeakPolarHBondContact O-CB 3.5Å; V161-F165 PolarHBondContact O-N 3.39Å; Y163-F165 VanDerWaalsContact C-N 3.31Å; Y163-F165 PolarHBondContact O-N 3.02Å; F165-L167 VanDerWaalsContact C-N 3.28Å; F165-L167 PolarHBondContact O-N 3.26Å; F165-V168 PolarHBondContact O-N 3.1Å; F165-Y169 HydrophobicContact CE1-CD2 4.48Å; F165-Y169 HydrophobicContact CZ-CD2 4.16Å; F165-Y169 VanDerWaalsContact O-CB 3.23Å; F165-Y169 WeakPolarHBondContact O-CB 3.34Å; F165-Y169 PolarHBondContact O-N 2.87Å
166	G	88.8	Confident	87.3	Confident	10 Å²	10	33.5 Å²	33.5	10%	0.103	18%	0.183	C	C	.	.	H	α-helix	trans	-59.2	-38	177.8	0	0	0	0	0	113.1	Q162 Y163 C164 Y170	Q162-G166 PolarHBondContact O-N 3.08Å; Y163-G166 PolarHBondContact O-N 3.12Å; C164-G166 PolarHBondContact O-N 2.98Å; G166-Y170 VanDerWaalsContact O-CD2 3.27Å; G166-Y170 WeakPolarHBondContact O-CD2 3.35Å; G166-Y170 PolarHBondContact O-N 3.29Å
167	L	91.9	Very high	88.5	Confident	34 Å²	34	32.3 Å²	32.3	18%	0.178	18%	0.176	C	C	.	.	H	α-helix	trans	-65.9	-51.1	175.7	-67.4	-178.5	0	0	0	112.6	F79 I82 Y163 C164 F165 Y169 Y170	F79-L167 HydrophobicContact CD1-CD2 3.63Å; F79-L167 HydrophobicContact CD1-CG 4.03Å; F79-L167 HydrophobicContact CE1-CD2 4.2Å; F79-L167 HydrophobicContact CE1-CG 4.14Å; I82-L167 HydrophobicContact CB-CD2 4.45Å; I82-L167 HydrophobicContact CD1-CD1 4.49Å; I82-L167 HydrophobicContact CD1-CD2 3.38Å; I82-L167 HydrophobicContact CD1-CG 4.47Å; I82-L167 HydrophobicContact CG1-CD2 4.43Å; Y163-L167 HydrophobicContact CD1-CD1 4.15Å; Y163-L167 HydrophobicContact CE1-CD1 3.57Å; Y163-L167 HydrophobicContact CE1-CG 4.39Å; Y163-L167 WeakPolarHBondContact O-CG 3.45Å; Y163-L167 PolarHBondContact O-N 3.33Å; Y163-L167 VanDerWaalsContact O-N 3.16Å; C164-L167 WeakPolarHBondContact O-CB 3.45Å; C164-L167 PolarHBondContact O-N 2.94Å; F165-L167 VanDerWaalsContact C-N 3.28Å; F165-L167 PolarHBondContact O-N 3.26Å; L167-Y169 VanDerWaalsContact C-N 3.28Å; L167-Y169 PolarHBondContact O-N 3.41Å; L167-Y170 PolarHBondContact O-N 3.26Å
168	V	94.6	Very high	89.4	Confident	93 Å²	93	29.4 Å²	29.4	56%	0.564	16%	0.162	S	C	*	.	H	α-helix	trans	-64.6	-36.6	-179.7	174.6	0	0	0	0	110.8	C164 F165 Y170 V171 L172	C164-V168 WeakPolarHBondContact O-CG2 3.47Å; C164-V168 PolarHBondContact O-N 3.32Å; F165-V168 PolarHBondContact O-N 3.1Å; V168-Y170 PolarHBondContact O-N 3.29Å; V168-V171 PolarHBondContact O-N 3.42Å; V168-L172 WeakPolarHBondContact O-CB 3.35Å; V168-L172 PolarHBondContact O-N 3.31Å
169	Y	94.7	Very high	90.1	Very high	23 Å²	23	29.4 Å²	29.4	9%	0.09	16%	0.162	C	C	.	.	H	α-helix	trans	-55.6	-50.7	179.1	178	-92.9	0	0	0	112.1	W19 F165 L167 V171 L172 V173 Y263 V284	W19-Y169 AromaticContact CH2-CD2 3.91Å; W19-Y169 HydrophobicContact CH2-CD2 3.91Å; W19-Y169 AromaticContact CH2-CE2 3.65Å; W19-Y169 HydrophobicContact CH2-CE2 3.65Å; W19-Y169 AromaticContact CZ3-CD2 3.97Å; W19-Y169 HydrophobicContact CZ3-CD2 3.97Å; W19-Y169 AromaticContact CZ3-CE2 3.6Å; W19-Y169 HydrophobicContact CZ3-CE2 3.6Å; F165-Y169 HydrophobicContact CE1-CD2 4.48Å; F165-Y169 HydrophobicContact CZ-CD2 4.16Å; F165-Y169 VanDerWaalsContact O-CB 3.23Å; F165-Y169 WeakPolarHBondContact O-CB 3.34Å; F165-Y169 PolarHBondContact O-N 2.87Å; L167-Y169 VanDerWaalsContact C-N 3.28Å; L167-Y169 PolarHBondContact O-N 3.41Å; Y169-V171 VanDerWaalsContact C-N 3.28Å; Y169-V171 PolarHBondContact O-N 3.09Å; Y169-L172 PolarHBondContact O-N 3.42Å; Y169-L172 VanDerWaalsContact O-N 3.17Å; Y169-V173 HydrophobicContact CD1-CG2 4.05Å; Y169-V173 HydrophobicContact CD2-CG2 4.35Å; Y169-V173 HydrophobicContact CE1-CG2 3.59Å; Y169-V173 HydrophobicContact CE2-CG2 3.93Å; Y169-V173 HydrophobicContact CG-CG2 4.4Å; Y169-V173 WeakPolarHBondContact O-CG2 3.39Å; Y169-V173 PolarHBondContact O-N 2.93Å; Y169-Y263 WeakPolarHBondContact OH-CE1 3.19Å; Y169-Y263 PolarHBondContact OH-OH 3.26Å; Y169-V284 WeakPolarHBondContact OH-CG2 3.23Å
170	Y	94.7	Very high	90.4	Very high	15 Å²	15	28.6 Å²	28.6	6%	0.059	16%	0.158	C	C	.	.	H	α-helix	trans	-68.6	-27	-178.3	-77.3	-65.1	0	0	0	113.8	F79 Y80 S83 N87 G166 L167 V168	F79-Y170 HydrophobicContact CB-CD2 3.86Å; F79-Y170 HydrophobicContact CB-CE2 3.7Å; Y80-Y170 HydrophobicContact CD1-CE2 4.42Å; Y80-Y170 HydrophobicContact CE1-CE1 4.27Å; Y80-Y170 HydrophobicContact CE1-CE2 4.2Å; Y80-Y170 AromaticContact CE1-CZ 3.59Å; Y80-Y170 WeakPolarHBondContact CE1-OH 3.35Å; Y80-Y170 PolarHBondContact OH-OH 3.39Å; S83-Y170 WeakPolarHBondContact OG-CD1 3.38Å; N87-Y170 PolarHBondContact ND2-O 2.84Å; G166-Y170 VanDerWaalsContact O-CD2 3.27Å; G166-Y170 WeakPolarHBondContact O-CD2 3.35Å; G166-Y170 PolarHBondContact O-N 3.29Å; L167-Y170 PolarHBondContact O-N 3.26Å; V168-Y170 PolarHBondContact O-N 3.29Å
171	V	96.3	Very high	90.4	Very high	45 Å²	45	26.5 Å²	26.5	27%	0.273	15%	0.146	S	C	.	.	H	α-helix	trans	-69	-47.4	170.7	174.1	0	0	0	0	110.4	I82 W86 V168 Y169 G174 L175	I82-V171 HydrophobicContact CG2-CG2 4.19Å; W86-V171 HydrophobicContact CD2-CG1 4.43Å; W86-V171 HydrophobicContact CG-CG2 4.31Å; W86-V171 HydrophobicContact CZ2-CG1 4.03Å; W86-V171 PolarHBondContact NE1-O 3.04Å; W86-V171 VanDerWaalsContact NE1-O 3.13Å; V168-V171 PolarHBondContact O-N 3.42Å; Y169-V171 VanDerWaalsContact C-N 3.28Å; Y169-V171 PolarHBondContact O-N 3.09Å; V171-G174 PolarHBondContact O-N 3.46Å; V171-L175 HydrophobicContact CG1-CD1 4.04Å; V171-L175 WeakPolarHBondContact O-CG 3.4Å; V171-L175 PolarHBondContact O-N 2.89Å; V171-L175 VanDerWaalsContact O-N 3.13Å
172	L	96.1	Very high	90	Very high	22 Å²	22	23.6 Å²	23.6	12%	0.115	13%	0.128	C	C	.	.	H	α-helix	trans	-66.2	-40.7	-177.6	-173.4	67.5	0	0	0	112.8	L15 V18 W19 L22 V168 Y169 G174 L175 T176	L15-L172 HydrophobicContact CD1-CD1 3.54Å; L15-L172 HydrophobicContact CD1-CG 4.25Å; V18-L172 HydrophobicContact CG1-CD2 3.55Å; W19-L172 HydrophobicContact CD2-CD2 4.42Å; W19-L172 HydrophobicContact CH2-CD2 3.85Å; W19-L172 HydrophobicContact CH2-CG 4.19Å; W19-L172 HydrophobicContact CZ2-CB 4.29Å; W19-L172 HydrophobicContact CZ2-CD2 3.63Å; W19-L172 HydrophobicContact CZ2-CG 3.63Å; W19-L172 HydrophobicContact CZ3-CD2 4.33Å; L22-L172 HydrophobicContact CD1-CD2 4.44Å; V168-L172 WeakPolarHBondContact O-CB 3.35Å; V168-L172 PolarHBondContact O-N 3.31Å; Y169-L172 PolarHBondContact O-N 3.42Å; Y169-L172 VanDerWaalsContact O-N 3.17Å; L172-G174 VanDerWaalsContact C-N 3.35Å; L172-G174 PolarHBondContact O-N 3.29Å; L172-L175 PolarHBondContact O-N 3.48Å; L172-T176 WeakPolarHBondContact O-CB 3.19Å; L172-T176 PolarHBondContact O-N 2.99Å; L172-T176 PolarHBondContact O-OG1 3.33Å
173	V	96.6	Very high	89.2	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-61.1	-44.5	177	174.8	0	0	0	0	110.6	W19 L136 Y169 L175 T176 V177 Y263 W277 V280	W19-V173 HydrophobicContact CH2-CG2 3.59Å; W19-V173 HydrophobicContact CZ2-CG2 3.95Å; L136-V173 HydrophobicContact CD1-CG1 3.8Å; L136-V173 HydrophobicContact CD2-CB 4.49Å; L136-V173 HydrophobicContact CD2-CG1 3.72Å; L136-V173 HydrophobicContact CG-CG1 4.42Å; Y169-V173 HydrophobicContact CD1-CG2 4.05Å; Y169-V173 HydrophobicContact CD2-CG2 4.35Å; Y169-V173 HydrophobicContact CE1-CG2 3.59Å; Y169-V173 HydrophobicContact CE2-CG2 3.93Å; Y169-V173 HydrophobicContact CG-CG2 4.4Å; Y169-V173 WeakPolarHBondContact O-CG2 3.39Å; Y169-V173 PolarHBondContact O-N 2.93Å; V173-L175 PolarHBondContact O-N 3.2Å; V173-T176 WeakPolarHBondContact O-CB 3.48Å; V173-T176 PolarHBondContact O-N 3.46Å; V173-T176 VanDerWaalsContact O-N 3.13Å; V173-V177 WeakPolarHBondContact O-CG2 3.49Å; V173-V177 PolarHBondContact O-N 2.86Å; V173-Y263 HydrophobicContact CG1-CE1 4.47Å; V173-W277 HydrophobicContact CG1-CH2 3.95Å; V173-W277 HydrophobicContact CG1-CZ3 4.17Å; V173-V280 HydrophobicContact CG2-CG1 4.41Å
174	G	96.2	Very high	87.9	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-58.8	-48.2	175.5	0	0	0	0	0	113.5	N87 L90 V171 L172 T176 V177 L178	N87-G174 WeakPolarHBondContact OD1-CA 3.42Å; L90-G174 VanDerWaalsContact CD1-C 3.45Å; V171-G174 PolarHBondContact O-N 3.46Å; L172-G174 VanDerWaalsContact C-N 3.35Å; L172-G174 PolarHBondContact O-N 3.29Å; G174-T176 PolarHBondContact O-N 2.87Å; G174-V177 PolarHBondContact O-N 3.05Å; G174-L178 PolarHBondContact O-N 2.99Å
175	L	94.9	Very high	86.1	Confident	11 Å²	11	27 Å²	27	6%	0.058	16%	0.157	C	C	.	.	H	α-helix	trans	-62	-33.5	175.5	-71.9	171	0	0	0	112	W86 L108 L111 L112 L115 V171 L172 V173 L178 S179	W86-L175 HydrophobicContact CZ2-CD1 4.15Å; W86-L175 HydrophobicContact CZ2-CD2 3.85Å; W86-L175 HydrophobicContact CZ2-CG 3.92Å; L108-L175 HydrophobicContact CD1-CD2 3.98Å; L111-L175 HydrophobicContact CD2-CD1 3.9Å; L111-L175 HydrophobicContact CD2-CD2 3.89Å; L112-L175 HydrophobicContact CD2-CD2 4.15Å; L115-L175 HydrophobicContact CD1-CB 4Å; L115-L175 HydrophobicContact CD1-CD1 4.02Å; L115-L175 HydrophobicContact CD1-CG 4.42Å; V171-L175 HydrophobicContact CG1-CD1 4.04Å; V171-L175 WeakPolarHBondContact O-CG 3.4Å; V171-L175 PolarHBondContact O-N 2.89Å; V171-L175 VanDerWaalsContact O-N 3.13Å; L172-L175 PolarHBondContact O-N 3.48Å; V173-L175 PolarHBondContact O-N 3.2Å; L175-L178 PolarHBondContact O-N 3.39Å; L175-S179 WeakPolarHBondContact O-CB 3.43Å; L175-S179 PolarHBondContact O-N 3.12Å; L175-S179 PolarHBondContact O-OG 3.31Å
176	T	94.4	Very high	84.1	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-66.3	-39.9	176.5	-58.1	0	0	0	0	112.4	L15 W19 L172 V173 G174 S179 Q180 T276 W277 V280	L15-T176 WeakPolarHBondContact CD1-OG1 3.45Å; L15-T176 HydrophobicContact CD2-CG2 3.99Å; W19-T176 WeakPolarHBondContact CZ2-OG1 3.37Å; W19-T176 PolarHBondContact NE1-OG1 3.35Å; L172-T176 WeakPolarHBondContact O-CB 3.19Å; L172-T176 PolarHBondContact O-N 2.99Å; L172-T176 PolarHBondContact O-OG1 3.33Å; V173-T176 WeakPolarHBondContact O-CB 3.48Å; V173-T176 PolarHBondContact O-N 3.46Å; V173-T176 VanDerWaalsContact O-N 3.13Å; G174-T176 PolarHBondContact O-N 2.87Å; T176-S179 PolarHBondContact O-OG 3.02Å; T176-Q180 VanDerWaalsContact O-CG 3.32Å; T176-Q180 WeakPolarHBondContact O-CG 3.48Å; T176-Q180 PolarHBondContact O-NE2 2.87Å; T176-T276 HydrophobicContact CG2-CG2 3.91Å; T176-W277 HydrophobicContact CG2-CE3 4.28Å; T176-V280 HydrophobicContact CG2-CG2 3.8Å
177	V	93.6	Very high	82	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-64.2	-48.1	173.9	177.9	0	0	0	0	109.8	A129 V132 L133 L136 V173 G174 S179 Q180 F270 W277	A129-V177 HydrophobicContact CB-CG1 4.38Å; A129-V177 VanDerWaalsContact O-CG1 3.31Å; A129-V177 WeakPolarHBondContact O-CG1 3Å; V132-V177 HydrophobicContact CB-CG1 4.23Å; V132-V177 HydrophobicContact CG1-CG1 4.04Å; V132-V177 HydrophobicContact CG1-CG2 3.71Å; L133-V177 HydrophobicContact CB-CG1 3.88Å; L133-V177 HydrophobicContact CD1-CB 4.33Å; L133-V177 HydrophobicContact CD1-CG1 4.28Å; L136-V177 HydrophobicContact CD2-CG2 4.41Å; V173-V177 WeakPolarHBondContact O-CG2 3.49Å; V173-V177 PolarHBondContact O-N 2.86Å; G174-V177 PolarHBondContact O-N 3.05Å; V177-S179 VanDerWaalsContact C-N 3.31Å; V177-S179 PolarHBondContact O-N 3.11Å; V177-Q180 WeakPolarHBondContact O-CB 3.39Å; V177-Q180 PolarHBondContact O-N 3.27Å; V177-Q180 VanDerWaalsContact O-N 3.13Å; V177-F270 HydrophobicContact CG1-CZ 4.22Å; V177-W277 HydrophobicContact CG2-CE3 4.23Å; V177-W277 HydrophobicContact CG2-CH2 3.88Å; V177-W277 HydrophobicContact CG2-CZ3 3.38Å
178	L	91.1	Very high	79.8	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-68.3	-30.4	-175.9	-165.3	61.4	0	0	0	112.7	L90 L94 F104 L108 L112 G174 L175 Q180 V181	L90-L178 HydrophobicContact CD2-CD2 3.91Å; L94-L178 HydrophobicContact CB-CD1 4.17Å; L94-L178 HydrophobicContact CD1-CD1 4.06Å; L94-L178 HydrophobicContact CD2-CD1 4.33Å; L94-L178 HydrophobicContact CG-CD1 4.42Å; F104-L178 HydrophobicContact CE1-CD1 4.01Å; F104-L178 HydrophobicContact CE1-CD2 4.31Å; F104-L178 HydrophobicContact CZ-CD1 3.77Å; L108-L178 HydrophobicContact CD1-CD2 4.26Å; L108-L178 HydrophobicContact CD2-CD2 3.92Å; L108-L178 HydrophobicContact CG-CD2 4.29Å; L112-L178 HydrophobicContact CD1-CD2 3.77Å; L112-L178 HydrophobicContact CD1-CG 3.82Å; L112-L178 HydrophobicContact CD2-CB 4.09Å; L112-L178 HydrophobicContact CD2-CD2 4.34Å; L112-L178 HydrophobicContact CD2-CG 4.2Å; G174-L178 PolarHBondContact O-N 2.99Å; L175-L178 PolarHBondContact O-N 3.39Å; L178-Q180 PolarHBondContact O-N 3.39Å; L178-V181 HydrophobicContact CD1-CG2 4.22Å; L178-V181 WeakPolarHBondContact O-CG2 3.42Å; L178-V181 PolarHBondContact O-N 2.94Å; L178-V181 VanDerWaalsContact O-N 3.14Å
179	S	88.2	Confident	77.9	Confident	4 Å²	4	38.8 Å²	38.8	3%	0.028	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-9.8	175.3	74.5	0	0	0	0	113.9	L15 L175 T176 V177 V181	L15-S179 WeakPolarHBondContact CD2-OG 3.44Å; L175-S179 WeakPolarHBondContact O-CB 3.43Å; L175-S179 PolarHBondContact O-N 3.12Å; L175-S179 PolarHBondContact O-OG 3.31Å; T176-S179 PolarHBondContact O-OG 3.02Å; V177-S179 VanDerWaalsContact C-N 3.31Å; V177-S179 PolarHBondContact O-N 3.11Å; S179-V181 VanDerWaalsContact C-N 3.31Å
180	Q	84.3	Confident	75.7	Confident	11 Å²	11	43 Å²	43	5%	0.051	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-9.7	173.5	-49.2	-47.6	-56.1	0	0	112.5	T176 V177 L178 F270 N274	T176-Q180 VanDerWaalsContact O-CG 3.32Å; T176-Q180 WeakPolarHBondContact O-CG 3.48Å; T176-Q180 PolarHBondContact O-NE2 2.87Å; V177-Q180 WeakPolarHBondContact O-CB 3.39Å; V177-Q180 PolarHBondContact O-N 3.27Å; V177-Q180 VanDerWaalsContact O-N 3.13Å; L178-Q180 PolarHBondContact O-N 3.39Å; Q180-F270 HydrophobicContact CB-CE1 4.19Å; Q180-F270 HydrophobicContact CB-CZ 4.39Å; Q180-F270 HydrophobicContact CG-CE1 4.25Å; Q180-F270 HydrophobicContact CG-CZ 4.03Å; Q180-N274 WeakPolarHBondContact CG-ND2 3.48Å; Q180-N274 PolarHBondContact OE1-ND2 3.42Å; Q180-N274 PolarHBondContact OE1-OD1 3.07Å
181	V	80	Confident	73.5	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.254	C	S	.	.	S	Bend	trans	-83.8	129.4	-179.4	-165.9	0	0	0	0	109.4	L94 A129 L178 S179 M183 Y189	L94-V181 HydrophobicContact CD1-CG1 4.26Å; L94-V181 HydrophobicContact CD1-CG2 4.05Å; A129-V181 HydrophobicContact CB-CG2 3.5Å; L178-V181 HydrophobicContact CD1-CG2 4.22Å; L178-V181 WeakPolarHBondContact O-CG2 3.42Å; L178-V181 PolarHBondContact O-N 2.94Å; L178-V181 VanDerWaalsContact O-N 3.14Å; S179-V181 VanDerWaalsContact C-N 3.31Å; V181-M183 PolarHBondContact O-N 3.5Å; V181-Y189 HydrophobicContact CG1-CE1 4.13Å; V181-Y189 WeakPolarHBondContact CG1-OH 3.05Å
