A0A060XQ23_ONCMY Loading...

Protein RER1

Involved in the retrieval of endoplasmic reticulum membrane proteins from the early Golgi compartment.

AlphaFold DB (A0A1S3LJP9), UniProt , Accession A0A060XQ23, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 195 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.4	Very low	46.3	Very low	244 Å²	244	140.4 Å²	140.4	100%	1.202	84%	0.842	S	S	*	*				0	96.7	0	-160.9	130.2	111.6	0	0	108.2
2	S	40.5	Very low	47.1	Very low	131 Å²	131	142.7 Å²	142.7	92%	0.916	84%	0.837	S	S	*	*			trans	-163.1	83.3	162.9	-171.9	0	0	0	0	105.3
3	E	45.4	Very low	47.9	Very low	196 Å²	196	135.6 Å²	135.6	92%	0.916	81%	0.813	S	S	*	*			trans	-102.9	133.3	174	-111.3	168	102	0	0	106.9
4	G	44.8	Very low	48.7	Very low	68 Å²	68	139.9 Å²	139.9	70%	0.701	82%	0.815	S	S	*	*			trans	114.3	50.8	146.7	0	0	0	0	0	118.6
5	D	48	Very low	49.2	Very low	180 Å²	180	137.4 Å²	137.4	96%	0.963	81%	0.806	S	S	*	*			trans	-97	87.5	151.3	-80.8	-24.4	0	0	0	108.7
6	S	46.2	Very low	50.4	Low	103 Å²	103	133.3 Å²	133.3	72%	0.72	79%	0.786	S	S	*	*			trans	-128.4	96.2	170.7	172.1	0	0	0	0	110.2
7	V	46.4	Very low	51.7	Low	117 Å²	117	132.1 Å²	132.1	71%	0.709	78%	0.781	S	S	*	*			trans	47.8	78.4	133.3	-167.2	0	0	0	0	115.1	E9	V7-E9 HydrophobicContact CG1-CB 3.82Å; V7-E9 PolarHBondContact O-N 3.23Å
8	G	44.8	Very low	53	Low	81 Å²	81	130.9 Å²	130.9	84%	0.835	77%	0.769	S	S	*	*			trans	-84.4	58.3	155.8	0	0	0	0	0	111	S10	G8-S10 VanDerWaalsContact C-N 3.34Å; G8-S10 PolarHBondContact O-N 3.16Å
9	E	47.5	Very low	54.2	Low	160 Å²	160	125.8 Å²	125.8	75%	0.748	75%	0.747	S	S	*	*			trans	-70.6	96.1	169.3	-167.3	171.1	155.2	0	0	107.5	V7 I11	V7-E9 HydrophobicContact CG1-CB 3.82Å; V7-E9 PolarHBondContact O-N 3.23Å; E9-I11 PolarHBondContact O-N 3Å
10	S	51.3	Low	55.3	Low	108 Å²	108	122.4 Å²	122.4	76%	0.755	73%	0.729	S	S	*	*			trans	-61	101.1	172.9	45.3	0	0	0	0	108.6	G8 H12	G8-S10 VanDerWaalsContact C-N 3.34Å; G8-S10 PolarHBondContact O-N 3.16Å; S10-H12 PolarHBondContact O-N 3.02Å
11	I	49.5	Very low	56.4	Low	156 Å²	156	122.9 Å²	122.9	80%	0.8	72%	0.723	S	S	*	*			trans	-62.6	89.2	169	-61.9	-167.4	0	0	0	107	E9 G13	E9-I11 PolarHBondContact O-N 3Å; I11-G13 PolarHBondContact O-N 2.97Å
12	H	56.9	Low	58.2	Low	168 Å²	168	118.1 Å²	118.1	78%	0.778	70%	0.695	S	S	*	*			trans	-68.3	84.9	163.9	-164.9	-53	0	0	0	106.2	S10 K14	S10-H12 PolarHBondContact O-N 3.02Å; H12-K14 PolarHBondContact O-N 2.83Å; H12-K14 VanDerWaalsContact O-N 3.07Å
13	G	57	Low	60.1	Low	51 Å²	51	115.9 Å²	115.9	53%	0.526	68%	0.676	S	S	.	*	P	Polyproline II helix	trans	-48.8	120.2	174.5	0	0	0	0	0	108.7	I11	I11-G13 PolarHBondContact O-N 2.97Å
14	K	58.3	Low	61.8	Low	195 Å²	195	114.8 Å²	114.8	85%	0.848	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-46.3	128.9	176	-72.9	174.1	174.9	172.8	0	108	H12 S16	H12-K14 PolarHBondContact O-N 2.83Å; H12-K14 VanDerWaalsContact O-N 3.07Å; K14-S16 PolarHBondContact O-N 3.43Å
15	P	56.2	Low	63.6	Low	103 Å²	103	114.9 Å²	114.9	67%	0.669	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-57.5	120.4	174.7	24.5	-31.8	0	0	0	107.1	T17	P15-T17 PolarHBondContact O-N 3.47Å; P15-T17 VanDerWaalsContact O-N 3.13Å
16	S	68.6	Low	65.2	Low	71 Å²	71	108 Å²	108	50%	0.497	62%	0.622	S	S	.	*	P	Polyproline II helix	trans	-50.6	123	-178.7	173.8	0	0	0	0	109	K14 I18 G19 S20	K14-S16 PolarHBondContact O-N 3.43Å; S16-I18 PolarHBondContact O-N 3.26Å; S16-G19 CarbonylContact O-C 3.58Å; S16-G19 WeakPolarHBondContact O-CA 3.44Å; S16-G19 PolarHBondContact O-N 3.32Å; S16-S20 PolarHBondContact O-N 2.95Å
17	T	73.6	Confident	67	Low	114 Å²	114	109.4 Å²	109.4	70%	0.699	62%	0.617	S	S	*	*	H	α-helix	trans	-53.4	-33.3	-178.9	-36.9	0	0	0	0	111	P15 S20 F21	P15-T17 PolarHBondContact O-N 3.47Å; P15-T17 VanDerWaalsContact O-N 3.13Å; T17-S20 WeakPolarHBondContact CA-OG 3.27Å; T17-S20 PolarHBondContact O-N 2.91Å; T17-S20 PolarHBondContact O-OG 3.07Å; T17-F21 WeakPolarHBondContact O-CB 3.37Å; T17-F21 PolarHBondContact O-N 3.13Å
18	I	73.8	Confident	68.7	Low	111 Å²	111	109 Å²	109	57%	0.569	61%	0.61	S	S	*	*	H	α-helix	trans	-65.9	-45.4	173.4	-67.3	136.2	0	0	0	111.4	S16 S20 F21 F22	S16-I18 PolarHBondContact O-N 3.26Å; I18-S20 PolarHBondContact O-N 3.31Å; I18-F21 PolarHBondContact O-N 2.91Å; I18-F22 HydrophobicContact CG2-CD2 3.65Å; I18-F22 HydrophobicContact CG2-CE2 3.39Å; I18-F22 WeakPolarHBondContact O-CD2 3.19Å; I18-F22 PolarHBondContact O-N 3.12Å
19	G	75.6	Confident	70.4	Confident	33 Å²	33	110.6 Å²	110.6	34%	0.34	59%	0.592	S	S	.	*	H	α-helix	trans	-62.9	-39	174.2	0	0	0	0	0	113	S16 F21 T23	S16-G19 CarbonylContact O-C 3.58Å; S16-G19 WeakPolarHBondContact O-CA 3.44Å; S16-G19 PolarHBondContact O-N 3.32Å; G19-F21 VanDerWaalsContact C-N 3.33Å; G19-F21 PolarHBondContact O-N 2.81Å; G19-T23 WeakPolarHBondContact O-CB 3.36Å; G19-T23 VanDerWaalsContact O-CG2 3.31Å; G19-T23 WeakPolarHBondContact O-CG2 3.4Å; G19-T23 PolarHBondContact O-N 3.17Å; G19-T23 PolarHBondContact O-OG1 2.96Å
20	S	76.9	Confident	72.1	Confident	57 Å²	57	109.1 Å²	109.1	40%	0.399	59%	0.585	S	S	.	*	H	α-helix	trans	-67.3	-32.3	174.8	76.2	0	0	0	0	112.9	S16 T17 I18 T23 R24	S16-S20 PolarHBondContact O-N 2.95Å; T17-S20 WeakPolarHBondContact CA-OG 3.27Å; T17-S20 PolarHBondContact O-N 2.91Å; T17-S20 PolarHBondContact O-OG 3.07Å; I18-S20 PolarHBondContact O-N 3.31Å; S20-T23 VanDerWaalsContact C-OG1 3.3Å; S20-T23 VanDerWaalsContact CA-OG1 3.26Å; S20-T23 WeakPolarHBondContact CA-OG1 3.47Å; S20-T23 PolarHBondContact O-OG1 2.7Å; S20-R24 WeakPolarHBondContact O-CB 3.47Å; S20-R24 PolarHBondContact O-N 2.75Å; S20-R24 VanDerWaalsContact O-N 3.12Å
21	F	78.9	Confident	73.4	Confident	134 Å²	134	107.7 Å²	107.7	59%	0.588	58%	0.575	S	S	*	*	H	α-helix	trans	-71.7	-47.1	174.6	-179.4	-98.9	0	0	0	111.8	T17 I18 G19 T23 R24 V25	T17-F21 WeakPolarHBondContact O-CB 3.37Å; T17-F21 PolarHBondContact O-N 3.13Å; I18-F21 PolarHBondContact O-N 2.91Å; G19-F21 VanDerWaalsContact C-N 3.33Å; G19-F21 PolarHBondContact O-N 2.81Å; F21-T23 VanDerWaalsContact C-N 3.32Å; F21-T23 PolarHBondContact O-N 2.9Å; F21-R24 PolarHBondContact O-N 3.23Å; F21-V25 HydrophobicContact CD1-CG2 4.16Å; F21-V25 HydrophobicContact CE1-CG2 3.76Å; F21-V25 HydrophobicContact CE2-CG2 4.23Å; F21-V25 HydrophobicContact CZ-CG2 3.8Å; F21-V25 WeakPolarHBondContact O-CG2 3.49Å; F21-V25 PolarHBondContact O-N 3.48Å
22	F	81.4	Confident	74.7	Confident	143 Å²	143	108.1 Å²	108.1	63%	0.627	57%	0.567	S	S	*	*	H	α-helix	trans	-61.5	-39.8	176.9	-79.9	-66.5	0	0	0	112.6	I18 V25 G26	I18-F22 HydrophobicContact CG2-CD2 3.65Å; I18-F22 HydrophobicContact CG2-CE2 3.39Å; I18-F22 WeakPolarHBondContact O-CD2 3.19Å; I18-F22 PolarHBondContact O-N 3.12Å; F22-V25 PolarHBondContact O-N 3.44Å; F22-G26 PolarHBondContact O-N 3.32Å
23	T	80.8	Confident	75.8	Confident	84 Å²	84	101.1 Å²	101.1	52%	0.515	53%	0.534	S	S	.	.	H	α-helix	trans	-64.3	-42.2	174.9	46.6	0	0	0	0	111.5	G19 S20 F21 G26 Q27	G19-T23 WeakPolarHBondContact O-CB 3.36Å; G19-T23 VanDerWaalsContact O-CG2 3.31Å; G19-T23 WeakPolarHBondContact O-CG2 3.4Å; G19-T23 PolarHBondContact O-N 3.17Å; G19-T23 PolarHBondContact O-OG1 2.96Å; S20-T23 VanDerWaalsContact C-OG1 3.3Å; S20-T23 VanDerWaalsContact CA-OG1 3.26Å; S20-T23 WeakPolarHBondContact CA-OG1 3.47Å; S20-T23 PolarHBondContact O-OG1 2.7Å; F21-T23 VanDerWaalsContact C-N 3.32Å; F21-T23 PolarHBondContact O-N 2.9Å; T23-G26 PolarHBondContact O-N 2.9Å; T23-Q27 VanDerWaalsContact O-CG 3.26Å; T23-Q27 WeakPolarHBondContact O-CG 3.33Å; T23-Q27 PolarHBondContact O-N 3.48Å
24	R	81.5	Confident	76.9	Confident	173 Å²	173	103.6 Å²	103.6	65%	0.653	54%	0.536	S	S	*	.	H	α-helix	trans	-65.2	-42.1	176.2	-168	167	-177.7	155.5	-0.8	113	S20 F21 G26 Q27 I28	S20-R24 WeakPolarHBondContact O-CB 3.47Å; S20-R24 PolarHBondContact O-N 2.75Å; S20-R24 VanDerWaalsContact O-N 3.12Å; F21-R24 PolarHBondContact O-N 3.23Å; R24-G26 VanDerWaalsContact C-N 3.35Å; R24-Q27 PolarHBondContact O-N 2.98Å; R24-I28 HydrophobicContact CG-CD1 4.26Å; R24-I28 VanDerWaalsContact O-CG1 3.29Å; R24-I28 WeakPolarHBondContact O-CG1 3.34Å; R24-I28 PolarHBondContact O-N 3.49Å
25	V	83.1	Confident	77.8	Confident	70 Å²	70	104 Å²	104	42%	0.424	53%	0.532	S	S	.	.	H	α-helix	trans	-63	-42.8	174	172.1	0	0	0	0	110.8	F21 F22 Q27 I28 Y29	F21-V25 HydrophobicContact CD1-CG2 4.16Å; F21-V25 HydrophobicContact CE1-CG2 3.76Å; F21-V25 HydrophobicContact CE2-CG2 4.23Å; F21-V25 HydrophobicContact CZ-CG2 3.8Å; F21-V25 WeakPolarHBondContact O-CG2 3.49Å; F21-V25 PolarHBondContact O-N 3.48Å; F22-V25 PolarHBondContact O-N 3.44Å; V25-Q27 VanDerWaalsContact C-N 3.34Å; V25-Q27 PolarHBondContact O-N 2.88Å; V25-I28 PolarHBondContact O-N 3.2Å; V25-Y29 WeakPolarHBondContact O-CB 3.36Å; V25-Y29 PolarHBondContact O-N 2.94Å
26	G	80.9	Confident	78.8	Confident	35 Å²	35	100.1 Å²	100.1	36%	0.361	51%	0.507	S	S	.	.	H	α-helix	trans	-60.8	-41.1	175.5	0	0	0	0	0	112.9	F22 T23 R24 Y29 Q30	F22-G26 PolarHBondContact O-N 3.32Å; T23-G26 PolarHBondContact O-N 2.9Å; R24-G26 VanDerWaalsContact C-N 3.35Å; G26-Y29 PolarHBondContact O-N 3.36Å; G26-Q30 PolarHBondContact O-N 2.9Å
27	Q	82.9	Confident	79.2	Confident	134 Å²	134	99.9 Å²	99.9	63%	0.626	50%	0.503	S	S	*	.	H	α-helix	trans	-65.5	-43.7	176.3	-74.7	169.9	-12.5	0	0	112.3	T23 R24 V25 Y29 Q30 S31	T23-Q27 VanDerWaalsContact O-CG 3.26Å; T23-Q27 WeakPolarHBondContact O-CG 3.33Å; T23-Q27 PolarHBondContact O-N 3.48Å; R24-Q27 PolarHBondContact O-N 2.98Å; V25-Q27 VanDerWaalsContact C-N 3.34Å; V25-Q27 PolarHBondContact O-N 2.88Å; Q27-Y29 VanDerWaalsContact C-N 3.33Å; Q27-Q30 PolarHBondContact O-N 3.34Å; Q27-S31 WeakPolarHBondContact O-CB 3.26Å; Q27-S31 PolarHBondContact O-N 3.01Å
28	I	82.6	Confident	79.6	Confident	109 Å²	109	99 Å²	99	56%	0.559	50%	0.499	S	S	*	.	H	α-helix	trans	-63.8	-43.4	176.4	-66.6	163.1	0	0	0	110.3	R24 V25 S31 W32	R24-I28 HydrophobicContact CG-CD1 4.26Å; R24-I28 VanDerWaalsContact O-CG1 3.29Å; R24-I28 WeakPolarHBondContact O-CG1 3.34Å; R24-I28 PolarHBondContact O-N 3.49Å; V25-I28 PolarHBondContact O-N 3.2Å; I28-S31 PolarHBondContact O-N 3.42Å; I28-W32 WeakPolarHBondContact O-CB 3.48Å; I28-W32 PolarHBondContact O-N 3.29Å
29	Y	81.9	Confident	80.1	Confident	114 Å²	114	100.2 Å²	100.2	45%	0.447	50%	0.501	S	S	.	.	H	α-helix	trans	-60.5	-46.2	176.9	-175.1	-112	0	0	0	111.9	V25 G26 Q27 W32 L33 H122	V25-Y29 WeakPolarHBondContact O-CB 3.36Å; V25-Y29 PolarHBondContact O-N 2.94Å; G26-Y29 PolarHBondContact O-N 3.36Å; Q27-Y29 VanDerWaalsContact C-N 3.33Å; Y29-W32 PolarHBondContact O-N 3.07Å; Y29-L33 HydrophobicContact CD1-CD1 3.77Å; Y29-L33 HydrophobicContact CD1-CG 4.46Å; Y29-L33 HydrophobicContact CE1-CD1 3.5Å; Y29-L33 VanDerWaalsContact CE1-CD1 3.5Å; Y29-L33 HydrophobicContact CE1-CG 4.28Å; Y29-L33 VanDerWaalsContact O-CG 3.3Å; Y29-L33 WeakPolarHBondContact O-CG 3.48Å; Y29-L33 PolarHBondContact O-N 2.99Å; Y29-H122 AromaticContact CE1-NE2 3.95Å; Y29-H122 AromaticContact CZ-NE2 3.54Å; Y29-H122 PolarHBondContact OH-CE1 2.88Å; Y29-H122 VanDerWaalsContact OH-CE1 3.23Å; Y29-H122 PolarHBondContact OH-NE2 3.38Å
30	Q	81.6	Confident	80.3	Confident	128 Å²	128	100.4 Å²	100.4	60%	0.598	50%	0.497	S	S	*	.	H	α-helix	trans	-63.1	-43.5	174.6	-77.4	-154.8	-9.9	0	0	112.4	G26 Q27 W32 L33 D34	G26-Q30 PolarHBondContact O-N 2.9Å; Q27-Q30 PolarHBondContact O-N 3.34Å; Q30-W32 VanDerWaalsContact C-N 3.27Å; Q30-W32 PolarHBondContact O-N 3.35Å; Q30-L33 WeakPolarHBondContact O-CB 3.1Å; Q30-L33 PolarHBondContact O-N 3.11Å; Q30-L33 VanDerWaalsContact O-N 3.11Å; Q30-D34 WeakPolarHBondContact O-CB 3.38Å; Q30-D34 PolarHBondContact O-N 2.99Å
31	S	79.7	Confident	80.7	Confident	78 Å²	78	105.2 Å²	105.2	55%	0.545	52%	0.516	S	S	.	.	H	α-helix	trans	-58.3	-40.2	176.5	-179.8	0	0	0	0	112.4	Q27 I28 D34 R35	Q27-S31 WeakPolarHBondContact O-CB 3.26Å; Q27-S31 PolarHBondContact O-N 3.01Å; I28-S31 PolarHBondContact O-N 3.42Å; S31-D34 PolarHBondContact O-N 3.43Å; S31-R35 WeakPolarHBondContact O-CB 3.49Å; S31-R35 PolarHBondContact O-N 3Å; S31-R35 VanDerWaalsContact O-N 3.07Å
32	W	77.3	Confident	81.2	Confident	166 Å²	166	101 Å²	101	63%	0.629	51%	0.51	S	S	*	.	H	α-helix	trans	-69.1	-38.2	176.7	-161.5	84.5	0	0	0	112.5	I28 Y29 Q30 R35 S36	I28-W32 WeakPolarHBondContact O-CB 3.48Å; I28-W32 PolarHBondContact O-N 3.29Å; Y29-W32 PolarHBondContact O-N 3.07Å; Q30-W32 VanDerWaalsContact C-N 3.27Å; Q30-W32 PolarHBondContact O-N 3.35Å; W32-R35 PolarHBondContact O-N 3.36Å; W32-S36 PolarHBondContact O-N 3.47Å; W32-S36 PolarHBondContact O-OG 3.46Å
33	L	79.4	Confident	81.6	Confident	20 Å²	20	95 Å²	95	11%	0.105	48%	0.483	C	S	.	.	H	α-helix	trans	-62.2	-46.8	172.5	-73.5	176.6	0	0	0	111.5	Y29 Q30 R35 S36 T37 F118 H122	Y29-L33 HydrophobicContact CD1-CD1 3.77Å; Y29-L33 HydrophobicContact CD1-CG 4.46Å; Y29-L33 HydrophobicContact CE1-CD1 3.5Å; Y29-L33 VanDerWaalsContact CE1-CD1 3.5Å; Y29-L33 HydrophobicContact CE1-CG 4.28Å; Y29-L33 VanDerWaalsContact O-CG 3.3Å; Y29-L33 WeakPolarHBondContact O-CG 3.48Å; Y29-L33 PolarHBondContact O-N 2.99Å; Q30-L33 WeakPolarHBondContact O-CB 3.1Å; Q30-L33 PolarHBondContact O-N 3.11Å; Q30-L33 VanDerWaalsContact O-N 3.11Å; L33-R35 VanDerWaalsContact C-N 3.28Å; L33-R35 PolarHBondContact O-N 2.95Å; L33-S36 WeakPolarHBondContact O-CB 3.47Å; L33-S36 PolarHBondContact O-N 3.36Å; L33-T37 PolarHBondContact O-N 2.82Å; L33-T37 PolarHBondContact O-OG1 3.23Å; L33-F118 HydrophobicContact CB-CE1 4.26Å; L33-F118 HydrophobicContact CB-CZ 3.9Å; L33-F118 HydrophobicContact CD2-CE1 4.46Å; L33-F118 HydrophobicContact CD2-CZ 4.06Å; L33-F118 WeakPolarHBondContact O-CZ 3.26Å; L33-H122 VanDerWaalsContact CD2-CD2 3.4Å; L33-H122 WeakPolarHBondContact CD2-CD2 3.37Å
34	D	80.6	Confident	82	Confident	103 Å²	103	94.8 Å²	94.8	55%	0.551	47%	0.473	S	S	*	.	H	α-helix	trans	-60.5	-40.1	179.8	-67.9	-22.2	0	0	0	111.1	Q30 S31 S36 T37	Q30-D34 WeakPolarHBondContact O-CB 3.38Å; Q30-D34 PolarHBondContact O-N 2.99Å; S31-D34 PolarHBondContact O-N 3.43Å; D34-S36 VanDerWaalsContact C-N 3.26Å; D34-S36 PolarHBondContact O-N 3.21Å; D34-T37 WeakPolarHBondContact CA-OG1 3.29Å; D34-T37 WeakPolarHBondContact O-CB 3.39Å; D34-T37 PolarHBondContact O-N 3.35Å; D34-T37 PolarHBondContact O-OG1 3.3Å
35	R	77.4	Confident	82.6	Confident	204 Å²	204	88.1 Å²	88.1	77%	0.77	46%	0.458	S	S	*	.	H	α-helix	trans	-66.1	-25.4	175.4	-168.3	165.2	-179.7	147.3	-1.5	113.8	S31 W32 L33 P38	S31-R35 WeakPolarHBondContact O-CB 3.49Å; S31-R35 PolarHBondContact O-N 3Å; S31-R35 VanDerWaalsContact O-N 3.07Å; W32-R35 PolarHBondContact O-N 3.36Å; L33-R35 VanDerWaalsContact C-N 3.28Å; L33-R35 PolarHBondContact O-N 2.95Å; R35-P38 WeakPolarHBondContact O-CD 3.33Å
36	S	76.8	Confident	83	Confident	22 Å²	22	88.7 Å²	88.7	15%	0.154	46%	0.461	C	S	.	.	H	α-helix	trans	-86.8	-11.9	178.2	-58.5	0	0	0	0	113.2	W32 L33 D34 P38 F39 R43	W32-S36 PolarHBondContact O-N 3.47Å; W32-S36 PolarHBondContact O-OG 3.46Å; L33-S36 WeakPolarHBondContact O-CB 3.47Å; L33-S36 PolarHBondContact O-N 3.36Å; D34-S36 VanDerWaalsContact C-N 3.26Å; D34-S36 PolarHBondContact O-N 3.21Å; S36-P38 VanDerWaalsContact C-CD 3.47Å; S36-F39 PolarHBondContact O-N 3.02Å; S36-R43 VanDerWaalsContact O-CD 3.27Å; S36-R43 WeakPolarHBondContact O-CD 3.3Å; S36-R43 PolarHBondContact O-NE 3.36Å
37	T	76.8	Confident	83.6	Confident	65 Å²	65	87.3 Å²	87.3	40%	0.399	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.1	-48.9	179.4	-53	0	0	0	0	114.7	L33 D34 F39 R43	L33-T37 PolarHBondContact O-N 2.82Å; L33-T37 PolarHBondContact O-OG1 3.23Å; D34-T37 WeakPolarHBondContact CA-OG1 3.29Å; D34-T37 WeakPolarHBondContact O-CB 3.39Å; D34-T37 PolarHBondContact O-N 3.35Å; D34-T37 PolarHBondContact O-OG1 3.3Å; T37-F39 VanDerWaalsContact C-N 3.3Å; T37-F39 PolarHBondContact O-N 3.04Å; T37-R43 PolarHBondContact O-NH2 3.33Å
38	P	82.5	Confident	84.2	Confident	95 Å²	95	86.5 Å²	86.5	62%	0.617	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-23.2	-173.4	26.6	-33.8	0	0	0	113.7	R35 S36 S40	R35-P38 WeakPolarHBondContact O-CD 3.33Å; S36-P38 VanDerWaalsContact C-CD 3.47Å; P38-S40 PolarHBondContact O-N 3.11Å; P38-S40 VanDerWaalsContact O-N 3.12Å
39	F	82.6	Confident	84.8	Confident	138 Å²	138	84.7 Å²	84.7	61%	0.605	44%	0.442	S	S	*	.			trans	-90.8	63.1	-172.4	-57.5	-71.2	0	0	0	112.8	S36 T37 I41 G42 R43	S36-F39 PolarHBondContact O-N 3.02Å; T37-F39 VanDerWaalsContact C-N 3.3Å; T37-F39 PolarHBondContact O-N 3.04Å; F39-I41 PolarHBondContact O-N 3.45Å; F39-G42 PolarHBondContact O-N 3.16Å; F39-R43 WeakPolarHBondContact O-CB 3.43Å; F39-R43 VanDerWaalsContact O-CG 3.28Å; F39-R43 WeakPolarHBondContact O-CG 3.47Å; F39-R43 PolarHBondContact O-N 2.87Å
40	S	81.1	Confident	85.5	Confident	37 Å²	37	81.7 Å²	81.7	26%	0.259	43%	0.434	S	S	.	.	H	α-helix	trans	-58.6	-45.5	-178	-170.2	0	0	0	0	113.1	P38 G42 R43 W44 E117	P38-S40 PolarHBondContact O-N 3.11Å; P38-S40 VanDerWaalsContact O-N 3.12Å; S40-G42 PolarHBondContact O-N 2.66Å; S40-R43 WeakPolarHBondContact O-CB 3.31Å; S40-R43 PolarHBondContact O-N 3.29Å; S40-W44 PolarHBondContact O-N 3.08Å; S40-E117 PolarHBondContact OG-OE1 3.45Å
41	I	85.6	Confident	86.1	Confident	158 Å²	158	77.9 Å²	77.9	81%	0.81	42%	0.419	S	S	*	.	H	α-helix	trans	-61.5	-45.9	-179.9	-61.3	170.1	0	0	0	111.3	F39 R43 W44 G45	F39-I41 PolarHBondContact O-N 3.45Å; I41-R43 PolarHBondContact O-N 2.91Å; I41-W44 PolarHBondContact O-N 3.17Å; I41-G45 PolarHBondContact O-N 2.86Å
42	G	87.8	Confident	86.9	Confident	44 Å²	44	76.4 Å²	76.4	45%	0.454	41%	0.412	S	S	.	.	H	α-helix	trans	-63.2	-42.5	178.7	0	0	0	0	0	112.3	F39 S40 G45 V46	F39-G42 PolarHBondContact O-N 3.16Å; S40-G42 PolarHBondContact O-N 2.66Å; G42-G45 PolarHBondContact O-N 3.43Å; G42-V46 WeakPolarHBondContact O-CG2 3.43Å; G42-V46 PolarHBondContact O-N 3.41Å
43	R	89.9	Confident	87.8	Confident	19 Å²	19	73.1 Å²	73.1	7%	0.072	41%	0.405	C	S	.	.	H	α-helix	trans	-55.7	-53.3	175.7	-80.2	-167.9	-64.5	116.2	-1	111.6	S36 T37 F39 S40 I41 V46 T47 W121	S36-R43 VanDerWaalsContact O-CD 3.27Å; S36-R43 WeakPolarHBondContact O-CD 3.3Å; S36-R43 PolarHBondContact O-NE 3.36Å; T37-R43 PolarHBondContact O-NH2 3.33Å; F39-R43 WeakPolarHBondContact O-CB 3.43Å; F39-R43 VanDerWaalsContact O-CG 3.28Å; F39-R43 WeakPolarHBondContact O-CG 3.47Å; F39-R43 PolarHBondContact O-N 2.87Å; S40-R43 WeakPolarHBondContact O-CB 3.31Å; S40-R43 PolarHBondContact O-N 3.29Å; I41-R43 PolarHBondContact O-N 2.91Å; R43-V46 PolarHBondContact O-N 3.49Å; R43-T47 PolarHBondContact O-N 3.47Å; R43-T47 VanDerWaalsContact O-N 3.11Å; R43-T47 PolarHBondContact O-OG1 3.47Å; R43-T47 VanDerWaalsContact O-OG1 3.1Å; R43-W121 HydrophobicContact CB-CD2 3.93Å; R43-W121 VanDerWaalsContact CB-CE2 3.43Å; R43-W121 HydrophobicContact CB-CG 4.25Å; R43-W121 HydrophobicContact CB-CH2 4.44Å; R43-W121 HydrophobicContact CB-CZ2 3.72Å; R43-W121 HydrophobicContact CG-CD2 4.13Å; R43-W121 HydrophobicContact CG-CE3 4.35Å; R43-W121 HydrophobicContact CG-CH2 3.81Å; R43-W121 HydrophobicContact CG-CZ2 3.56Å; R43-W121 HydrophobicContact CG-CZ3 4.2Å; R43-W121 PolarHBondContact O-NE1 3.03Å
44	W	90	Very high	88.6	Confident	79 Å²	79	72.3 Å²	72.3	30%	0.299	40%	0.401	S	S	.	.	H	α-helix	trans	-67.9	-36	179.3	-73.4	109.2	0	0	0	112.9	S40 I41 V46 T47 L48 E117 F120 W121	S40-W44 PolarHBondContact O-N 3.08Å; I41-W44 PolarHBondContact O-N 3.17Å; W44-V46 PolarHBondContact O-N 3.29Å; W44-T47 PolarHBondContact O-N 3.31Å; W44-L48 WeakPolarHBondContact O-CB 3.32Å; W44-L48 VanDerWaalsContact O-CG 3.28Å; W44-L48 WeakPolarHBondContact O-CG 3.39Å; W44-L48 PolarHBondContact O-N 3.28Å; W44-E117 HydrophobicContact CZ2-CG 4.17Å; W44-E117 PolarHBondContact NE1-OE1 3.46Å; W44-E117 VanDerWaalsContact NE1-OE1 3.14Å; W44-F120 AromaticContact CH2-CD1 3.42Å; W44-F120 HydrophobicContact CH2-CD1 3.42Å; W44-F120 VanDerWaalsContact CH2-CD1 3.42Å; W44-F120 AromaticContact CH2-CE1 3.33Å; W44-F120 HydrophobicContact CH2-CE1 3.33Å; W44-F120 AromaticContact CZ2-CD1 4Å; W44-F120 HydrophobicContact CZ2-CD1 4Å; W44-F120 HydrophobicContact CZ2-CE1 4.33Å; W44-F120 HydrophobicContact CZ3-CD1 4.33Å; W44-F120 AromaticContact CZ3-CE1 3.94Å; W44-F120 HydrophobicContact CZ3-CE1 3.94Å; W44-W121 HydrophobicContact CZ2-CB 4.37Å
45	G	93.3	Very high	89.3	Confident	32 Å²	32	72.4 Å²	72.4	33%	0.33	40%	0.399	S	S	.	.	H	α-helix	trans	-55.3	-49.7	171.9	0	0	0	0	0	111.8	I41 G42 T47 L48 S49	I41-G45 PolarHBondContact O-N 2.86Å; G42-G45 PolarHBondContact O-N 3.43Å; G45-T47 PolarHBondContact O-N 2.89Å; G45-L48 PolarHBondContact O-N 3.11Å; G45-S49 PolarHBondContact O-N 3.31Å; G45-S49 PolarHBondContact O-OG 2.88Å; G45-S49 VanDerWaalsContact O-OG 3.06Å
46	V	92.7	Very high	90.2	Very high	82 Å²	82	67.5 Å²	67.5	50%	0.497	39%	0.388	S	S	.	.	H	α-helix	trans	-60.6	-45.4	177	171.9	0	0	0	0	111.8	G42 R43 W44 L48 S49 L50	G42-V46 WeakPolarHBondContact O-CG2 3.43Å; G42-V46 PolarHBondContact O-N 3.41Å; R43-V46 PolarHBondContact O-N 3.49Å; W44-V46 PolarHBondContact O-N 3.29Å; V46-L48 PolarHBondContact O-N 3.35Å; V46-S49 PolarHBondContact O-N 2.98Å; V46-L50 HydrophobicContact CG1-CD1 3.98Å; V46-L50 HydrophobicContact CG1-CG 4.45Å; V46-L50 WeakPolarHBondContact O-CB 3.46Å; V46-L50 WeakPolarHBondContact O-CG 3.3Å; V46-L50 PolarHBondContact O-N 3.43Å
47	T	93.3	Very high	91	Very high	7 Å²	7	69.5 Å²	69.5	4%	0.043	39%	0.392	C	S	.	.	H	α-helix	trans	-63.3	-41	178.9	-52.5	0	0	0	0	112.1	R43 W44 G45 L50 T51 W121 T125 I128	R43-T47 PolarHBondContact O-N 3.47Å; R43-T47 VanDerWaalsContact O-N 3.11Å; R43-T47 PolarHBondContact O-OG1 3.47Å; R43-T47 VanDerWaalsContact O-OG1 3.1Å; W44-T47 PolarHBondContact O-N 3.31Å; G45-T47 PolarHBondContact O-N 2.89Å; T47-L50 PolarHBondContact O-N 2.89Å; T47-T51 WeakPolarHBondContact O-CB 3.31Å; T47-T51 PolarHBondContact O-N 2.92Å; T47-T51 PolarHBondContact O-OG1 3.46Å; T47-W121 PolarHBondContact OG1-NE1 3.47Å; T47-T125 PolarHBondContact OG1-OG1 3.24Å; T47-I128 HydrophobicContact CG2-CD1 3.66Å
48	L	94.6	Very high	91.8	Very high	117 Å²	117	67 Å²	67	61%	0.613	38%	0.377	S	S	*	.	H	α-helix	trans	-65.8	-43.7	176.8	-72.4	174.8	0	0	0	111.2	W44 G45 V46 T51 A52	W44-L48 WeakPolarHBondContact O-CB 3.32Å; W44-L48 VanDerWaalsContact O-CG 3.28Å; W44-L48 WeakPolarHBondContact O-CG 3.39Å; W44-L48 PolarHBondContact O-N 3.28Å; G45-L48 PolarHBondContact O-N 3.11Å; V46-L48 PolarHBondContact O-N 3.35Å; L48-T51 PolarHBondContact O-N 3.06Å; L48-A52 WeakPolarHBondContact O-CB 3.39Å; L48-A52 PolarHBondContact O-N 3.45Å
49	S	96.1	Very high	92.3	Very high	70 Å²	70	70.9 Å²	70.9	49%	0.49	38%	0.38	S	S	.	.	H	α-helix	trans	-60.3	-46	174.2	-61.1	0	0	0	0	111.9	G45 V46 T51 A52 I53	G45-S49 PolarHBondContact O-N 3.31Å; G45-S49 PolarHBondContact O-OG 2.88Å; G45-S49 VanDerWaalsContact O-OG 3.06Å; V46-S49 PolarHBondContact O-N 2.98Å; S49-T51 VanDerWaalsContact C-N 3.34Å; S49-T51 PolarHBondContact O-N 2.89Å; S49-A52 PolarHBondContact O-N 3.3Å; S49-I53 VanDerWaalsContact O-CG1 3.27Å; S49-I53 WeakPolarHBondContact O-CG1 3.42Å; S49-I53 PolarHBondContact O-N 3.45Å
50	L	95.8	Very high	92.8	Very high	51 Å²	51	70 Å²	70	27%	0.267	38%	0.381	S	S	.	.	H	α-helix	trans	-61.4	-41.7	176.1	-76.5	171.3	0	0	0	112.2	V46 T47 I53 Y54 T125 I128 V129	V46-L50 HydrophobicContact CG1-CD1 3.98Å; V46-L50 HydrophobicContact CG1-CG 4.45Å; V46-L50 WeakPolarHBondContact O-CB 3.46Å; V46-L50 WeakPolarHBondContact O-CG 3.3Å; V46-L50 PolarHBondContact O-N 3.43Å; T47-L50 PolarHBondContact O-N 2.89Å; L50-I53 PolarHBondContact O-N 3.47Å; L50-Y54 WeakPolarHBondContact O-CB 3.35Å; L50-Y54 PolarHBondContact O-N 3.35Å; L50-T125 HydrophobicContact CD1-CG2 3.94Å; L50-I128 HydrophobicContact CB-CG2 4.03Å; L50-V129 HydrophobicContact CD1-CG2 4.38Å
51	T	95.3	Very high	93.3	Very high	49 Å²	49	72.2 Å²	72.2	30%	0.301	39%	0.389	S	S	.	.	H	α-helix	trans	-61.7	-45.3	175.4	-56.4	0	0	0	0	111	T47 L48 S49 Y54 M55 I128	T47-T51 WeakPolarHBondContact O-CB 3.31Å; T47-T51 PolarHBondContact O-N 2.92Å; T47-T51 PolarHBondContact O-OG1 3.46Å; L48-T51 PolarHBondContact O-N 3.06Å; S49-T51 VanDerWaalsContact C-N 3.34Å; S49-T51 PolarHBondContact O-N 2.89Å; T51-Y54 WeakPolarHBondContact O-CB 3.47Å; T51-Y54 PolarHBondContact O-N 3.43Å; T51-M55 HydrophobicContact CG2-CG 4.36Å; T51-M55 VanDerWaalsContact O-CG 3.3Å; T51-M55 WeakPolarHBondContact O-CG 3.38Å; T51-M55 PolarHBondContact O-N 2.95Å; T51-I128 WeakPolarHBondContact OG1-CD1 3.37Å
52	A	96.1	Very high	93.6	Very high	47 Å²	47	69.6 Å²	69.6	39%	0.388	37%	0.373	S	S	.	.	H	α-helix	trans	-61.9	-46.3	178.8	0	0	0	0	0	111.4	L48 S49 Y54 M55 I56	L48-A52 WeakPolarHBondContact O-CB 3.39Å; L48-A52 PolarHBondContact O-N 3.45Å; S49-A52 PolarHBondContact O-N 3.3Å; A52-Y54 VanDerWaalsContact C-N 3.31Å; A52-Y54 PolarHBondContact O-N 2.74Å; A52-M55 PolarHBondContact O-N 3.25Å; A52-I56 WeakPolarHBondContact O-CB 3.46Å; A52-I56 WeakPolarHBondContact O-CD1 3.4Å; A52-I56 WeakPolarHBondContact O-CG1 3.41Å; A52-I56 PolarHBondContact O-N 2.89Å
53	I	96.6	Very high	93.7	Very high	96 Å²	96	67.5 Å²	67.5	49%	0.492	35%	0.352	S	S	.	.	H	α-helix	trans	-59.8	-43.2	176.5	-65.1	163.7	0	0	0	110.7	S49 L50 R57 M132	S49-I53 VanDerWaalsContact O-CG1 3.27Å; S49-I53 WeakPolarHBondContact O-CG1 3.42Å; S49-I53 PolarHBondContact O-N 3.45Å; L50-I53 PolarHBondContact O-N 3.47Å; I53-R57 WeakPolarHBondContact O-CB 3.46Å; I53-R57 PolarHBondContact O-N 2.97Å; I53-M132 HydrophobicContact CB-CE 4.38Å; I53-M132 HydrophobicContact CG2-CE 3.84Å
54	Y	96.3	Very high	93.8	Very high	3 Å²	3	67.8 Å²	67.8	1%	0.012	35%	0.353	C	S	.	.	H	α-helix	trans	-60.1	-49	175.8	176.3	-91.6	0	0	0	112.1	L50 T51 A52 R57 V58 T68 L71 A131 M132 T135	L50-Y54 WeakPolarHBondContact O-CB 3.35Å; L50-Y54 PolarHBondContact O-N 3.35Å; T51-Y54 WeakPolarHBondContact O-CB 3.47Å; T51-Y54 PolarHBondContact O-N 3.43Å; A52-Y54 VanDerWaalsContact C-N 3.31Å; A52-Y54 PolarHBondContact O-N 2.74Å; Y54-R57 WeakPolarHBondContact O-CB 3.43Å; Y54-R57 PolarHBondContact O-N 2.9Å; Y54-V58 HydrophobicContact CD1-CG2 4.36Å; Y54-V58 HydrophobicContact CE1-CG2 3.84Å; Y54-V58 HydrophobicContact CE2-CG2 4.19Å; Y54-V58 WeakPolarHBondContact O-CG2 3.45Å; Y54-V58 PolarHBondContact O-N 2.9Å; Y54-T68 HydrophobicContact CE1-CG2 4.16Å; Y54-T68 VanDerWaalsContact OH-CA 3.24Å; Y54-T68 WeakPolarHBondContact OH-CA 3.26Å; Y54-T68 PolarHBondContact OH-N 3.23Å; Y54-T68 PolarHBondContact OH-OG1 3Å; Y54-L71 HydrophobicContact CD1-CD2 4.15Å; Y54-L71 HydrophobicContact CE1-CD2 3.8Å; Y54-L71 HydrophobicContact CE2-CD2 4.45Å; Y54-A131 HydrophobicContact CD2-CB 4.45Å; Y54-A131 HydrophobicContact CE2-CB 3.76Å; Y54-M132 VanDerWaalsContact CA-CE 3.49Å; Y54-M132 HydrophobicContact CD2-CB 4.38Å; Y54-M132 HydrophobicContact CD2-CE 4.28Å; Y54-M132 HydrophobicContact CD2-SD 4.37Å; Y54-T135 HydrophobicContact CD2-CG2 4.49Å; Y54-T135 HydrophobicContact CE2-CG2 3.73Å