182	P	69.8	Low	71.2	Confident	16 Å²	16	48.9 Å²	48.9	10%	0.104	28%	0.283	C	S	.	.			trans	-60.3	103.8	179.9	-28	35.9	0	0	0	113.9	F120 G122 D184 Y189	F120-P182 VanDerWaalsContact O-CB 3.25Å; F120-P182 WeakPolarHBondContact O-CB 3.28Å; F120-P182 WeakPolarHBondContact O-CG 3.29Å; G122-P182 VanDerWaalsContact O-CG 3.27Å; G122-P182 WeakPolarHBondContact O-CG 3.49Å; P182-D184 PolarHBondContact O-N 3.34Å; P182-D184 VanDerWaalsContact O-N 3.07Å; P182-Y189 WeakPolarHBondContact O-CE1 3.45Å; P182-Y189 PolarHBondContact O-OH 3.17Å
183	M	65	Low	69.2	Low	22 Å²	22	55.9 Å²	55.9	11%	0.108	31%	0.313	C	S	.	.			trans	-80.3	91.4	-178	-59.2	-67.1	-82.3	0	0	110.8	F104 H109 L112 V181	F104-M183 HydrophobicContact CD2-CE 3.48Å; F104-M183 VanDerWaalsContact CD2-CE 3.48Å; F104-M183 HydrophobicContact CD2-SD 3.8Å; F104-M183 HydrophobicContact CE2-CE 4Å; F104-M183 HydrophobicContact CE2-SD 3.69Å; F104-M183 HydrophobicContact CG-CE 4.31Å; H109-M183 HydrophobicContact CB-CE 4.13Å; H109-M183 WeakPolarHBondContact CD2-CE 3.24Å; L112-M183 HydrophobicContact CD1-CE 3.74Å; L112-M183 HydrophobicContact CD1-SD 4.21Å; V181-M183 PolarHBondContact O-N 3.5Å
184	D	57.8	Low	67.8	Low	143 Å²	143	60.8 Å²	60.8	77%	0.765	34%	0.339	S	S	*	.			trans	-82.6	119.2	177.7	-139.7	-2.3	0	0	0	110.7	P182 R186	P182-D184 PolarHBondContact O-N 3.34Å; P182-D184 VanDerWaalsContact O-N 3.07Å; D184-R186 VanDerWaalsContact C-N 3.27Å; D184-R186 PolarHBondContact O-N 3.43Å
185	G	50.8	Low	66.7	Low	50 Å²	50	61.6 Å²	61.6	52%	0.515	34%	0.344	S	S	.	.	S	Bend	trans	-74.7	11.1	-150.4	0	0	0	0	0	118
186	R	45.9	Very low	65.8	Low	239 Å²	239	67.5 Å²	67.5	90%	0.902	38%	0.375	S	S	*	.	S	Bend	trans	-154.2	-14.1	-175.7	-107.9	172.7	-159.9	-157.2	3	117.3	D184	D184-R186 VanDerWaalsContact C-N 3.27Å; D184-R186 PolarHBondContact O-N 3.43Å
187	N	44.9	Very low	64.9	Low	131 Å²	131	74.9 Å²	74.9	70%	0.701	41%	0.411	S	S	*	.	S	Bend	trans	-121.2	126.2	174.8	-66.4	-39.1	0	0	0	106.8	Y189	N187-Y189 PolarHBondContact O-N 3.48Å
188	A	46.6	Very low	64.3	Low	26 Å²	26	77.6 Å²	77.6	22%	0.215	42%	0.424	C	S	.	.			trans	-19	134.9	139.7	0	0	0	0	0	110.8	G101 V190	G101-A188 WeakPolarHBondContact O-CB 3.48Å; A188-V190 HydrophobicContact CB-CG2 3.96Å; A188-V190 PolarHBondContact O-N 3.23Å
189	Y	53.1	Low	64.1	Low	56 Å²	56	80.6 Å²	80.6	22%	0.22	45%	0.448	C	S	.	.			trans	-61.3	76.6	174	-67.6	-102.2	0	0	0	109.3	S97 F104 V181 P182 N187 T191	S97-Y189 WeakPolarHBondContact OG-CD2 3.44Å; S97-Y189 VanDerWaalsContact OG-CE2 3.3Å; S97-Y189 WeakPolarHBondContact OG-CE2 3.29Å; F104-Y189 HydrophobicContact CE2-CE2 4.07Å; V181-Y189 HydrophobicContact CG1-CE1 4.13Å; V181-Y189 WeakPolarHBondContact CG1-OH 3.05Å; P182-Y189 WeakPolarHBondContact O-CE1 3.45Å; P182-Y189 PolarHBondContact O-OH 3.17Å; N187-Y189 PolarHBondContact O-N 3.48Å; Y189-T191 PolarHBondContact O-N 2.9Å; Y189-T191 VanDerWaalsContact O-N 3.13Å
190	V	48.6	Very low	64.3	Low	113 Å²	113	85.8 Å²	85.8	69%	0.685	47%	0.467	S	S	*	.			trans	-87.8	82.2	171.8	179.8	0	0	0	0	103.4	A188	A188-V190 HydrophobicContact CB-CG2 3.96Å; A188-V190 PolarHBondContact O-N 3.23Å
191	T	48.8	Very low	64.7	Low	96 Å²	96	93.2 Å²	93.2	59%	0.589	50%	0.495	S	S	*	.			trans	-145.3	86.6	140.9	-65.3	0	0	0	0	105.7	Y189 K193	Y189-T191 PolarHBondContact O-N 2.9Å; Y189-T191 VanDerWaalsContact O-N 3.13Å; T191-K193 HydrophobicContact CG2-CB 3.75Å; T191-K193 HydrophobicContact CG2-CD 3.83Å; T191-K193 HydrophobicContact CG2-CG 3.61Å; T191-K193 PolarHBondContact O-N 3.35Å
192	G	47.5	Very low	65.4	Low	87 Å²	87	94.3 Å²	94.3	90%	0.897	50%	0.5	S	S	*	.			trans	-62.9	52.1	160.9	0	0	0	0	0	111.9
193	K	54.6	Low	66.7	Low	169 Å²	169	94 Å²	94	74%	0.735	50%	0.497	S	S	*	.	S	Bend	trans	-99.9	116.8	157.8	-69.7	-178	175.6	-179.1	0	105.5	T191 V195	T191-K193 HydrophobicContact CG2-CB 3.75Å; T191-K193 HydrophobicContact CG2-CD 3.83Å; T191-K193 HydrophobicContact CG2-CG 3.61Å; T191-K193 PolarHBondContact O-N 3.35Å; K193-V195 PolarHBondContact O-N 3.42Å
194	N	67.9	Low	68.2	Low	102 Å²	102	98.3 Å²	98.3	55%	0.545	52%	0.519	S	S	.	.			trans	-15	100.1	179.3	-69.1	-30.9	0	0	0	113.8	L196 M197	N194-L196 PolarHBondContact O-N 2.84Å; N194-M197 HydrophobicContact CB-CB 4.05Å; N194-M197 HydrophobicContact CB-CG 3.6Å; N194-M197 HydrophobicContact CB-SD 3.95Å; N194-M197 WeakPolarHBondContact O-CA 3.36Å; N194-M197 VanDerWaalsContact O-CB 3.3Å; N194-M197 WeakPolarHBondContact O-CB 3.36Å; N194-M197 PolarHBondContact O-N 3.14Å
195	V	73.3	Confident	70.1	Confident	18 Å²	18	94.6 Å²	94.6	11%	0.109	50%	0.499	C	S	.	.	G	3₁₀ helix	trans	-51.4	-33	172.5	179.3	0	0	0	0	110.3	F99 L127 K193 M197 Q198	F99-V195 HydrophobicContact CE1-CG2 4.41Å; L127-V195 HydrophobicContact CB-CG1 3.86Å; L127-V195 HydrophobicContact CD1-CG1 3.91Å; L127-V195 HydrophobicContact CG-CG1 4.44Å; K193-V195 PolarHBondContact O-N 3.42Å; V195-M197 VanDerWaalsContact C-N 3.27Å; V195-M197 PolarHBondContact O-N 3.37Å; V195-Q198 VanDerWaalsContact O-CB 3.25Å; V195-Q198 WeakPolarHBondContact O-CB 3.4Å; V195-Q198 WeakPolarHBondContact O-CG 3.27Å; V195-Q198 PolarHBondContact O-N 3.25Å
196	L	74.8	Confident	72.3	Confident	134 Å²	134	92.2 Å²	92.2	70%	0.702	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-62	-25.5	173.6	-64.7	174.3	0	0	0	114.6	N194 Q198 A199	N194-L196 PolarHBondContact O-N 2.84Å; L196-Q198 PolarHBondContact O-N 3.44Å; L196-A199 WeakPolarHBondContact O-CB 3.3Å; L196-A199 PolarHBondContact O-N 3.44Å
197	M	76.8	Confident	74.8	Confident	155 Å²	155	84.2 Å²	84.2	76%	0.764	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-70.6	-12.7	173	-75	-176	151.9	0	0	112.8	N194 V195 A199	N194-M197 HydrophobicContact CB-CB 4.05Å; N194-M197 HydrophobicContact CB-CG 3.6Å; N194-M197 HydrophobicContact CB-SD 3.95Å; N194-M197 WeakPolarHBondContact O-CA 3.36Å; N194-M197 VanDerWaalsContact O-CB 3.3Å; N194-M197 WeakPolarHBondContact O-CB 3.36Å; N194-M197 PolarHBondContact O-N 3.14Å; V195-M197 VanDerWaalsContact C-N 3.27Å; V195-M197 PolarHBondContact O-N 3.37Å; M197-A199 PolarHBondContact O-N 2.92Å
198	Q	80.5	Confident	77.4	Confident	58 Å²	58	83.8 Å²	83.8	27%	0.271	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-78.6	-1.9	168.5	-53.6	-178.8	-6.4	0	0	112.3	G123 L127 V195 L196 R200 H203	G123-Q198 VanDerWaalsContact O-CD 3.3Å; G123-Q198 PolarHBondContact O-NE2 3.39Å; G123-Q198 PolarHBondContact O-OE1 3Å; L127-Q198 HydrophobicContact CB-CB 3.98Å; L127-Q198 HydrophobicContact CD2-CB 3.99Å; V195-Q198 VanDerWaalsContact O-CB 3.25Å; V195-Q198 WeakPolarHBondContact O-CB 3.4Å; V195-Q198 WeakPolarHBondContact O-CG 3.27Å; V195-Q198 PolarHBondContact O-N 3.25Å; L196-Q198 PolarHBondContact O-N 3.44Å; Q198-R200 PolarHBondContact O-N 2.86Å; Q198-H203 PolarHBondContact O-CE1 2.65Å
199	A	87.7	Confident	79.9	Confident	62 Å²	62	84.9 Å²	84.9	51%	0.512	45%	0.445	S	S	.	.			trans	-59	138.2	178.2	0	0	0	0	0	110.5	L127 L196 M197	L127-A199 HydrophobicContact CD2-CB 4.08Å; L196-A199 WeakPolarHBondContact O-CB 3.3Å; L196-A199 PolarHBondContact O-N 3.44Å; M197-A199 PolarHBondContact O-N 2.92Å
200	R	91.1	Very high	82	Confident	113 Å²	113	82.9 Å²	82.9	43%	0.426	44%	0.437	S	S	.	.			trans	-140.1	157.8	-175.4	-71	-172.8	178.5	-173.7	7.1	107.1	E124 Q198 F202 H203	E124-R200 IonicContact OE1-NH2 2.95Å; E124-R200 PolarHBondContact OE1-NH2 3.04Å; E124-R200 IonicContact OE2-CZ 3.47Å; E124-R200 IonicContact OE2-NH1 3.41Å; E124-R200 PolarHBondContact OE2-NH1 3.4Å; E124-R200 IonicContact OE2-NH2 2.88Å; E124-R200 PolarHBondContact OE2-NH2 2.87Å; Q198-R200 PolarHBondContact O-N 2.86Å; R200-F202 HydrophobicContact CB-CD1 3.78Å; R200-F202 HydrophobicContact CB-CE1 3.46Å; R200-F202 VanDerWaalsContact CB-CE1 3.46Å; R200-F202 HydrophobicContact CB-CE2 4.32Å; R200-F202 HydrophobicContact CB-CG 4.36Å; R200-F202 HydrophobicContact CB-CZ 3.75Å; R200-F202 HydrophobicContact CG-CE1 3.97Å; R200-F202 HydrophobicContact CG-CZ 4.16Å; R200-F202 PolarHBondContact O-N 3.06Å; R200-F202 VanDerWaalsContact O-N 3.11Å; R200-H203 PolarHBondContact N-ND1 3.12Å; R200-H203 WeakPolarHBondContact O-CB 3.47Å; R200-H203 PolarHBondContact O-N 3.06Å; R200-H203 PolarHBondContact O-ND1 3.27Å
201	W	94.1	Very high	84.4	Confident	168 Å²	168	82.3 Å²	82.3	64%	0.636	43%	0.429	S	S	*	.	H	α-helix	trans	-54.3	-34.6	-175.8	67.4	-93.9	0	0	0	113.2	H203 I204 L205 F272	W201-H203 VanDerWaalsContact C-N 3.28Å; W201-H203 PolarHBondContact O-N 3.38Å; W201-I204 PolarHBondContact O-N 3.45Å; W201-I204 VanDerWaalsContact O-N 3.17Å; W201-L205 HydrophobicContact CE3-CB 4.45Å; W201-L205 HydrophobicContact CE3-CD2 4.36Å; W201-L205 HydrophobicContact CZ3-CD2 3.67Å; W201-L205 PolarHBondContact O-N 2.97Å; W201-F272 AromaticContact CH2-CE2 3.75Å; W201-F272 HydrophobicContact CH2-CE2 3.75Å; W201-F272 HydrophobicContact CH2-CZ 4.47Å; W201-F272 HydrophobicContact CZ3-CE2 4.3Å
202	F	94.6	Very high	86.8	Confident	22 Å²	22	84.8 Å²	84.8	10%	0.096	43%	0.428	C	S	.	.	H	α-helix	trans	-68.5	-24.1	179.7	61.3	-109.3	0	0	0	113.2	R200 G206 V268 T269 F272	R200-F202 HydrophobicContact CB-CD1 3.78Å; R200-F202 HydrophobicContact CB-CE1 3.46Å; R200-F202 VanDerWaalsContact CB-CE1 3.46Å; R200-F202 HydrophobicContact CB-CE2 4.32Å; R200-F202 HydrophobicContact CB-CG 4.36Å; R200-F202 HydrophobicContact CB-CZ 3.75Å; R200-F202 HydrophobicContact CG-CE1 3.97Å; R200-F202 HydrophobicContact CG-CZ 4.16Å; R200-F202 PolarHBondContact O-N 3.06Å; R200-F202 VanDerWaalsContact O-N 3.11Å; F202-G206 PolarHBondContact O-N 3.05Å; F202-V268 HydrophobicContact CB-CG1 4.35Å; F202-V268 WeakPolarHBondContact CB-O 3.13Å; F202-V268 WeakPolarHBondContact CD2-O 3.25Å; F202-T269 WeakPolarHBondContact CD2-O 3.39Å; F202-T269 VanDerWaalsContact CE2-O 3.27Å; F202-T269 WeakPolarHBondContact CE2-O 3.22Å; F202-F272 HydrophobicContact CB-CE2 4.34Å
203	H	95.6	Very high	89.2	Confident	9 Å²	9	80.6 Å²	80.6	4%	0.042	39%	0.385	C	S	.	.	H	α-helix	trans	-67.5	-40.6	172.3	-62.8	118.3	0	0	0	111.1	S128 L131 Q198 R200 W201 M207 T269	S128-H203 PolarHBondContact OG-NE2 3.11Å; L131-H203 HydrophobicContact CD1-CB 4Å; Q198-H203 PolarHBondContact O-CE1 2.65Å; R200-H203 PolarHBondContact N-ND1 3.12Å; R200-H203 WeakPolarHBondContact O-CB 3.47Å; R200-H203 PolarHBondContact O-N 3.06Å; R200-H203 PolarHBondContact O-ND1 3.27Å; W201-H203 VanDerWaalsContact C-N 3.28Å; W201-H203 PolarHBondContact O-N 3.38Å; H203-M207 WeakPolarHBondContact O-CB 3.19Å; H203-M207 PolarHBondContact O-N 3.29Å; H203-T269 PolarHBondContact CD2-O 3.47Å
204	I	96.8	Very high	91.3	Very high	113 Å²	113	73.1 Å²	73.1	58%	0.579	35%	0.354	S	S	*	.	H	α-helix	trans	-68.3	-47.2	176.8	-57.8	174.5	0	0	0	109.8	W201 G206 M207 M208	W201-I204 PolarHBondContact O-N 3.45Å; W201-I204 VanDerWaalsContact O-N 3.17Å; I204-G206 PolarHBondContact O-N 3.28Å; I204-M207 WeakPolarHBondContact O-CB 3.36Å; I204-M207 PolarHBondContact O-N 3.07Å; I204-M208 HydrophobicContact CG2-SD 4.19Å; I204-M208 WeakPolarHBondContact O-CG 3.46Å; I204-M208 PolarHBondContact O-N 3.32Å
205	L	97.7	Very high	92.7	Very high	65 Å²	65	70.3 Å²	70.3	34%	0.34	35%	0.345	S	S	.	.	H	α-helix	trans	-59.3	-46.9	176.7	179.7	62.3	0	0	0	111.5	W201 M207 M208 M209 V268 F272	W201-L205 HydrophobicContact CE3-CB 4.45Å; W201-L205 HydrophobicContact CE3-CD2 4.36Å; W201-L205 HydrophobicContact CZ3-CD2 3.67Å; W201-L205 PolarHBondContact O-N 2.97Å; L205-M207 VanDerWaalsContact C-N 3.34Å; L205-M207 PolarHBondContact O-N 3.46Å; L205-M208 PolarHBondContact O-N 3.11Å; L205-M209 HydrophobicContact CD1-CG 4.21Å; L205-M209 HydrophobicContact CD1-SD 4.19Å; L205-M209 HydrophobicContact CG-CG 4.45Å; L205-M209 HydrophobicContact CG-SD 3.99Å; L205-M209 WeakPolarHBondContact O-CB 3.36Å; L205-M209 WeakPolarHBondContact O-CG 3.47Å; L205-M209 PolarHBondContact O-N 2.95Å; L205-V268 HydrophobicContact CB-CG1 4.16Å; L205-V268 HydrophobicContact CD2-CG1 3.91Å; L205-V268 HydrophobicContact CG-CG1 3.96Å; L205-F272 HydrophobicContact CD2-CZ 4.39Å
206	G	98.1	Very high	93.9	Very high	0 Å²	0	70 Å²	70	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-58.8	-43.2	176.5	0	0	0	0	0	112.5	F202 I204 M209 F210 S265	F202-G206 PolarHBondContact O-N 3.05Å; I204-G206 PolarHBondContact O-N 3.28Å; G206-M209 PolarHBondContact O-N 3.05Å; G206-F210 VanDerWaalsContact O-CB 3.29Å; G206-F210 WeakPolarHBondContact O-CB 3.33Å; G206-F210 PolarHBondContact O-N 3.06Å; G206-S265 WeakPolarHBondContact O-CB 3.37Å
207	M	98.3	Very high	95	Very high	72 Å²	72	63.8 Å²	63.8	36%	0.355	31%	0.31	S	S	.	.	H	α-helix	trans	-60.5	-48.4	174.1	-177.7	74.9	73.2	0	0	112.2	L131 F135 H203 I204 L205 M209 F210 I211	L131-M207 HydrophobicContact CD2-CE 4.44Å; F135-M207 HydrophobicContact CD1-SD 4.44Å; F135-M207 HydrophobicContact CE1-CE 3.41Å; F135-M207 VanDerWaalsContact CE1-CE 3.41Å; F135-M207 HydrophobicContact CE1-SD 3.3Å; F135-M207 WeakPolarHBondContact CE1-SD 3.38Å; F135-M207 HydrophobicContact CZ-CB 3.92Å; F135-M207 HydrophobicContact CZ-CE 3.56Å; F135-M207 HydrophobicContact CZ-CG 4.31Å; F135-M207 HydrophobicContact CZ-SD 3.46Å; F135-M207 WeakPolarHBondContact CZ-SD 3.44Å; H203-M207 WeakPolarHBondContact O-CB 3.19Å; H203-M207 PolarHBondContact O-N 3.29Å; I204-M207 WeakPolarHBondContact O-CB 3.36Å; I204-M207 PolarHBondContact O-N 3.07Å; L205-M207 VanDerWaalsContact C-N 3.34Å; L205-M207 PolarHBondContact O-N 3.46Å; M207-M209 PolarHBondContact O-N 2.79Å; M207-F210 WeakPolarHBondContact O-CB 3.42Å; M207-F210 PolarHBondContact O-N 2.82Å; M207-I211 HydrophobicContact CG-CD1 3.99Å; M207-I211 WeakPolarHBondContact O-CG1 3.49Å; M207-I211 PolarHBondContact O-N 3.2Å; M207-I211 HydrophobicContact SD-CD1 4.27Å
208	M	98.5	Very high	96	Very high	122 Å²	122	60.7 Å²	60.7	60%	0.601	29%	0.29	S	S	*	.	H	α-helix	trans	-61.7	-45.7	179.5	-70.1	177	70.7	0	0	111.4	I204 L205 F210 I211 W212	I204-M208 HydrophobicContact CG2-SD 4.19Å; I204-M208 WeakPolarHBondContact O-CG 3.46Å; I204-M208 PolarHBondContact O-N 3.32Å; L205-M208 PolarHBondContact O-N 3.11Å; M208-F210 VanDerWaalsContact C-N 3.33Å; M208-F210 PolarHBondContact O-N 3.1Å; M208-I211 PolarHBondContact O-N 3.4Å; M208-W212 WeakPolarHBondContact O-CB 3.27Å; M208-W212 PolarHBondContact O-N 3.36Å
209	M	98.6	Very high	96.8	Very high	49 Å²	49	63.3 Å²	63.3	24%	0.241	30%	0.301	C	S	.	.	H	α-helix	trans	-62.2	-40.4	176	-71.8	178.6	69.4	0	0	111.9	L205 G206 M207 S213 I264 V268	L205-M209 HydrophobicContact CD1-CG 4.21Å; L205-M209 HydrophobicContact CD1-SD 4.19Å; L205-M209 HydrophobicContact CG-CG 4.45Å; L205-M209 HydrophobicContact CG-SD 3.99Å; L205-M209 WeakPolarHBondContact O-CB 3.36Å; L205-M209 WeakPolarHBondContact O-CG 3.47Å; L205-M209 PolarHBondContact O-N 2.95Å; G206-M209 PolarHBondContact O-N 3.05Å; M207-M209 PolarHBondContact O-N 2.79Å; M209-S213 VanDerWaalsContact O-CB 3.27Å; M209-S213 WeakPolarHBondContact O-CB 3.06Å; M209-S213 PolarHBondContact O-N 3.09Å; M209-S213 PolarHBondContact O-OG 3.18Å; M209-I264 HydrophobicContact CE-CG2 3.98Å; M209-V268 HydrophobicContact CE-CG2 4.27Å; M209-V268 HydrophobicContact SD-CG2 3.9Å