55	M	94.3	Very high	94	Very high	105 Å²	105	66 Å²	66	52%	0.517	35%	0.346	S	S	.	.	H	α-helix	trans	-63.7	-43.3	-179.6	-70.4	-62.9	-69.2	0	0	111.8	T51 A52 R57 V58 Y59	T51-M55 HydrophobicContact CG2-CG 4.36Å; T51-M55 VanDerWaalsContact O-CG 3.3Å; T51-M55 WeakPolarHBondContact O-CG 3.38Å; T51-M55 PolarHBondContact O-N 2.95Å; A52-M55 PolarHBondContact O-N 3.25Å; M55-R57 VanDerWaalsContact C-N 3.33Å; M55-R57 PolarHBondContact O-N 3.4Å; M55-V58 PolarHBondContact O-N 2.99Å; M55-Y59 VanDerWaalsContact O-CB 3.28Å; M55-Y59 WeakPolarHBondContact O-CB 3.22Å; M55-Y59 PolarHBondContact O-N 2.86Å
56	I	96.1	Very high	94	Very high	102 Å²	102	67.9 Å²	67.9	52%	0.523	35%	0.348	S	S	.	.	H	α-helix	trans	-59.3	-46.1	175.5	-69.9	164.5	0	0	0	110.2	A52 Y59 I60	A52-I56 WeakPolarHBondContact O-CB 3.46Å; A52-I56 WeakPolarHBondContact O-CD1 3.4Å; A52-I56 WeakPolarHBondContact O-CG1 3.41Å; A52-I56 PolarHBondContact O-N 2.89Å; I56-Y59 PolarHBondContact O-N 3.25Å; I56-I60 HydrophobicContact CG2-CD1 3.66Å; I56-I60 HydrophobicContact CG2-CG1 4.4Å; I56-I60 WeakPolarHBondContact O-CG1 3.32Å; I56-I60 PolarHBondContact O-N 2.85Å
57	R	94.8	Very high	94.1	Very high	64 Å²	64	64.8 Å²	64.8	24%	0.242	33%	0.33	C	S	.	.	H	α-helix	trans	-59.4	-50.4	178.2	178.4	-179	175	96.4	0.9	112	I53 Y54 M55 Y59 I60 L61 T135	I53-R57 WeakPolarHBondContact O-CB 3.46Å; I53-R57 PolarHBondContact O-N 2.97Å; Y54-R57 WeakPolarHBondContact O-CB 3.43Å; Y54-R57 PolarHBondContact O-N 2.9Å; M55-R57 VanDerWaalsContact C-N 3.33Å; M55-R57 PolarHBondContact O-N 3.4Å; R57-Y59 VanDerWaalsContact C-N 3.3Å; R57-Y59 PolarHBondContact O-N 3.28Å; R57-I60 PolarHBondContact O-N 3.4Å; R57-L61 HydrophobicContact CG-CD1 3.7Å; R57-L61 HydrophobicContact CG-CG 4.43Å; R57-L61 WeakPolarHBondContact O-CB 3.3Å; R57-L61 WeakPolarHBondContact O-CG 3.47Å; R57-L61 PolarHBondContact O-N 2.98Å; R57-T135 PolarHBondContact NE-OG1 2.9Å; R57-T135 PolarHBondContact NH2-O 3.27Å
58	V	93.4	Very high	94.2	Very high	13 Å²	13	66.1 Å²	66.1	8%	0.079	34%	0.338	C	S	.	.	H	α-helix	trans	-62	-39.6	178.8	169.5	0	0	0	0	111.2	Y54 M55 Q62	Y54-V58 HydrophobicContact CD1-CG2 4.36Å; Y54-V58 HydrophobicContact CE1-CG2 3.84Å; Y54-V58 HydrophobicContact CE2-CG2 4.19Å; Y54-V58 WeakPolarHBondContact O-CG2 3.45Å; Y54-V58 PolarHBondContact O-N 2.9Å; M55-V58 PolarHBondContact O-N 2.99Å; V58-Q62 WeakPolarHBondContact O-CA 3.28Å; V58-Q62 PolarHBondContact O-N 3Å
59	Y	92.9	Very high	94.1	Very high	175 Å²	175	63.8 Å²	63.8	69%	0.686	32%	0.321	S	S	*	.	H	α-helix	trans	-66.5	-40.2	177.4	-177.6	-97.8	0	0	0	112.7	M55 I56 R57 Q62	M55-Y59 VanDerWaalsContact O-CB 3.28Å; M55-Y59 WeakPolarHBondContact O-CB 3.22Å; M55-Y59 PolarHBondContact O-N 2.86Å; I56-Y59 PolarHBondContact O-N 3.25Å; R57-Y59 VanDerWaalsContact C-N 3.3Å; R57-Y59 PolarHBondContact O-N 3.28Å; Y59-Q62 PolarHBondContact O-NE2 3.3Å
60	I	94	Very high	94.1	Very high	121 Å²	121	63 Å²	63	62%	0.621	32%	0.32	S	S	*	.	H	α-helix	trans	-71.5	-44.2	178.1	-67.7	169.1	0	0	0	110.8	I56 R57 Q62	I56-I60 HydrophobicContact CG2-CD1 3.66Å; I56-I60 HydrophobicContact CG2-CG1 4.4Å; I56-I60 WeakPolarHBondContact O-CG1 3.32Å; I56-I60 PolarHBondContact O-N 2.85Å; R57-I60 PolarHBondContact O-N 3.4Å; I60-Q62 VanDerWaalsContact C-N 3.33Å
61	L	91.5	Very high	94	Very high	82 Å²	82	61.6 Å²	61.6	43%	0.429	31%	0.312	S	S	.	.	H	α-helix	trans	-82	-11.4	-175	-61.7	176.2	0	0	0	113.8	R57 G63 W64	R57-L61 HydrophobicContact CG-CD1 3.7Å; R57-L61 HydrophobicContact CG-CG 4.43Å; R57-L61 WeakPolarHBondContact O-CB 3.3Å; R57-L61 WeakPolarHBondContact O-CG 3.47Å; R57-L61 PolarHBondContact O-N 2.98Å; L61-G63 PolarHBondContact O-N 3.07Å; L61-W64 HydrophobicContact CB-CE3 4.37Å; L61-W64 HydrophobicContact CB-CZ3 3.8Å; L61-W64 HydrophobicContact CD1-CH2 4.4Å; L61-W64 HydrophobicContact CD1-CZ3 3.92Å; L61-W64 HydrophobicContact CG-CZ3 4.47Å
62	Q	90.8	Very high	94	Very high	103 Å²	103	60.2 Å²	60.2	48%	0.481	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	42	177.8	-65	-73.3	-47.4	0	0	113.1	V58 Y59 I60 Y65	V58-Q62 WeakPolarHBondContact O-CA 3.28Å; V58-Q62 PolarHBondContact O-N 3Å; Y59-Q62 PolarHBondContact O-NE2 3.3Å; I60-Q62 VanDerWaalsContact C-N 3.33Å; Q62-Y65 VanDerWaalsContact CA-OH 3.31Å; Q62-Y65 WeakPolarHBondContact CA-OH 3.31Å; Q62-Y65 WeakPolarHBondContact O-CE2 3.31Å; Q62-Y65 PolarHBondContact O-OH 2.83Å; Q62-Y65 PolarHBondContact OE1-OH 2.92Å
63	G	89.8	Confident	93.9	Very high	1 Å²	1	60.8 Å²	60.8	1%	0.01	30%	0.303	C	S	.	.			trans	-150.3	-175.9	-173.8	0	0	0	0	0	114	L61 Y65	L61-G63 PolarHBondContact O-N 3.07Å; G63-Y65 PolarHBondContact O-N 3Å
64	W	92.6	Very high	93.8	Very high	25 Å²	25	59.7 Å²	59.7	10%	0.095	29%	0.294	C	S	.	.			trans	56	35.8	179.9	-60	-93.7	0	0	0	114.1	L61 I66 V67 T68 T135 F137 N141	L61-W64 HydrophobicContact CB-CE3 4.37Å; L61-W64 HydrophobicContact CB-CZ3 3.8Å; L61-W64 HydrophobicContact CD1-CH2 4.4Å; L61-W64 HydrophobicContact CD1-CZ3 3.92Å; L61-W64 HydrophobicContact CG-CZ3 4.47Å; W64-I66 VanDerWaalsContact C-N 3.29Å; W64-I66 PolarHBondContact O-N 2.81Å; W64-V67 HydrophobicContact CB-CB 4.26Å; W64-V67 HydrophobicContact CB-CG2 4.25Å; W64-V67 PolarHBondContact O-N 3.22Å; W64-T68 PolarHBondContact O-N 3.33Å; W64-T68 PolarHBondContact O-OG1 3.46Å; W64-T68 VanDerWaalsContact O-OG1 3.14Å; W64-T135 HydrophobicContact CB-CG2 4.07Å; W64-T135 HydrophobicContact CG-CG2 4.11Å; W64-T135 WeakPolarHBondContact CZ2-O 3.42Å; W64-F137 PolarHBondContact NE1-O 3.36Å; W64-N141 HydrophobicContact CD2-CB 4.07Å; W64-N141 HydrophobicContact CG-CB 4.31Å; W64-N141 HydrophobicContact CZ2-CB 4.02Å; W64-N141 PolarHBondContact N-OD1 2.91Å
65	Y	93.5	Very high	93.7	Very high	40 Å²	40	62 Å²	62	16%	0.157	30%	0.304	C	S	.	.	H	α-helix	trans	-62.4	-35	179.7	-59.7	-65.4	0	0	0	112.9	Q62 G63 T68 Y69 V144 W146	Q62-Y65 VanDerWaalsContact CA-OH 3.31Å; Q62-Y65 WeakPolarHBondContact CA-OH 3.31Å; Q62-Y65 WeakPolarHBondContact O-CE2 3.31Å; Q62-Y65 PolarHBondContact O-OH 2.83Å; Q62-Y65 PolarHBondContact OE1-OH 2.92Å; G63-Y65 PolarHBondContact O-N 3Å; Y65-T68 PolarHBondContact O-N 3.21Å; Y65-Y69 VanDerWaalsContact O-CB 3.26Å; Y65-Y69 WeakPolarHBondContact O-CB 3.19Å; Y65-Y69 PolarHBondContact O-N 3.26Å; Y65-V144 HydrophobicContact CD2-CG2 4.38Å; Y65-W146 HydrophobicContact CD1-CB 3.49Å; Y65-W146 VanDerWaalsContact CD1-CB 3.49Å; Y65-W146 AromaticContact CD1-CG 4Å; Y65-W146 HydrophobicContact CD1-CG 4Å; Y65-W146 HydrophobicContact CD2-CB 3.81Å; Y65-W146 HydrophobicContact CD2-CG 4.43Å; Y65-W146 HydrophobicContact CE1-CB 3.8Å; Y65-W146 HydrophobicContact CE1-CD2 4.29Å; Y65-W146 AromaticContact CE1-CG 3.77Å; Y65-W146 HydrophobicContact CE1-CG 3.77Å; Y65-W146 HydrophobicContact CE2-CB 4.11Å; Y65-W146 AromaticContact CE2-CD1 3.97Å; Y65-W146 HydrophobicContact CE2-CG 4.24Å; Y65-W146 HydrophobicContact CG-CB 3.49Å; Y65-W146 VanDerWaalsContact CG-CB 3.49Å; Y65-W146 HydrophobicContact CG-CG 4.32Å; Y65-W146 AromaticContact CZ-CD1 3.71Å; Y65-W146 AromaticContact CZ-CG 3.9Å
66	I	93.3	Very high	93.5	Very high	72 Å²	72	57.4 Å²	57.4	37%	0.369	28%	0.282	S	S	.	.	H	α-helix	trans	-64.5	-43	176	-59.1	-176.4	0	0	0	110.8	W64 T68 Y69 A70 V142 V144	W64-I66 VanDerWaalsContact C-N 3.29Å; W64-I66 PolarHBondContact O-N 2.81Å; I66-T68 VanDerWaalsContact C-N 3.33Å; I66-T68 PolarHBondContact O-N 3.33Å; I66-Y69 PolarHBondContact O-N 2.9Å; I66-A70 WeakPolarHBondContact O-CB 3.5Å; I66-A70 PolarHBondContact O-N 3.5Å; I66-V142 HydrophobicContact CD1-CB 3.74Å; I66-V142 HydrophobicContact CD1-CG1 4.35Å; I66-V142 HydrophobicContact CD1-CG2 4.16Å; I66-V144 HydrophobicContact CD1-CG1 3.92Å; I66-V144 HydrophobicContact CG1-CG1 4.15Å; I66-V144 HydrophobicContact CG1-CG2 4.06Å
67	V	94.9	Very high	93.2	Very high	18 Å²	18	57.1 Å²	57.1	11%	0.109	28%	0.282	C	S	.	.	H	α-helix	trans	-62.6	-44.5	177.3	-178.8	0	0	0	0	110.2	W64 Y69 A70 L71 A131 C134 F140	W64-V67 HydrophobicContact CB-CB 4.26Å; W64-V67 HydrophobicContact CB-CG2 4.25Å; W64-V67 PolarHBondContact O-N 3.22Å; V67-Y69 VanDerWaalsContact C-N 3.34Å; V67-Y69 PolarHBondContact O-N 3.34Å; V67-A70 PolarHBondContact O-N 2.81Å; V67-L71 WeakPolarHBondContact O-CB 3.47Å; V67-L71 PolarHBondContact O-N 2.71Å; V67-A131 HydrophobicContact CG1-CB 3.92Å; V67-C134 HydrophobicContact CG1-CB 3.92Å; V67-C134 HydrophobicContact CG2-CB 4.28Å; V67-F140 HydrophobicContact CG2-CB 3.64Å; V67-F140 HydrophobicContact CG2-CG 4.4Å
68	T	94.8	Very high	92.9	Very high	35 Å²	35	54.7 Å²	54.7	22%	0.215	27%	0.273	C	S	.	.	H	α-helix	trans	-62.2	-42	176.3	-56.8	0	0	0	0	112	Y54 W64 Y65 I66 L71 G72	Y54-T68 HydrophobicContact CE1-CG2 4.16Å; Y54-T68 VanDerWaalsContact OH-CA 3.24Å; Y54-T68 WeakPolarHBondContact OH-CA 3.26Å; Y54-T68 PolarHBondContact OH-N 3.23Å; Y54-T68 PolarHBondContact OH-OG1 3Å; W64-T68 PolarHBondContact O-N 3.33Å; W64-T68 PolarHBondContact O-OG1 3.46Å; W64-T68 VanDerWaalsContact O-OG1 3.14Å; Y65-T68 PolarHBondContact O-N 3.21Å; I66-T68 VanDerWaalsContact C-N 3.33Å; I66-T68 PolarHBondContact O-N 3.33Å; T68-L71 WeakPolarHBondContact O-CB 3.45Å; T68-L71 PolarHBondContact O-N 3.12Å; T68-G72 PolarHBondContact O-N 2.99Å
69	Y	94	Very high	92.6	Very high	67 Å²	67	57.5 Å²	57.5	26%	0.263	28%	0.284	S	S	.	.	H	α-helix	trans	-64.2	-45.9	177	179.2	-108.3	0	0	0	112	Y65 I66 V67 L71 G72 I73 L149 F153	Y65-Y69 VanDerWaalsContact O-CB 3.26Å; Y65-Y69 WeakPolarHBondContact O-CB 3.19Å; Y65-Y69 PolarHBondContact O-N 3.26Å; I66-Y69 PolarHBondContact O-N 2.9Å; V67-Y69 VanDerWaalsContact C-N 3.34Å; V67-Y69 PolarHBondContact O-N 3.34Å; Y69-L71 VanDerWaalsContact C-N 3.33Å; Y69-L71 PolarHBondContact O-N 3.46Å; Y69-G72 PolarHBondContact O-N 3.32Å; Y69-I73 HydrophobicContact CD1-CD1 3.91Å; Y69-I73 HydrophobicContact CE1-CD1 3.31Å; Y69-I73 HydrophobicContact CE1-CG1 4.41Å; Y69-I73 HydrophobicContact CE2-CD1 4.05Å; Y69-I73 HydrophobicContact CE2-CG1 4.45Å; Y69-I73 HydrophobicContact CG-CD1 4.5Å; Y69-I73 VanDerWaalsContact CZ-CD1 3.4Å; Y69-I73 PolarHBondContact O-N 3.46Å; Y69-L149 HydrophobicContact CD1-CD2 4.4Å; Y69-L149 HydrophobicContact CD2-CB 4.05Å; Y69-L149 HydrophobicContact CD2-CD2 4.41Å; Y69-L149 HydrophobicContact CE1-CD2 4.47Å; Y69-L149 HydrophobicContact CE2-CB 4.48Å; Y69-L149 HydrophobicContact CE2-CD2 4.49Å; Y69-L149 HydrophobicContact CG-CB 4.49Å; Y69-L149 HydrophobicContact CG-CD2 4.36Å; Y69-F153 HydrophobicContact CD2-CB 4.36Å; Y69-F153 HydrophobicContact CE2-CB 4.08Å
70	A	94.8	Very high	92.2	Very high	55 Å²	55	50.5 Å²	50.5	46%	0.455	26%	0.258	S	S	.	.	H	α-helix	trans	-60.8	-42.7	175	0	0	0	0	0	111.6	I66 V67 G72 I73 Y74	I66-A70 WeakPolarHBondContact O-CB 3.5Å; I66-A70 PolarHBondContact O-N 3.5Å; V67-A70 PolarHBondContact O-N 2.81Å; A70-G72 VanDerWaalsContact C-N 3.32Å; A70-G72 PolarHBondContact O-N 3.46Å; A70-I73 PolarHBondContact O-N 2.97Å; A70-Y74 VanDerWaalsContact O-CB 3.26Å; A70-Y74 WeakPolarHBondContact O-CB 3.37Å; A70-Y74 PolarHBondContact O-N 3.35Å
71	L	95.1	Very high	91.7	Very high	20 Å²	20	45.6 Å²	45.6	11%	0.105	24%	0.236	C	C	.	.	H	α-helix	trans	-60.3	-42.2	174.2	-174.6	66.4	0	0	0	111.5	Y54 V67 T68 Y69 Y74 H75 G127 I128 A131	Y54-L71 HydrophobicContact CD1-CD2 4.15Å; Y54-L71 HydrophobicContact CE1-CD2 3.8Å; Y54-L71 HydrophobicContact CE2-CD2 4.45Å; V67-L71 WeakPolarHBondContact O-CB 3.47Å; V67-L71 PolarHBondContact O-N 2.71Å; T68-L71 WeakPolarHBondContact O-CB 3.45Å; T68-L71 PolarHBondContact O-N 3.12Å; Y69-L71 VanDerWaalsContact C-N 3.33Å; Y69-L71 PolarHBondContact O-N 3.46Å; L71-Y74 WeakPolarHBondContact O-CB 3.4Å; L71-Y74 PolarHBondContact O-N 3.4Å; L71-H75 VanDerWaalsContact CD1-CE1 3.46Å; L71-H75 WeakPolarHBondContact CD1-CE1 3.39Å; L71-H75 PolarHBondContact O-N 3.36Å; L71-H75 PolarHBondContact O-ND1 3.39Å; L71-G127 VanDerWaalsContact CD1-C 3.46Å; L71-G127 WeakPolarHBondContact CD1-O 3.44Å; L71-I128 HydrophobicContact CD1-CG1 4.5Å; L71-I128 HydrophobicContact CD2-CG1 4.44Å; L71-A131 HydrophobicContact CB-CB 4.29Å; L71-A131 HydrophobicContact CD1-CB 3.9Å; L71-A131 HydrophobicContact CD2-CB 3.79Å; L71-A131 HydrophobicContact CG-CB 4.2Å
72	G	94	Very high	91.1	Very high	20 Å²	20	43.7 Å²	43.7	21%	0.206	23%	0.225	C	C	.	.	H	α-helix	trans	-62.7	-49.7	177.1	0	0	0	0	0	112.5	T68 Y69 A70 Y74 H75 L76 F153	T68-G72 PolarHBondContact O-N 2.99Å; Y69-G72 PolarHBondContact O-N 3.32Å; A70-G72 VanDerWaalsContact C-N 3.32Å; A70-G72 PolarHBondContact O-N 3.46Å; G72-Y74 VanDerWaalsContact C-N 3.27Å; G72-Y74 PolarHBondContact O-N 2.78Å; G72-H75 PolarHBondContact O-N 3.48Å; G72-L76 PolarHBondContact O-N 3.27Å; G72-F153 VanDerWaalsContact C-CE2 3.42Å; G72-F153 WeakPolarHBondContact O-CE2 3.27Å
73	I	94.1	Very high	90.4	Very high	60 Å²	60	40 Å²	40	31%	0.308	21%	0.208	S	C	.	.	H	α-helix	trans	-59.8	-41.7	175.5	-70.3	172.6	0	0	0	110.7	Y69 A70 H75 L76 N77 F153 L156	Y69-I73 HydrophobicContact CD1-CD1 3.91Å; Y69-I73 HydrophobicContact CE1-CD1 3.31Å; Y69-I73 HydrophobicContact CE1-CG1 4.41Å; Y69-I73 HydrophobicContact CE2-CD1 4.05Å; Y69-I73 HydrophobicContact CE2-CG1 4.45Å; Y69-I73 HydrophobicContact CG-CD1 4.5Å; Y69-I73 VanDerWaalsContact CZ-CD1 3.4Å; Y69-I73 PolarHBondContact O-N 3.46Å; A70-I73 PolarHBondContact O-N 2.97Å; I73-H75 PolarHBondContact O-N 2.93Å; I73-L76 WeakPolarHBondContact O-CB 3.32Å; I73-L76 PolarHBondContact O-N 3.43Å; I73-N77 PolarHBondContact O-N 3.01Å; I73-F153 HydrophobicContact CG1-CD2 4.43Å; I73-L156 HydrophobicContact CG1-CD2 4.34Å
74	Y	94.7	Very high	89.6	Confident	73 Å²	73	41 Å²	41	29%	0.286	22%	0.215	S	C	.	.	H	α-helix	trans	-60.4	-45.5	177.4	174.8	-107.6	0	0	0	112.1	A70 L71 G72 L76 N77 L78 S123	A70-Y74 VanDerWaalsContact O-CB 3.26Å; A70-Y74 WeakPolarHBondContact O-CB 3.37Å; A70-Y74 PolarHBondContact O-N 3.35Å; L71-Y74 WeakPolarHBondContact O-CB 3.4Å; L71-Y74 PolarHBondContact O-N 3.4Å; G72-Y74 VanDerWaalsContact C-N 3.27Å; G72-Y74 PolarHBondContact O-N 2.78Å; Y74-L76 VanDerWaalsContact C-N 3.35Å; Y74-L76 PolarHBondContact O-N 2.76Å; Y74-N77 PolarHBondContact O-N 2.75Å; Y74-L78 HydrophobicContact CD1-CD1 4Å; Y74-L78 HydrophobicContact CE1-CD1 3.48Å; Y74-L78 VanDerWaalsContact CE1-CD1 3.48Å; Y74-L78 HydrophobicContact CE1-CG 4.27Å; Y74-L78 HydrophobicContact CE2-CD1 4.4Å; Y74-L78 HydrophobicContact CE2-CG 4.36Å; Y74-L78 WeakPolarHBondContact O-CG 3.28Å; Y74-L78 PolarHBondContact O-N 2.94Å; Y74-S123 PolarHBondContact OH-O 2.84Å; Y74-S123 PolarHBondContact OH-OG 3.35Å
75	H	93.6	Very high	88.3	Confident	50 Å²	50	40.9 Å²	40.9	23%	0.231	22%	0.217	C	C	.	.	H	α-helix	trans	-63.2	-40.2	174.4	-79.1	81.2	0	0	0	112.3	L71 G72 I73 N77 L78 F79	L71-H75 VanDerWaalsContact CD1-CE1 3.46Å; L71-H75 WeakPolarHBondContact CD1-CE1 3.39Å; L71-H75 PolarHBondContact O-N 3.36Å; L71-H75 PolarHBondContact O-ND1 3.39Å; G72-H75 PolarHBondContact O-N 3.48Å; I73-H75 PolarHBondContact O-N 2.93Å; H75-N77 VanDerWaalsContact C-N 3.32Å; H75-N77 PolarHBondContact O-N 3.41Å; H75-L78 PolarHBondContact O-N 3.06Å; H75-F79 WeakPolarHBondContact O-CB 3.38Å; H75-F79 PolarHBondContact O-N 3.37Å
76	L	90.7	Very high	86.7	Confident	10 Å²	10	44.4 Å²	44.4	5%	0.052	23%	0.234	C	C	.	.	H	α-helix	trans	-59.7	-44.4	174	177.8	55.6	0	0	0	111	G72 I73 Y74 L78 F79 I80 F153 L156 F157	G72-L76 PolarHBondContact O-N 3.27Å; I73-L76 WeakPolarHBondContact O-CB 3.32Å; I73-L76 PolarHBondContact O-N 3.43Å; Y74-L76 VanDerWaalsContact C-N 3.35Å; Y74-L76 PolarHBondContact O-N 2.76Å; L76-L78 PolarHBondContact O-N 3.1Å; L76-F79 WeakPolarHBondContact O-CB 3.44Å; L76-F79 PolarHBondContact O-N 3.04Å; L76-F79 VanDerWaalsContact O-N 3.17Å; L76-I80 HydrophobicContact CD1-CD1 4.36Å; L76-I80 HydrophobicContact CD1-CG1 4.41Å; L76-I80 HydrophobicContact CG-CD1 4.19Å; L76-I80 VanDerWaalsContact O-CG1 3.27Å; L76-I80 WeakPolarHBondContact O-CG1 3.35Å; L76-I80 PolarHBondContact O-N 2.89Å; L76-F153 HydrophobicContact CB-CE2 4.44Å; L76-F153 HydrophobicContact CD2-CE2 4.5Å; L76-L156 HydrophobicContact CD2-CD2 4.28Å; L76-L156 HydrophobicContact CD2-CG 4.25Å; L76-F157 HydrophobicContact CD1-CD2 3.57Å; L76-F157 HydrophobicContact CD1-CE2 3.96Å; L76-F157 HydrophobicContact CD2-CB 4.39Å; L76-F157 HydrophobicContact CD2-CD2 4.39Å; L76-F157 HydrophobicContact CG-CD2 4.47Å
77	N	90.8	Very high	85	Confident	96 Å²	96	45.7 Å²	45.7	51%	0.513	24%	0.244	S	C	.	.	H	α-helix	trans	-63.1	-42.6	176.8	-173.4	43.9	0	0	0	112.3	I73 Y74 H75 F79 I80 A81	I73-N77 PolarHBondContact O-N 3.01Å; Y74-N77 PolarHBondContact O-N 2.75Å; H75-N77 VanDerWaalsContact C-N 3.32Å; H75-N77 PolarHBondContact O-N 3.41Å; N77-F79 VanDerWaalsContact C-N 3.27Å; N77-F79 PolarHBondContact O-N 3.13Å; N77-I80 PolarHBondContact O-N 2.88Å; N77-A81 WeakPolarHBondContact O-CB 3.42Å; N77-A81 PolarHBondContact O-N 3.37Å
78	L	88.4	Confident	83.4	Confident	13 Å²	13	48.1 Å²	48.1	7%	0.068	26%	0.257	C	S	.	.	H	α-helix	trans	-60.5	-39.6	173.3	-71.8	175.3	0	0	0	111.7	Y74 H75 L76 A81 F82 L115 F120 A124	Y74-L78 HydrophobicContact CD1-CD1 4Å; Y74-L78 HydrophobicContact CE1-CD1 3.48Å; Y74-L78 VanDerWaalsContact CE1-CD1 3.48Å; Y74-L78 HydrophobicContact CE1-CG 4.27Å; Y74-L78 HydrophobicContact CE2-CD1 4.4Å; Y74-L78 HydrophobicContact CE2-CG 4.36Å; Y74-L78 WeakPolarHBondContact O-CG 3.28Å; Y74-L78 PolarHBondContact O-N 2.94Å; H75-L78 PolarHBondContact O-N 3.06Å; L76-L78 PolarHBondContact O-N 3.1Å; L78-A81 PolarHBondContact O-N 3.31Å; L78-F82 WeakPolarHBondContact O-CB 3.3Å; L78-F82 PolarHBondContact O-N 3.49Å; L78-L115 HydrophobicContact CD2-CD2 4.01Å; L78-F120 HydrophobicContact CB-CD2 4.02Å; L78-F120 HydrophobicContact CB-CE2 3.72Å; L78-A124 HydrophobicContact CD1-CB 4.22Å
79	F	86.5	Confident	81.6	Confident	71 Å²	71	47.9 Å²	47.9	31%	0.311	26%	0.256	S	S	.	.	H	α-helix	trans	-67.5	-41.1	179.5	-169.6	-100.2	0	0	0	111.8	H75 L76 N77 F82 L83 M161	H75-F79 WeakPolarHBondContact O-CB 3.38Å; H75-F79 PolarHBondContact O-N 3.37Å; L76-F79 WeakPolarHBondContact O-CB 3.44Å; L76-F79 PolarHBondContact O-N 3.04Å; L76-F79 VanDerWaalsContact O-N 3.17Å; N77-F79 VanDerWaalsContact C-N 3.27Å; N77-F79 PolarHBondContact O-N 3.13Å; F79-F82 WeakPolarHBondContact O-CB 3.4Å; F79-F82 PolarHBondContact O-N 3.47Å; F79-L83 HydrophobicContact CD1-CD1 3.88Å; F79-L83 HydrophobicContact CD1-CG 4.42Å; F79-L83 HydrophobicContact CE1-CD1 3.35Å; F79-L83 HydrophobicContact CE1-CG 4.06Å; F79-L83 HydrophobicContact CZ-CD1 3.96Å; F79-L83 HydrophobicContact CZ-CG 4.34Å; F79-L83 WeakPolarHBondContact O-CG 3.38Å; F79-L83 PolarHBondContact O-N 3.19Å; F79-M161 HydrophobicContact CD1-CE 4.28Å; F79-M161 HydrophobicContact CD1-SD 3.7Å; F79-M161 HydrophobicContact CE1-CE 3.46Å; F79-M161 VanDerWaalsContact CE1-CE 3.46Å; F79-M161 HydrophobicContact CE1-SD 3.5Å; F79-M161 WeakPolarHBondContact CE1-SD 3.48Å; F79-M161 HydrophobicContact CZ-CE 4.31Å
80	I	84.9	Confident	79.8	Confident	28 Å²	28	46.3 Å²	46.3	14%	0.144	25%	0.254	C	S	.	.	H	α-helix	trans	-60.8	-49	171.8	-63.2	158.8	0	0	0	110.1	L76 N77 F82 L83 S84 T160 Q164	L76-I80 HydrophobicContact CD1-CD1 4.36Å; L76-I80 HydrophobicContact CD1-CG1 4.41Å; L76-I80 HydrophobicContact CG-CD1 4.19Å; L76-I80 VanDerWaalsContact O-CG1 3.27Å; L76-I80 WeakPolarHBondContact O-CG1 3.35Å; L76-I80 PolarHBondContact O-N 2.89Å; N77-I80 PolarHBondContact O-N 2.88Å; I80-F82 PolarHBondContact O-N 2.73Å; I80-L83 CarbonylContact O-C 3.58Å; I80-L83 PolarHBondContact O-N 3.36Å; I80-S84 PolarHBondContact O-N 3.14Å; I80-S84 PolarHBondContact O-OG 3.14Å; I80-T160 HydrophobicContact CD1-CG2 3.2Å; I80-T160 HydrophobicContact CG1-CG2 3.76Å; I80-Q164 HydrophobicContact CG1-CG 4.26Å; I80-Q164 HydrophobicContact CG2-CG 4.11Å
81	A	82.1	Confident	78	Confident	19 Å²	19	50.1 Å²	50.1	16%	0.157	26%	0.264	C	S	.	.	H	α-helix	trans	-62.6	-26.4	178.7	0	0	0	0	0	113	N77 L78 R114 L115	N77-A81 WeakPolarHBondContact O-CB 3.42Å; N77-A81 PolarHBondContact O-N 3.37Å; L78-A81 PolarHBondContact O-N 3.31Å; A81-R114 WeakPolarHBondContact O-CB 3.23Å; A81-L115 PolarHBondContact O-N 3.46Å
82	F	80.4	Confident	76.2	Confident	42 Å²	42	52.6 Å²	52.6	18%	0.184	28%	0.278	C	S	.	.	H	α-helix	trans	-73.3	-37.9	172.4	177.8	-100.2	0	0	0	112.4	L78 F79 I80 R113 L115 F120	L78-F82 WeakPolarHBondContact O-CB 3.3Å; L78-F82 PolarHBondContact O-N 3.49Å; F79-F82 WeakPolarHBondContact O-CB 3.4Å; F79-F82 PolarHBondContact O-N 3.47Å; I80-F82 PolarHBondContact O-N 2.73Å; F82-R113 VanDerWaalsContact CZ-NH1 3.33Å; F82-L115 WeakPolarHBondContact CD2-O 3.4Å; F82-F120 HydrophobicContact CB-CD2 3.96Å; F82-F120 HydrophobicContact CB-CE2 4.37Å; F82-F120 HydrophobicContact CD2-CB 4.45Å; F82-F120 HydrophobicContact CD2-CD2 4.49Å; F82-F120 HydrophobicContact CG-CD2 4.41Å
83	L	74.5	Confident	74.4	Confident	26 Å²	26	56.2 Å²	56.2	14%	0.136	29%	0.292	C	S	.	.	H	α-helix	trans	-80.5	-28.2	178.8	-68.7	-178.4	0	0	0	113.7	F79 I80 M161 M168	F79-L83 HydrophobicContact CD1-CD1 3.88Å; F79-L83 HydrophobicContact CD1-CG 4.42Å; F79-L83 HydrophobicContact CE1-CD1 3.35Å; F79-L83 HydrophobicContact CE1-CG 4.06Å; F79-L83 HydrophobicContact CZ-CD1 3.96Å; F79-L83 HydrophobicContact CZ-CG 4.34Å; F79-L83 WeakPolarHBondContact O-CG 3.38Å; F79-L83 PolarHBondContact O-N 3.19Å; I80-L83 CarbonylContact O-C 3.58Å; I80-L83 PolarHBondContact O-N 3.36Å; L83-M161 HydrophobicContact CD1-CE 4.38Å; L83-M161 HydrophobicContact CD1-SD 4.38Å; L83-M168 HydrophobicContact CD2-CE 4.44Å
84	S	73.1	Confident	72.7	Confident	22 Å²	22	61.5 Å²	61.5	15%	0.154	32%	0.316	C	S	.	.	S	Bend	trans	-71.1	139	179.1	-59.2	0	0	0	0	111.4	I80 R114	I80-S84 PolarHBondContact O-N 3.14Å; I80-S84 PolarHBondContact O-OG 3.14Å; S84-R114 WeakPolarHBondContact O-CB 3.43Å; S84-R114 PolarHBondContact O-N 3.38Å; S84-R114 VanDerWaalsContact O-N 3.07Å
85	P	67.3	Low	70.8	Confident	22 Å²	22	65.3 Å²	65.3	14%	0.143	34%	0.341	C	S	.	.	B	Isolated β-bridge	trans	-68.4	155	175.5	29.6	-33.6	0	0	0	111	V87 P89 Y173	P85-V87 VanDerWaalsContact C-N 3.31Å; P85-V87 WeakPolarHBondContact CB-O 3.28Å; P85-V87 PolarHBondContact O-N 2.85Å; P85-P89 HydrophobicContact CG-CG 4.3Å; P85-Y173 HydrophobicContact CG-CD2 4.49Å; P85-Y173 HydrophobicContact CG-CE1 4.46Å; P85-Y173 HydrophobicContact CG-CE2 4.15Å
86	K	59.9	Low	68.8	Low	114 Å²	114	69.1 Å²	69.1	50%	0.496	36%	0.359	S	S	.	.	S	Bend	trans	-62.4	-37.3	175.1	-87.6	-169.8	-172.9	171.6	0	113.4	I112 R113 R114	K86-I112 HydrophobicContact CD-CB 4.34Å; K86-I112 HydrophobicContact CD-CG2 3.56Å; K86-I112 HydrophobicContact CG-CG2 4.23Å; K86-I112 PolarHBondContact N-O 3.33Å; K86-I112 VanDerWaalsContact N-O 3.1Å; K86-R113 VanDerWaalsContact CE-O 3.25Å; K86-R113 WeakPolarHBondContact CE-O 3.31Å; K86-R114 VanDerWaalsContact CG-CA 3.47Å; K86-R114 HydrophobicContact CG-CB 4.21Å; K86-R114 HydrophobicContact CG-CG 4.5Å
87	V	57.3	Low	67.3	Low	98 Å²	98	71 Å²	71	59%	0.594	38%	0.38	S	S	*	.	S	Bend	trans	-113.4	122.7	178.2	-178.8	0	0	0	0	106	P85 P89 L92	P85-V87 VanDerWaalsContact C-N 3.31Å; P85-V87 WeakPolarHBondContact CB-O 3.28Å; P85-V87 PolarHBondContact O-N 2.85Å; V87-P89 VanDerWaalsContact O-CD 3.3Å; V87-P89 WeakPolarHBondContact O-CD 3.42Å; V87-L92 HydrophobicContact CG1-CD1 4.46Å
88	D	60.5	Low	65.4	Low	70 Å²	70	73.3 Å²	73.3	37%	0.374	40%	0.401	S	S	.	.			trans	-72.1	117.5	179.8	-163.8	-27.7	0	0	0	109	S90 M91 H167	D88-S90 PolarHBondContact O-N 3.29Å; D88-S90 PolarHBondContact OD1-N 2.91Å; D88-S90 VanDerWaalsContact OD1-N 3.15Å; D88-S90 PolarHBondContact OD1-OG 2.75Å; D88-S90 PolarHBondContact OD2-OG 2.96Å; D88-M91 HydrophobicContact CB-CG 4.41Å; D88-M91 PolarHBondContact O-N 3.44Å; D88-H167 IonicContact OD1-CE1 3.79Å
89	P	55.9	Low	63.8	Low	29 Å²	29	76.1 Å²	76.1	19%	0.188	43%	0.426	C	S	.	.	G	3₁₀ helix	trans	-60.6	-25.6	-179.4	-22	33.3	0	0	0	113	P85 V87 M91 L92 D93 Y171 Y173	P85-P89 HydrophobicContact CG-CG 4.3Å; V87-P89 VanDerWaalsContact O-CD 3.3Å; V87-P89 WeakPolarHBondContact O-CD 3.42Å; P89-M91 PolarHBondContact O-N 2.96Å; P89-L92 WeakPolarHBondContact O-CB 3.17Å; P89-L92 PolarHBondContact O-N 3Å; P89-D93 PolarHBondContact O-N 3.5Å; P89-Y171 HydrophobicContact CB-CD1 3.79Å; P89-Y171 HydrophobicContact CB-CG 4.18Å; P89-Y173 HydrophobicContact CG-CD1 4.11Å; P89-Y173 HydrophobicContact CG-CE1 4.44Å
90	S	57.8	Low	62.1	Low	34 Å²	34	80 Å²	80	24%	0.238	45%	0.449	C	S	.	.	G	3₁₀ helix	trans	-65.3	-23.1	179.6	60.8	0	0	0	0	113.9	D88 L92	D88-S90 PolarHBondContact O-N 3.29Å; D88-S90 PolarHBondContact OD1-N 2.91Å; D88-S90 VanDerWaalsContact OD1-N 3.15Å; D88-S90 PolarHBondContact OD1-OG 2.75Å; D88-S90 PolarHBondContact OD2-OG 2.96Å; S90-L92 VanDerWaalsContact C-N 3.32Å
91	M	56	Low	60.2	Low	135 Å²	135	84.4 Å²	84.4	67%	0.665	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-81.7	-12.6	175.3	-62.7	-127.6	-82.8	0	0	112.9	D88 P89	D88-M91 HydrophobicContact CB-CG 4.41Å; D88-M91 PolarHBondContact O-N 3.44Å; P89-M91 PolarHBondContact O-N 2.96Å
92	L	58.1	Low	58.6	Low	73 Å²	73	90 Å²	90	38%	0.382	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-33.1	176	-62.1	172	0	0	0	111.1	V87 P89 S90 E94 D95	V87-L92 HydrophobicContact CG1-CD1 4.46Å; P89-L92 WeakPolarHBondContact O-CB 3.17Å; P89-L92 PolarHBondContact O-N 3Å; S90-L92 VanDerWaalsContact C-N 3.32Å; L92-E94 VanDerWaalsContact C-N 3.26Å; L92-E94 PolarHBondContact O-N 2.76Å; L92-D95 PolarHBondContact O-N 3.28Å
93	D	56.2	Low	57.3	Low	96 Å²	96	97.2 Å²	97.2	51%	0.513	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-17.3	178.3	-71.7	-11.8	0	0	0	113.3	P89 Y171	P89-D93 PolarHBondContact O-N 3.5Å; D93-Y171 VanDerWaalsContact OD2-CE1 3.25Å; D93-Y171 WeakPolarHBondContact OD2-CE1 3.46Å