210	F	98.7	Very high	97.2	Very high	13 Å²	13	60.3 Å²	60.3	6%	0.057	28%	0.276	C	S	.	.	H	α-helix	trans	-60.8	-49.8	177.2	175.4	-102.4	0	0	0	111.2	F135 L138 H139 G206 M207 M208 S214 I262 S265 M266	F135-F210 HydrophobicContact CB-CD2 3.88Å; F135-F210 HydrophobicContact CB-CE1 4.37Å; F135-F210 HydrophobicContact CB-CE2 3.7Å; F135-F210 HydrophobicContact CB-CG 4.29Å; F135-F210 HydrophobicContact CB-CZ 3.97Å; F135-F210 HydrophobicContact CD1-CD1 4.06Å; F135-F210 HydrophobicContact CD1-CE1 4.22Å; F135-F210 HydrophobicContact CD1-CG 4.33Å; F135-F210 HydrophobicContact CD2-CB 4.15Å; F135-F210 HydrophobicContact CD2-CD2 4.19Å; F135-F210 HydrophobicContact CD2-CG 4.05Å; F135-F210 HydrophobicContact CE1-CD1 4.46Å; F135-F210 HydrophobicContact CE2-CB 4.19Å; F135-F210 HydrophobicContact CE2-CG 4.48Å; F135-F210 HydrophobicContact CG-CD1 4.14Å; F135-F210 HydrophobicContact CG-CD2 4.04Å; F135-F210 HydrophobicContact CG-CE1 4.37Å; F135-F210 HydrophobicContact CG-CE2 4.27Å; F135-F210 AromaticContact CG-CG 3.97Å; F135-F210 HydrophobicContact CG-CG 3.97Å; F135-F210 HydrophobicContact CG-CZ 4.43Å; F135-F210 WeakPolarHBondContact O-CE2 3.47Å; F135-F210 VanDerWaalsContact O-CZ 3.27Å; F135-F210 WeakPolarHBondContact O-CZ 3.39Å; L138-F210 HydrophobicContact CB-CZ 4.41Å; H139-F210 HydrophobicContact CB-CE2 4.12Å; H139-F210 HydrophobicContact CB-CZ 4.19Å; G206-F210 VanDerWaalsContact O-CB 3.29Å; G206-F210 WeakPolarHBondContact O-CB 3.33Å; G206-F210 PolarHBondContact O-N 3.06Å; M207-F210 WeakPolarHBondContact O-CB 3.42Å; M207-F210 PolarHBondContact O-N 2.82Å; M208-F210 VanDerWaalsContact C-N 3.33Å; M208-F210 PolarHBondContact O-N 3.1Å; F210-S214 WeakPolarHBondContact O-CB 3.41Å; F210-S214 PolarHBondContact O-N 3.12Å; F210-S214 PolarHBondContact O-OG 3.43Å; F210-I262 HydrophobicContact CD2-CG2 3.92Å; F210-I262 HydrophobicContact CE2-CG2 3.81Å; F210-S265 WeakPolarHBondContact CA-OG 3.2Å; F210-S265 WeakPolarHBondContact CB-OG 3.46Å; F210-M266 HydrophobicContact CD2-CE 4.33Å; F210-M266 HydrophobicContact CE2-CE 4.01Å
211	I	98.6	Very high	97.4	Very high	101 Å²	101	55.7 Å²	55.7	52%	0.518	26%	0.259	S	S	.	.	H	α-helix	trans	-63.2	-47	-179.5	-67	167.8	0	0	0	110.5	M207 M208 S214 A215	M207-I211 HydrophobicContact CG-CD1 3.99Å; M207-I211 WeakPolarHBondContact O-CG1 3.49Å; M207-I211 PolarHBondContact O-N 3.2Å; M207-I211 HydrophobicContact SD-CD1 4.27Å; M208-I211 PolarHBondContact O-N 3.4Å; I211-S214 WeakPolarHBondContact O-CB 3.43Å; I211-S214 PolarHBondContact O-N 3.26Å; I211-A215 WeakPolarHBondContact O-CB 3.22Å; I211-A215 PolarHBondContact O-N 3.01Å
212	W	98.4	Very high	97.4	Very high	148 Å²	148	49.4 Å²	49.4	56%	0.561	24%	0.239	S	C	*	.	H	α-helix	trans	-58.9	-52	179.2	178.6	-105.1	0	0	0	112.1	M208 S214 A215 H216	M208-W212 WeakPolarHBondContact O-CB 3.27Å; M208-W212 PolarHBondContact O-N 3.36Å; W212-S214 VanDerWaalsContact C-N 3.3Å; W212-S214 PolarHBondContact O-N 2.86Å; W212-A215 PolarHBondContact O-N 3.41Å; W212-H216 AromaticContact CD2-CD2 3.87Å; W212-H216 AromaticContact CD2-NE2 3.88Å; W212-H216 AromaticContact CE2-CD2 3.47Å; W212-H216 VanDerWaalsContact CE2-CD2 3.47Å; W212-H216 AromaticContact CE2-NE2 3.2Å; W212-H216 AromaticContact CH2-NE2 3.48Å; W212-H216 WeakPolarHBondContact CH2-NE2 3.48Å; W212-H216 AromaticContact CZ2-CD2 3.8Å; W212-H216 AromaticContact CZ2-NE2 3Å; W212-H216 WeakPolarHBondContact CZ2-NE2 3.5Å; W212-H216 AromaticContact NE1-CD2 3.55Å; W212-H216 AromaticContact NE1-NE2 3.67Å; W212-H216 PolarHBondContact O-CD2 2.9Å; W212-H216 PolarHBondContact O-N 3.25Å; W212-H216 VanDerWaalsContact O-N 3.13Å
213	S	98.3	Very high	97.5	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-64.7	-38.4	-179.2	-51.2	0	0	0	0	111.4	M209 H216 Q217 M261	M209-S213 VanDerWaalsContact O-CB 3.27Å; M209-S213 WeakPolarHBondContact O-CB 3.06Å; M209-S213 PolarHBondContact O-N 3.09Å; M209-S213 PolarHBondContact O-OG 3.18Å; S213-H216 PolarHBondContact O-N 2.82Å; S213-Q217 WeakPolarHBondContact O-CB 3.23Å; S213-Q217 PolarHBondContact O-N 3.26Å; S213-M261 WeakPolarHBondContact OG-CB 3.38Å
214	S	98.3	Very high	97.3	Very high	11 Å²	11	51.7 Å²	51.7	8%	0.077	25%	0.252	C	S	.	.	H	α-helix	trans	-60	-43.6	173.8	-74.3	0	0	0	0	113.1	R142 F210 I211 W212 Q217 Y218	R142-S214 PolarHBondContact NH1-OG 3.06Å; F210-S214 WeakPolarHBondContact O-CB 3.41Å; F210-S214 PolarHBondContact O-N 3.12Å; F210-S214 PolarHBondContact O-OG 3.43Å; I211-S214 WeakPolarHBondContact O-CB 3.43Å; I211-S214 PolarHBondContact O-N 3.26Å; W212-S214 VanDerWaalsContact C-N 3.3Å; W212-S214 PolarHBondContact O-N 2.86Å; S214-Q217 PolarHBondContact O-N 3.16Å; S214-Y218 WeakPolarHBondContact O-CB 3.32Å; S214-Y218 PolarHBondContact O-N 3.21Å
215	A	98.1	Very high	97	Very high	43 Å²	43	46.5 Å²	46.5	36%	0.355	23%	0.226	S	C	.	.	H	α-helix	trans	-64.7	-45	178.3	0	0	0	0	0	111.7	I211 W212 Y218 K219	I211-A215 WeakPolarHBondContact O-CB 3.22Å; I211-A215 PolarHBondContact O-N 3.01Å; W212-A215 PolarHBondContact O-N 3.41Å; A215-Y218 PolarHBondContact O-N 3.35Å; A215-K219 WeakPolarHBondContact O-CG 3.27Å; A215-K219 PolarHBondContact O-N 2.88Å
216	H	97.9	Very high	96.8	Very high	12 Å²	12	47.8 Å²	47.8	6%	0.056	23%	0.234	C	C	.	.	H	α-helix	trans	-63.8	-42	176.1	-82.5	-70.5	0	0	0	112.6	W212 S213 Y218 K219 C220 D246 W247 A258	W212-H216 AromaticContact CD2-CD2 3.87Å; W212-H216 AromaticContact CD2-NE2 3.88Å; W212-H216 AromaticContact CE2-CD2 3.47Å; W212-H216 VanDerWaalsContact CE2-CD2 3.47Å; W212-H216 AromaticContact CE2-NE2 3.2Å; W212-H216 AromaticContact CH2-NE2 3.48Å; W212-H216 WeakPolarHBondContact CH2-NE2 3.48Å; W212-H216 AromaticContact CZ2-CD2 3.8Å; W212-H216 AromaticContact CZ2-NE2 3Å; W212-H216 WeakPolarHBondContact CZ2-NE2 3.5Å; W212-H216 AromaticContact NE1-CD2 3.55Å; W212-H216 AromaticContact NE1-NE2 3.67Å; W212-H216 PolarHBondContact O-CD2 2.9Å; W212-H216 PolarHBondContact O-N 3.25Å; W212-H216 VanDerWaalsContact O-N 3.13Å; S213-H216 PolarHBondContact O-N 2.82Å; H216-Y218 PolarHBondContact O-N 2.73Å; H216-K219 PolarHBondContact O-N 2.97Å; H216-C220 PolarHBondContact O-N 3.03Å; H216-C220 PolarHBondContact O-SG 3.36Å; H216-D246 IonicContact CE1-OD1 2.62Å; H216-D246 PolarHBondContact CE1-OD1 2.66Å; H216-D246 IonicContact CE1-OD2 3.97Å; H216-D246 IonicContact CG-OD2 3.17Å; H216-D246 VanDerWaalsContact ND1-CG 3.34Å; H216-D246 IonicContact ND1-OD1 3.87Å; H216-D246 PolarHBondContact ND1-OD1 3.5Å; H216-D246 IonicContact ND1-OD2 2.71Å; H216-D246 PolarHBondContact ND1-OD2 2.9Å; H216-W247 HydrophobicContact CB-CD2 4.48Å; H216-W247 HydrophobicContact CB-CE3 4.31Å; H216-W247 HydrophobicContact CB-CH2 3.84Å; H216-W247 HydrophobicContact CB-CZ2 4.02Å; H216-W247 HydrophobicContact CB-CZ3 4Å; H216-W247 AromaticContact CD2-CE2 3.99Å; H216-W247 AromaticContact CD2-CH2 3.89Å; H216-W247 AromaticContact CD2-CZ2 3.4Å; H216-W247 VanDerWaalsContact CD2-CZ2 3.4Å; H216-W247 WeakPolarHBondContact CD2-CZ2 3.38Å; H216-W247 AromaticContact CE1-CE2 3.77Å; H216-W247 AromaticContact CE1-CZ2 3.93Å; H216-W247 AromaticContact CE1-NE1 3.52Å; H216-W247 AromaticContact CG-CE2 3.72Å; H216-W247 AromaticContact CG-CH2 3.81Å; H216-W247 AromaticContact CG-CZ2 3.47Å; H216-W247 VanDerWaalsContact CG-CZ2 3.47Å; H216-W247 AromaticContact ND1-CE2 3.61Å; H216-W247 AromaticContact ND1-CZ2 3.83Å; H216-W247 AromaticContact ND1-NE1 3.67Å; H216-W247 AromaticContact NE2-CZ2 3.72Å; H216-A258 HydrophobicContact CB-CB 4.45Å
217	Q	98.1	Very high	96.4	Very high	4 Å²	4	50 Å²	50	2%	0.019	25%	0.245	C	C	.	.	H	α-helix	trans	-61.4	-46.5	176.5	-169.9	177.7	60.9	0	0	111.8	S213 S214 K219 C220 H221 N255 A258 E259 I262	S213-Q217 WeakPolarHBondContact O-CB 3.23Å; S213-Q217 PolarHBondContact O-N 3.26Å; S214-Q217 PolarHBondContact O-N 3.16Å; Q217-K219 PolarHBondContact O-N 3.2Å; Q217-C220 WeakPolarHBondContact O-CB 3.4Å; Q217-C220 PolarHBondContact O-N 3.14Å; Q217-H221 VanDerWaalsContact CG-CE1 3.47Å; Q217-H221 WeakPolarHBondContact CG-CE1 3.15Å; Q217-H221 PolarHBondContact O-N 2.95Å; Q217-H221 PolarHBondContact O-ND1 3.43Å; Q217-N255 PolarHBondContact NE2-O 3.46Å; Q217-A258 HydrophobicContact CB-CB 3.65Å; Q217-A258 HydrophobicContact CG-CB 4.27Å; Q217-E259 PolarHBondContact NE2-OE2 3.27Å; Q217-E259 PolarHBondContact OE1-OE2 2.89Å; Q217-I262 HydrophobicContact CB-CD1 4.47Å
218	Y	97.3	Very high	95.9	Very high	90 Å²	90	47.9 Å²	47.9	35%	0.353	23%	0.233	S	C	.	.	H	α-helix	trans	-58	-48.3	177	175.2	-101.1	0	0	0	111.2	F145 E146 V150 S214 A215 H216 C220 H221 V222	F145-Y218 HydrophobicContact CE1-CE2 4.32Å; E146-Y218 HydrophobicContact CG-CD2 3.74Å; E146-Y218 HydrophobicContact CG-CE2 4.08Å; E146-Y218 WeakPolarHBondContact OE1-CD2 3.37Å; V150-Y218 HydrophobicContact CG2-CE2 4.1Å; S214-Y218 WeakPolarHBondContact O-CB 3.32Å; S214-Y218 PolarHBondContact O-N 3.21Å; A215-Y218 PolarHBondContact O-N 3.35Å; H216-Y218 PolarHBondContact O-N 2.73Å; Y218-C220 VanDerWaalsContact C-N 3.3Å; Y218-C220 PolarHBondContact O-N 2.85Å; Y218-H221 PolarHBondContact O-N 2.93Å; Y218-H221 VanDerWaalsContact O-N 3.09Å; Y218-V222 HydrophobicContact CD1-CG2 4.11Å; Y218-V222 HydrophobicContact CD2-CG2 4.48Å; Y218-V222 HydrophobicContact CE1-CG2 3.64Å; Y218-V222 HydrophobicContact CE2-CG2 4.04Å; Y218-V222 WeakPolarHBondContact O-CG2 3.19Å; Y218-V222 PolarHBondContact O-N 3.34Å
219	K	97.4	Very high	95.4	Very high	112 Å²	112	44.3 Å²	44.3	49%	0.487	21%	0.214	S	C	.	.	H	α-helix	trans	-55.4	-44.8	175.7	-75.9	179	-179.6	179.6	0	111.7	A215 H216 Q217 H221 V222 I223	A215-K219 WeakPolarHBondContact O-CG 3.27Å; A215-K219 PolarHBondContact O-N 2.88Å; H216-K219 PolarHBondContact O-N 2.97Å; Q217-K219 PolarHBondContact O-N 3.2Å; K219-H221 VanDerWaalsContact C-N 3.33Å; K219-H221 PolarHBondContact O-N 3.06Å; K219-V222 PolarHBondContact O-N 3.16Å; K219-I223 WeakPolarHBondContact O-CG1 3.48Å; K219-I223 PolarHBondContact O-N 2.96Å
220	C	96.4	Very high	94.8	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-60.5	-41.4	177.2	-68.1	0	0	0	0	112.3	H216 Q217 Y218 I223 L224 F248 N255	H216-C220 PolarHBondContact O-N 3.03Å; H216-C220 PolarHBondContact O-SG 3.36Å; Q217-C220 WeakPolarHBondContact O-CB 3.4Å; Q217-C220 PolarHBondContact O-N 3.14Å; Y218-C220 VanDerWaalsContact C-N 3.3Å; Y218-C220 PolarHBondContact O-N 2.85Å; C220-I223 PolarHBondContact O-N 3.47Å; C220-L224 VanDerWaalsContact O-CG 3.3Å; C220-L224 WeakPolarHBondContact O-CG 3.38Å; C220-L224 PolarHBondContact O-N 3.41Å; C220-F248 HydrophobicContact CB-CE2 3.92Å; C220-F248 HydrophobicContact CB-CZ 4.28Å; C220-N255 HydrophobicContact CB-CB 3.77Å
221	H	95.4	Very high	94	Very high	15 Å²	15	55 Å²	55	7%	0.069	26%	0.263	C	S	.	.	H	α-helix	trans	-68.7	-36.7	176.6	-66.7	142.9	0	0	0	113.1	R143 E146 Q217 Y218 K219 L224 G225	R143-H221 PolarHBondContact NH1-CE1 2.67Å; R143-H221 PolarHBondContact NH1-ND1 3.2Å; E146-H221 IonicContact OE2-CE1 3.76Å; E146-H221 IonicContact OE2-CG 3.04Å; E146-H221 IonicContact OE2-ND1 3.02Å; E146-H221 PolarHBondContact OE2-ND1 2.93Å; Q217-H221 VanDerWaalsContact CG-CE1 3.47Å; Q217-H221 WeakPolarHBondContact CG-CE1 3.15Å; Q217-H221 PolarHBondContact O-N 2.95Å; Q217-H221 PolarHBondContact O-ND1 3.43Å; Y218-H221 PolarHBondContact O-N 2.93Å; Y218-H221 VanDerWaalsContact O-N 3.09Å; K219-H221 VanDerWaalsContact C-N 3.33Å; K219-H221 PolarHBondContact O-N 3.06Å; H221-L224 PolarHBondContact O-N 2.88Å; H221-G225 PolarHBondContact O-N 3.01Å
222	V	95.3	Very high	93.1	Very high	36 Å²	36	54.1 Å²	54.1	22%	0.218	27%	0.27	C	S	.	.	H	α-helix	trans	-61.9	-47.1	172.6	171.9	0	0	0	0	110.7	V150 Y218 K219 L224 G225 N226	V150-V222 HydrophobicContact CG1-CB 4.42Å; V150-V222 HydrophobicContact CG1-CG2 3.84Å; Y218-V222 HydrophobicContact CD1-CG2 4.11Å; Y218-V222 HydrophobicContact CD2-CG2 4.48Å; Y218-V222 HydrophobicContact CE1-CG2 3.64Å; Y218-V222 HydrophobicContact CE2-CG2 4.04Å; Y218-V222 WeakPolarHBondContact O-CG2 3.19Å; Y218-V222 PolarHBondContact O-N 3.34Å; K219-V222 PolarHBondContact O-N 3.16Å; V222-L224 PolarHBondContact O-N 3.25Å; V222-G225 PolarHBondContact O-N 3.22Å; V222-N226 WeakPolarHBondContact CG1-ND2 3.42Å; V222-N226 WeakPolarHBondContact O-CB 3.47Å; V222-N226 VanDerWaalsContact O-CG 3.27Å; V222-N226 PolarHBondContact O-N 3.5Å
223	I	94.9	Very high	92.2	Very high	38 Å²	38	49.1 Å²	49.1	20%	0.195	27%	0.265	C	S	.	.	H	α-helix	trans	-56	-51.5	175.5	-68.9	166.3	0	0	0	109.9	K219 C220 G225 N226 L227 P243 D246 F248	K219-I223 WeakPolarHBondContact O-CG1 3.48Å; K219-I223 PolarHBondContact O-N 2.96Å; C220-I223 PolarHBondContact O-N 3.47Å; I223-G225 VanDerWaalsContact C-N 3.32Å; I223-G225 PolarHBondContact O-N 3.32Å; I223-N226 PolarHBondContact O-N 2.93Å; I223-L227 WeakPolarHBondContact O-CG 3.35Å; I223-L227 PolarHBondContact O-N 3.03Å; I223-L227 VanDerWaalsContact O-N 3.14Å; I223-P243 HydrophobicContact CG2-CB 4.2Å; I223-D246 HydrophobicContact CD1-CB 4.04Å; I223-F248 HydrophobicContact CB-CE2 4.17Å; I223-F248 HydrophobicContact CD1-CD2 4.13Å; I223-F248 HydrophobicContact CD1-CE2 4.34Å; I223-F248 HydrophobicContact CG2-CD2 4.1Å; I223-F248 HydrophobicContact CG2-CE2 3.97Å
224	L	92.9	Very high	91.4	Very high	42 Å²	42	53.3 Å²	53.3	22%	0.22	29%	0.29	C	S	.	.	H	α-helix	trans	-61.9	-37.4	-179.9	-71.5	172.4	0	0	0	113.2	C220 H221 V222 L227 P243 F248	C220-L224 VanDerWaalsContact O-CG 3.3Å; C220-L224 WeakPolarHBondContact O-CG 3.38Å; C220-L224 PolarHBondContact O-N 3.41Å; H221-L224 PolarHBondContact O-N 2.88Å; V222-L224 PolarHBondContact O-N 3.25Å; L224-L227 HydrophobicContact CD2-CD1 4.45Å; L224-P243 HydrophobicContact CD2-CB 4.22Å; L224-P243 HydrophobicContact CD2-CG 4.4Å; L224-F248 HydrophobicContact CD1-CZ 4Å; L224-F248 HydrophobicContact CD2-CE1 4.28Å; L224-F248 HydrophobicContact CD2-CZ 3.83Å; L224-F248 HydrophobicContact CG-CE2 4.36Å; L224-F248 HydrophobicContact CG-CZ 3.73Å
225	G	90.6	Very high	90.7	Very high	3 Å²	3	56.2 Å²	56.2	3%	0.031	31%	0.307	C	S	.	.	H	α-helix	trans	-67.4	-44.9	175.5	0	0	0	0	0	112.2	H221 V222 I223 L227 R228	H221-G225 PolarHBondContact O-N 3.01Å; V222-G225 PolarHBondContact O-N 3.22Å; I223-G225 VanDerWaalsContact C-N 3.32Å; I223-G225 PolarHBondContact O-N 3.32Å; G225-L227 VanDerWaalsContact C-N 3.28Å; G225-L227 PolarHBondContact O-N 3.11Å; G225-R228 PolarHBondContact O-N 2.74Å
226	N	92.3	Very high	89.8	Confident	93 Å²	93	59.1 Å²	59.1	50%	0.497	32%	0.316	S	S	.	.	H	α-helix	trans	-67.1	-26.4	-178.2	-73.4	-13.8	0	0	0	113.1	V222 I223 R228 K229	V222-N226 WeakPolarHBondContact CG1-ND2 3.42Å; V222-N226 WeakPolarHBondContact O-CB 3.47Å; V222-N226 VanDerWaalsContact O-CG 3.27Å; V222-N226 PolarHBondContact O-N 3.5Å; I223-N226 PolarHBondContact O-N 2.93Å; N226-R228 PolarHBondContact O-N 3.06Å; N226-K229 PolarHBondContact O-N 2.84Å; N226-K229 VanDerWaalsContact O-N 3.11Å; N226-K229 VanDerWaalsContact O-O 3.07Å