94	E	57	Low	56	Low	170 Å²	170	104.2 Å²	104.2	79%	0.794	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-25.3	176.1	-75.9	-173.2	167.5	0	0	113	L92	L92-E94 VanDerWaalsContact C-N 3.26Å; L92-E94 PolarHBondContact O-N 2.76Å
95	D	56.2	Low	54.8	Low	153 Å²	153	110.3 Å²	110.3	82%	0.818	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	-15.4	178.9	-84.5	-31.9	0	0	0	113.1	L92 G97	L92-D95 PolarHBondContact O-N 3.28Å; D95-G97 PolarHBondContact O-N 3.25Å
96	E	52.1	Low	54	Low	130 Å²	130	116.4 Å²	116.4	61%	0.607	63%	0.633	S	S	*	*	S	Bend	trans	-92.2	86.1	178.1	-140.2	168	-175.8	0	0	109.6
97	G	58.4	Low	53.5	Low	49 Å²	49	117.7 Å²	117.7	51%	0.505	64%	0.641	S	S	.	*			trans	-53.1	173.2	170.2	0	0	0	0	0	112.8	D95 A99	D95-G97 PolarHBondContact O-N 3.25Å; G97-A99 VanDerWaalsContact C-N 3.34Å; G97-A99 PolarHBondContact O-N 3.15Å
98	P	50.2	Low	53	Low	146 Å²	146	119.8 Å²	119.8	95%	0.948	64%	0.642	S	S	*	*	S	Bend	trans	-60.9	89.4	-165.6	27.1	-34.4	0	0	0	111.9
99	A	56.2	Low	52.7	Low	72 Å²	72	123.7 Å²	123.7	60%	0.595	65%	0.651	S	S	*	*			trans	-86.9	134.1	-178.3	0	0	0	0	0	109.5	G97	G97-A99 VanDerWaalsContact C-N 3.34Å; G97-A99 PolarHBondContact O-N 3.15Å
100	L	49.9	Very low	52.5	Low	153 Å²	153	127.2 Å²	127.2	80%	0.801	67%	0.674	S	S	*	*			trans	-55.3	136.3	177.4	-75.4	150.9	0	0	0	110.1	T102	L100-T102 VanDerWaalsContact C-N 3.32Å; L100-T102 PolarHBondContact O-N 2.87Å
101	P	45.7	Very low	52.2	Low	120 Å²	120	128.6 Å²	128.6	78%	0.779	68%	0.676	S	S	*	*			trans	-72.2	84.7	-170.7	30.2	-34.3	0	0	0	110.7	K103	P101-K103 VanDerWaalsContact C-N 3.34Å; P101-K103 PolarHBondContact O-N 3.25Å
102	T	46.8	Very low	52.2	Low	135 Å²	135	127.1 Å²	127.1	83%	0.828	67%	0.67	S	S	*	*			trans	-87.8	79.4	168.2	44.4	0	0	0	0	109.1	L100 Q104	L100-T102 VanDerWaalsContact C-N 3.32Å; L100-T102 PolarHBondContact O-N 2.87Å; T102-Q104 PolarHBondContact O-N 3.39Å
103	K	54.3	Low	52.6	Low	195 Å²	195	128.3 Å²	128.3	85%	0.848	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.5	104.7	161.6	-74.8	176.5	174.4	175.4	0	108.5	P101	P101-K103 VanDerWaalsContact C-N 3.34Å; P101-K103 PolarHBondContact O-N 3.25Å
104	Q	46.9	Very low	52.9	Low	172 Å²	172	131.2 Å²	131.2	80%	0.804	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	177	-0.4	138.3	-102.9	174.2	3	0	0	117.5	T102	T102-Q104 PolarHBondContact O-N 3.39Å
105	N	47.7	Very low	53.5	Low	151 Å²	151	124.7 Å²	124.7	81%	0.807	64%	0.644	S	S	*	*			trans	-128.1	75.1	170	-74.6	-42.8	0	0	0	109.8	E107	N105-E107 PolarHBondContact O-N 2.9Å
106	E	51.4	Low	54.6	Low	149 Å²	149	120.1 Å²	120.1	70%	0.696	62%	0.622	S	S	*	*			trans	-60.7	93.6	157.4	-72.4	-175.2	162.5	0	0	106.2	F108 R172	E106-F108 PolarHBondContact O-N 2.95Å; E106-R172 IonicContact OE1-CZ 3.76Å; E106-R172 IonicContact OE1-NE 2.85Å; E106-R172 IonicContact OE1-NH2 3.01Å; E106-R172 PolarHBondContact OE1-NH2 3.18Å; E106-R172 IonicContact OE2-CZ 3.93Å; E106-R172 IonicContact OE2-NH2 3.74Å; E106-R172 PolarHBondContact OE2-NH2 3.05Å
107	E	48.2	Very low	56.1	Low	142 Å²	142	117.4 Å²	117.4	66%	0.664	61%	0.609	S	S	*	*			trans	-54.4	113	178.2	-172	-178.1	-176.5	0	0	108.1	N105 R109	N105-E107 PolarHBondContact O-N 2.9Å; E107-R109 VanDerWaalsContact C-N 3.28Å; E107-R109 HydrophobicContact CG-CG 4.48Å; E107-R109 PolarHBondContact O-N 2.84Å; E107-R109 IonicContact OE2-CZ 3.68Å; E107-R109 IonicContact OE2-NH2 3.81Å
108	F	46.6	Very low	57.3	Low	141 Å²	141	117.3 Å²	117.3	62%	0.618	60%	0.595	S	S	*	*			trans	-70.5	88.5	-179.5	-162.1	-90.6	0	0	0	108.2	E106 P110 T177	E106-F108 PolarHBondContact O-N 2.95Å; F108-P110 VanDerWaalsContact O-CD 3.25Å; F108-P110 WeakPolarHBondContact O-CD 3.24Å; F108-T177 HydrophobicContact CE1-CG2 3.94Å; F108-T177 HydrophobicContact CZ-CG2 3.77Å
109	R	55.5	Low	58.9	Low	152 Å²	152	116.7 Å²	116.7	57%	0.574	58%	0.578	S	S	*	*			trans	-73.7	113	178.5	-59.3	-164.1	-163.6	-125.7	10.4	108.4	E107 F111	E107-R109 VanDerWaalsContact C-N 3.28Å; E107-R109 HydrophobicContact CG-CG 4.48Å; E107-R109 PolarHBondContact O-N 2.84Å; E107-R109 IonicContact OE2-CZ 3.68Å; E107-R109 IonicContact OE2-NH2 3.81Å; R109-F111 PolarHBondContact O-N 3.14Å
110	P	52	Low	60.4	Low	104 Å²	104	114.4 Å²	114.4	68%	0.675	55%	0.554	S	S	*	*			trans	-61.3	133.6	-179.2	-8.6	19	0	0	0	109.3	F108 I112	F108-P110 VanDerWaalsContact O-CD 3.25Å; F108-P110 WeakPolarHBondContact O-CD 3.24Å; P110-I112 PolarHBondContact O-N 2.81Å
111	F	51.5	Low	62.4	Low	63 Å²	63	108 Å²	108	28%	0.276	52%	0.519	S	S	.	.			trans	-69.8	107.5	179.3	-101.1	-84.7	0	0	0	113.5	R109 Y173 L174	R109-F111 PolarHBondContact O-N 3.14Å; F111-Y173 AromaticContact CE1-CD2 3.31Å; F111-Y173 HydrophobicContact CE1-CD2 3.31Å; F111-Y173 HydrophobicContact CE1-CE2 4.33Å; F111-Y173 AromaticContact CE1-CG 3.82Å; F111-Y173 HydrophobicContact CE1-CG 3.82Å; F111-Y173 VanDerWaalsContact CE2-CB 3.41Å; F111-Y173 HydrophobicContact CE2-CG 4.43Å; F111-Y173 AromaticContact CZ-CD2 3.31Å; F111-Y173 HydrophobicContact CZ-CD2 3.31Å; F111-Y173 AromaticContact CZ-CG 3.52Å; F111-Y173 HydrophobicContact CZ-CG 3.52Å; F111-Y173 WeakPolarHBondContact CZ-O 3.38Å; F111-L174 WeakPolarHBondContact CD2-O 3.36Å; F111-L174 WeakPolarHBondContact CE2-O 3.3Å
112	I	55.7	Low	64.5	Low	104 Å²	104	104.4 Å²	104.4	53%	0.533	49%	0.492	S	S	.	.			trans	-99	99.5	166.1	-46.6	178.9	0	0	0	107.3	K86 P110	K86-I112 HydrophobicContact CD-CB 4.34Å; K86-I112 HydrophobicContact CD-CG2 3.56Å; K86-I112 HydrophobicContact CG-CG2 4.23Å; K86-I112 PolarHBondContact N-O 3.33Å; K86-I112 VanDerWaalsContact N-O 3.1Å; P110-I112 PolarHBondContact O-N 2.81Å
113	R	65.2	Low	66.7	Low	97 Å²	97	99.4 Å²	99.4	37%	0.366	46%	0.462	S	S	.	.	B	Isolated β-bridge	trans	-56.3	138.3	175.6	-58	178.5	-158.4	155.6	4.1	109.8	F82 K86 L115	F82-R113 VanDerWaalsContact CZ-NH1 3.33Å; K86-R113 VanDerWaalsContact CE-O 3.25Å; K86-R113 WeakPolarHBondContact CE-O 3.31Å; R113-L115 VanDerWaalsContact C-N 3.29Å; R113-L115 PolarHBondContact O-N 2.96Å
114	R	62.5	Low	68.5	Low	157 Å²	157	90.2 Å²	90.2	59%	0.592	42%	0.423	S	S	*	.	S	Bend	trans	-61.2	-38.4	-179.5	-172.4	178.3	-179.4	-150	2	112.7	A81 S84 K86	A81-R114 WeakPolarHBondContact O-CB 3.23Å; S84-R114 WeakPolarHBondContact O-CB 3.43Å; S84-R114 PolarHBondContact O-N 3.38Å; S84-R114 VanDerWaalsContact O-N 3.07Å; K86-R114 VanDerWaalsContact CG-CA 3.47Å; K86-R114 HydrophobicContact CG-CB 4.21Å; K86-R114 HydrophobicContact CG-CG 4.5Å
115	L	71.1	Confident	70.8	Confident	34 Å²	34	82.9 Å²	82.9	18%	0.178	39%	0.39	C	S	.	.	S	Bend	trans	-111.2	113.8	174	-155.2	71.2	0	0	0	111.2	L78 A81 F82 R113 K119 F120	L78-L115 HydrophobicContact CD2-CD2 4.01Å; A81-L115 PolarHBondContact O-N 3.46Å; F82-L115 WeakPolarHBondContact CD2-O 3.4Å; R113-L115 VanDerWaalsContact C-N 3.29Å; R113-L115 PolarHBondContact O-N 2.96Å; L115-K119 HydrophobicContact CD1-CB 3.96Å; L115-K119 HydrophobicContact CG-CB 4.11Å; L115-F120 HydrophobicContact CD2-CB 3.82Å; L115-F120 HydrophobicContact CD2-CD2 4.1Å; L115-F120 HydrophobicContact CD2-CG 4.45Å; L115-F120 HydrophobicContact CG-CB 4.38Å
116	P	79.4	Confident	73	Confident	56 Å²	56	80.9 Å²	80.9	36%	0.364	37%	0.374	S	S	.	.			trans	-57.4	145.4	169.3	-22.8	32.8	0	0	0	111.1	F118 K119 F120	P116-F118 PolarHBondContact O-N 3.37Å; P116-F118 VanDerWaalsContact O-N 3.15Å; P116-K119 HydrophobicContact CG-CD 4.48Å; P116-K119 PolarHBondContact O-N 2.87Å; P116-F120 PolarHBondContact O-N 3.29Å
117	E	82.2	Confident	75.1	Confident	73 Å²	73	74.1 Å²	74.1	34%	0.341	35%	0.345	S	S	.	.	H	α-helix	trans	-52	-40.4	-178.9	-175.9	-166.3	142.1	0	0	112.6	S40 W44 K119 F120 W121	S40-E117 PolarHBondContact OG-OE1 3.45Å; W44-E117 HydrophobicContact CZ2-CG 4.17Å; W44-E117 PolarHBondContact NE1-OE1 3.46Å; W44-E117 VanDerWaalsContact NE1-OE1 3.14Å; E117-K119 PolarHBondContact O-N 2.95Å; E117-F120 WeakPolarHBondContact O-CB 3.36Å; E117-F120 PolarHBondContact O-N 3.17Å; E117-W121 WeakPolarHBondContact O-CB 3.48Å; E117-W121 PolarHBondContact O-N 2.9Å
118	F	83.4	Confident	77.4	Confident	47 Å²	47	67.5 Å²	67.5	21%	0.206	31%	0.314	C	S	.	.	H	α-helix	trans	-60.8	-43.8	177.9	-174.3	-96.3	0	0	0	112.4	L33 P116 W121 H122	L33-F118 HydrophobicContact CB-CE1 4.26Å; L33-F118 HydrophobicContact CB-CZ 3.9Å; L33-F118 HydrophobicContact CD2-CE1 4.46Å; L33-F118 HydrophobicContact CD2-CZ 4.06Å; L33-F118 WeakPolarHBondContact O-CZ 3.26Å; P116-F118 PolarHBondContact O-N 3.37Å; P116-F118 VanDerWaalsContact O-N 3.15Å; F118-W121 HydrophobicContact CD2-CE3 4.44Å; F118-W121 HydrophobicContact CE2-CE3 4.26Å; F118-W121 HydrophobicContact CE2-CZ3 4.12Å; F118-W121 HydrophobicContact CZ-CZ3 4.33Å; F118-W121 PolarHBondContact O-N 3.44Å; F118-H122 VanDerWaalsContact O-CB 3.31Å; F118-H122 WeakPolarHBondContact O-CB 3.45Å; F118-H122 PolarHBondContact O-N 2.91Å
119	K	84.1	Confident	79.7	Confident	134 Å²	134	63.8 Å²	63.8	58%	0.583	30%	0.303	S	S	*	.	H	α-helix	trans	-69.5	-37	176.7	-67.4	-166.2	178.3	-177.4	0	111.4	L115 P116 E117 S123	L115-K119 HydrophobicContact CD1-CB 3.96Å; L115-K119 HydrophobicContact CG-CB 4.11Å; P116-K119 HydrophobicContact CG-CD 4.48Å; P116-K119 PolarHBondContact O-N 2.87Å; E117-K119 PolarHBondContact O-N 2.95Å; K119-S123 VanDerWaalsContact O-CB 3.23Å; K119-S123 WeakPolarHBondContact O-CB 3.42Å; K119-S123 PolarHBondContact O-N 2.83Å
120	F	88	Confident	81.7	Confident	23 Å²	23	60.8 Å²	60.8	10%	0.101	30%	0.297	C	S	.	.	H	α-helix	trans	-58	-54.7	173.2	177.8	-84	0	0	0	111	W44 L78 F82 L115 P116 E117 H122 S123 A124	W44-F120 AromaticContact CH2-CD1 3.42Å; W44-F120 HydrophobicContact CH2-CD1 3.42Å; W44-F120 VanDerWaalsContact CH2-CD1 3.42Å; W44-F120 AromaticContact CH2-CE1 3.33Å; W44-F120 HydrophobicContact CH2-CE1 3.33Å; W44-F120 AromaticContact CZ2-CD1 4Å; W44-F120 HydrophobicContact CZ2-CD1 4Å; W44-F120 HydrophobicContact CZ2-CE1 4.33Å; W44-F120 HydrophobicContact CZ3-CD1 4.33Å; W44-F120 AromaticContact CZ3-CE1 3.94Å; W44-F120 HydrophobicContact CZ3-CE1 3.94Å; L78-F120 HydrophobicContact CB-CD2 4.02Å; L78-F120 HydrophobicContact CB-CE2 3.72Å; F82-F120 HydrophobicContact CB-CD2 3.96Å; F82-F120 HydrophobicContact CB-CE2 4.37Å; F82-F120 HydrophobicContact CD2-CB 4.45Å; F82-F120 HydrophobicContact CD2-CD2 4.49Å; F82-F120 HydrophobicContact CG-CD2 4.41Å; L115-F120 HydrophobicContact CD2-CB 3.82Å; L115-F120 HydrophobicContact CD2-CD2 4.1Å; L115-F120 HydrophobicContact CD2-CG 4.45Å; L115-F120 HydrophobicContact CG-CB 4.38Å; P116-F120 PolarHBondContact O-N 3.29Å; E117-F120 WeakPolarHBondContact O-CB 3.36Å; E117-F120 PolarHBondContact O-N 3.17Å; F120-H122 VanDerWaalsContact C-N 3.33Å; F120-H122 PolarHBondContact O-N 3.11Å; F120-S123 PolarHBondContact O-N 2.99Å; F120-A124 HydrophobicContact CE1-CB 4.37Å; F120-A124 WeakPolarHBondContact O-CB 3.49Å; F120-A124 PolarHBondContact O-N 3.36Å
121	W	91.9	Very high	83.7	Confident	19 Å²	19	56.1 Å²	56.1	7%	0.072	27%	0.267	C	S	.	.	H	α-helix	trans	-57.2	-46.9	-179.5	165.5	77.9	0	0	0	111.9	R43 W44 T47 E117 F118 A124 T125	R43-W121 HydrophobicContact CB-CD2 3.93Å; R43-W121 VanDerWaalsContact CB-CE2 3.43Å; R43-W121 HydrophobicContact CB-CG 4.25Å; R43-W121 HydrophobicContact CB-CH2 4.44Å; R43-W121 HydrophobicContact CB-CZ2 3.72Å; R43-W121 HydrophobicContact CG-CD2 4.13Å; R43-W121 HydrophobicContact CG-CE3 4.35Å; R43-W121 HydrophobicContact CG-CH2 3.81Å; R43-W121 HydrophobicContact CG-CZ2 3.56Å; R43-W121 HydrophobicContact CG-CZ3 4.2Å; R43-W121 PolarHBondContact O-NE1 3.03Å; W44-W121 HydrophobicContact CZ2-CB 4.37Å; T47-W121 PolarHBondContact OG1-NE1 3.47Å; E117-W121 WeakPolarHBondContact O-CB 3.48Å; E117-W121 PolarHBondContact O-N 2.9Å; F118-W121 HydrophobicContact CD2-CE3 4.44Å; F118-W121 HydrophobicContact CE2-CE3 4.26Å; F118-W121 HydrophobicContact CE2-CZ3 4.12Å; F118-W121 HydrophobicContact CZ-CZ3 4.33Å; F118-W121 PolarHBondContact O-N 3.44Å; W121-A124 PolarHBondContact O-N 3.13Å; W121-T125 PolarHBondContact NE1-OG1 2.88Å; W121-T125 WeakPolarHBondContact O-CB 3.26Å; W121-T125 PolarHBondContact O-N 3.47Å; W121-T125 PolarHBondContact O-OG1 3.49Å
122	H	90.6	Very high	85.8	Confident	45 Å²	45	54.6 Å²	54.6	21%	0.208	26%	0.261	C	S	.	.	H	α-helix	trans	-63	-45.8	-179.9	-178.7	-97.6	0	0	0	111.8	Y29 L33 F118 F120 T125 K126	Y29-H122 AromaticContact CE1-NE2 3.95Å; Y29-H122 AromaticContact CZ-NE2 3.54Å; Y29-H122 PolarHBondContact OH-CE1 2.88Å; Y29-H122 VanDerWaalsContact OH-CE1 3.23Å; Y29-H122 PolarHBondContact OH-NE2 3.38Å; L33-H122 VanDerWaalsContact CD2-CD2 3.4Å; L33-H122 WeakPolarHBondContact CD2-CD2 3.37Å; F118-H122 VanDerWaalsContact O-CB 3.31Å; F118-H122 WeakPolarHBondContact O-CB 3.45Å; F118-H122 PolarHBondContact O-N 2.91Å; F120-H122 VanDerWaalsContact C-N 3.33Å; F120-H122 PolarHBondContact O-N 3.11Å; H122-T125 PolarHBondContact O-N 3.3Å; H122-K126 WeakPolarHBondContact O-CB 3.43Å; H122-K126 PolarHBondContact O-N 3.11Å
123	S	91.8	Very high	87.7	Confident	29 Å²	29	53.8 Å²	53.8	20%	0.203	26%	0.257	C	S	.	.	H	α-helix	trans	-64.2	-45	179	-144.9	0	0	0	0	111.8	Y74 K119 F120 K126 G127	Y74-S123 PolarHBondContact OH-O 2.84Å; Y74-S123 PolarHBondContact OH-OG 3.35Å; K119-S123 VanDerWaalsContact O-CB 3.23Å; K119-S123 WeakPolarHBondContact O-CB 3.42Å; K119-S123 PolarHBondContact O-N 2.83Å; F120-S123 PolarHBondContact O-N 2.99Å; S123-K126 PolarHBondContact O-N 3.17Å; S123-G127 PolarHBondContact O-N 3.49Å
124	A	93.5	Very high	89.1	Confident	2 Å²	2	50.5 Å²	50.5	2%	0.017	25%	0.249	C	C	.	.	H	α-helix	trans	-60.2	-50	176.2	0	0	0	0	0	111.5	L78 F120 W121 K126 G127 I128	L78-A124 HydrophobicContact CD1-CB 4.22Å; F120-A124 HydrophobicContact CE1-CB 4.37Å; F120-A124 WeakPolarHBondContact O-CB 3.49Å; F120-A124 PolarHBondContact O-N 3.36Å; W121-A124 PolarHBondContact O-N 3.13Å; A124-K126 VanDerWaalsContact C-N 3.35Å; A124-K126 PolarHBondContact O-N 3.47Å; A124-G127 PolarHBondContact O-N 2.9Å; A124-G127 VanDerWaalsContact O-N 3.13Å; A124-I128 WeakPolarHBondContact O-CG1 2.98Å; A124-I128 PolarHBondContact O-N 3.5Å
125	T	94.1	Very high	90.6	Very high	19 Å²	19	43 Å²	43	12%	0.117	22%	0.221	C	C	.	.	H	α-helix	trans	-60.6	-43.9	178.7	-54.5	0	0	0	0	111.4	T47 L50 W121 H122 G127 I128 V129	T47-T125 PolarHBondContact OG1-OG1 3.24Å; L50-T125 HydrophobicContact CD1-CG2 3.94Å; W121-T125 PolarHBondContact NE1-OG1 2.88Å; W121-T125 WeakPolarHBondContact O-CB 3.26Å; W121-T125 PolarHBondContact O-N 3.47Å; W121-T125 PolarHBondContact O-OG1 3.49Å; H122-T125 PolarHBondContact O-N 3.3Å; T125-G127 VanDerWaalsContact C-N 3.32Å; T125-G127 PolarHBondContact O-N 3.3Å; T125-I128 PolarHBondContact O-N 2.95Å; T125-V129 WeakPolarHBondContact O-CG2 3.45Å; T125-V129 PolarHBondContact O-N 3.4Å
126	K	93.9	Very high	91.6	Very high	108 Å²	108	47.6 Å²	47.6	47%	0.47	24%	0.239	S	C	.	.	H	α-helix	trans	-59.6	-43.5	175.4	-165	-173.1	82.8	171.1	0	111.4	H122 S123 A124 I128 V129 I130	H122-K126 WeakPolarHBondContact O-CB 3.43Å; H122-K126 PolarHBondContact O-N 3.11Å; S123-K126 PolarHBondContact O-N 3.17Å; A124-K126 VanDerWaalsContact C-N 3.35Å; A124-K126 PolarHBondContact O-N 3.47Å; K126-I128 PolarHBondContact O-N 2.86Å; K126-V129 PolarHBondContact O-N 3.24Å; K126-I130 HydrophobicContact CD-CD1 4.42Å; K126-I130 HydrophobicContact CG-CD1 4.01Å; K126-I130 VanDerWaalsContact O-CG1 3.3Å; K126-I130 WeakPolarHBondContact O-CG1 3.45Å; K126-I130 PolarHBondContact O-N 2.92Å
127	G	95.9	Very high	92.3	Very high	8 Å²	8	50.4 Å²	50.4	8%	0.082	25%	0.246	C	C	.	.	H	α-helix	trans	-58.6	-45.8	176.4	0	0	0	0	0	112.4	L71 S123 A124 T125 I130 A131	L71-G127 VanDerWaalsContact CD1-C 3.46Å; L71-G127 WeakPolarHBondContact CD1-O 3.44Å; S123-G127 PolarHBondContact O-N 3.49Å; A124-G127 PolarHBondContact O-N 2.9Å; A124-G127 VanDerWaalsContact O-N 3.13Å; T125-G127 VanDerWaalsContact C-N 3.32Å; T125-G127 PolarHBondContact O-N 3.3Å; G127-I130 PolarHBondContact O-N 3.47Å; G127-A131 WeakPolarHBondContact O-CB 3.43Å; G127-A131 PolarHBondContact O-N 3.24Å
128	I	96.3	Very high	92.6	Very high	3 Å²	3	54.7 Å²	54.7	2%	0.015	27%	0.266	C	S	.	.	H	α-helix	trans	-63	-43.9	178.2	-64.1	155.5	0	0	0	111.1	T47 L50 T51 L71 A124 T125 K126 A131 M132	T47-I128 HydrophobicContact CG2-CD1 3.66Å; L50-I128 HydrophobicContact CB-CG2 4.03Å; T51-I128 WeakPolarHBondContact OG1-CD1 3.37Å; L71-I128 HydrophobicContact CD1-CG1 4.5Å; L71-I128 HydrophobicContact CD2-CG1 4.44Å; A124-I128 WeakPolarHBondContact O-CG1 2.98Å; A124-I128 PolarHBondContact O-N 3.5Å; T125-I128 PolarHBondContact O-N 2.95Å; K126-I128 PolarHBondContact O-N 2.86Å; I128-A131 PolarHBondContact O-N 3.39Å; I128-M132 VanDerWaalsContact O-CB 3.3Å; I128-M132 WeakPolarHBondContact O-CB 3.13Å; I128-M132 PolarHBondContact O-N 2.78Å
129	V	96.1	Very high	93	Very high	63 Å²	63	56.7 Å²	56.7	38%	0.382	29%	0.291	S	S	.	.	H	α-helix	trans	-62.8	-44.1	177.9	172.2	0	0	0	0	111.1	L50 T125 K126 M132 I133	L50-V129 HydrophobicContact CD1-CG2 4.38Å; T125-V129 WeakPolarHBondContact O-CG2 3.45Å; T125-V129 PolarHBondContact O-N 3.4Å; K126-V129 PolarHBondContact O-N 3.24Å; V129-M132 WeakPolarHBondContact O-CB 3.35Å; V129-M132 PolarHBondContact O-N 3.5Å; V129-I133 HydrophobicContact CG1-CD1 3.99Å; V129-I133 VanDerWaalsContact O-CG1 3.31Å; V129-I133 WeakPolarHBondContact O-CG1 3.12Å; V129-I133 PolarHBondContact O-N 3.22Å
130	I	95.9	Very high	93.2	Very high	88 Å²	88	55 Å²	55	45%	0.451	28%	0.284	S	S	.	.	H	α-helix	trans	-62.8	-47.3	176.5	-68.2	167.2	0	0	0	110.4	K126 G127 M132 I133 C134	K126-I130 HydrophobicContact CD-CD1 4.42Å; K126-I130 HydrophobicContact CG-CD1 4.01Å; K126-I130 VanDerWaalsContact O-CG1 3.3Å; K126-I130 WeakPolarHBondContact O-CG1 3.45Å; K126-I130 PolarHBondContact O-N 2.92Å; G127-I130 PolarHBondContact O-N 3.47Å; I130-M132 VanDerWaalsContact C-N 3.31Å; I130-M132 PolarHBondContact O-N 3.44Å; I130-I133 PolarHBondContact O-N 3.39Å; I130-I133 VanDerWaalsContact O-N 3.17Å; I130-C134 PolarHBondContact O-N 2.89Å; I130-C134 PolarHBondContact O-SG 2.87Å
131	A	95.5	Very high	93.3	Very high	6 Å²	6	56.9 Å²	56.9	5%	0.05	30%	0.295	C	S	.	.	H	α-helix	trans	-59.9	-43.1	177.6	0	0	0	0	0	111.5	Y54 V67 L71 G127 I128 I133 C134 T135	Y54-A131 HydrophobicContact CD2-CB 4.45Å; Y54-A131 HydrophobicContact CE2-CB 3.76Å; V67-A131 HydrophobicContact CG1-CB 3.92Å; L71-A131 HydrophobicContact CB-CB 4.29Å; L71-A131 HydrophobicContact CD1-CB 3.9Å; L71-A131 HydrophobicContact CD2-CB 3.79Å; L71-A131 HydrophobicContact CG-CB 4.2Å; G127-A131 WeakPolarHBondContact O-CB 3.43Å; G127-A131 PolarHBondContact O-N 3.24Å; I128-A131 PolarHBondContact O-N 3.39Å; A131-I133 VanDerWaalsContact C-N 3.34Å; A131-I133 PolarHBondContact O-N 3.49Å; A131-C134 WeakPolarHBondContact O-CB 3.33Å; A131-C134 PolarHBondContact O-N 2.97Å; A131-C134 VanDerWaalsContact O-N 3.16Å; A131-T135 VanDerWaalsContact O-CG2 3.31Å; A131-T135 WeakPolarHBondContact O-CG2 3.48Å; A131-T135 PolarHBondContact O-N 3.38Å
132	M	95.3	Very high	93.1	Very high	31 Å²	31	59.3 Å²	59.3	15%	0.153	31%	0.312	C	S	.	.	H	α-helix	trans	-56.6	-48.1	174.2	-176.1	66.9	80.7	0	0	111.1	I53 Y54 I128 V129 I130 C134 T135 F136	I53-M132 HydrophobicContact CB-CE 4.38Å; I53-M132 HydrophobicContact CG2-CE 3.84Å; Y54-M132 VanDerWaalsContact CA-CE 3.49Å; Y54-M132 HydrophobicContact CD2-CB 4.38Å; Y54-M132 HydrophobicContact CD2-CE 4.28Å; Y54-M132 HydrophobicContact CD2-SD 4.37Å; I128-M132 VanDerWaalsContact O-CB 3.3Å; I128-M132 WeakPolarHBondContact O-CB 3.13Å; I128-M132 PolarHBondContact O-N 2.78Å; V129-M132 WeakPolarHBondContact O-CB 3.35Å; V129-M132 PolarHBondContact O-N 3.5Å; I130-M132 VanDerWaalsContact C-N 3.31Å; I130-M132 PolarHBondContact O-N 3.44Å; M132-C134 VanDerWaalsContact C-N 3.34Å; M132-C134 PolarHBondContact O-N 3.28Å; M132-T135 PolarHBondContact O-N 3.37Å; M132-T135 VanDerWaalsContact O-N 3.11Å; M132-T135 PolarHBondContact O-OG1 2.89Å; M132-F136 HydrophobicContact CG-CE2 4.2Å; M132-F136 WeakPolarHBondContact O-CD2 3.22Å; M132-F136 WeakPolarHBondContact O-CE2 3.41Å
133	I	95.4	Very high	93	Very high	87 Å²	87	63.1 Å²	63.1	45%	0.446	34%	0.341	S	S	.	.	H	α-helix	trans	-59.8	-44	176	-68.4	165.4	0	0	0	110.9	V129 I130 A131 T135 F136 F137	V129-I133 HydrophobicContact CG1-CD1 3.99Å; V129-I133 VanDerWaalsContact O-CG1 3.31Å; V129-I133 WeakPolarHBondContact O-CG1 3.12Å; V129-I133 PolarHBondContact O-N 3.22Å; I130-I133 PolarHBondContact O-N 3.39Å; I130-I133 VanDerWaalsContact O-N 3.17Å; A131-I133 VanDerWaalsContact C-N 3.34Å; A131-I133 PolarHBondContact O-N 3.49Å; I133-T135 PolarHBondContact O-N 3.07Å; I133-F136 WeakPolarHBondContact O-CB 3.25Å; I133-F136 PolarHBondContact O-N 3.21Å; I133-F137 HydrophobicContact CG2-CE2 3.88Å; I133-F137 VanDerWaalsContact O-CD2 3.32Å; I133-F137 WeakPolarHBondContact O-CD2 3.44Å
134	C	94.6	Very high	92.9	Very high	28 Å²	28	64.2 Å²	64.2	19%	0.189	35%	0.346	C	S	.	.	H	α-helix	trans	-59.7	-30.4	176.6	-67.2	0	0	0	0	112.8	V67 I130 A131 M132 F136 F137 F140	V67-C134 HydrophobicContact CG1-CB 3.92Å; V67-C134 HydrophobicContact CG2-CB 4.28Å; I130-C134 PolarHBondContact O-N 2.89Å; I130-C134 PolarHBondContact O-SG 2.87Å; A131-C134 WeakPolarHBondContact O-CB 3.33Å; A131-C134 PolarHBondContact O-N 2.97Å; A131-C134 VanDerWaalsContact O-N 3.16Å; M132-C134 VanDerWaalsContact C-N 3.34Å; M132-C134 PolarHBondContact O-N 3.28Å; C134-F136 PolarHBondContact O-N 3.23Å; C134-F137 PolarHBondContact O-N 2.93Å; C134-F137 VanDerWaalsContact O-N 3.16Å; C134-F140 HydrophobicContact CB-CD2 4Å; C134-F140 HydrophobicContact CB-CE2 4.33Å
135	T	93.3	Very high	92.7	Very high	1 Å²	1	71.3 Å²	71.3	1%	0.006	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-3.3	175.8	71.9	0	0	0	0	115	Y54 R57 W64 A131 M132 I133	Y54-T135 HydrophobicContact CD2-CG2 4.49Å; Y54-T135 HydrophobicContact CE2-CG2 3.73Å; R57-T135 PolarHBondContact NE-OG1 2.9Å; R57-T135 PolarHBondContact NH2-O 3.27Å; W64-T135 HydrophobicContact CB-CG2 4.07Å; W64-T135 HydrophobicContact CG-CG2 4.11Å; W64-T135 WeakPolarHBondContact CZ2-O 3.42Å; A131-T135 VanDerWaalsContact O-CG2 3.31Å; A131-T135 WeakPolarHBondContact O-CG2 3.48Å; A131-T135 PolarHBondContact O-N 3.38Å; M132-T135 PolarHBondContact O-N 3.37Å; M132-T135 VanDerWaalsContact O-N 3.11Å; M132-T135 PolarHBondContact O-OG1 2.89Å; I133-T135 PolarHBondContact O-N 3.07Å
136	F	92.6	Very high	92.5	Very high	129 Å²	129	76 Å²	76	57%	0.566	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-13.2	170.3	-68.8	-86.5	0	0	0	112.8	M132 I133 C134	M132-F136 HydrophobicContact CG-CE2 4.2Å; M132-F136 WeakPolarHBondContact O-CD2 3.22Å; M132-F136 WeakPolarHBondContact O-CE2 3.41Å; I133-F136 WeakPolarHBondContact O-CB 3.25Å; I133-F136 PolarHBondContact O-N 3.21Å; C134-F136 PolarHBondContact O-N 3.23Å
137	F	93.4	Very high	92.4	Very high	115 Å²	115	72.9 Å²	72.9	50%	0.504	38%	0.383	S	S	.	.			trans	-104.7	125.6	-179.8	-57.9	-83.4	0	0	0	110.3	W64 I133 C134 A139 F140	W64-F137 PolarHBondContact NE1-O 3.36Å; I133-F137 HydrophobicContact CG2-CE2 3.88Å; I133-F137 VanDerWaalsContact O-CD2 3.32Å; I133-F137 WeakPolarHBondContact O-CD2 3.44Å; C134-F137 PolarHBondContact O-N 2.93Å; C134-F137 VanDerWaalsContact O-N 3.16Å; F137-A139 PolarHBondContact O-N 3.41Å; F137-F140 HydrophobicContact CB-CD2 3.89Å; F137-F140 HydrophobicContact CB-CE2 4.06Å; F137-F140 HydrophobicContact CD2-CE2 4.38Å; F137-F140 HydrophobicContact CG-CE2 4.48Å; F137-F140 PolarHBondContact O-N 3.02Å
138	E	89.8	Confident	92.2	Very high	163 Å²	163	76.2 Å²	76.2	76%	0.762	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-68.2	-21.9	178	-66.4	-175.1	169.5	0	0	112.9	F140 N141	E138-F140 PolarHBondContact O-N 2.92Å; E138-F140 VanDerWaalsContact O-N 3.08Å; E138-N141 WeakPolarHBondContact O-CB 3.47Å; E138-N141 PolarHBondContact O-N 3.05Å
139	A	90.6	Very high	92	Very high	89 Å²	89	77.7 Å²	77.7	74%	0.736	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-56.5	-27.6	177.8	0	0	0	0	0	113.7	F137	F137-A139 PolarHBondContact O-N 3.41Å
140	F	89.1	Confident	91.7	Very high	100 Å²	100	77.9 Å²	77.9	44%	0.439	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-93.3	-0.2	177	-55.6	-68.6	0	0	0	113.5	V67 C134 F137 E138 V142	V67-F140 HydrophobicContact CG2-CB 3.64Å; V67-F140 HydrophobicContact CG2-CG 4.4Å; C134-F140 HydrophobicContact CB-CD2 4Å; C134-F140 HydrophobicContact CB-CE2 4.33Å; F137-F140 HydrophobicContact CB-CD2 3.89Å; F137-F140 HydrophobicContact CB-CE2 4.06Å; F137-F140 HydrophobicContact CD2-CE2 4.38Å; F137-F140 HydrophobicContact CG-CE2 4.48Å; F137-F140 PolarHBondContact O-N 3.02Å; E138-F140 PolarHBondContact O-N 2.92Å; E138-F140 VanDerWaalsContact O-N 3.08Å; F140-V142 PolarHBondContact O-N 2.83Å
141	N	90.7	Very high	91.6	Very high	62 Å²	62	79.6 Å²	79.6	33%	0.332	42%	0.415	S	S	.	.			trans	-93.8	77.8	-179.7	-164.9	14.1	0	0	0	110.9	W64 E138	W64-N141 HydrophobicContact CD2-CB 4.07Å; W64-N141 HydrophobicContact CG-CB 4.31Å; W64-N141 HydrophobicContact CZ2-CB 4.02Å; W64-N141 PolarHBondContact N-OD1 2.91Å; E138-N141 WeakPolarHBondContact O-CB 3.47Å; E138-N141 PolarHBondContact O-N 3.05Å
142	V	87.9	Confident	91.5	Very high	70 Å²	70	85.1 Å²	85.1	42%	0.424	44%	0.435	S	S	.	.			trans	-94.4	129.4	177.4	-176.4	0	0	0	0	109.6	I66 F140 V144	I66-V142 HydrophobicContact CD1-CB 3.74Å; I66-V142 HydrophobicContact CD1-CG1 4.35Å; I66-V142 HydrophobicContact CD1-CG2 4.16Å; F140-V142 PolarHBondContact O-N 2.83Å; V142-V144 HydrophobicContact CG1-CG1 4.21Å; V142-V144 PolarHBondContact O-N 3.37Å; V142-V144 VanDerWaalsContact O-N 3.14Å
143	P	88.1	Confident	91.4	Very high	125 Å²	125	86.5 Å²	86.5	81%	0.812	44%	0.44	S	S	*	.			trans	-66.6	114	176.2	27.3	-33.4	0	0	0	109.7
144	V	89.4	Confident	91.3	Very high	51 Å²	51	86.5 Å²	86.5	31%	0.309	44%	0.44	S	S	.	.			trans	-134.4	152.7	179	-65.9	0	0	0	0	109.5	Y65 I66 V142 W146 L149	Y65-V144 HydrophobicContact CD2-CG2 4.38Å; I66-V144 HydrophobicContact CD1-CG1 3.92Å; I66-V144 HydrophobicContact CG1-CG1 4.15Å; I66-V144 HydrophobicContact CG1-CG2 4.06Å; V142-V144 HydrophobicContact CG1-CG1 4.21Å; V142-V144 PolarHBondContact O-N 3.37Å; V142-V144 VanDerWaalsContact O-N 3.14Å; V144-W146 VanDerWaalsContact C-N 3.29Å; V144-W146 PolarHBondContact O-N 2.65Å; V144-L149 HydrophobicContact CG2-CD1 3.71Å