227	L	90.2	Very high	88.9	Confident	45 Å²	45	60.4 Å²	60.4	24%	0.236	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-15.3	171.7	-69.7	173.6	0	0	0	113.9	I223 L224 G225 H237 R241 P243	I223-L227 WeakPolarHBondContact O-CG 3.35Å; I223-L227 PolarHBondContact O-N 3.03Å; I223-L227 VanDerWaalsContact O-N 3.14Å; L224-L227 HydrophobicContact CD2-CD1 4.45Å; G225-L227 VanDerWaalsContact C-N 3.28Å; G225-L227 PolarHBondContact O-N 3.11Å; L227-H237 PolarHBondContact O-CE1 3.42Å; L227-R241 HydrophobicContact CD1-CB 4.48Å; L227-R241 HydrophobicContact CD2-CB 4.22Å; L227-R241 PolarHBondContact O-NE 2.92Å; L227-P243 HydrophobicContact CD1-CB 3.86Å
228	R	88.1	Confident	87.7	Confident	28 Å²	28	62.9 Å²	62.9	11%	0.106	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	-7.3	-179.6	-62.6	176.6	171.9	-163.2	-8.4	113.2	V152 G225 N226 V235 I236 H237 H240	V152-R228 HydrophobicContact CB-CB 4.05Å; V152-R228 HydrophobicContact CG1-CB 4.07Å; V152-R228 HydrophobicContact CG2-CB 4.18Å; V152-R228 PolarHBondContact O-NH1 3.31Å; G225-R228 PolarHBondContact O-N 2.74Å; N226-R228 PolarHBondContact O-N 3.06Å; R228-V235 WeakPolarHBondContact O-CA 3.37Å; R228-I236 PolarHBondContact O-N 2.81Å; R228-H237 WeakPolarHBondContact CB-O 3.23Å; R228-H240 PolarHBondContact NH2-CD2 3.23Å; R228-H240 PolarHBondContact NH2-NE2 2.84Å
229	K	87.8	Confident	86.8	Confident	47 Å²	47	64 Å²	64	20%	0.204	35%	0.351	C	S	.	.	B	Isolated β-bridge	trans	-111.5	152.2	-176.3	-64.6	175.9	176.8	171	0	110.7	Y149 V150 V152 N226 V234 V235	Y149-K229 PolarHBondContact O-NZ 3.19Å; V150-K229 PolarHBondContact O-NZ 2.95Å; V152-K229 HydrophobicContact CG2-CD 4.25Å; V152-K229 HydrophobicContact CG2-CG 4.01Å; N226-K229 PolarHBondContact O-N 2.84Å; N226-K229 VanDerWaalsContact O-N 3.11Å; N226-K229 VanDerWaalsContact O-O 3.07Å; K229-V234 CarbonylContact C-O 3.59Å; K229-V234 VanDerWaalsContact CA-O 3.28Å; K229-V234 WeakPolarHBondContact CA-O 3.47Å; K229-V235 HydrophobicContact CG-CG2 4.35Å
230	N	85.9	Confident	86.1	Confident	65 Å²	65	59.9 Å²	59.9	35%	0.348	33%	0.333	S	S	.	.			trans	-82.8	179.2	166.6	65.1	14.6	0	0	0	111	A232 G233 V234 I236	N230-A232 PolarHBondContact O-N 3.34Å; N230-A232 VanDerWaalsContact OD1-C 3.31Å; N230-A232 WeakPolarHBondContact OD1-CA 3.39Å; N230-A232 WeakPolarHBondContact OD1-CB 3.22Å; N230-A232 PolarHBondContact OD1-N 3.42Å; N230-G233 PolarHBondContact O-N 3.49Å; N230-G233 PolarHBondContact OD1-N 2.75Å; N230-G233 VanDerWaalsContact OD1-N 3.07Å; N230-V234 PolarHBondContact N-O 3.02Å; N230-V234 PolarHBondContact OD1-N 3.5Å; N230-V234 PolarHBondContact OD1-O 3.26Å; N230-I236 HydrophobicContact CB-CD1 3.42Å; N230-I236 VanDerWaalsContact CB-CD1 3.42Å; N230-I236 HydrophobicContact CB-CG1 3.68Å
231	K	81.8	Confident	85.6	Confident	222 Å²	222	66 Å²	66	97%	0.965	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-23	176.1	-66.6	-173.5	178	-177.8	0	113.6	G233	K231-G233 VanDerWaalsContact C-N 3.31Å
232	A	80.4	Confident	85.4	Confident	82 Å²	82	66.4 Å²	66.4	68%	0.678	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	4.3	174.9	0	0	0	0	0	113.2	N230 V234	N230-A232 PolarHBondContact O-N 3.34Å; N230-A232 VanDerWaalsContact OD1-C 3.31Å; N230-A232 WeakPolarHBondContact OD1-CA 3.39Å; N230-A232 WeakPolarHBondContact OD1-CB 3.22Å; N230-A232 PolarHBondContact OD1-N 3.42Å; A232-V234 VanDerWaalsContact C-N 3.29Å; A232-V234 HydrophobicContact CB-CG2 4.43Å; A232-V234 PolarHBondContact O-N 2.96Å
233	G	78.8	Confident	85.4	Confident	43 Å²	43	64.7 Å²	64.7	44%	0.443	35%	0.348	S	S	.	.	S	Bend	trans	80.5	0.5	179.9	0	0	0	0	0	115.2	N230 K231	N230-G233 PolarHBondContact O-N 3.49Å; N230-G233 PolarHBondContact OD1-N 2.75Å; N230-G233 VanDerWaalsContact OD1-N 3.07Å; K231-G233 VanDerWaalsContact C-N 3.31Å
234	V	81.9	Confident	85.3	Confident	88 Å²	88	68.1 Å²	68.1	53%	0.533	36%	0.362	S	S	.	.			trans	-78.3	133.2	-179.5	-176.7	0	0	0	0	110.2	K229 N230 A232 I236	K229-V234 CarbonylContact C-O 3.59Å; K229-V234 VanDerWaalsContact CA-O 3.28Å; K229-V234 WeakPolarHBondContact CA-O 3.47Å; N230-V234 PolarHBondContact N-O 3.02Å; N230-V234 PolarHBondContact OD1-N 3.5Å; N230-V234 PolarHBondContact OD1-O 3.26Å; A232-V234 VanDerWaalsContact C-N 3.29Å; A232-V234 HydrophobicContact CB-CG2 4.43Å; A232-V234 PolarHBondContact O-N 2.96Å; V234-I236 WeakPolarHBondContact O-CG1 3.34Å; V234-I236 PolarHBondContact O-N 3.31Å
235	V	82.4	Confident	85.3	Confident	73 Å²	73	67.5 Å²	67.5	44%	0.442	37%	0.366	S	S	.	.	B	Isolated β-bridge	trans	-68.2	118.7	177.2	179.8	0	0	0	0	109.5	V152 R228 K229	V152-V235 HydrophobicContact CG1-CB 4.48Å; V152-V235 HydrophobicContact CG1-CG1 3.73Å; V152-V235 HydrophobicContact CG1-CG2 3.84Å; V152-V235 HydrophobicContact CG2-CG2 3.9Å; R228-V235 WeakPolarHBondContact O-CA 3.37Å; K229-V235 HydrophobicContact CG-CG2 4.35Å
236	I	80.1	Confident	85.6	Confident	103 Å²	103	69.6 Å²	69.6	53%	0.528	38%	0.377	S	S	.	.			trans	-97.8	-38.1	-176.1	-28.5	171.1	0	0	0	111.5	R228 N230 V234	R228-I236 PolarHBondContact O-N 2.81Å; N230-I236 HydrophobicContact CB-CD1 3.42Å; N230-I236 VanDerWaalsContact CB-CD1 3.42Å; N230-I236 HydrophobicContact CB-CG1 3.68Å; V234-I236 WeakPolarHBondContact O-CG1 3.34Å; V234-I236 PolarHBondContact O-N 3.31Å
237	H	78	Confident	85.7	Confident	39 Å²	39	67.4 Å²	67.4	18%	0.181	36%	0.361	C	S	.	.			trans	-159.1	158.6	178.6	61	71.4	0	0	0	111.4	L227 R228 N239 R241	L227-H237 PolarHBondContact O-CE1 3.42Å; R228-H237 WeakPolarHBondContact CB-O 3.23Å; H237-N239 PolarHBondContact ND1-N 3.3Å; H237-N239 PolarHBondContact ND1-O 3.25Å; H237-R241 PolarHBondContact CD2-NH2 3.43Å; H237-R241 PolarHBondContact CE1-NE 2.79Å; H237-R241 VanDerWaalsContact NE2-CZ 3.27Å; H237-R241 PolarHBondContact NE2-NE 3.5Å; H237-R241 PolarHBondContact NE2-NH2 3.49Å
238	C	74.1	Confident	86	Confident	56 Å²	56	65.3 Å²	65.3	38%	0.378	35%	0.35	S	S	.	.			trans	-95.3	2	173.1	-72.6	0	0	0	0	113.5
239	N	77.7	Confident	86.4	Confident	114 Å²	114	67.1 Å²	67.1	61%	0.61	36%	0.36	S	S	*	.			trans	-61.6	145.3	-178.9	-70.6	-14.3	0	0	0	112.4	H237	H237-N239 PolarHBondContact ND1-N 3.3Å; H237-N239 PolarHBondContact ND1-O 3.25Å
240	H	82.1	Confident	86.7	Confident	26 Å²	26	70.6 Å²	70.6	12%	0.12	37%	0.373	C	S	.	.			trans	-75.1	137	176.1	-67.1	104.9	0	0	0	110.3	K54 R228 F298 F303	K54-H240 WeakPolarHBondContact CD-CD2 3.28Å; K54-H240 WeakPolarHBondContact CD-NE2 3.41Å; K54-H240 WeakPolarHBondContact CE-CD2 3.47Å; K54-H240 WeakPolarHBondContact CE-NE2 3.31Å; K54-H240 VanDerWaalsContact CG-CE1 3.49Å; K54-H240 WeakPolarHBondContact CG-CE1 3.18Å; K54-H240 VanDerWaalsContact CG-NE2 3.26Å; K54-H240 WeakPolarHBondContact CG-NE2 3.16Å; K54-H240 PolarHBondContact NZ-CD2 3.47Å; K54-H240 VanDerWaalsContact NZ-CD2 3.27Å; R228-H240 PolarHBondContact NH2-CD2 3.23Å; R228-H240 PolarHBondContact NH2-NE2 2.84Å; H240-F298 HydrophobicContact CB-CE1 4.17Å; H240-F298 HydrophobicContact CB-CZ 4.22Å; H240-F298 AromaticContact CG-CZ 3.92Å; H240-F298 AromaticContact ND1-CZ 3.72Å; H240-F303 HydrophobicContact CB-CE2 4.46Å; H240-F303 HydrophobicContact CB-CZ 4.04Å; H240-F303 VanDerWaalsContact O-CZ 3.26Å; H240-F303 WeakPolarHBondContact O-CZ 3.47Å
241	R	87.3	Confident	87.2	Confident	129 Å²	129	67.5 Å²	67.5	49%	0.487	36%	0.356	S	S	.	.			trans	-127.4	162.3	170.9	-61.1	-174.8	-169.6	-114.5	10	108.9	L227 H237 P243	L227-R241 HydrophobicContact CD1-CB 4.48Å; L227-R241 HydrophobicContact CD2-CB 4.22Å; L227-R241 PolarHBondContact O-NE 2.92Å; H237-R241 PolarHBondContact CD2-NH2 3.43Å; H237-R241 PolarHBondContact CE1-NE 2.79Å; H237-R241 VanDerWaalsContact NE2-CZ 3.27Å; H237-R241 PolarHBondContact NE2-NE 3.5Å; H237-R241 PolarHBondContact NE2-NH2 3.49Å; R241-P243 WeakPolarHBondContact O-CD 3.29Å
242	I	91.9	Very high	87.9	Confident	22 Å²	22	57 Å²	57	11%	0.113	31%	0.311	C	S	.	.			trans	-76.8	122.4	175	-55.1	171.6	0	0	0	108.4	F244 F303 Y306	I242-F244 HydrophobicContact CB-CE2 3.81Å; I242-F244 HydrophobicContact CB-CZ 4.27Å; I242-F244 HydrophobicContact CG2-CD2 4.3Å; I242-F244 HydrophobicContact CG2-CE1 4.42Å; I242-F244 HydrophobicContact CG2-CE2 3.58Å; I242-F244 HydrophobicContact CG2-CZ 3.64Å; I242-F244 WeakPolarHBondContact O-CD2 3.34Å; I242-F303 HydrophobicContact CD1-CB 3.86Å; I242-F303 HydrophobicContact CD1-CD1 4.38Å; I242-F303 HydrophobicContact CD1-CG 4.07Å; I242-F303 HydrophobicContact CG1-CB 4.15Å; I242-F303 HydrophobicContact CG1-CD1 4.13Å; I242-F303 HydrophobicContact CG1-CD2 4.04Å; I242-F303 HydrophobicContact CG1-CG 3.84Å; I242-Y306 HydrophobicContact CD1-CD2 4.21Å; I242-Y306 HydrophobicContact CG1-CD2 4.13Å; I242-Y306 HydrophobicContact CG2-CD2 4Å; I242-Y306 HydrophobicContact CG2-CE2 4Å
243	P	93.6	Very high	88.5	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.28	C	S	.	.			trans	-76.1	144.4	175.3	30.5	-33.9	0	0	0	111.8	I223 L224 L227 R241 F248 R310	I223-P243 HydrophobicContact CG2-CB 4.2Å; L224-P243 HydrophobicContact CD2-CB 4.22Å; L224-P243 HydrophobicContact CD2-CG 4.4Å; L227-P243 HydrophobicContact CD1-CB 3.86Å; R241-P243 WeakPolarHBondContact O-CD 3.29Å; P243-F248 HydrophobicContact CB-CB 4.42Å; P243-F248 HydrophobicContact CB-CD1 3.6Å; P243-F248 HydrophobicContact CB-CD2 3.97Å; P243-F248 HydrophobicContact CB-CE1 3.69Å; P243-F248 HydrophobicContact CB-CE2 4.07Å; P243-F248 HydrophobicContact CB-CG 3.74Å; P243-F248 HydrophobicContact CB-CZ 3.95Å; P243-F248 HydrophobicContact CG-CD1 3.28Å; P243-F248 HydrophobicContact CG-CE1 3.38Å; P243-F248 HydrophobicContact CG-CG 3.92Å; P243-F248 HydrophobicContact CG-CZ 4.12Å; P243-R310 PolarHBondContact O-NH1 3.27Å; P243-R310 PolarHBondContact O-NH2 3.44Å; P243-R310 VanDerWaalsContact O-NH2 3.11Å
244	F	93.9	Very high	89.4	Confident	110 Å²	110	51.2 Å²	51.2	48%	0.482	26%	0.259	S	S	.	.			trans	-135.7	158.1	175	-67.5	-86	0	0	0	109.6	I242 E249 P307 R310	I242-F244 HydrophobicContact CB-CE2 3.81Å; I242-F244 HydrophobicContact CB-CZ 4.27Å; I242-F244 HydrophobicContact CG2-CD2 4.3Å; I242-F244 HydrophobicContact CG2-CE1 4.42Å; I242-F244 HydrophobicContact CG2-CE2 3.58Å; I242-F244 HydrophobicContact CG2-CZ 3.64Å; I242-F244 WeakPolarHBondContact O-CD2 3.34Å; F244-E249 WeakPolarHBondContact CA-OE1 3.49Å; F244-P307 HydrophobicContact CE1-CG 4.09Å; F244-P307 HydrophobicContact CZ-CG 4.34Å; F244-R310 VanDerWaalsContact CE1-NH2 3.34Å
245	G	93.2	Very high	90.1	Very high	29 Å²	29	47.8 Å²	47.8	30%	0.299	24%	0.237	S	C	.	.	S	Bend	trans	91.8	156.7	-176.2	0	0	0	0	0	114.1	F248 E249	G245-F248 WeakPolarHBondContact O-CB 3.39Å; G245-F248 WeakPolarHBondContact O-CD2 3.47Å; G245-F248 PolarHBondContact O-N 3.07Å; G245-E249 PolarHBondContact N-OE1 2.74Å
246	D	95.8	Very high	90.8	Very high	48 Å²	48	47.1 Å²	47.1	26%	0.257	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	51.9	-145.2	-173.2	-159.5	10.5	0	0	0	111.6	H216 I223 F248 E249	H216-D246 IonicContact CE1-OD1 2.62Å; H216-D246 PolarHBondContact CE1-OD1 2.66Å; H216-D246 IonicContact CE1-OD2 3.97Å; H216-D246 IonicContact CG-OD2 3.17Å; H216-D246 VanDerWaalsContact ND1-CG 3.34Å; H216-D246 IonicContact ND1-OD1 3.87Å; H216-D246 PolarHBondContact ND1-OD1 3.5Å; H216-D246 IonicContact ND1-OD2 2.71Å; H216-D246 PolarHBondContact ND1-OD2 2.9Å; I223-D246 HydrophobicContact CD1-CB 4.04Å; D246-F248 PolarHBondContact O-N 3.19Å; D246-F248 VanDerWaalsContact O-N 3.09Å; D246-E249 PolarHBondContact O-N 3.1Å
247	W	95.7	Very high	91.6	Very high	46 Å²	46	43.1 Å²	43.1	17%	0.174	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-68.6	-3.2	179.9	-63.2	-9.6	0	0	0	115	H216 E249 Y250 V251 P254 L257 A258 M261	H216-W247 HydrophobicContact CB-CD2 4.48Å; H216-W247 HydrophobicContact CB-CE3 4.31Å; H216-W247 HydrophobicContact CB-CH2 3.84Å; H216-W247 HydrophobicContact CB-CZ2 4.02Å; H216-W247 HydrophobicContact CB-CZ3 4Å; H216-W247 AromaticContact CD2-CE2 3.99Å; H216-W247 AromaticContact CD2-CH2 3.89Å; H216-W247 AromaticContact CD2-CZ2 3.4Å; H216-W247 VanDerWaalsContact CD2-CZ2 3.4Å; H216-W247 WeakPolarHBondContact CD2-CZ2 3.38Å; H216-W247 AromaticContact CE1-CE2 3.77Å; H216-W247 AromaticContact CE1-CZ2 3.93Å; H216-W247 AromaticContact CE1-NE1 3.52Å; H216-W247 AromaticContact CG-CE2 3.72Å; H216-W247 AromaticContact CG-CH2 3.81Å; H216-W247 AromaticContact CG-CZ2 3.47Å; H216-W247 VanDerWaalsContact CG-CZ2 3.47Å; H216-W247 AromaticContact ND1-CE2 3.61Å; H216-W247 AromaticContact ND1-CZ2 3.83Å; H216-W247 AromaticContact ND1-NE1 3.67Å; H216-W247 AromaticContact NE2-CZ2 3.72Å; W247-E249 PolarHBondContact O-N 2.73Å; W247-Y250 PolarHBondContact O-N 3.15Å; W247-Y250 VanDerWaalsContact O-N 3.12Å; W247-V251 PolarHBondContact O-N 2.97Å; W247-P254 HydrophobicContact CB-CB 3.4Å; W247-P254 VanDerWaalsContact CB-CB 3.4Å; W247-P254 HydrophobicContact CB-CG 4.32Å; W247-P254 HydrophobicContact CE3-CB 4.38Å; W247-L257 HydrophobicContact CE3-CD2 4.08Å; W247-L257 HydrophobicContact CE3-CG 4.43Å; W247-L257 HydrophobicContact CZ3-CD2 4.33Å; W247-L257 HydrophobicContact CZ3-CG 4.31Å; W247-A258 HydrophobicContact CE3-CB 4.45Å; W247-A258 HydrophobicContact CZ3-CB 3.83Å; W247-M261 HydrophobicContact CH2-CE 4.49Å; W247-M261 HydrophobicContact CH2-SD 3.59Å; W247-M261 VanDerWaalsContact CH2-SD 3.59Å; W247-M261 HydrophobicContact CZ3-SD 3.99Å
248	F	96.5	Very high	92.6	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.009	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-62.1	-22.9	172.9	-76.8	-73.4	0	0	0	112	C220 I223 L224 P243 G245 D246 Y250 V251 P254 R310	C220-F248 HydrophobicContact CB-CE2 3.92Å; C220-F248 HydrophobicContact CB-CZ 4.28Å; I223-F248 HydrophobicContact CB-CE2 4.17Å; I223-F248 HydrophobicContact CD1-CD2 4.13Å; I223-F248 HydrophobicContact CD1-CE2 4.34Å; I223-F248 HydrophobicContact CG2-CD2 4.1Å; I223-F248 HydrophobicContact CG2-CE2 3.97Å; L224-F248 HydrophobicContact CD1-CZ 4Å; L224-F248 HydrophobicContact CD2-CE1 4.28Å; L224-F248 HydrophobicContact CD2-CZ 3.83Å; L224-F248 HydrophobicContact CG-CE2 4.36Å; L224-F248 HydrophobicContact CG-CZ 3.73Å; P243-F248 HydrophobicContact CB-CB 4.42Å; P243-F248 HydrophobicContact CB-CD1 3.6Å; P243-F248 HydrophobicContact CB-CD2 3.97Å; P243-F248 HydrophobicContact CB-CE1 3.69Å; P243-F248 HydrophobicContact CB-CE2 4.07Å; P243-F248 HydrophobicContact CB-CG 3.74Å; P243-F248 HydrophobicContact CB-CZ 3.95Å; P243-F248 HydrophobicContact CG-CD1 3.28Å; P243-F248 HydrophobicContact CG-CE1 3.38Å; P243-F248 HydrophobicContact CG-CG 3.92Å; P243-F248 HydrophobicContact CG-CZ 4.12Å; G245-F248 WeakPolarHBondContact O-CB 3.39Å; G245-F248 WeakPolarHBondContact O-CD2 3.47Å; G245-F248 PolarHBondContact O-N 3.07Å; D246-F248 PolarHBondContact O-N 3.19Å; D246-F248 VanDerWaalsContact O-N 3.09Å; F248-Y250 PolarHBondContact O-N 3.34Å; F248-V251 WeakPolarHBondContact CA-O 3.38Å; F248-P254 HydrophobicContact CB-CG 4.35Å; F248-P254 HydrophobicContact CD1-CG 3.4Å; F248-P254 VanDerWaalsContact CD1-CG 3.4Å; F248-P254 HydrophobicContact CD2-CG 3.74Å; F248-P254 HydrophobicContact CE1-CG 3.46Å; F248-P254 VanDerWaalsContact CE1-CG 3.46Å; F248-P254 HydrophobicContact CE2-CG 3.77Å; F248-P254 HydrophobicContact CG-CG 3.56Å; F248-P254 HydrophobicContact CZ-CG 3.63Å; F248-R310 VanDerWaalsContact O-CD 3.23Å; F248-R310 WeakPolarHBondContact O-CD 3.21Å; F248-R310 PolarHBondContact O-NE 2.87Å; F248-R310 PolarHBondContact O-NH1 3.14Å; F248-R310 PolarHBondContact O-NH2 3.21Å