145	F	88.8	Confident	91.2	Very high	151 Å²	151	90 Å²	90	66%	0.662	46%	0.455	S	S	*	.			trans	-72.3	85.6	175.5	-166	-104.6	0	0	0	110	P147 I148	F145-P147 VanDerWaalsContact C-N 3.31Å; F145-P147 HydrophobicContact CD1-CB 4.28Å; F145-P147 HydrophobicContact CD1-CG 4.27Å; F145-P147 HydrophobicContact CE1-CB 3.81Å; F145-P147 HydrophobicContact CE1-CG 3.88Å; F145-P147 HydrophobicContact CE2-CG 4.39Å; F145-P147 HydrophobicContact CZ-CB 4.28Å; F145-P147 HydrophobicContact CZ-CG 3.94Å; F145-I148 HydrophobicContact CB-CG2 4.22Å; F145-I148 HydrophobicContact CD1-CB 3.98Å; F145-I148 HydrophobicContact CD1-CG2 4.11Å; F145-I148 WeakPolarHBondContact O-CG2 3.44Å; F145-I148 PolarHBondContact O-N 3.42Å; F145-I148 VanDerWaalsContact O-N 3.11Å
146	W	89.3	Confident	91.1	Very high	118 Å²	118	93.2 Å²	93.2	45%	0.447	47%	0.472	S	S	.	.	H	α-helix	trans	-56.1	-30.3	-174.1	73	-93.1	0	0	0	115.6	Y65 V144 I148 L149 V150	Y65-W146 HydrophobicContact CD1-CB 3.49Å; Y65-W146 VanDerWaalsContact CD1-CB 3.49Å; Y65-W146 AromaticContact CD1-CG 4Å; Y65-W146 HydrophobicContact CD1-CG 4Å; Y65-W146 HydrophobicContact CD2-CB 3.81Å; Y65-W146 HydrophobicContact CD2-CG 4.43Å; Y65-W146 HydrophobicContact CE1-CB 3.8Å; Y65-W146 HydrophobicContact CE1-CD2 4.29Å; Y65-W146 AromaticContact CE1-CG 3.77Å; Y65-W146 HydrophobicContact CE1-CG 3.77Å; Y65-W146 HydrophobicContact CE2-CB 4.11Å; Y65-W146 AromaticContact CE2-CD1 3.97Å; Y65-W146 HydrophobicContact CE2-CG 4.24Å; Y65-W146 HydrophobicContact CG-CB 3.49Å; Y65-W146 VanDerWaalsContact CG-CB 3.49Å; Y65-W146 HydrophobicContact CG-CG 4.32Å; Y65-W146 AromaticContact CZ-CD1 3.71Å; Y65-W146 AromaticContact CZ-CG 3.9Å; V144-W146 VanDerWaalsContact C-N 3.29Å; V144-W146 PolarHBondContact O-N 2.65Å; W146-I148 VanDerWaalsContact C-N 3.25Å; W146-I148 PolarHBondContact O-N 2.87Å; W146-L149 WeakPolarHBondContact O-CB 3.5Å; W146-L149 PolarHBondContact O-N 3.49Å; W146-L149 VanDerWaalsContact O-N 3.11Å; W146-V150 HydrophobicContact CE3-CG2 3.84Å; W146-V150 HydrophobicContact CZ3-CG2 4.07Å; W146-V150 PolarHBondContact O-N 3.4Å; W146-V150 VanDerWaalsContact O-N 3.13Å
147	P	92.5	Very high	91	Very high	43 Å²	43	90.9 Å²	90.9	28%	0.279	46%	0.462	S	S	.	.	H	α-helix	trans	-61.6	-34.7	177	-23.9	36	0	0	0	112.5	F145 L149 V150 M151	F145-P147 VanDerWaalsContact C-N 3.31Å; F145-P147 HydrophobicContact CD1-CB 4.28Å; F145-P147 HydrophobicContact CD1-CG 4.27Å; F145-P147 HydrophobicContact CE1-CB 3.81Å; F145-P147 HydrophobicContact CE1-CG 3.88Å; F145-P147 HydrophobicContact CE2-CG 4.39Å; F145-P147 HydrophobicContact CZ-CB 4.28Å; F145-P147 HydrophobicContact CZ-CG 3.94Å; P147-L149 VanDerWaalsContact C-N 3.32Å; P147-L149 PolarHBondContact O-N 3.37Å; P147-V150 PolarHBondContact O-N 2.9Å; P147-M151 WeakPolarHBondContact O-CG 3.27Å; P147-M151 PolarHBondContact O-N 2.86Å
148	I	92.8	Very high	90.9	Very high	77 Å²	77	88.8 Å²	88.8	40%	0.395	46%	0.46	S	S	.	.	H	α-helix	trans	-67.1	-36.8	177.6	-163.3	70.6	0	0	0	111.1	F145 W146 V150 M151 Y152	F145-I148 HydrophobicContact CB-CG2 4.22Å; F145-I148 HydrophobicContact CD1-CB 3.98Å; F145-I148 HydrophobicContact CD1-CG2 4.11Å; F145-I148 WeakPolarHBondContact O-CG2 3.44Å; F145-I148 PolarHBondContact O-N 3.42Å; F145-I148 VanDerWaalsContact O-N 3.11Å; W146-I148 VanDerWaalsContact C-N 3.25Å; W146-I148 PolarHBondContact O-N 2.87Å; I148-V150 VanDerWaalsContact C-N 3.34Å; I148-V150 PolarHBondContact O-N 2.92Å; I148-M151 PolarHBondContact O-N 3.06Å; I148-Y152 HydrophobicContact CD1-CE2 4.08Å; I148-Y152 HydrophobicContact CG1-CD2 3.73Å; I148-Y152 HydrophobicContact CG1-CE2 3.34Å; I148-Y152 WeakPolarHBondContact O-CD2 3.21Å; I148-Y152 PolarHBondContact O-N 2.8Å
149	L	91.1	Very high	90.9	Very high	34 Å²	34	85.9 Å²	85.9	18%	0.178	45%	0.449	C	S	.	.	H	α-helix	trans	-64.6	-40.6	177.5	-65.3	178	0	0	0	111.4	Y69 V144 W146 P147 Y152 F153	Y69-L149 HydrophobicContact CD1-CD2 4.4Å; Y69-L149 HydrophobicContact CD2-CB 4.05Å; Y69-L149 HydrophobicContact CD2-CD2 4.41Å; Y69-L149 HydrophobicContact CE1-CD2 4.47Å; Y69-L149 HydrophobicContact CE2-CB 4.48Å; Y69-L149 HydrophobicContact CE2-CD2 4.49Å; Y69-L149 HydrophobicContact CG-CB 4.49Å; Y69-L149 HydrophobicContact CG-CD2 4.36Å; V144-L149 HydrophobicContact CG2-CD1 3.71Å; W146-L149 WeakPolarHBondContact O-CB 3.5Å; W146-L149 PolarHBondContact O-N 3.49Å; W146-L149 VanDerWaalsContact O-N 3.11Å; P147-L149 VanDerWaalsContact C-N 3.32Å; P147-L149 PolarHBondContact O-N 3.37Å; L149-Y152 PolarHBondContact O-N 3.3Å; L149-F153 WeakPolarHBondContact O-CB 3.12Å; L149-F153 PolarHBondContact O-N 3.2Å
150	V	90.5	Very high	90.8	Very high	67 Å²	67	82.8 Å²	82.8	41%	0.406	42%	0.421	S	S	.	.	H	α-helix	trans	-63.5	-45.1	175.5	175.7	0	0	0	0	110.6	W146 P147 I148 Y152 F153 I154	W146-V150 HydrophobicContact CE3-CG2 3.84Å; W146-V150 HydrophobicContact CZ3-CG2 4.07Å; W146-V150 PolarHBondContact O-N 3.4Å; W146-V150 VanDerWaalsContact O-N 3.13Å; P147-V150 PolarHBondContact O-N 2.9Å; I148-V150 VanDerWaalsContact C-N 3.34Å; I148-V150 PolarHBondContact O-N 2.92Å; V150-Y152 PolarHBondContact O-N 3.1Å; V150-F153 PolarHBondContact O-N 3.2Å; V150-I154 HydrophobicContact CG1-CD1 3.81Å; V150-I154 HydrophobicContact CG1-CG1 4.39Å; V150-I154 WeakPolarHBondContact O-CG1 3.37Å; V150-I154 PolarHBondContact O-N 2.89Å
151	M	93.4	Very high	90.7	Very high	124 Å²	124	79.5 Å²	79.5	61%	0.611	41%	0.408	S	S	*	.	H	α-helix	trans	-61.2	-44.9	176.8	-70.7	-62.1	-69.5	0	0	112.1	P147 I148 F153 I154 M155	P147-M151 WeakPolarHBondContact O-CG 3.27Å; P147-M151 PolarHBondContact O-N 2.86Å; I148-M151 PolarHBondContact O-N 3.06Å; M151-F153 VanDerWaalsContact C-N 3.33Å; M151-F153 PolarHBondContact O-N 2.86Å; M151-I154 PolarHBondContact O-N 3.48Å; M151-M155 WeakPolarHBondContact O-CB 3.23Å; M151-M155 PolarHBondContact O-N 3.32Å
152	Y	92.6	Very high	90.5	Very high	123 Å²	123	84.3 Å²	84.3	48%	0.482	43%	0.426	S	S	.	.	H	α-helix	trans	-60.1	-43.7	173.9	-81	-60.4	0	0	0	111.9	I148 L149 V150 M155 L156	I148-Y152 HydrophobicContact CD1-CE2 4.08Å; I148-Y152 HydrophobicContact CG1-CD2 3.73Å; I148-Y152 HydrophobicContact CG1-CE2 3.34Å; I148-Y152 WeakPolarHBondContact O-CD2 3.21Å; I148-Y152 PolarHBondContact O-N 2.8Å; L149-Y152 PolarHBondContact O-N 3.3Å; V150-Y152 PolarHBondContact O-N 3.1Å; Y152-M155 HydrophobicContact CD1-CE 3.86Å; Y152-M155 HydrophobicContact CE1-CE 4.26Å; Y152-M155 PolarHBondContact O-N 3Å; Y152-L156 WeakPolarHBondContact O-CB 3.15Å; Y152-L156 PolarHBondContact O-N 3.42Å
153	F	93.1	Very high	90.3	Very high	59 Å²	59	90.3 Å²	90.3	26%	0.259	44%	0.44	S	S	.	.	H	α-helix	trans	-62	-46.9	178.6	-178.9	-99.9	0	0	0	111.6	Y69 G72 I73 L76 L149 V150 M151 M155 L156 F157	Y69-F153 HydrophobicContact CD2-CB 4.36Å; Y69-F153 HydrophobicContact CE2-CB 4.08Å; G72-F153 VanDerWaalsContact C-CE2 3.42Å; G72-F153 WeakPolarHBondContact O-CE2 3.27Å; I73-F153 HydrophobicContact CG1-CD2 4.43Å; L76-F153 HydrophobicContact CB-CE2 4.44Å; L76-F153 HydrophobicContact CD2-CE2 4.5Å; L149-F153 WeakPolarHBondContact O-CB 3.12Å; L149-F153 PolarHBondContact O-N 3.2Å; V150-F153 PolarHBondContact O-N 3.2Å; M151-F153 VanDerWaalsContact C-N 3.33Å; M151-F153 PolarHBondContact O-N 2.86Å; F153-M155 PolarHBondContact O-N 2.87Å; F153-L156 PolarHBondContact O-N 3.27Å; F153-F157 HydrophobicContact CZ-CD2 4.43Å; F153-F157 WeakPolarHBondContact O-CB 3.22Å; F153-F157 PolarHBondContact O-N 2.88Å
154	I	93	Very high	90	Very high	88 Å²	88	85.9 Å²	85.9	45%	0.451	41%	0.409	S	S	.	.	H	α-helix	trans	-61.7	-46.7	178.4	-68	168.6	0	0	0	110.5	V150 M151 F157 C158	V150-I154 HydrophobicContact CG1-CD1 3.81Å; V150-I154 HydrophobicContact CG1-CG1 4.39Å; V150-I154 WeakPolarHBondContact O-CG1 3.37Å; V150-I154 PolarHBondContact O-N 2.89Å; M151-I154 PolarHBondContact O-N 3.48Å; I154-F157 PolarHBondContact O-N 3.49Å; I154-C158 WeakPolarHBondContact O-CB 3.45Å; I154-C158 PolarHBondContact O-N 3.44Å; I154-C158 PolarHBondContact O-SG 2.96Å
155	M	93.3	Very high	89.7	Confident	101 Å²	101	87.7 Å²	87.7	50%	0.498	42%	0.416	S	S	.	.	H	α-helix	trans	-60.7	-49	178.1	-177.7	179.8	64.1	0	0	111.4	M151 Y152 F153 F157 C158 I159	M151-M155 WeakPolarHBondContact O-CB 3.23Å; M151-M155 PolarHBondContact O-N 3.32Å; Y152-M155 HydrophobicContact CD1-CE 3.86Å; Y152-M155 HydrophobicContact CE1-CE 4.26Å; Y152-M155 PolarHBondContact O-N 3Å; F153-M155 PolarHBondContact O-N 2.87Å; M155-F157 PolarHBondContact O-N 2.83Å; M155-C158 PolarHBondContact O-N 3.03Å; M155-I159 HydrophobicContact CG-CD1 3.74Å; M155-I159 HydrophobicContact CG-CG1 4.49Å; M155-I159 WeakPolarHBondContact O-CB 3.48Å; M155-I159 VanDerWaalsContact O-CG1 3.28Å; M155-I159 WeakPolarHBondContact O-CG1 3.28Å; M155-I159 PolarHBondContact O-N 3.44Å
156	L	90.9	Very high	89.4	Confident	68 Å²	68	88.2 Å²	88.2	36%	0.356	42%	0.418	S	S	.	.	H	α-helix	trans	-60.8	-44.7	177.7	-179	70.3	0	0	0	111.2	I73 L76 Y152 F153 T160	I73-L156 HydrophobicContact CG1-CD2 4.34Å; L76-L156 HydrophobicContact CD2-CD2 4.28Å; L76-L156 HydrophobicContact CD2-CG 4.25Å; Y152-L156 WeakPolarHBondContact O-CB 3.15Å; Y152-L156 PolarHBondContact O-N 3.42Å; F153-L156 PolarHBondContact O-N 3.27Å; L156-T160 WeakPolarHBondContact O-CB 2.95Å; L156-T160 PolarHBondContact O-N 3.22Å; L156-T160 PolarHBondContact O-OG1 2.95Å
157	F	90.8	Very high	88.9	Confident	80 Å²	80	85 Å²	85	35%	0.351	41%	0.408	S	S	.	.	H	α-helix	trans	-58.2	-53	177.5	179	-91.6	0	0	0	110.5	L76 F153 I154 M155 T160 M161	L76-F157 HydrophobicContact CD1-CD2 3.57Å; L76-F157 HydrophobicContact CD1-CE2 3.96Å; L76-F157 HydrophobicContact CD2-CB 4.39Å; L76-F157 HydrophobicContact CD2-CD2 4.39Å; L76-F157 HydrophobicContact CG-CD2 4.47Å; F153-F157 HydrophobicContact CZ-CD2 4.43Å; F153-F157 WeakPolarHBondContact O-CB 3.22Å; F153-F157 PolarHBondContact O-N 2.88Å; I154-F157 PolarHBondContact O-N 3.49Å; M155-F157 PolarHBondContact O-N 2.83Å; F157-T160 PolarHBondContact O-N 3.15Å; F157-M161 HydrophobicContact CD1-CG 4.2Å; F157-M161 HydrophobicContact CD2-CG 4.36Å; F157-M161 HydrophobicContact CE1-CG 3.89Å; F157-M161 HydrophobicContact CE2-CG 4.04Å; F157-M161 HydrophobicContact CG-CG 4.42Å; F157-M161 HydrophobicContact CZ-CG 3.79Å; F157-M161 WeakPolarHBondContact O-CB 3.31Å; F157-M161 VanDerWaalsContact O-CG 3.23Å; F157-M161 WeakPolarHBondContact O-CG 3.27Å; F157-M161 PolarHBondContact O-N 2.72Å
158	C	91.1	Very high	88.1	Confident	71 Å²	71	84 Å²	84	48%	0.48	40%	0.4	S	S	.	.	H	α-helix	trans	-62	-46.7	-179.6	-72.4	0	0	0	0	112.4	I154 M155 K162	I154-C158 WeakPolarHBondContact O-CB 3.45Å; I154-C158 PolarHBondContact O-N 3.44Å; I154-C158 PolarHBondContact O-SG 2.96Å; M155-C158 PolarHBondContact O-N 3.03Å; C158-K162 WeakPolarHBondContact O-CB 3.41Å; C158-K162 PolarHBondContact O-N 2.93Å
159	I	90.8	Very high	87.3	Confident	102 Å²	102	85.3 Å²	85.3	52%	0.523	41%	0.411	S	S	.	.	H	α-helix	trans	-61.8	-47.3	178	-70.3	171.5	0	0	0	110.3	M155 K162 R163	M155-I159 HydrophobicContact CG-CD1 3.74Å; M155-I159 HydrophobicContact CG-CG1 4.49Å; M155-I159 WeakPolarHBondContact O-CB 3.48Å; M155-I159 VanDerWaalsContact O-CG1 3.28Å; M155-I159 WeakPolarHBondContact O-CG1 3.28Å; M155-I159 PolarHBondContact O-N 3.44Å; I159-K162 PolarHBondContact O-N 3.02Å; I159-R163 WeakPolarHBondContact O-CB 3.22Å; I159-R163 PolarHBondContact O-N 2.83Å
160	T	88.6	Confident	86.5	Confident	25 Å²	25	90.7 Å²	90.7	15%	0.153	43%	0.433	C	S	.	.	H	α-helix	trans	-64.1	-48	-178.3	-56.8	0	0	0	0	111	I80 L156 F157 K162 R163 Q164	I80-T160 HydrophobicContact CD1-CG2 3.2Å; I80-T160 HydrophobicContact CG1-CG2 3.76Å; L156-T160 WeakPolarHBondContact O-CB 2.95Å; L156-T160 PolarHBondContact O-N 3.22Å; L156-T160 PolarHBondContact O-OG1 2.95Å; F157-T160 PolarHBondContact O-N 3.15Å; T160-K162 PolarHBondContact O-N 3.42Å; T160-R163 PolarHBondContact O-N 2.98Å; T160-Q164 HydrophobicContact CG2-CG 4.44Å; T160-Q164 VanDerWaalsContact O-CG 3.31Å; T160-Q164 WeakPolarHBondContact O-CG 3.42Å; T160-Q164 PolarHBondContact O-N 3.23Å
161	M	86	Confident	85.4	Confident	31 Å²	31	90 Å²	90	15%	0.153	42%	0.424	C	S	.	.	H	α-helix	trans	-61.4	-44.4	177.3	-76.5	-61.9	-71.9	0	0	112.4	F79 L83 F157 R163 Q164 I165	F79-M161 HydrophobicContact CD1-CE 4.28Å; F79-M161 HydrophobicContact CD1-SD 3.7Å; F79-M161 HydrophobicContact CE1-CE 3.46Å; F79-M161 VanDerWaalsContact CE1-CE 3.46Å; F79-M161 HydrophobicContact CE1-SD 3.5Å; F79-M161 WeakPolarHBondContact CE1-SD 3.48Å; F79-M161 HydrophobicContact CZ-CE 4.31Å; L83-M161 HydrophobicContact CD1-CE 4.38Å; L83-M161 HydrophobicContact CD1-SD 4.38Å; F157-M161 HydrophobicContact CD1-CG 4.2Å; F157-M161 HydrophobicContact CD2-CG 4.36Å; F157-M161 HydrophobicContact CE1-CG 3.89Å; F157-M161 HydrophobicContact CE2-CG 4.04Å; F157-M161 HydrophobicContact CG-CG 4.42Å; F157-M161 HydrophobicContact CZ-CG 3.79Å; F157-M161 WeakPolarHBondContact O-CB 3.31Å; F157-M161 VanDerWaalsContact O-CG 3.23Å; F157-M161 WeakPolarHBondContact O-CG 3.27Å; F157-M161 PolarHBondContact O-N 2.72Å; M161-R163 VanDerWaalsContact C-N 3.32Å; M161-R163 PolarHBondContact O-N 3.06Å; M161-Q164 PolarHBondContact O-N 3.38Å; M161-I165 WeakPolarHBondContact O-CB 3.18Å; M161-I165 VanDerWaalsContact O-CG1 3.27Å; M161-I165 WeakPolarHBondContact O-CG1 3.48Å; M161-I165 PolarHBondContact O-N 3.1Å