249	E	94.7	Very high	93.7	Very high	66 Å²	66	39.1 Å²	39.1	31%	0.308	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-65.9	-23.1	176.2	-57.7	-49.2	150.8	0	0	113.6	F244 G245 D246 W247 H309 R310	F244-E249 WeakPolarHBondContact CA-OE1 3.49Å; G245-E249 PolarHBondContact N-OE1 2.74Å; D246-E249 PolarHBondContact O-N 3.1Å; W247-E249 PolarHBondContact O-N 2.73Å; E249-H309 PolarHBondContact O-NE2 3.28Å; E249-H309 VanDerWaalsContact O-NE2 3.15Å; E249-R310 IonicContact OE1-NH2 3.15Å; E249-R310 IonicContact OE2-NH2 2.66Å; E249-R310 PolarHBondContact OE2-NH2 3.44Å
250	Y	95.5	Very high	94.7	Very high	119 Å²	119	34.1 Å²	34.1	47%	0.467	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-39.3	-178.4	-55.7	-77.8	0	0	0	112.7	W247 F248 R310 K311 F316	W247-Y250 PolarHBondContact O-N 3.15Å; W247-Y250 VanDerWaalsContact O-N 3.12Å; F248-Y250 PolarHBondContact O-N 3.34Å; Y250-R310 WeakPolarHBondContact O-CA 3.48Å; Y250-K311 PolarHBondContact O-N 2.91Å; Y250-F316 HydrophobicContact CD1-CE1 4.12Å; Y250-F316 AromaticContact CD1-CZ 3.73Å; Y250-F316 HydrophobicContact CD1-CZ 3.73Å; Y250-F316 AromaticContact CE1-CZ 3.98Å; Y250-F316 HydrophobicContact CE1-CZ 3.98Å
251	V	96.8	Very high	95.5	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	16%	0.162	C	C	.	.	B	Isolated β-bridge	trans	-134.7	156.7	-173.2	-62.6	0	0	0	0	111.9	W247 F248 P254 L257 K311 P315	W247-V251 PolarHBondContact O-N 2.97Å; F248-V251 WeakPolarHBondContact CA-O 3.38Å; V251-P254 HydrophobicContact CG2-CB 3.75Å; V251-P254 HydrophobicContact CG2-CG 4.46Å; V251-L257 HydrophobicContact CG2-CD2 4.48Å; V251-K311 CarbonylContact C-O 3.49Å; V251-K311 VanDerWaalsContact CA-O 3.28Å; V251-K311 WeakPolarHBondContact CA-O 3.01Å; V251-K311 HydrophobicContact CG1-CB 4.24Å; V251-P315 HydrophobicContact CG1-CB 4.3Å; V251-P315 HydrophobicContact CG1-CG 3.88Å
252	S	95.4	Very high	96	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.014	14%	0.139	C	C	.	.	S	Bend	trans	-78.1	-30.5	-174.7	-53.3	0	0	0	0	112.6	P254 H296 Y306 K311 A312	S252-P254 VanDerWaalsContact C-CD 3.47Å; S252-H296 PolarHBondContact OG-ND1 2.88Å; S252-Y306 WeakPolarHBondContact CA-OH 3.01Å; S252-Y306 WeakPolarHBondContact CB-OH 3.28Å; S252-Y306 PolarHBondContact OG-OH 3.14Å; S252-K311 PolarHBondContact N-O 2.75Å; S252-K311 PolarHBondContact OG-O 3.42Å; S252-A312 PolarHBondContact N-O 2.76Å
253	S	94	Very high	96.3	Very high	4 Å²	4	28.2 Å²	28.2	3%	0.028	13%	0.134	C	C	.	.			trans	-130.1	62.3	-177.5	-45.4	0	0	0	0	111.9	N255 Y256 L257 A312	S253-N255 PolarHBondContact O-N 3.12Å; S253-Y256 WeakPolarHBondContact O-CB 3.3Å; S253-Y256 PolarHBondContact O-N 3.38Å; S253-L257 PolarHBondContact O-N 3.07Å; S253-A312 PolarHBondContact N-O 3.2Å
254	P	96.8	Very high	96.6	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-63.6	-25.7	-178.7	27.2	-35.9	0	0	0	113.7	W247 F248 V251 S252 Y256 L257 A258	W247-P254 HydrophobicContact CB-CB 3.4Å; W247-P254 VanDerWaalsContact CB-CB 3.4Å; W247-P254 HydrophobicContact CB-CG 4.32Å; W247-P254 HydrophobicContact CE3-CB 4.38Å; F248-P254 HydrophobicContact CB-CG 4.35Å; F248-P254 HydrophobicContact CD1-CG 3.4Å; F248-P254 VanDerWaalsContact CD1-CG 3.4Å; F248-P254 HydrophobicContact CD2-CG 3.74Å; F248-P254 HydrophobicContact CE1-CG 3.46Å; F248-P254 VanDerWaalsContact CE1-CG 3.46Å; F248-P254 HydrophobicContact CE2-CG 3.77Å; F248-P254 HydrophobicContact CG-CG 3.56Å; F248-P254 HydrophobicContact CZ-CG 3.63Å; V251-P254 HydrophobicContact CG2-CB 3.75Å; V251-P254 HydrophobicContact CG2-CG 4.46Å; S252-P254 VanDerWaalsContact C-CD 3.47Å; P254-Y256 PolarHBondContact O-N 2.72Å; P254-L257 WeakPolarHBondContact O-CB 3.24Å; P254-L257 PolarHBondContact O-N 2.83Å; P254-L257 VanDerWaalsContact O-N 3.16Å; P254-A258 WeakPolarHBondContact O-CB 3.46Å; P254-A258 PolarHBondContact O-N 3.5Å
255	N	96.3	Very high	96.8	Very high	16 Å²	16	25.1 Å²	25.1	9%	0.086	12%	0.122	C	C	.	.	H	α-helix	trans	-61.9	-30.4	173.9	62.6	-55.9	0	0	0	112.3	Q217 C220 S253 E259	Q217-N255 PolarHBondContact NE2-O 3.46Å; C220-N255 HydrophobicContact CB-CB 3.77Å; S253-N255 PolarHBondContact O-N 3.12Å; N255-E259 PolarHBondContact O-N 3Å; N255-E259 VanDerWaalsContact O-N 3.11Å
256	Y	97.3	Very high	97	Very high	59 Å²	59	23.7 Å²	23.7	23%	0.231	11%	0.108	C	C	.	.	H	α-helix	trans	-77	-37.4	174.2	-59.4	-23	0	0	0	111.3	S253 P254 A258 E259 L260 Q288 A292	S253-Y256 WeakPolarHBondContact O-CB 3.3Å; S253-Y256 PolarHBondContact O-N 3.38Å; P254-Y256 PolarHBondContact O-N 2.72Å; Y256-A258 VanDerWaalsContact C-N 3.34Å; Y256-E259 WeakPolarHBondContact O-CB 3.34Å; Y256-E259 PolarHBondContact O-N 3.48Å; Y256-L260 PolarHBondContact O-N 3.47Å; Y256-Q288 VanDerWaalsContact CB-OE1 3.24Å; Y256-A292 HydrophobicContact CD2-CB 3.95Å
257	L	97.8	Very high	97.1	Very high	18 Å²	18	21.5 Å²	21.5	9%	0.094	10%	0.096	C	C	.	.	H	α-helix	trans	-62.5	-44.4	173.7	177.2	62.9	0	0	0	110.7	W247 V251 S253 P254 E259 L260 M261 F313 L314 P315	W247-L257 HydrophobicContact CE3-CD2 4.08Å; W247-L257 HydrophobicContact CE3-CG 4.43Å; W247-L257 HydrophobicContact CZ3-CD2 4.33Å; W247-L257 HydrophobicContact CZ3-CG 4.31Å; V251-L257 HydrophobicContact CG2-CD2 4.48Å; S253-L257 PolarHBondContact O-N 3.07Å; P254-L257 WeakPolarHBondContact O-CB 3.24Å; P254-L257 PolarHBondContact O-N 2.83Å; P254-L257 VanDerWaalsContact O-N 3.16Å; L257-E259 VanDerWaalsContact C-N 3.32Å; L257-E259 PolarHBondContact O-N 3.18Å; L257-L260 WeakPolarHBondContact O-CB 3.15Å; L257-L260 PolarHBondContact O-N 3.48Å; L257-M261 WeakPolarHBondContact O-CG 3Å; L257-M261 PolarHBondContact O-N 3.07Å; L257-F313 HydrophobicContact CB-CD2 4.45Å; L257-F313 HydrophobicContact CB-CE2 4.32Å; L257-L314 HydrophobicContact CD1-CD2 4.01Å; L257-P315 HydrophobicContact CD2-CG 3.94Å
258	A	97.9	Very high	97.1	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-62.9	-37.2	175.2	0	0	0	0	0	112.2	H216 Q217 W247 P254 Y256 M261 I262	H216-A258 HydrophobicContact CB-CB 4.45Å; Q217-A258 HydrophobicContact CB-CB 3.65Å; Q217-A258 HydrophobicContact CG-CB 4.27Å; W247-A258 HydrophobicContact CE3-CB 4.45Å; W247-A258 HydrophobicContact CZ3-CB 3.83Å; P254-A258 WeakPolarHBondContact O-CB 3.46Å; P254-A258 PolarHBondContact O-N 3.5Å; Y256-A258 VanDerWaalsContact C-N 3.34Å; A258-M261 PolarHBondContact O-N 3.27Å; A258-I262 WeakPolarHBondContact O-CG1 3.26Å; A258-I262 PolarHBondContact O-N 3.14Å
259	E	98.1	Very high	97.1	Very high	11 Å²	11	19.3 Å²	19.3	5%	0.051	9%	0.088	C	C	.	.	H	α-helix	trans	-58.9	-50	171.2	-172.5	77.4	167.8	0	0	110.9	H139 Q217 N255 Y256 L257 M261 I262 Y263 V284	H139-E259 IonicContact CE1-OE1 3.65Å; H139-E259 IonicContact CE1-OE2 3.67Å; H139-E259 PolarHBondContact CE1-OE2 2.92Å; H139-E259 IonicContact NE2-OE1 3.53Å; H139-E259 PolarHBondContact NE2-OE1 3.01Å; H139-E259 IonicContact NE2-OE2 2.7Å; Q217-E259 PolarHBondContact NE2-OE2 3.27Å; Q217-E259 PolarHBondContact OE1-OE2 2.89Å; N255-E259 PolarHBondContact O-N 3Å; N255-E259 VanDerWaalsContact O-N 3.11Å; Y256-E259 WeakPolarHBondContact O-CB 3.34Å; Y256-E259 PolarHBondContact O-N 3.48Å; L257-E259 VanDerWaalsContact C-N 3.32Å; L257-E259 PolarHBondContact O-N 3.18Å; E259-M261 VanDerWaalsContact C-N 3.26Å; E259-M261 PolarHBondContact O-N 3.06Å; E259-I262 WeakPolarHBondContact O-CB 3.09Å; E259-I262 PolarHBondContact O-N 2.99Å; E259-Y263 HydrophobicContact CG-CD2 4.26Å; E259-Y263 HydrophobicContact CG-CE2 4.04Å; E259-Y263 WeakPolarHBondContact O-CD2 3.49Å; E259-Y263 PolarHBondContact O-N 3.48Å; E259-Y263 WeakPolarHBondContact OE1-CE2 3.26Å; E259-V284 HydrophobicContact CG-CG1 4.39Å
260	L	98.4	Very high	97	Very high	10 Å²	10	16.6 Å²	16.6	5%	0.052	8%	0.075	C	C	.	.	H	α-helix	trans	-55.7	-44	177.5	173.8	66.6	0	0	0	111.3	Y256 L257 I262 Y263 I264 V281 V284 F285 F313	Y256-L260 PolarHBondContact O-N 3.47Å; L257-L260 WeakPolarHBondContact O-CB 3.15Å; L257-L260 PolarHBondContact O-N 3.48Å; L260-I262 VanDerWaalsContact C-N 3.3Å; L260-I262 PolarHBondContact O-N 2.74Å; L260-Y263 PolarHBondContact O-N 3.36Å; L260-Y263 VanDerWaalsContact O-N 3.15Å; L260-I264 HydrophobicContact CD1-CD1 4.19Å; L260-I264 HydrophobicContact CD1-CG1 4.39Å; L260-I264 HydrophobicContact CD2-CD1 4.41Å; L260-I264 HydrophobicContact CG-CD1 3.87Å; L260-I264 HydrophobicContact CG-CG1 4.46Å; L260-I264 WeakPolarHBondContact O-CG1 3.47Å; L260-I264 PolarHBondContact O-N 3.07Å; L260-V281 HydrophobicContact CD1-CG1 4.1Å; L260-V284 HydrophobicContact CD1-CG1 4.41Å; L260-F285 HydrophobicContact CD1-CB 3.92Å; L260-F285 HydrophobicContact CD1-CD2 4.25Å; L260-F285 HydrophobicContact CD2-CD2 3.62Å; L260-F285 HydrophobicContact CD2-CE2 4.26Å; L260-F313 HydrophobicContact CB-CZ 4.15Å; L260-F313 HydrophobicContact CD2-CE1 4.12Å; L260-F313 HydrophobicContact CD2-CZ 3.79Å
261	M	98.4	Very high	96.8	Very high	51 Å²	51	11.3 Å²	11.3	25%	0.251	6%	0.057	S	C	.	.	H	α-helix	trans	-65.1	-31	178.3	-66.6	-175.9	66.8	0	0	113.3	S213 W247 L257 A258 E259 I264 S265	S213-M261 WeakPolarHBondContact OG-CB 3.38Å; W247-M261 HydrophobicContact CH2-CE 4.49Å; W247-M261 HydrophobicContact CH2-SD 3.59Å; W247-M261 VanDerWaalsContact CH2-SD 3.59Å; W247-M261 HydrophobicContact CZ3-SD 3.99Å; L257-M261 WeakPolarHBondContact O-CG 3Å; L257-M261 PolarHBondContact O-N 3.07Å; A258-M261 PolarHBondContact O-N 3.27Å; E259-M261 VanDerWaalsContact C-N 3.26Å; E259-M261 PolarHBondContact O-N 3.06Å; M261-I264 PolarHBondContact O-N 3.41Å; M261-S265 WeakPolarHBondContact O-CB 3.11Å; M261-S265 PolarHBondContact O-N 2.78Å
262	I	98.7	Very high	96.4	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-63.8	-41.3	171.5	-71	167.9	0	0	0	111.1	F210 Q217 A258 E259 L260 S265 M266	F210-I262 HydrophobicContact CD2-CG2 3.92Å; F210-I262 HydrophobicContact CE2-CG2 3.81Å; Q217-I262 HydrophobicContact CB-CD1 4.47Å; A258-I262 WeakPolarHBondContact O-CG1 3.26Å; A258-I262 PolarHBondContact O-N 3.14Å; E259-I262 WeakPolarHBondContact O-CB 3.09Å; E259-I262 PolarHBondContact O-N 2.99Å; L260-I262 VanDerWaalsContact C-N 3.3Å; L260-I262 PolarHBondContact O-N 2.74Å; I262-S265 PolarHBondContact O-N 3.27Å; I262-S265 PolarHBondContact O-OG 3.09Å; I262-M266 HydrophobicContact CG2-CE 3.69Å; I262-M266 WeakPolarHBondContact O-CG 3.23Å; I262-M266 PolarHBondContact O-N 3.34Å
263	Y	98.5	Very high	95.9	Very high	1 Å²	1	23 Å²	23	0%	0.004	11%	0.11	C	C	.	.	H	α-helix	trans	-73.3	-35.4	177.4	-79.7	-101.3	0	0	0	112.2	Y169 V173 E259 L260 S265 M266 A267 W277 V280 V284	Y169-Y263 WeakPolarHBondContact OH-CE1 3.19Å; Y169-Y263 PolarHBondContact OH-OH 3.26Å; V173-Y263 HydrophobicContact CG1-CE1 4.47Å; E259-Y263 HydrophobicContact CG-CD2 4.26Å; E259-Y263 HydrophobicContact CG-CE2 4.04Å; E259-Y263 WeakPolarHBondContact O-CD2 3.49Å; E259-Y263 PolarHBondContact O-N 3.48Å; E259-Y263 WeakPolarHBondContact OE1-CE2 3.26Å; L260-Y263 PolarHBondContact O-N 3.36Å; L260-Y263 VanDerWaalsContact O-N 3.15Å; Y263-S265 VanDerWaalsContact C-N 3.32Å; Y263-M266 WeakPolarHBondContact O-CB 3.13Å; Y263-M266 PolarHBondContact O-N 2.97Å; Y263-A267 PolarHBondContact O-N 3.26Å; Y263-A267 VanDerWaalsContact O-N 3.08Å; Y263-W277 HydrophobicContact CD1-CH2 4.44Å; Y263-W277 AromaticContact CD1-CZ2 3.95Å; Y263-W277 HydrophobicContact CD1-CZ2 3.95Å; Y263-W277 HydrophobicContact CE1-CZ2 4.49Å; Y263-W277 PolarHBondContact O-NE1 3.41Å; Y263-W277 VanDerWaalsContact O-NE1 3.1Å; Y263-V280 HydrophobicContact CD1-CG1 3.85Å; Y263-V280 HydrophobicContact CE1-CG1 3.87Å; Y263-V284 HydrophobicContact CD1-CG2 3.75Å; Y263-V284 HydrophobicContact CD2-CG1 4.05Å; Y263-V284 HydrophobicContact CD2-CG2 4.05Å; Y263-V284 HydrophobicContact CE1-CG2 3.8Å; Y263-V284 HydrophobicContact CE2-CG1 4.48Å; Y263-V284 HydrophobicContact CE2-CG2 4.11Å; Y263-V284 HydrophobicContact CG-CB 4.4Å; Y263-V284 HydrophobicContact CG-CG1 4.31Å; Y263-V284 HydrophobicContact CG-CG2 3.86Å
264	I	98.5	Very high	95.7	Very high	45 Å²	45	23.5 Å²	23.5	23%	0.231	11%	0.112	C	C	.	.	H	α-helix	trans	-61.8	-42.1	172	-68.6	169	0	0	0	110.1	M209 L260 M261 M266 A267 V268 V281	M209-I264 HydrophobicContact CE-CG2 3.98Å; L260-I264 HydrophobicContact CD1-CD1 4.19Å; L260-I264 HydrophobicContact CD1-CG1 4.39Å; L260-I264 HydrophobicContact CD2-CD1 4.41Å; L260-I264 HydrophobicContact CG-CD1 3.87Å; L260-I264 HydrophobicContact CG-CG1 4.46Å; L260-I264 WeakPolarHBondContact O-CG1 3.47Å; L260-I264 PolarHBondContact O-N 3.07Å; M261-I264 PolarHBondContact O-N 3.41Å; I264-M266 PolarHBondContact O-N 3.32Å; I264-A267 CarbonylContact O-C 3.38Å; I264-A267 WeakPolarHBondContact O-CA 3.26Å; I264-A267 VanDerWaalsContact O-CB 3.24Å; I264-A267 WeakPolarHBondContact O-CB 2.96Å; I264-A267 PolarHBondContact O-N 3.5Å; I264-V268 HydrophobicContact CG2-CG2 4.36Å; I264-V268 WeakPolarHBondContact O-CG2 3.38Å; I264-V268 PolarHBondContact O-N 3.39Å; I264-V281 HydrophobicContact CG1-CG1 3.78Å
265	S	98.6	Very high	95.3	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-62.1	-34.2	178.7	78.5	0	0	0	0	112.5	G206 F210 M261 I262 Y263 V268 T269	G206-S265 WeakPolarHBondContact O-CB 3.37Å; F210-S265 WeakPolarHBondContact CA-OG 3.2Å; F210-S265 WeakPolarHBondContact CB-OG 3.46Å; M261-S265 WeakPolarHBondContact O-CB 3.11Å; M261-S265 PolarHBondContact O-N 2.78Å; I262-S265 PolarHBondContact O-N 3.27Å; I262-S265 PolarHBondContact O-OG 3.09Å; Y263-S265 VanDerWaalsContact C-N 3.32Å; S265-V268 PolarHBondContact O-N 3.15Å; S265-T269 PolarHBondContact O-N 3.41Å; S265-T269 PolarHBondContact O-OG1 2.82Å
266	M	97.7	Very high	95.1	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-67.5	-35.9	171.1	-65.1	174.6	-163.5	0	0	111.9	V132 F135 L136 F210 I262 Y263 I264 T269 F270 W277	V132-M266 HydrophobicContact CG1-CB 3.88Å; V132-M266 HydrophobicContact CG1-CG 3.97Å; V132-M266 HydrophobicContact CG1-SD 4.03Å; V132-M266 HydrophobicContact CG2-CB 4.01Å; V132-M266 HydrophobicContact CG2-CG 4.43Å; F135-M266 HydrophobicContact CB-CE 3.81Å; F135-M266 HydrophobicContact CB-CG 4.26Å; F135-M266 HydrophobicContact CD2-CG 4.26Å; L136-M266 HydrophobicContact CB-CE 4.42Å; F210-M266 HydrophobicContact CD2-CE 4.33Å; F210-M266 HydrophobicContact CE2-CE 4.01Å; I262-M266 HydrophobicContact CG2-CE 3.69Å; I262-M266 WeakPolarHBondContact O-CG 3.23Å; I262-M266 PolarHBondContact O-N 3.34Å; Y263-M266 WeakPolarHBondContact O-CB 3.13Å; Y263-M266 PolarHBondContact O-N 2.97Å; I264-M266 PolarHBondContact O-N 3.32Å; M266-T269 WeakPolarHBondContact O-CB 3.32Å; M266-T269 PolarHBondContact O-N 2.66Å; M266-F270 WeakPolarHBondContact O-CD2 3.37Å; M266-F270 PolarHBondContact O-N 3.03Å; M266-W277 HydrophobicContact CB-CH2 4.5Å; M266-W277 HydrophobicContact CB-CZ2 3.44Å; M266-W277 VanDerWaalsContact CB-CZ2 3.44Å; M266-W277 HydrophobicContact CG-CZ2 4.04Å; M266-W277 HydrophobicContact SD-CH2 3.87Å; M266-W277 HydrophobicContact SD-CZ2 3.42Å; M266-W277 WeakPolarHBondContact SD-CZ2 3.46Å
267	A	96.6	Very high	95	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.008	12%	0.117	C	C	.	.	H	α-helix	trans	-64.4	-41.2	173.3	0	0	0	0	0	112.2	Y263 I264 T269 F270 G271 F272 W277 W278 V281	Y263-A267 PolarHBondContact O-N 3.26Å; Y263-A267 VanDerWaalsContact O-N 3.08Å; I264-A267 CarbonylContact O-C 3.38Å; I264-A267 WeakPolarHBondContact O-CA 3.26Å; I264-A267 VanDerWaalsContact O-CB 3.24Å; I264-A267 WeakPolarHBondContact O-CB 2.96Å; I264-A267 PolarHBondContact O-N 3.5Å; A267-T269 VanDerWaalsContact C-N 3.3Å; A267-T269 PolarHBondContact O-N 3.23Å; A267-F270 CarbonylContact O-C 3.47Å; A267-F270 PolarHBondContact O-N 3.16Å; A267-G271 PolarHBondContact O-N 2.96Å; A267-F272 PolarHBondContact O-N 3.48Å; A267-F272 VanDerWaalsContact O-N 3.07Å; A267-W277 VanDerWaalsContact CB-CD1 3.47Å; A267-W278 HydrophobicContact CB-CD2 4.37Å; A267-W278 HydrophobicContact CB-CH2 4.3Å; A267-W278 HydrophobicContact CB-CZ2 4Å; A267-V281 HydrophobicContact CB-CG2 4.06Å
268	V	96.9	Very high	94.8	Very high	2 Å²	2	27.5 Å²	27.5	1%	0.012	13%	0.128	C	C	.	.	H	α-helix	trans	-61	-41.5	171.8	176.6	0	0	0	0	110.6	F202 L205 M209 I264 S265 F270 G271 F272	F202-V268 HydrophobicContact CB-CG1 4.35Å; F202-V268 WeakPolarHBondContact CB-O 3.13Å; F202-V268 WeakPolarHBondContact CD2-O 3.25Å; L205-V268 HydrophobicContact CB-CG1 4.16Å; L205-V268 HydrophobicContact CD2-CG1 3.91Å; L205-V268 HydrophobicContact CG-CG1 3.96Å; M209-V268 HydrophobicContact CE-CG2 4.27Å; M209-V268 HydrophobicContact SD-CG2 3.9Å; I264-V268 HydrophobicContact CG2-CG2 4.36Å; I264-V268 WeakPolarHBondContact O-CG2 3.38Å; I264-V268 PolarHBondContact O-N 3.39Å; S265-V268 PolarHBondContact O-N 3.15Å; V268-F270 PolarHBondContact O-N 2.88Å; V268-G271 WeakPolarHBondContact O-CA 3.1Å; V268-G271 PolarHBondContact O-N 2.97Å; V268-F272 HydrophobicContact CB-CE1 4.19Å; V268-F272 HydrophobicContact CB-CE2 4.38Å; V268-F272 HydrophobicContact CB-CZ 3.95Å; V268-F272 HydrophobicContact CG1-CE1 4.28Å; V268-F272 HydrophobicContact CG1-CE2 3.79Å; V268-F272 HydrophobicContact CG1-CZ 3.54Å; V268-F272 HydrophobicContact CG2-CD1 4.2Å; V268-F272 HydrophobicContact CG2-CE1 3.43Å; V268-F272 VanDerWaalsContact CG2-CE1 3.43Å; V268-F272 HydrophobicContact CG2-CE2 4.44Å; V268-F272 HydrophobicContact CG2-CZ 3.57Å
269	T	96	Very high	94.7	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-63.9	-28.4	177.9	-53.1	0	0	0	0	112.1	S128 L131 V132 F135 F202 H203 S265 M266 A267 G271	S128-T269 VanDerWaalsContact CB-O 3.29Å; S128-T269 WeakPolarHBondContact CB-O 3.33Å; S128-T269 PolarHBondContact OG-O 2.8Å; L131-T269 HydrophobicContact CB-CG2 3.82Å; L131-T269 HydrophobicContact CD1-CG2 4.33Å; V132-T269 HydrophobicContact CG2-CG2 3.75Å; F135-T269 HydrophobicContact CE2-CG2 4.13Å; F135-T269 WeakPolarHBondContact CE2-OG1 3.24Å; F202-T269 WeakPolarHBondContact CD2-O 3.39Å; F202-T269 VanDerWaalsContact CE2-O 3.27Å; F202-T269 WeakPolarHBondContact CE2-O 3.22Å; H203-T269 PolarHBondContact CD2-O 3.47Å; S265-T269 PolarHBondContact O-N 3.41Å; S265-T269 PolarHBondContact O-OG1 2.82Å; M266-T269 WeakPolarHBondContact O-CB 3.32Å; M266-T269 PolarHBondContact O-N 2.66Å; A267-T269 VanDerWaalsContact C-N 3.3Å; A267-T269 PolarHBondContact O-N 3.23Å; T269-G271 PolarHBondContact O-N 2.7Å
270	F	92.6	Very high	94.7	Very high	9 Å²	9	27.6 Å²	27.6	4%	0.039	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	9	168.8	-78	-55	0	0	0	114.7	L125 A129 V132 V177 Q180 M266 A267 V268 N274 W277	L125-F270 HydrophobicContact CD2-CD1 4.11Å; A129-F270 HydrophobicContact CB-CE1 4.03Å; A129-F270 HydrophobicContact CB-CZ 4.5Å; V132-F270 HydrophobicContact CB-CE2 3.97Å; V132-F270 HydrophobicContact CB-CZ 3.93Å; V132-F270 HydrophobicContact CG1-CE2 3.73Å; V132-F270 HydrophobicContact CG1-CZ 4.02Å; V132-F270 HydrophobicContact CG2-CD2 3.9Å; V132-F270 HydrophobicContact CG2-CE1 4.32Å; V132-F270 HydrophobicContact CG2-CE2 3.7Å; V132-F270 HydrophobicContact CG2-CG 4.3Å; V132-F270 HydrophobicContact CG2-CZ 3.92Å; V177-F270 HydrophobicContact CG1-CZ 4.22Å; Q180-F270 HydrophobicContact CB-CE1 4.19Å; Q180-F270 HydrophobicContact CB-CZ 4.39Å; Q180-F270 HydrophobicContact CG-CE1 4.25Å; Q180-F270 HydrophobicContact CG-CZ 4.03Å; M266-F270 WeakPolarHBondContact O-CD2 3.37Å; M266-F270 PolarHBondContact O-N 3.03Å; A267-F270 CarbonylContact O-C 3.47Å; A267-F270 PolarHBondContact O-N 3.16Å; V268-F270 PolarHBondContact O-N 2.88Å; F270-N274 HydrophobicContact CB-CB 3.71Å; F270-N274 HydrophobicContact CD2-CB 4.42Å; F270-N274 HydrophobicContact CG-CB 4.08Å; F270-W277 HydrophobicContact CD2-CB 3.86Å; F270-W277 AromaticContact CD2-CD2 3.94Å; F270-W277 HydrophobicContact CD2-CD2 3.94Å; F270-W277 AromaticContact CD2-CG 3.61Å; F270-W277 HydrophobicContact CD2-CG 3.61Å; F270-W277 HydrophobicContact CE2-CB 4.12Å; F270-W277 AromaticContact CE2-CD2 3.65Å; F270-W277 HydrophobicContact CE2-CD2 3.65Å; F270-W277 AromaticContact CE2-CE3 3.77Å; F270-W277 HydrophobicContact CE2-CE3 3.77Å; F270-W277 AromaticContact CE2-CG 3.79Å; F270-W277 HydrophobicContact CE2-CG 3.79Å
271	G	91.1	Very high	94.7	Very high	9 Å²	9	27.4 Å²	27.4	9%	0.093	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	73	26.8	178	0	0	0	0	0	114.1	A267 V268 T269 H273	A267-G271 PolarHBondContact O-N 2.96Å; V268-G271 WeakPolarHBondContact O-CA 3.1Å; V268-G271 PolarHBondContact O-N 2.97Å; T269-G271 PolarHBondContact O-N 2.7Å; G271-H273 PolarHBondContact O-CD2 3.47Å; G271-H273 PolarHBondContact O-N 2.88Å
272	F	88.4	Confident	94.6	Very high	80 Å²	80	27.5 Å²	27.5	35%	0.351	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.2	-13.4	176.9	-55.9	-92.1	0	0	0	117.1	W201 F202 L205 A267 V268 W278	W201-F272 AromaticContact CH2-CE2 3.75Å; W201-F272 HydrophobicContact CH2-CE2 3.75Å; W201-F272 HydrophobicContact CH2-CZ 4.47Å; W201-F272 HydrophobicContact CZ3-CE2 4.3Å; F202-F272 HydrophobicContact CB-CE2 4.34Å; L205-F272 HydrophobicContact CD2-CZ 4.39Å; A267-F272 PolarHBondContact O-N 3.48Å; A267-F272 VanDerWaalsContact O-N 3.07Å; V268-F272 HydrophobicContact CB-CE1 4.19Å; V268-F272 HydrophobicContact CB-CE2 4.38Å; V268-F272 HydrophobicContact CB-CZ 3.95Å; V268-F272 HydrophobicContact CG1-CE1 4.28Å; V268-F272 HydrophobicContact CG1-CE2 3.79Å; V268-F272 HydrophobicContact CG1-CZ 3.54Å; V268-F272 HydrophobicContact CG2-CD1 4.2Å; V268-F272 HydrophobicContact CG2-CE1 3.43Å; V268-F272 VanDerWaalsContact CG2-CE1 3.43Å; V268-F272 HydrophobicContact CG2-CE2 4.44Å; V268-F272 HydrophobicContact CG2-CZ 3.57Å; F272-W278 HydrophobicContact CD1-CZ2 4.44Å; F272-W278 PolarHBondContact O-NE1 2.9Å
273	H	85.9	Confident	94.6	Very high	166 Å²	166	27.6 Å²	27.6	77%	0.769	13%	0.131	S	C	*	.			trans	-96.2	-6.6	-173.4	-60.1	-60.8	0	0	0	114	G271 F275	G271-H273 PolarHBondContact O-CD2 3.47Å; G271-H273 PolarHBondContact O-N 2.88Å; H273-F275 PolarHBondContact O-N 3.38Å
274	N	88.6	Confident	94.5	Very high	15 Å²	15	27.7 Å²	27.7	8%	0.08	13%	0.132	C	C	.	.			trans	-74.1	96.4	-178.2	-167.2	-59.1	0	0	0	111.9	Q180 F270 T276 W277 W278	Q180-N274 WeakPolarHBondContact CG-ND2 3.48Å; Q180-N274 PolarHBondContact OE1-ND2 3.42Å; Q180-N274 PolarHBondContact OE1-OD1 3.07Å; F270-N274 HydrophobicContact CB-CB 3.71Å; F270-N274 HydrophobicContact CD2-CB 4.42Å; F270-N274 HydrophobicContact CG-CB 4.08Å; N274-T276 PolarHBondContact O-N 3.29Å; N274-T276 PolarHBondContact OD1-N 3.3Å; N274-W277 HydrophobicContact CB-CB 4.1Å; N274-W277 PolarHBondContact O-N 3.04Å; N274-W277 WeakPolarHBondContact OD1-CB 3.13Å; N274-W277 PolarHBondContact OD1-N 2.79Å; N274-W278 VanDerWaalsContact O-CD1 3.29Å; N274-W278 PolarHBondContact O-N 3.33Å; N274-W278 VanDerWaalsContact O-N 3.08Å
275	F	89.9	Confident	94.5	Very high	88 Å²	88	28.4 Å²	28.4	39%	0.386	13%	0.134	S	C	.	.	H	α-helix	trans	-58.7	-44.1	-178.9	-179.3	-109.3	0	0	0	113	H273 W277 W278 L279	H273-F275 PolarHBondContact O-N 3.38Å; F275-W277 VanDerWaalsContact C-N 3.27Å; F275-W277 PolarHBondContact O-N 3.28Å; F275-W278 PolarHBondContact O-N 2.9Å; F275-W278 VanDerWaalsContact O-N 3.12Å; F275-L279 HydrophobicContact CD1-CD1 4.4Å; F275-L279 HydrophobicContact CE1-CD1 3.96Å; F275-L279 HydrophobicContact CE1-CD2 4.33Å; F275-L279 HydrophobicContact CE1-CG 4.23Å; F275-L279 HydrophobicContact CE2-CD2 4.44Å; F275-L279 HydrophobicContact CZ-CD1 4.44Å; F275-L279 HydrophobicContact CZ-CD2 3.98Å; F275-L279 HydrophobicContact CZ-CG 4.33Å; F275-L279 PolarHBondContact O-N 2.86Å; F275-L279 VanDerWaalsContact O-N 3.09Å
276	T	91.3	Very high	94.4	Very high	4 Å²	4	30.2 Å²	30.2	3%	0.025	14%	0.141	C	C	.	.	H	α-helix	trans	-58.9	-41.7	179.8	-47.7	0	0	0	0	111	L15 R16 T176 N274 L279 V280	L15-T276 HydrophobicContact CD2-CG2 4.02Å; L15-T276 HydrophobicContact CG-CG2 4.4Å; R16-T276 HydrophobicContact CG-CG2 4.15Å; R16-T276 PolarHBondContact NE-OG1 2.75Å; T176-T276 HydrophobicContact CG2-CG2 3.91Å; N274-T276 PolarHBondContact O-N 3.29Å; N274-T276 PolarHBondContact OD1-N 3.3Å; T276-L279 WeakPolarHBondContact O-CB 3.45Å; T276-L279 PolarHBondContact O-N 2.81Å; T276-V280 PolarHBondContact O-N 3.17Å
277	W	94.5	Very high	94.3	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-70.1	-35.6	177.5	-168.2	-96.2	0	0	0	112.6	V132 V173 T176 V177 Y263 M266 A267 F270 N274 F275 L279 V280 V281	V132-W277 HydrophobicContact CG1-CH2 4.03Å; V132-W277 HydrophobicContact CG1-CZ2 4.18Å; V132-W277 HydrophobicContact CG1-CZ3 4.37Å; V173-W277 HydrophobicContact CG1-CH2 3.95Å; V173-W277 HydrophobicContact CG1-CZ3 4.17Å; T176-W277 HydrophobicContact CG2-CE3 4.28Å; V177-W277 HydrophobicContact CG2-CE3 4.23Å; V177-W277 HydrophobicContact CG2-CH2 3.88Å; V177-W277 HydrophobicContact CG2-CZ3 3.38Å; Y263-W277 HydrophobicContact CD1-CH2 4.44Å; Y263-W277 AromaticContact CD1-CZ2 3.95Å; Y263-W277 HydrophobicContact CD1-CZ2 3.95Å; Y263-W277 HydrophobicContact CE1-CZ2 4.49Å; Y263-W277 PolarHBondContact O-NE1 3.41Å; Y263-W277 VanDerWaalsContact O-NE1 3.1Å; M266-W277 HydrophobicContact CB-CH2 4.5Å; M266-W277 HydrophobicContact CB-CZ2 3.44Å; M266-W277 VanDerWaalsContact CB-CZ2 3.44Å; M266-W277 HydrophobicContact CG-CZ2 4.04Å; M266-W277 HydrophobicContact SD-CH2 3.87Å; M266-W277 HydrophobicContact SD-CZ2 3.42Å; M266-W277 WeakPolarHBondContact SD-CZ2 3.46Å; A267-W277 VanDerWaalsContact CB-CD1 3.47Å; F270-W277 HydrophobicContact CD2-CB 3.86Å; F270-W277 AromaticContact CD2-CD2 3.94Å; F270-W277 HydrophobicContact CD2-CD2 3.94Å; F270-W277 AromaticContact CD2-CG 3.61Å; F270-W277 HydrophobicContact CD2-CG 3.61Å; F270-W277 HydrophobicContact CE2-CB 4.12Å; F270-W277 AromaticContact CE2-CD2 3.65Å; F270-W277 HydrophobicContact CE2-CD2 3.65Å; F270-W277 AromaticContact CE2-CE3 3.77Å; F270-W277 HydrophobicContact CE2-CE3 3.77Å; F270-W277 AromaticContact CE2-CG 3.79Å; F270-W277 HydrophobicContact CE2-CG 3.79Å; N274-W277 HydrophobicContact CB-CB 4.1Å; N274-W277 PolarHBondContact O-N 3.04Å; N274-W277 WeakPolarHBondContact OD1-CB 3.13Å; N274-W277 PolarHBondContact OD1-N 2.79Å; F275-W277 VanDerWaalsContact C-N 3.27Å; F275-W277 PolarHBondContact O-N 3.28Å; W277-L279 PolarHBondContact O-N 3.26Å; W277-V280 HydrophobicContact CE3-CB 4.45Å; W277-V280 HydrophobicContact CE3-CG2 4.13Å; W277-V280 HydrophobicContact CZ3-CG2 4.41Å; W277-V280 WeakPolarHBondContact O-CA 3.35Å; W277-V280 VanDerWaalsContact O-CB 3.27Å; W277-V280 WeakPolarHBondContact O-CB 3.47Å; W277-V280 PolarHBondContact O-N 3.35Å; W277-V281 PolarHBondContact O-N 3.38Å
278	W	95.4	Very high	94.2	Very high	86 Å²	86	32.6 Å²	32.6	33%	0.326	16%	0.155	S	C	.	.	H	α-helix	trans	-62.5	-29.7	172.3	-82.3	114.3	0	0	0	113.3	A267 F272 N274 F275 V280 V281 T282	A267-W278 HydrophobicContact CB-CD2 4.37Å; A267-W278 HydrophobicContact CB-CH2 4.3Å; A267-W278 HydrophobicContact CB-CZ2 4Å; F272-W278 HydrophobicContact CD1-CZ2 4.44Å; F272-W278 PolarHBondContact O-NE1 2.9Å; N274-W278 VanDerWaalsContact O-CD1 3.29Å; N274-W278 PolarHBondContact O-N 3.33Å; N274-W278 VanDerWaalsContact O-N 3.08Å; F275-W278 PolarHBondContact O-N 2.9Å; F275-W278 VanDerWaalsContact O-N 3.12Å; W278-V280 VanDerWaalsContact C-N 3.34Å; W278-V281 HydrophobicContact CE3-CB 3.9Å; W278-V281 HydrophobicContact CE3-CG1 3.9Å; W278-V281 HydrophobicContact CE3-CG2 4.16Å; W278-V281 HydrophobicContact CZ3-CB 4.31Å; W278-V281 HydrophobicContact CZ3-CG1 3.82Å; W278-V281 HydrophobicContact CZ3-CG2 4.49Å; W278-V281 PolarHBondContact O-N 3.49Å; W278-T282 WeakPolarHBondContact O-CB 3.36Å; W278-T282 PolarHBondContact O-N 3.46Å; W278-T282 PolarHBondContact O-OG1 3.12Å
279	L	95.7	Very high	94.2	Very high	13 Å²	13	32.5 Å²	32.5	7%	0.068	15%	0.154	C	C	.	.	H	α-helix	trans	-63.7	-40.2	169.2	-60.9	175.7	0	0	0	111.5	R16 W19 L20 F275 T276 W277 T282 N283	R16-L279 HydrophobicContact CB-CD1 3.81Å; R16-L279 HydrophobicContact CG-CD1 3.85Å; W19-L279 HydrophobicContact CB-CB 3.72Å; W19-L279 HydrophobicContact CB-CD1 4.31Å; W19-L279 HydrophobicContact CG-CB 4.44Å; L20-L279 HydrophobicContact CD2-CD2 3.56Å; L20-L279 HydrophobicContact CG-CD1 4.11Å; L20-L279 HydrophobicContact CG-CD2 3.97Å; F275-L279 HydrophobicContact CD1-CD1 4.4Å; F275-L279 HydrophobicContact CE1-CD1 3.96Å; F275-L279 HydrophobicContact CE1-CD2 4.33Å; F275-L279 HydrophobicContact CE1-CG 4.23Å; F275-L279 HydrophobicContact CE2-CD2 4.44Å; F275-L279 HydrophobicContact CZ-CD1 4.44Å; F275-L279 HydrophobicContact CZ-CD2 3.98Å; F275-L279 HydrophobicContact CZ-CG 4.33Å; F275-L279 PolarHBondContact O-N 2.86Å; F275-L279 VanDerWaalsContact O-N 3.09Å; T276-L279 WeakPolarHBondContact O-CB 3.45Å; T276-L279 PolarHBondContact O-N 2.81Å; W277-L279 PolarHBondContact O-N 3.26Å; L279-T282 PolarHBondContact O-N 3.43Å; L279-N283 WeakPolarHBondContact O-CB 3.41Å; L279-N283 PolarHBondContact O-N 3.47Å
280	V	97.2	Very high	94	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-61.5	-47.4	173.6	-173.7	0	0	0	0	110.6	W19 V173 T176 Y263 T276 W277 W278 T282 N283 V284	W19-V280 HydrophobicContact CD2-CG2 3.94Å; W19-V280 HydrophobicContact CE3-CG2 4.46Å; W19-V280 HydrophobicContact CG-CG2 4.32Å; W19-V280 HydrophobicContact CH2-CG1 4.33Å; W19-V280 HydrophobicContact CH2-CG2 4.47Å; W19-V280 HydrophobicContact CZ2-CG1 4.47Å; W19-V280 HydrophobicContact CZ2-CG2 3.9Å; V173-V280 HydrophobicContact CG2-CG1 4.41Å; T176-V280 HydrophobicContact CG2-CG2 3.8Å; Y263-V280 HydrophobicContact CD1-CG1 3.85Å; Y263-V280 HydrophobicContact CE1-CG1 3.87Å; T276-V280 PolarHBondContact O-N 3.17Å; W277-V280 HydrophobicContact CE3-CB 4.45Å; W277-V280 HydrophobicContact CE3-CG2 4.13Å; W277-V280 HydrophobicContact CZ3-CG2 4.41Å; W277-V280 WeakPolarHBondContact O-CA 3.35Å; W277-V280 VanDerWaalsContact O-CB 3.27Å; W277-V280 WeakPolarHBondContact O-CB 3.47Å; W277-V280 PolarHBondContact O-N 3.35Å; W278-V280 VanDerWaalsContact C-N 3.34Å; V280-T282 VanDerWaalsContact C-N 3.31Å; V280-T282 PolarHBondContact O-N 3.17Å; V280-N283 WeakPolarHBondContact O-CB 3.36Å; V280-N283 PolarHBondContact O-N 2.68Å; V280-V284 WeakPolarHBondContact O-CG2 3.36Å; V280-V284 PolarHBondContact O-N 3Å
281	V	98.2	Very high	93.9	Very high	6 Å²	6	34.8 Å²	34.8	4%	0.036	17%	0.17	C	C	.	.	H	α-helix	trans	-58.6	-44.2	177.4	176.2	0	0	0	0	110.9	L260 I264 A267 W277 W278 V284 F285	L260-V281 HydrophobicContact CD1-CG1 4.1Å; I264-V281 HydrophobicContact CG1-CG1 3.78Å; A267-V281 HydrophobicContact CB-CG2 4.06Å; W277-V281 PolarHBondContact O-N 3.38Å; W278-V281 HydrophobicContact CE3-CB 3.9Å; W278-V281 HydrophobicContact CE3-CG1 3.9Å; W278-V281 HydrophobicContact CE3-CG2 4.16Å; W278-V281 HydrophobicContact CZ3-CB 4.31Å; W278-V281 HydrophobicContact CZ3-CG1 3.82Å; W278-V281 HydrophobicContact CZ3-CG2 4.49Å; W278-V281 PolarHBondContact O-N 3.49Å; V281-V284 PolarHBondContact O-N 3.16Å; V281-F285 WeakPolarHBondContact O-CB 3.32Å; V281-F285 PolarHBondContact O-N 3Å
282	T	97.6	Very high	94.1	Very high	53 Å²	53	34.4 Å²	34.4	33%	0.325	17%	0.166	S	C	.	.	H	α-helix	trans	-66	-40.6	179.6	-53.7	0	0	0	0	111.3	T23 W278 L279 V280 V284 F285 F286	T23-T282 HydrophobicContact CG2-CG2 3.58Å; W278-T282 WeakPolarHBondContact O-CB 3.36Å; W278-T282 PolarHBondContact O-N 3.46Å; W278-T282 PolarHBondContact O-OG1 3.12Å; L279-T282 PolarHBondContact O-N 3.43Å; V280-T282 VanDerWaalsContact C-N 3.31Å; V280-T282 PolarHBondContact O-N 3.17Å; T282-V284 PolarHBondContact O-N 3.15Å; T282-F285 WeakPolarHBondContact O-CB 2.88Å; T282-F285 PolarHBondContact O-N 2.93Å; T282-F286 HydrophobicContact CG2-CD2 3.86Å; T282-F286 HydrophobicContact CG2-CE2 3.51Å; T282-F286 VanDerWaalsContact O-CD2 3.31Å; T282-F286 WeakPolarHBondContact O-CD2 3.22Å; T282-F286 PolarHBondContact O-N 3.31Å
283	N	97.3	Very high	94.3	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-61	-44	172.6	-179.8	79.1	0	0	0	111.9	W19 L22 T23 F26 L279 V280 S287	W19-N283 HydrophobicContact CE3-CB 4.12Å; W19-N283 HydrophobicContact CZ3-CB 4.45Å; L22-N283 VanDerWaalsContact CB-OD1 3.22Å; L22-N283 WeakPolarHBondContact CB-OD1 3.27Å; T23-N283 PolarHBondContact N-OD1 3.01Å; T23-N283 WeakPolarHBondContact OG1-CB 3.37Å; F26-N283 WeakPolarHBondContact CD2-OD1 3.38Å; L279-N283 WeakPolarHBondContact O-CB 3.41Å; L279-N283 PolarHBondContact O-N 3.47Å; V280-N283 WeakPolarHBondContact O-CB 3.36Å; V280-N283 PolarHBondContact O-N 2.68Å; N283-S287 WeakPolarHBondContact O-CB 3.49Å; N283-S287 PolarHBondContact O-N 3.04Å; N283-S287 PolarHBondContact O-OG 3.05Å
284	V	97.5	Very high	94.5	Very high	3 Å²	3	24.8 Å²	24.8	2%	0.018	12%	0.123	C	C	.	.	H	α-helix	trans	-62.2	-44	174.8	172.4	0	0	0	0	110.4	Y169 E259 L260 Y263 V280 V281 T282 F286 S287 Q288	Y169-V284 WeakPolarHBondContact OH-CG2 3.23Å; E259-V284 HydrophobicContact CG-CG1 4.39Å; L260-V284 HydrophobicContact CD1-CG1 4.41Å; Y263-V284 HydrophobicContact CD1-CG2 3.75Å; Y263-V284 HydrophobicContact CD2-CG1 4.05Å; Y263-V284 HydrophobicContact CD2-CG2 4.05Å; Y263-V284 HydrophobicContact CE1-CG2 3.8Å; Y263-V284 HydrophobicContact CE2-CG1 4.48Å; Y263-V284 HydrophobicContact CE2-CG2 4.11Å; Y263-V284 HydrophobicContact CG-CB 4.4Å; Y263-V284 HydrophobicContact CG-CG1 4.31Å; Y263-V284 HydrophobicContact CG-CG2 3.86Å; V280-V284 WeakPolarHBondContact O-CG2 3.36Å; V280-V284 PolarHBondContact O-N 3Å; V281-V284 PolarHBondContact O-N 3.16Å; T282-V284 PolarHBondContact O-N 3.15Å; V284-F286 PolarHBondContact O-N 3.22Å; V284-S287 WeakPolarHBondContact CA-OG 3.47Å; V284-S287 PolarHBondContact O-N 3.43Å; V284-S287 PolarHBondContact O-OG 3.43Å; V284-S287 VanDerWaalsContact O-OG 3.06Å; V284-Q288 HydrophobicContact CG1-CG 3.91Å; V284-Q288 WeakPolarHBondContact O-CB 3.43Å; V284-Q288 WeakPolarHBondContact O-CG 3.46Å; V284-Q288 PolarHBondContact O-N 2.7Å
285	F	98	Very high	94.5	Very high	60 Å²	60	25.1 Å²	25.1	26%	0.263	13%	0.127	S	C	.	.	H	α-helix	trans	-54.2	-54.7	177.2	178.9	-89.3	0	0	0	111.8	L260 V281 T282 Q288 A289 F313 L314	L260-F285 HydrophobicContact CD1-CB 3.92Å; L260-F285 HydrophobicContact CD1-CD2 4.25Å; L260-F285 HydrophobicContact CD2-CD2 3.62Å; L260-F285 HydrophobicContact CD2-CE2 4.26Å; V281-F285 WeakPolarHBondContact O-CB 3.32Å; V281-F285 PolarHBondContact O-N 3Å; T282-F285 WeakPolarHBondContact O-CB 2.88Å; T282-F285 PolarHBondContact O-N 2.93Å; F285-Q288 PolarHBondContact O-N 2.99Å; F285-A289 WeakPolarHBondContact O-CB 3.21Å; F285-A289 PolarHBondContact O-N 3.37Å; F285-F313 AromaticContact CD2-CE1 3.91Å; F285-F313 HydrophobicContact CD2-CE1 3.91Å; F285-F313 HydrophobicContact CE2-CD1 4.49Å; F285-F313 AromaticContact CE2-CE1 3.87Å; F285-F313 HydrophobicContact CE2-CE1 3.87Å; F285-F313 HydrophobicContact CZ-CE1 4.45Å; F285-L314 HydrophobicContact CE2-CD1 4.07Å; F285-L314 HydrophobicContact CE2-CD2 4.37Å; F285-L314 HydrophobicContact CZ-CD1 4.16Å
286	F	96.7	Very high	94.7	Very high	38 Å²	38	21.9 Å²	21.9	17%	0.167	11%	0.113	C	C	.	.	H	α-helix	trans	-71.6	-38	-176.3	-69.8	-59.3	0	0	0	113.5	T23 F26 L27 L30 T282 V284 A289 L290	T23-F286 HydrophobicContact CG2-CD2 3.64Å; T23-F286 HydrophobicContact CG2-CE2 3.95Å; F26-F286 HydrophobicContact CB-CB 3.84Å; L27-F286 HydrophobicContact CB-CD1 4.21Å; L27-F286 HydrophobicContact CB-CD2 4.16Å; L27-F286 HydrophobicContact CB-CE1 4.43Å; L27-F286 HydrophobicContact CB-CE2 4.33Å; L27-F286 HydrophobicContact CB-CG 4.09Å; L27-F286 HydrophobicContact CB-CZ 4.47Å; L27-F286 HydrophobicContact CD1-CD1 3.91Å; L27-F286 HydrophobicContact CD1-CE1 3.54Å; L27-F286 HydrophobicContact CD1-CZ 3.9Å; L27-F286 HydrophobicContact CD2-CE2 4.38Å; L27-F286 HydrophobicContact CD2-CZ 4.22Å; L27-F286 HydrophobicContact CG-CE1 4.41Å; L27-F286 HydrophobicContact CG-CZ 4.42Å; L30-F286 HydrophobicContact CD2-CD1 4.15Å; T282-F286 HydrophobicContact CG2-CD2 3.86Å; T282-F286 HydrophobicContact CG2-CE2 3.51Å; T282-F286 VanDerWaalsContact O-CD2 3.31Å; T282-F286 WeakPolarHBondContact O-CD2 3.22Å; T282-F286 PolarHBondContact O-N 3.31Å; V284-F286 PolarHBondContact O-N 3.22Å; F286-A289 PolarHBondContact O-N 3.08Å; F286-L290 WeakPolarHBondContact O-CB 3.25Å; F286-L290 PolarHBondContact O-N 3.04Å
287	S	94.5	Very high	94.7	Very high	19 Å²	19	25.7 Å²	25.7	13%	0.133	13%	0.13	C	C	.	.	H	α-helix	trans	-64.5	-39.9	176.1	59.5	0	0	0	0	112.4	N283 V284 S291	N283-S287 WeakPolarHBondContact O-CB 3.49Å; N283-S287 PolarHBondContact O-N 3.04Å; N283-S287 PolarHBondContact O-OG 3.05Å; V284-S287 WeakPolarHBondContact CA-OG 3.47Å; V284-S287 PolarHBondContact O-N 3.43Å; V284-S287 PolarHBondContact O-OG 3.43Å; V284-S287 VanDerWaalsContact O-OG 3.06Å; S287-S291 PolarHBondContact O-N 3.03Å; S287-S291 VanDerWaalsContact O-N 3.15Å; S287-S291 PolarHBondContact O-OG 3.44Å
288	Q	95.6	Very high	94.4	Very high	32 Å²	32	26.5 Å²	26.5	15%	0.15	13%	0.134	C	C	.	.	H	α-helix	trans	-72.4	-40.4	175.5	-68	-58.1	-10.3	0	0	112.1	Y256 V284 F285 L290 S291 A292 F313	Y256-Q288 VanDerWaalsContact CB-OE1 3.24Å; V284-Q288 HydrophobicContact CG1-CG 3.91Å; V284-Q288 WeakPolarHBondContact O-CB 3.43Å; V284-Q288 WeakPolarHBondContact O-CG 3.46Å; V284-Q288 PolarHBondContact O-N 2.7Å; F285-Q288 PolarHBondContact O-N 2.99Å; Q288-L290 PolarHBondContact O-N 3.27Å; Q288-S291 PolarHBondContact O-N 3.14Å; Q288-A292 WeakPolarHBondContact O-CB 3.14Å; Q288-A292 PolarHBondContact O-N 3.03Å; Q288-F313 HydrophobicContact CB-CE2 3.8Å; Q288-F313 HydrophobicContact CB-CZ 3.71Å
289	A	95.9	Very high	94.2	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-59.6	-45.1	175.3	0	0	0	0	0	111.8	L30 F285 F286 A292 F293 F313 F318	L30-A289 HydrophobicContact CD2-CB 3.9Å; F285-A289 WeakPolarHBondContact O-CB 3.21Å; F285-A289 PolarHBondContact O-N 3.37Å; F286-A289 PolarHBondContact O-N 3.08Å; A289-A292 PolarHBondContact O-N 3.42Å; A289-F293 VanDerWaalsContact O-CB 3.32Å; A289-F293 WeakPolarHBondContact O-CB 3.3Å; A289-F293 PolarHBondContact O-N 2.87Å; A289-F313 HydrophobicContact CB-CD1 3.86Å; A289-F313 HydrophobicContact CB-CE1 4.04Å; A289-F318 HydrophobicContact CB-CE1 3.94Å
290	L	92.9	Very high	94	Very high	11 Å²	11	27.8 Å²	27.8	6%	0.058	14%	0.141	C	C	.	.	H	α-helix	trans	-59	-50.1	173.8	176.6	63.7	0	0	0	111.6	F26 T29 L30 Q33 I50 F286 Q288 A292 F293 L294	F26-L290 HydrophobicContact CD1-CD2 4.05Å; T29-L290 HydrophobicContact CG2-CD1 3.95Å; T29-L290 HydrophobicContact CG2-CD2 3.49Å; T29-L290 VanDerWaalsContact CG2-CD2 3.49Å; T29-L290 HydrophobicContact CG2-CG 4.39Å; L30-L290 HydrophobicContact CB-CB 4.45Å; L30-L290 HydrophobicContact CB-CD1 4.41Å; L30-L290 HydrophobicContact CD1-CB 4.49Å; L30-L290 HydrophobicContact CD1-CD1 4.44Å; Q33-L290 HydrophobicContact CB-CD1 4.44Å; Q33-L290 HydrophobicContact CG-CD1 4.01Å; I50-L290 HydrophobicContact CG2-CD1 4.3Å; I50-L290 HydrophobicContact CG2-CD2 4.42Å; F286-L290 WeakPolarHBondContact O-CB 3.25Å; F286-L290 PolarHBondContact O-N 3.04Å; Q288-L290 PolarHBondContact O-N 3.27Å; L290-A292 VanDerWaalsContact C-N 3.32Å; L290-A292 PolarHBondContact O-N 3.3Å; L290-F293 PolarHBondContact O-N 2.97Å; L290-L294 HydrophobicContact CD1-CD1 4.15Å; L290-L294 HydrophobicContact CD1-CG 4.38Å; L290-L294 HydrophobicContact CG-CD1 4.28Å; L290-L294 WeakPolarHBondContact O-CG 3.3Å; L290-L294 PolarHBondContact O-N 2.94Å; L290-L294 VanDerWaalsContact O-N 3.09Å
291	S	90.7	Very high	93.7	Very high	47 Å²	47	32.6 Å²	32.6	33%	0.329	17%	0.174	S	C	.	.	H	α-helix	trans	-63.3	-38.5	180	-62.1	0	0	0	0	112.4	S287 Q288 S295	S287-S291 PolarHBondContact O-N 3.03Å; S287-S291 VanDerWaalsContact O-N 3.15Å; S287-S291 PolarHBondContact O-OG 3.44Å; Q288-S291 PolarHBondContact O-N 3.14Å; S291-S295 WeakPolarHBondContact O-CB 3.37Å; S291-S295 PolarHBondContact O-N 3.44Å; S291-S295 PolarHBondContact O-OG 2.92Å
292	A	93.7	Very high	93.3	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-67	-44.8	177.2	0	0	0	0	0	111.6	Y256 Q288 A289 L290 S295 H296 F313	Y256-A292 HydrophobicContact CD2-CB 3.95Å; Q288-A292 WeakPolarHBondContact O-CB 3.14Å; Q288-A292 PolarHBondContact O-N 3.03Å; A289-A292 PolarHBondContact O-N 3.42Å; L290-A292 VanDerWaalsContact C-N 3.32Å; L290-A292 PolarHBondContact O-N 3.3Å; A292-S295 PolarHBondContact O-N 3.13Å; A292-H296 WeakPolarHBondContact O-CB 3.37Å; A292-H296 PolarHBondContact O-N 2.85Å; A292-F313 HydrophobicContact CB-CB 3.62Å; A292-F313 HydrophobicContact CB-CD2 4Å; A292-F313 HydrophobicContact CB-CG 4.03Å
293	F	93.4	Very high	93	Very high	25 Å²	25	36.2 Å²	36.2	11%	0.11	19%	0.185	C	C	.	.	H	α-helix	trans	-59.4	-50.7	178	176.8	-102.2	0	0	0	111.4	L30 Q33 L34 A289 L290 S295 H296 Q297 F318	L30-F293 HydrophobicContact CD1-CB 4.3Å; Q33-F293 HydrophobicContact CB-CD1 4.26Å; Q33-F293 HydrophobicContact CB-CE1 4.02Å; Q33-F293 WeakPolarHBondContact O-CE1 3.46Å; L34-F293 HydrophobicContact CD2-CD2 4.02Å; L34-F293 HydrophobicContact CD2-CE2 3.57Å; L34-F293 HydrophobicContact CD2-CZ 3.88Å; A289-F293 VanDerWaalsContact O-CB 3.32Å; A289-F293 WeakPolarHBondContact O-CB 3.3Å; A289-F293 PolarHBondContact O-N 2.87Å; L290-F293 PolarHBondContact O-N 2.97Å; F293-S295 VanDerWaalsContact C-N 3.28Å; F293-S295 PolarHBondContact O-N 3.34Å; F293-H296 WeakPolarHBondContact O-CB 3.29Å; F293-H296 PolarHBondContact O-N 3.34Å; F293-H296 VanDerWaalsContact O-N 3.16Å; F293-Q297 HydrophobicContact CD1-CG 4.45Å; F293-Q297 HydrophobicContact CE1-CG 4.04Å; F293-Q297 HydrophobicContact CE2-CG 4.23Å; F293-Q297 HydrophobicContact CZ-CG 3.93Å; F293-Q297 WeakPolarHBondContact O-CG 3.18Å; F293-Q297 PolarHBondContact O-N 3.39Å; F293-F318 HydrophobicContact CB-CZ 4.04Å; F293-F318 HydrophobicContact CD2-CE2 4.24Å; F293-F318 HydrophobicContact CD2-CZ 4.1Å; F293-F318 HydrophobicContact CG-CZ 4.42Å
294	L	89.3	Confident	92.8	Very high	19 Å²	19	43.5 Å²	43.5	10%	0.099	23%	0.229	C	C	.	.	H	α-helix	trans	-62.4	-38.3	178.3	-63.1	172.3	0	0	0	111.6	Q33 I50 T55 L290 F298	Q33-L294 HydrophobicContact CG-CD2 4.46Å; I50-L294 HydrophobicContact CG2-CD1 3.85Å; T55-L294 HydrophobicContact CG2-CB 3.74Å; T55-L294 WeakPolarHBondContact CG2-O 3.34Å; L290-L294 HydrophobicContact CD1-CD1 4.15Å; L290-L294 HydrophobicContact CD1-CG 4.38Å; L290-L294 HydrophobicContact CG-CD1 4.28Å; L290-L294 WeakPolarHBondContact O-CG 3.3Å; L290-L294 PolarHBondContact O-N 2.94Å; L290-L294 VanDerWaalsContact O-N 3.09Å; L294-F298 WeakPolarHBondContact O-CB 3.5Å; L294-F298 PolarHBondContact O-N 3.4Å
295	S	89.8	Confident	92.6	Very high	23 Å²	23	47.9 Å²	47.9	16%	0.161	26%	0.26	C	S	.	.	H	α-helix	trans	-65.6	-40.1	175.6	-61.4	0	0	0	0	112.1	S291 A292 F293 F298 Y299	S291-S295 WeakPolarHBondContact O-CB 3.37Å; S291-S295 PolarHBondContact O-N 3.44Å; S291-S295 PolarHBondContact O-OG 2.92Å; A292-S295 PolarHBondContact O-N 3.13Å; F293-S295 VanDerWaalsContact C-N 3.28Å; F293-S295 PolarHBondContact O-N 3.34Å; S295-F298 PolarHBondContact O-N 2.71Å; S295-Y299 WeakPolarHBondContact O-CD2 3.24Å; S295-Y299 PolarHBondContact O-N 3.15Å
296	H	93.6	Very high	92.4	Very high	20 Å²	20	45.6 Å²	45.6	9%	0.093	25%	0.25	C	C	.	.	H	α-helix	trans	-64.9	-46.3	177.3	-176.7	63.8	0	0	0	111.8	S252 A292 F293 F298 Y299 K300 Y306 R310 A312	S252-H296 PolarHBondContact OG-ND1 2.88Å; A292-H296 WeakPolarHBondContact O-CB 3.37Å; A292-H296 PolarHBondContact O-N 2.85Å; F293-H296 WeakPolarHBondContact O-CB 3.29Å; F293-H296 PolarHBondContact O-N 3.34Å; F293-H296 VanDerWaalsContact O-N 3.16Å; H296-F298 VanDerWaalsContact C-N 3.32Å; H296-F298 PolarHBondContact O-N 3.17Å; H296-Y299 PolarHBondContact O-N 2.81Å; H296-Y299 VanDerWaalsContact O-N 3.17Å; H296-K300 VanDerWaalsContact NE2-CD 3.3Å; H296-K300 WeakPolarHBondContact NE2-CD 3.31Å; H296-K300 PolarHBondContact O-N 2.98Å; H296-Y306 AromaticContact CE1-CE1 3.92Å; H296-Y306 AromaticContact ND1-CE1 3.84Å; H296-R310 PolarHBondContact CE1-O 3.23Å; H296-R310 VanDerWaalsContact CE1-O 3.23Å; H296-A312 HydrophobicContact CB-CB 3.69Å
297	Q	90.9	Very high	92.3	Very high	83 Å²	83	44.8 Å²	44.8	39%	0.388	25%	0.249	S	C	.	.	H	α-helix	trans	-58.8	-44.2	175.2	-70.6	-63.7	-12.7	0	0	111.6	F293 Y299 K300 S301	F293-Q297 HydrophobicContact CD1-CG 4.45Å; F293-Q297 HydrophobicContact CE1-CG 4.04Å; F293-Q297 HydrophobicContact CE2-CG 4.23Å; F293-Q297 HydrophobicContact CZ-CG 3.93Å; F293-Q297 WeakPolarHBondContact O-CG 3.18Å; F293-Q297 PolarHBondContact O-N 3.39Å; Q297-Y299 PolarHBondContact O-N 3.27Å; Q297-K300 PolarHBondContact O-N 3.41Å; Q297-S301 PolarHBondContact O-N 3.47Å; Q297-S301 PolarHBondContact O-OG 3.49Å
298	F	89.1	Confident	92.2	Very high	18 Å²	18	53.6 Å²	53.6	8%	0.079	28%	0.284	C	S	.	.	H	α-helix	trans	-58	-44.7	174.6	168.6	-93.5	0	0	0	112.5	K54 T55 H240 L294 S295 H296 S301 K302	K54-F298 HydrophobicContact CB-CD1 4.04Å; K54-F298 HydrophobicContact CB-CD2 4.06Å; K54-F298 HydrophobicContact CB-CE1 3.89Å; K54-F298 HydrophobicContact CB-CE2 3.9Å; K54-F298 HydrophobicContact CB-CG 4.11Å; K54-F298 HydrophobicContact CB-CZ 3.8Å; K54-F298 HydrophobicContact CD-CD1 4.26Å; K54-F298 HydrophobicContact CD-CE1 3.91Å; K54-F298 HydrophobicContact CD-CZ 4.44Å; K54-F298 VanDerWaalsContact O-CD2 3.22Å; K54-F298 WeakPolarHBondContact O-CD2 3.33Å; K54-F298 WeakPolarHBondContact O-CE2 3.2Å; T55-F298 HydrophobicContact CG2-CB 4.34Å; H240-F298 HydrophobicContact CB-CE1 4.17Å; H240-F298 HydrophobicContact CB-CZ 4.22Å; H240-F298 AromaticContact CG-CZ 3.92Å; H240-F298 AromaticContact ND1-CZ 3.72Å; L294-F298 WeakPolarHBondContact O-CB 3.5Å; L294-F298 PolarHBondContact O-N 3.4Å; S295-F298 PolarHBondContact O-N 2.71Å; H296-F298 VanDerWaalsContact C-N 3.32Å; H296-F298 PolarHBondContact O-N 3.17Å; F298-S301 PolarHBondContact O-OG 2.62Å; F298-K302 HydrophobicContact CE1-CD 3.94Å; F298-K302 HydrophobicContact CE2-CD 3.83Å; F298-K302 HydrophobicContact CZ-CB 4.48Å; F298-K302 HydrophobicContact CZ-CD 3.31Å; F298-K302 WeakPolarHBondContact O-CB 3.3Å; F298-K302 PolarHBondContact O-N 3.43Å
299	Y	91.5	Very high	92.1	Very high	8 Å²	8	58.1 Å²	58.1	3%	0.031	31%	0.305	C	S	.	.	H	α-helix	trans	-66.4	-41.6	179.1	-78.5	-62	0	0	0	112.1	K54 S295 H296 Q297 K302 F303 Y306	K54-Y299 PolarHBondContact NZ-OH 3.07Å; S295-Y299 WeakPolarHBondContact O-CD2 3.24Å; S295-Y299 PolarHBondContact O-N 3.15Å; H296-Y299 PolarHBondContact O-N 2.81Å; H296-Y299 VanDerWaalsContact O-N 3.17Å; Q297-Y299 PolarHBondContact O-N 3.27Å; Y299-K302 PolarHBondContact O-N 2.95Å; Y299-F303 AromaticContact CD1-CD2 3.79Å; Y299-F303 HydrophobicContact CD1-CD2 3.79Å; Y299-F303 AromaticContact CD1-CE2 3.61Å; Y299-F303 HydrophobicContact CD1-CE2 3.61Å; Y299-F303 HydrophobicContact CE1-CE2 4.05Å; Y299-F303 PolarHBondContact O-N 3.36Å; Y299-Y306 VanDerWaalsContact CB-CE2 3.46Å; Y299-Y306 HydrophobicContact CD1-CD2 4.46Å; Y299-Y306 HydrophobicContact CD1-CE2 4.16Å; Y299-Y306 HydrophobicContact CD2-CE2 4.3Å; Y299-Y306 HydrophobicContact CG-CD2 4.26Å; Y299-Y306 AromaticContact CG-CE2 3.75Å; Y299-Y306 HydrophobicContact CG-CE2 3.75Å
300	K	91.8	Very high	92	Very high	118 Å²	118	58.3 Å²	58.3	51%	0.513	31%	0.306	S	S	.	.	H	α-helix	trans	-64.6	-39.2	177.8	-74.7	-179	64.6	177.2	0	113	H296 Q297 Y306	H296-K300 VanDerWaalsContact NE2-CD 3.3Å; H296-K300 WeakPolarHBondContact NE2-CD 3.31Å; H296-K300 PolarHBondContact O-N 2.98Å; Q297-K300 PolarHBondContact O-N 3.41Å; K300-Y306 HydrophobicContact CG-CD1 3.87Å; K300-Y306 HydrophobicContact CG-CE1 4.34Å
301	S	89.7	Confident	92.2	Very high	101 Å²	101	61.7 Å²	61.7	71%	0.706	32%	0.32	S	S	*	.	H	α-helix	trans	-75.5	-34.1	178.8	66.7	0	0	0	0	112.5	Q297 F298	Q297-S301 PolarHBondContact O-N 3.47Å; Q297-S301 PolarHBondContact O-OG 3.49Å; F298-S301 PolarHBondContact O-OG 2.62Å
302	K	89.5	Confident	92.3	Very high	98 Å²	98	59.5 Å²	59.5	43%	0.426	31%	0.305	S	S	.	.	H	α-helix	trans	-83	-35.5	-175.2	-176.4	165.2	-177.3	150.7	0	114.1	F298 Y299	F298-K302 HydrophobicContact CE1-CD 3.94Å; F298-K302 HydrophobicContact CE2-CD 3.83Å; F298-K302 HydrophobicContact CZ-CB 4.48Å; F298-K302 HydrophobicContact CZ-CD 3.31Å; F298-K302 WeakPolarHBondContact O-CB 3.3Å; F298-K302 PolarHBondContact O-N 3.43Å; Y299-K302 PolarHBondContact O-N 2.95Å
303	F	92.1	Very high	92.3	Very high	37 Å²	37	59.5 Å²	59.5	16%	0.162	31%	0.305	C	S	.	.			trans	-120.3	111.1	-172.1	-56.5	-80.8	0	0	0	111.2	H240 I242 Y299 S305 Y306	H240-F303 HydrophobicContact CB-CE2 4.46Å; H240-F303 HydrophobicContact CB-CZ 4.04Å; H240-F303 VanDerWaalsContact O-CZ 3.26Å; H240-F303 WeakPolarHBondContact O-CZ 3.47Å; I242-F303 HydrophobicContact CD1-CB 3.86Å; I242-F303 HydrophobicContact CD1-CD1 4.38Å; I242-F303 HydrophobicContact CD1-CG 4.07Å; I242-F303 HydrophobicContact CG1-CB 4.15Å; I242-F303 HydrophobicContact CG1-CD1 4.13Å; I242-F303 HydrophobicContact CG1-CD2 4.04Å; I242-F303 HydrophobicContact CG1-CG 3.84Å; Y299-F303 AromaticContact CD1-CD2 3.79Å; Y299-F303 HydrophobicContact CD1-CD2 3.79Å; Y299-F303 AromaticContact CD1-CE2 3.61Å; Y299-F303 HydrophobicContact CD1-CE2 3.61Å; Y299-F303 HydrophobicContact CE1-CE2 4.05Å; Y299-F303 PolarHBondContact O-N 3.36Å; F303-S305 PolarHBondContact O-N 3.17Å; F303-Y306 VanDerWaalsContact O-CB 3.25Å; F303-Y306 WeakPolarHBondContact O-CB 3.34Å; F303-Y306 PolarHBondContact O-N 2.97Å
304	V	92.2	Very high	92.3	Very high	153 Å²	153	60.2 Å²	60.2	93%	0.927	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-34.7	174.6	-179.5	0	0	0	0	111.5	Y306	V304-Y306 VanDerWaalsContact C-N 3.27Å; V304-Y306 PolarHBondContact O-N 3.38Å
305	S	93.2	Very high	92.4	Very high	95 Å²	95	61.2 Å²	61.2	66%	0.664	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	10.3	177.9	57.1	0	0	0	0	114.5	F303	F303-S305 PolarHBondContact O-N 3.17Å
306	Y	95.3	Very high	92.4	Very high	12 Å²	12	67.9 Å²	67.9	5%	0.047	34%	0.344	C	S	.	.			trans	-63.2	132.1	-179.7	-166.2	-107.3	0	0	0	111.9	I242 S252 H296 Y299 K300 F303 V304 K308 R310	I242-Y306 HydrophobicContact CD1-CD2 4.21Å; I242-Y306 HydrophobicContact CG1-CD2 4.13Å; I242-Y306 HydrophobicContact CG2-CD2 4Å; I242-Y306 HydrophobicContact CG2-CE2 4Å; S252-Y306 WeakPolarHBondContact CA-OH 3.01Å; S252-Y306 WeakPolarHBondContact CB-OH 3.28Å; S252-Y306 PolarHBondContact OG-OH 3.14Å; H296-Y306 AromaticContact CE1-CE1 3.92Å; H296-Y306 AromaticContact ND1-CE1 3.84Å; Y299-Y306 VanDerWaalsContact CB-CE2 3.46Å; Y299-Y306 HydrophobicContact CD1-CD2 4.46Å; Y299-Y306 HydrophobicContact CD1-CE2 4.16Å; Y299-Y306 HydrophobicContact CD2-CE2 4.3Å; Y299-Y306 HydrophobicContact CG-CD2 4.26Å; Y299-Y306 AromaticContact CG-CE2 3.75Å; Y299-Y306 HydrophobicContact CG-CE2 3.75Å; K300-Y306 HydrophobicContact CG-CD1 3.87Å; K300-Y306 HydrophobicContact CG-CE1 4.34Å; F303-Y306 VanDerWaalsContact O-CB 3.25Å; F303-Y306 WeakPolarHBondContact O-CB 3.34Å; F303-Y306 PolarHBondContact O-N 2.97Å; V304-Y306 VanDerWaalsContact C-N 3.27Å; V304-Y306 PolarHBondContact O-N 3.38Å; Y306-K308 PolarHBondContact O-N 3.34Å; Y306-K308 VanDerWaalsContact O-N 3.08Å; Y306-R310 HydrophobicContact CE1-CB 4.36Å
307	P	93.8	Very high	92.3	Very high	22 Å²	22	73.7 Å²	73.7	14%	0.143	38%	0.375	C	S	.	.			trans	-61.4	114.2	-178.6	-24.9	35.2	0	0	0	112.4	F244 H309 R310	F244-P307 HydrophobicContact CE1-CG 4.09Å; F244-P307 HydrophobicContact CZ-CG 4.34Å; P307-H309 VanDerWaalsContact C-N 3.27Å; P307-H309 PolarHBondContact O-N 3.2Å; P307-R310 HydrophobicContact CB-CG 4.03Å; P307-R310 PolarHBondContact O-N 3.42Å
308	K	92.1	Very high	92.1	Very high	203 Å²	203	72.9 Å²	72.9	88%	0.883	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-22.1	-174.2	-64.3	-177	-179.6	178.3	0	114.3	Y306	Y306-K308 PolarHBondContact O-N 3.34Å; Y306-K308 VanDerWaalsContact O-N 3.08Å
309	H	92.9	Very high	92.2	Very high	128 Å²	128	75.6 Å²	75.6	59%	0.593	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-20.9	179.6	64.8	-95.8	0	0	0	112.9	E249 P307	E249-H309 PolarHBondContact O-NE2 3.28Å; E249-H309 VanDerWaalsContact O-NE2 3.15Å; P307-H309 VanDerWaalsContact C-N 3.27Å; P307-H309 PolarHBondContact O-N 3.2Å
310	R	95.4	Very high	92.3	Very high	3 Å²	3	79.2 Å²	79.2	1%	0.011	40%	0.403	C	S	.	.			trans	-65.1	139.3	-179.3	-73.3	178.2	-174.1	-167.2	-6.9	110.8	P243 F244 F248 E249 Y250 H296 Y306 P307	P243-R310 PolarHBondContact O-NH1 3.27Å; P243-R310 PolarHBondContact O-NH2 3.44Å; P243-R310 VanDerWaalsContact O-NH2 3.11Å; F244-R310 VanDerWaalsContact CE1-NH2 3.34Å; F248-R310 VanDerWaalsContact O-CD 3.23Å; F248-R310 WeakPolarHBondContact O-CD 3.21Å; F248-R310 PolarHBondContact O-NE 2.87Å; F248-R310 PolarHBondContact O-NH1 3.14Å; F248-R310 PolarHBondContact O-NH2 3.21Å; E249-R310 IonicContact OE1-NH2 3.15Å; E249-R310 IonicContact OE2-NH2 2.66Å; E249-R310 PolarHBondContact OE2-NH2 3.44Å; Y250-R310 WeakPolarHBondContact O-CA 3.48Å; H296-R310 PolarHBondContact CE1-O 3.23Å; H296-R310 VanDerWaalsContact CE1-O 3.23Å; Y306-R310 HydrophobicContact CE1-CB 4.36Å; P307-R310 HydrophobicContact CB-CG 4.03Å; P307-R310 PolarHBondContact O-N 3.42Å
311	K	95.8	Very high	92.3	Very high	82 Å²	82	77 Å²	77	36%	0.357	40%	0.397	S	S	.	.	B	Isolated β-bridge	trans	-94.3	172	172.7	-60.7	-58.9	-176.2	173.4	0	111.1	Y250 V251 S252 L314	Y250-K311 PolarHBondContact O-N 2.91Å; V251-K311 CarbonylContact C-O 3.49Å; V251-K311 VanDerWaalsContact CA-O 3.28Å; V251-K311 WeakPolarHBondContact CA-O 3.01Å; V251-K311 HydrophobicContact CG1-CB 4.24Å; S252-K311 PolarHBondContact N-O 2.75Å; S252-K311 PolarHBondContact OG-O 3.42Å; K311-L314 WeakPolarHBondContact CB-O 3.47Å
312	A	93.8	Very high	92.4	Very high	1 Å²	1	75.6 Å²	75.6	1%	0.008	38%	0.379	C	S	.	.	S	Bend	trans	-74.1	-49.2	-177.8	0	0	0	0	0	111.7	S252 S253 H296 F318	S252-A312 PolarHBondContact N-O 2.76Å; S253-A312 PolarHBondContact N-O 3.2Å; H296-A312 HydrophobicContact CB-CB 3.69Å; A312-F318 WeakPolarHBondContact CB-OXT 3.5Å; A312-F318 PolarHBondContact N-O 3.17Å; A312-F318 VanDerWaalsContact N-O 3.17Å; A312-F318 PolarHBondContact N-OXT 2.86Å
313	F	93.9	Very high	92.6	Very high	0 Å²	0	74.2 Å²	74.2	0%	0	38%	0.376	C	S	.	.	S	Bend	trans	-140.6	-52.1	-163.8	-175.1	-135.9	0	0	0	114	L257 L260 F285 Q288 A289 A292 F318	L257-F313 HydrophobicContact CB-CD2 4.45Å; L257-F313 HydrophobicContact CB-CE2 4.32Å; L260-F313 HydrophobicContact CB-CZ 4.15Å; L260-F313 HydrophobicContact CD2-CE1 4.12Å; L260-F313 HydrophobicContact CD2-CZ 3.79Å; F285-F313 AromaticContact CD2-CE1 3.91Å; F285-F313 HydrophobicContact CD2-CE1 3.91Å; F285-F313 HydrophobicContact CE2-CD1 4.49Å; F285-F313 AromaticContact CE2-CE1 3.87Å; F285-F313 HydrophobicContact CE2-CE1 3.87Å; F285-F313 HydrophobicContact CZ-CE1 4.45Å; Q288-F313 HydrophobicContact CB-CE2 3.8Å; Q288-F313 HydrophobicContact CB-CZ 3.71Å; A289-F313 HydrophobicContact CB-CD1 3.86Å; A289-F313 HydrophobicContact CB-CE1 4.04Å; A292-F313 HydrophobicContact CB-CB 3.62Å; A292-F313 HydrophobicContact CB-CD2 4Å; A292-F313 HydrophobicContact CB-CG 4.03Å; F313-F318 CarbonylContact C-O 3.57Å; F313-F318 WeakPolarHBondContact CA-O 3.36Å; F313-F318 HydrophobicContact CB-CD1 3.88Å; F313-F318 HydrophobicContact CB-CE1 4.23Å; F313-F318 HydrophobicContact CD1-CD1 4.36Å; F313-F318 PolarHBondContact N-O 3.23Å
314	L	93.1	Very high	92.7	Very high	40 Å²	40	76.7 Å²	76.7	21%	0.209	39%	0.39	C	S	.	.	S	Bend	trans	-101.7	121.7	-179	-63.7	-178.9	0	0	0	110	L257 F285 K311 F316 L317 F318	L257-L314 HydrophobicContact CD1-CD2 4.01Å; F285-L314 HydrophobicContact CE2-CD1 4.07Å; F285-L314 HydrophobicContact CE2-CD2 4.37Å; F285-L314 HydrophobicContact CZ-CD1 4.16Å; K311-L314 WeakPolarHBondContact CB-O 3.47Å; L314-F316 PolarHBondContact O-N 3.1Å; L314-L317 HydrophobicContact CB-CB 4.09Å; L314-L317 PolarHBondContact O-N 3.06Å; L314-F318 HydrophobicContact CB-CB 4.22Å; L314-F318 HydrophobicContact CD1-CB 4.5Å; L314-F318 PolarHBondContact N-O 3.15Å; L314-F318 PolarHBondContact O-N 2.74Å; L314-F318 VanDerWaalsContact O-N 3.1Å
315	P	91	Very high	92.7	Very high	41 Å²	41	71.2 Å²	71.2	27%	0.266	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	134.9	178.5	-25.8	34.5	0	0	0	111.1	V251 L257 L317	V251-P315 HydrophobicContact CG1-CB 4.3Å; V251-P315 HydrophobicContact CG1-CG 3.88Å; L257-P315 HydrophobicContact CD2-CG 3.94Å; P315-L317 PolarHBondContact O-N 3.13Å
316	F	89.7	Confident	92.6	Very high	163 Å²	163	69.4 Å²	69.4	72%	0.715	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.8	-10.5	178.1	-41.1	-70.6	0	0	0	116.6	Y250 L314	Y250-F316 HydrophobicContact CD1-CE1 4.12Å; Y250-F316 AromaticContact CD1-CZ 3.73Å; Y250-F316 HydrophobicContact CD1-CZ 3.73Å; Y250-F316 AromaticContact CE1-CZ 3.98Å; Y250-F316 HydrophobicContact CE1-CZ 3.98Å; L314-F316 PolarHBondContact O-N 3.1Å
317	L	91.1	Very high	92.4	Very high	141 Å²	141	74.2 Å²	74.2	74%	0.738	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.1	-67.3	-175.8	-69.2	169.8	0	0	0	112.8	L314 P315	L314-L317 HydrophobicContact CB-CB 4.09Å; L314-L317 PolarHBondContact O-N 3.06Å; P315-L317 PolarHBondContact O-N 3.13Å
318	F	86.6	Confident	92.3	Very high	66 Å²	66	78.9 Å²	78.9	29%	0.289	37%	0.37	S	S	.	.			trans	-129.9	0	-166.2	176.7	-114.6	0	0	0	112.7	L30 L34 A289 F293 A312 F313 L314	L30-F318 HydrophobicContact CD1-CZ 4.17Å; L34-F318 HydrophobicContact CD2-CE2 4.25Å; A289-F318 HydrophobicContact CB-CE1 3.94Å; F293-F318 HydrophobicContact CB-CZ 4.04Å; F293-F318 HydrophobicContact CD2-CE2 4.24Å; F293-F318 HydrophobicContact CD2-CZ 4.1Å; F293-F318 HydrophobicContact CG-CZ 4.42Å; A312-F318 WeakPolarHBondContact CB-OXT 3.5Å; A312-F318 PolarHBondContact N-O 3.17Å; A312-F318 VanDerWaalsContact N-O 3.17Å; A312-F318 PolarHBondContact N-OXT 2.86Å; F313-F318 CarbonylContact C-O 3.57Å; F313-F318 WeakPolarHBondContact CA-O 3.36Å; F313-F318 HydrophobicContact CB-CD1 3.88Å; F313-F318 HydrophobicContact CB-CE1 4.23Å; F313-F318 HydrophobicContact CD1-CD1 4.36Å; F313-F318 PolarHBondContact N-O 3.23Å; L314-F318 HydrophobicContact CB-CB 4.22Å; L314-F318 HydrophobicContact CD1-CB 4.5Å; L314-F318 PolarHBondContact N-O 3.15Å; L314-F318 PolarHBondContact O-N 2.74Å; L314-F318 VanDerWaalsContact O-N 3.1Å

Retrieved 318 of 318 residues in 177.9 ms (Link to these results)

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