162	K	85.8	Confident	84	Confident	163 Å²	163	92.2 Å²	92.2	71%	0.709	43%	0.425	S	S	*	.	H	α-helix	trans	-59.7	-43.2	175.5	-177	179.1	-179.7	179	0	111.5	C158 I159 T160 K166	C158-K162 WeakPolarHBondContact O-CB 3.41Å; C158-K162 PolarHBondContact O-N 2.93Å; I159-K162 PolarHBondContact O-N 3.02Å; T160-K162 PolarHBondContact O-N 3.42Å; K162-K166 WeakPolarHBondContact O-CB 3.25Å; K162-K166 PolarHBondContact O-N 2.9Å
163	R	83.8	Confident	82.6	Confident	195 Å²	195	87 Å²	87	74%	0.736	40%	0.404	S	S	*	.	H	α-helix	trans	-63.7	-45.2	176.5	-176.1	177.5	178.3	176.9	0.1	111.4	I159 T160 M161 K166 H167	I159-R163 WeakPolarHBondContact O-CB 3.22Å; I159-R163 PolarHBondContact O-N 2.83Å; T160-R163 PolarHBondContact O-N 2.98Å; M161-R163 VanDerWaalsContact C-N 3.32Å; M161-R163 PolarHBondContact O-N 3.06Å; R163-K166 PolarHBondContact O-N 3.24Å; R163-H167 PolarHBondContact O-N 3.4Å
164	Q	82.6	Confident	80.8	Confident	33 Å²	33	89.4 Å²	89.4	15%	0.154	42%	0.42	C	S	.	.	H	α-helix	trans	-62.2	-48.6	177.9	-67.4	-52.7	-34.9	0	0	111.3	I80 T160 M161 K166 H167 M168	I80-Q164 HydrophobicContact CG1-CG 4.26Å; I80-Q164 HydrophobicContact CG2-CG 4.11Å; T160-Q164 HydrophobicContact CG2-CG 4.44Å; T160-Q164 VanDerWaalsContact O-CG 3.31Å; T160-Q164 WeakPolarHBondContact O-CG 3.42Å; T160-Q164 PolarHBondContact O-N 3.23Å; M161-Q164 PolarHBondContact O-N 3.38Å; Q164-K166 VanDerWaalsContact C-N 3.35Å; Q164-K166 PolarHBondContact O-N 2.91Å; Q164-H167 WeakPolarHBondContact O-CB 3.29Å; Q164-H167 PolarHBondContact O-N 3.14Å; Q164-H167 VanDerWaalsContact O-N 3.14Å; Q164-M168 VanDerWaalsContact O-CG 3.22Å; Q164-M168 WeakPolarHBondContact O-CG 3.32Å; Q164-M168 PolarHBondContact O-N 2.95Å
165	I	82.9	Confident	78.8	Confident	88 Å²	88	87.3 Å²	87.3	45%	0.451	41%	0.412	S	S	.	.	H	α-helix	trans	-61.5	-41.9	177.7	-65.6	165.5	0	0	0	111.2	M161 H167 M168 V169	M161-I165 WeakPolarHBondContact O-CB 3.18Å; M161-I165 VanDerWaalsContact O-CG1 3.27Å; M161-I165 WeakPolarHBondContact O-CG1 3.48Å; M161-I165 PolarHBondContact O-N 3.1Å; I165-H167 VanDerWaalsContact C-N 3.31Å; I165-H167 PolarHBondContact O-N 3.16Å; I165-M168 WeakPolarHBondContact O-CB 3.41Å; I165-M168 PolarHBondContact O-N 3.06Å; I165-V169 HydrophobicContact CG2-CG2 4.3Å; I165-V169 VanDerWaalsContact O-CG2 3.32Å; I165-V169 WeakPolarHBondContact O-CG2 3.3Å; I165-V169 PolarHBondContact O-N 3.21Å
166	K	82.2	Confident	76.9	Confident	162 Å²	162	89.8 Å²	89.8	70%	0.704	42%	0.42	S	S	*	.	H	α-helix	trans	-61	-39.9	176.1	-173	178	-177.1	-179.5	0	111.9	K162 R163 Q164 K170	K162-K166 WeakPolarHBondContact O-CB 3.25Å; K162-K166 PolarHBondContact O-N 2.9Å; R163-K166 PolarHBondContact O-N 3.24Å; Q164-K166 VanDerWaalsContact C-N 3.35Å; Q164-K166 PolarHBondContact O-N 2.91Å; K166-K170 WeakPolarHBondContact O-CB 3.35Å; K166-K170 PolarHBondContact O-N 2.94Å
167	H	79.3	Confident	74.9	Confident	52 Å²	52	90.2 Å²	90.2	24%	0.241	43%	0.426	C	S	.	.	H	α-helix	trans	-64.2	-46.9	175	-162.1	-113.2	0	0	0	111	D88 R163 Q164 I165 V169 K170 Y171 Y173	D88-H167 IonicContact OD1-CE1 3.79Å; R163-H167 PolarHBondContact O-N 3.4Å; Q164-H167 WeakPolarHBondContact O-CB 3.29Å; Q164-H167 PolarHBondContact O-N 3.14Å; Q164-H167 VanDerWaalsContact O-N 3.14Å; I165-H167 VanDerWaalsContact C-N 3.31Å; I165-H167 PolarHBondContact O-N 3.16Å; H167-V169 VanDerWaalsContact C-N 3.32Å; H167-V169 PolarHBondContact O-N 3.02Å; H167-K170 PolarHBondContact O-N 3.4Å; H167-Y171 AromaticContact CD2-CD2 3.49Å; H167-Y171 VanDerWaalsContact CD2-CD2 3.49Å; H167-Y171 WeakPolarHBondContact CD2-CD2 3.41Å; H167-Y171 AromaticContact CD2-CE2 3.29Å; H167-Y171 WeakPolarHBondContact CD2-CE2 3.49Å; H167-Y171 AromaticContact CE1-CD2 3.69Å; H167-Y171 AromaticContact CE1-CE2 3.85Å; H167-Y171 AromaticContact CG-CD2 3.89Å; H167-Y171 AromaticContact NE2-CD2 3.36Å; H167-Y171 WeakPolarHBondContact NE2-CD2 3.49Å; H167-Y171 AromaticContact NE2-CE2 3.07Å; H167-Y171 WeakPolarHBondContact NE2-CE2 3.07Å; H167-Y171 AromaticContact NE2-CZ 3.93Å; H167-Y171 WeakPolarHBondContact O-CD2 3.49Å; H167-Y171 PolarHBondContact O-N 3.4Å; H167-Y173 AromaticContact ND1-CE1 3.53Å; H167-Y173 AromaticContact ND1-CZ 3.58Å; H167-Y173 PolarHBondContact ND1-OH 3.33Å
168	M	75.8	Confident	72.7	Confident	22 Å²	22	95 Å²	95	11%	0.108	45%	0.449	C	S	.	.	H	α-helix	trans	-55.4	-46.2	176.6	-68.7	173.7	82.7	0	0	112.1	L83 Q164 I165 R172 Y173 P175	L83-M168 HydrophobicContact CD2-CE 4.44Å; Q164-M168 VanDerWaalsContact O-CG 3.22Å; Q164-M168 WeakPolarHBondContact O-CG 3.32Å; Q164-M168 PolarHBondContact O-N 2.95Å; I165-M168 WeakPolarHBondContact O-CB 3.41Å; I165-M168 PolarHBondContact O-N 3.06Å; M168-R172 WeakPolarHBondContact O-CA 3.33Å; M168-R172 PolarHBondContact O-N 3.27Å; M168-Y173 HydrophobicContact CB-CD2 4.25Å; M168-Y173 HydrophobicContact CB-CE2 4.01Å; M168-Y173 HydrophobicContact CE-CD2 4.48Å; M168-Y173 HydrophobicContact CE-CE2 4.42Å; M168-Y173 HydrophobicContact CG-CD2 3.84Å; M168-Y173 HydrophobicContact CG-CE1 4.48Å; M168-Y173 HydrophobicContact CG-CE2 3.25Å; M168-Y173 WeakPolarHBondContact CG-OH 3.33Å; M168-Y173 PolarHBondContact N-OH 3.34Å; M168-Y173 PolarHBondContact O-N 2.83Å; M168-P175 HydrophobicContact CE-CG 3.86Å
169	V	75.8	Confident	70.7	Confident	104 Å²	104	94.2 Å²	94.2	63%	0.63	45%	0.453	S	S	*	.	H	α-helix	trans	-68.6	-42.4	178.6	174	0	0	0	0	111.5	I165 H167 R172	I165-V169 HydrophobicContact CG2-CG2 4.3Å; I165-V169 VanDerWaalsContact O-CG2 3.32Å; I165-V169 WeakPolarHBondContact O-CG2 3.3Å; I165-V169 PolarHBondContact O-N 3.21Å; H167-V169 VanDerWaalsContact C-N 3.32Å; H167-V169 PolarHBondContact O-N 3.02Å; V169-R172 PolarHBondContact O-N 3.19Å
170	K	74.8	Confident	68.5	Low	147 Å²	147	97.9 Å²	97.9	64%	0.639	47%	0.465	S	S	*	.	H	α-helix	trans	-61.6	-46.9	179.8	-178.8	179.6	175.2	-161.9	0	111.9	K166 H167 R172	K166-K170 WeakPolarHBondContact O-CB 3.35Å; K166-K170 PolarHBondContact O-N 2.94Å; H167-K170 PolarHBondContact O-N 3.4Å; K170-R172 VanDerWaalsContact C-N 3.28Å; K170-R172 PolarHBondContact O-N 2.98Å
171	Y	67.1	Low	66.7	Low	53 Å²	53	106.8 Å²	106.8	21%	0.208	50%	0.495	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	16.1	-177.5	-66	-85	0	0	0	112.5	P89 D93 H167 Y173	P89-Y171 HydrophobicContact CB-CD1 3.79Å; P89-Y171 HydrophobicContact CB-CG 4.18Å; D93-Y171 VanDerWaalsContact OD2-CE1 3.25Å; D93-Y171 WeakPolarHBondContact OD2-CE1 3.46Å; H167-Y171 AromaticContact CD2-CD2 3.49Å; H167-Y171 VanDerWaalsContact CD2-CD2 3.49Å; H167-Y171 WeakPolarHBondContact CD2-CD2 3.41Å; H167-Y171 AromaticContact CD2-CE2 3.29Å; H167-Y171 WeakPolarHBondContact CD2-CE2 3.49Å; H167-Y171 AromaticContact CE1-CD2 3.69Å; H167-Y171 AromaticContact CE1-CE2 3.85Å; H167-Y171 AromaticContact CG-CD2 3.89Å; H167-Y171 AromaticContact NE2-CD2 3.36Å; H167-Y171 WeakPolarHBondContact NE2-CD2 3.49Å; H167-Y171 AromaticContact NE2-CE2 3.07Å; H167-Y171 WeakPolarHBondContact NE2-CE2 3.07Å; H167-Y171 AromaticContact NE2-CZ 3.93Å; H167-Y171 WeakPolarHBondContact O-CD2 3.49Å; H167-Y171 PolarHBondContact O-N 3.4Å; Y171-Y173 PolarHBondContact O-N 2.9Å
172	R	64.2	Low	64.6	Low	169 Å²	169	111.4 Å²	111.4	64%	0.638	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	47	34.4	172.7	-72	-100.2	-95.5	175.2	-5.1	114.1	E106 M168 V169 K170	E106-R172 IonicContact OE1-CZ 3.76Å; E106-R172 IonicContact OE1-NE 2.85Å; E106-R172 IonicContact OE1-NH2 3.01Å; E106-R172 PolarHBondContact OE1-NH2 3.18Å; E106-R172 IonicContact OE2-CZ 3.93Å; E106-R172 IonicContact OE2-NH2 3.74Å; E106-R172 PolarHBondContact OE2-NH2 3.05Å; M168-R172 WeakPolarHBondContact O-CA 3.33Å; M168-R172 PolarHBondContact O-N 3.27Å; V169-R172 PolarHBondContact O-N 3.19Å; K170-R172 VanDerWaalsContact C-N 3.28Å; K170-R172 PolarHBondContact O-N 2.98Å
173	Y	63.3	Low	62.9	Low	13 Å²	13	114.3 Å²	114.3	5%	0.051	53%	0.534	C	S	.	.			trans	-98.4	109.3	174.7	76.6	-104.5	0	0	0	106	P85 P89 F111 H167 M168 Y171	P85-Y173 HydrophobicContact CG-CD2 4.49Å; P85-Y173 HydrophobicContact CG-CE1 4.46Å; P85-Y173 HydrophobicContact CG-CE2 4.15Å; P89-Y173 HydrophobicContact CG-CD1 4.11Å; P89-Y173 HydrophobicContact CG-CE1 4.44Å; F111-Y173 AromaticContact CE1-CD2 3.31Å; F111-Y173 HydrophobicContact CE1-CD2 3.31Å; F111-Y173 HydrophobicContact CE1-CE2 4.33Å; F111-Y173 AromaticContact CE1-CG 3.82Å; F111-Y173 HydrophobicContact CE1-CG 3.82Å; F111-Y173 VanDerWaalsContact CE2-CB 3.41Å; F111-Y173 HydrophobicContact CE2-CG 4.43Å; F111-Y173 AromaticContact CZ-CD2 3.31Å; F111-Y173 HydrophobicContact CZ-CD2 3.31Å; F111-Y173 AromaticContact CZ-CG 3.52Å; F111-Y173 HydrophobicContact CZ-CG 3.52Å; F111-Y173 WeakPolarHBondContact CZ-O 3.38Å; H167-Y173 AromaticContact ND1-CE1 3.53Å; H167-Y173 AromaticContact ND1-CZ 3.58Å; H167-Y173 PolarHBondContact ND1-OH 3.33Å; M168-Y173 HydrophobicContact CB-CD2 4.25Å; M168-Y173 HydrophobicContact CB-CE2 4.01Å; M168-Y173 HydrophobicContact CE-CD2 4.48Å; M168-Y173 HydrophobicContact CE-CE2 4.42Å; M168-Y173 HydrophobicContact CG-CD2 3.84Å; M168-Y173 HydrophobicContact CG-CE1 4.48Å; M168-Y173 HydrophobicContact CG-CE2 3.25Å; M168-Y173 WeakPolarHBondContact CG-OH 3.33Å; M168-Y173 PolarHBondContact N-OH 3.34Å; M168-Y173 PolarHBondContact O-N 2.83Å; Y171-Y173 PolarHBondContact O-N 2.9Å
174	L	55.2	Low	60.9	Low	110 Å²	110	115.5 Å²	115.5	58%	0.576	54%	0.538	S	S	*	.			trans	-104.5	130	163	-73.4	112.6	0	0	0	114.8	F111 F176	F111-L174 WeakPolarHBondContact CD2-O 3.36Å; F111-L174 WeakPolarHBondContact CE2-O 3.3Å; L174-F176 PolarHBondContact O-N 3.06Å
175	P	51.8	Low	59	Low	45 Å²	45	116.7 Å²	116.7	29%	0.292	56%	0.56	S	S	.	*	S	Bend	trans	-69.2	-13.4	175.7	29.1	-35.7	0	0	0	113.4	M168	M168-P175 HydrophobicContact CE-CG 3.86Å
176	F	52	Low	57.2	Low	152 Å²	152	122.4 Å²	122.4	67%	0.667	58%	0.581	S	S	*	*	S	Bend	trans	-108.5	116.5	173.2	-94.2	-92.3	0	0	0	109.1	L174 H178	L174-F176 PolarHBondContact O-N 3.06Å; F176-H178 PolarHBondContact O-N 3.49Å
177	T	48.8	Very low	55.5	Low	78 Å²	78	122 Å²	122	48%	0.479	58%	0.582	S	S	.	*			trans	-71.9	74.7	172.3	59.3	0	0	0	0	109.5	F108 G179	F108-T177 HydrophobicContact CE1-CG2 3.94Å; F108-T177 HydrophobicContact CZ-CG2 3.77Å; T177-G179 PolarHBondContact O-N 3.01Å
178	H	44.6	Very low	54.1	Low	181 Å²	181	128.6 Å²	128.6	84%	0.838	61%	0.613	S	S	*	*			trans	-76	103.6	166.3	-100.7	-72.9	0	0	0	108.2	F176	F176-H178 PolarHBondContact O-N 3.49Å
179	G	49.8	Very low	52.6	Low	54 Å²	54	133.7 Å²	133.7	56%	0.557	65%	0.645	S	S	*	*			trans	106.1	69.9	180	0	0	0	0	0	112.9	T177 R181	T177-G179 PolarHBondContact O-N 3.01Å; G179-R181 PolarHBondContact O-N 2.85Å; G179-R181 VanDerWaalsContact O-N 3.16Å
180	K	43.4	Very low	51.2	Low	179 Å²	179	132.2 Å²	132.2	78%	0.778	65%	0.651	S	S	*	*			trans	-61	116.6	157	-72	-173.7	-179.9	-176.3	0	107	T182	K180-T182 PolarHBondContact O-N 3.39Å; K180-T182 VanDerWaalsContact O-N 3.1Å
181	R	51.8	Low	49.8	Very low	211 Å²	211	134.1 Å²	134.1	80%	0.796	66%	0.659	S	S	*	*			trans	-66.2	107.8	161.4	-76.1	-174	178.4	178.4	1.4	106.6	G179 Y183	G179-R181 PolarHBondContact O-N 2.85Å; G179-R181 VanDerWaalsContact O-N 3.16Å; R181-Y183 PolarHBondContact O-N 3.37Å
182	T	42.3	Very low	48.8	Very low	129 Å²	129	137.1 Å²	137.1	79%	0.791	69%	0.685	S	S	*	*			trans	-55.3	111.5	162.8	-66.9	0	0	0	0	106.9	K180 R184	K180-T182 PolarHBondContact O-N 3.39Å; K180-T182 VanDerWaalsContact O-N 3.1Å; T182-R184 PolarHBondContact O-N 3.37Å
183	Y	49.7	Very low	48.1	Very low	224 Å²	224	139.3 Å²	139.3	88%	0.878	70%	0.7	S	S	*	*			trans	-62.3	104.6	165.1	-80	-90.7	0	0	0	106.2	R181 G185	R181-Y183 PolarHBondContact O-N 3.37Å; Y183-G185 PolarHBondContact O-N 3.27Å
184	R	42.4	Very low	47.4	Very low	220 Å²	220	143.3 Å²	143.3	83%	0.83	74%	0.735	S	S	*	*			trans	-63.7	108.2	168.5	-153.8	178.9	-178.5	-178.6	-1.3	105	T182 K186	T182-R184 PolarHBondContact O-N 3.37Å; R184-K186 PolarHBondContact O-N 3.23Å
185	G	42.7	Very low	46.9	Very low	58 Å²	58	147.6 Å²	147.6	60%	0.598	78%	0.775	S	S	*	*			trans	-49.9	132.9	176.2	0	0	0	0	0	108.5	Y183 E187	Y183-G185 PolarHBondContact O-N 3.27Å; G185-E187 PolarHBondContact O-N 3.3Å
186	K	45.1	Very low	46.6	Very low	208 Å²	208	152.8 Å²	152.8	90%	0.904	80%	0.799	S	S	*	*			trans	-53.5	106.7	167.5	-114.4	177	173.6	178.9	0	106	R184 E188	R184-K186 PolarHBondContact O-N 3.23Å; K186-E188 PolarHBondContact O-N 2.99Å
187	E	45.6	Very low	46.3	Very low	153 Å²	153	152.8 Å²	152.8	72%	0.715	81%	0.806	S	S	*	*			trans	-58.6	121.4	169.5	-77.4	175.3	-177.2	0	0	107.1	G185 T189	G185-E187 PolarHBondContact O-N 3.3Å; E187-T189 PolarHBondContact O-N 3.2Å
188	E	50.3	Low	46.2	Very low	191 Å²	191	156.9 Å²	156.9	89%	0.893	82%	0.824	S	S	*	*			trans	-53.9	106.3	171	-61.6	-169.8	163	0	0	108.9	K186	K186-E188 PolarHBondContact O-N 2.99Å
189	T	44.9	Very low	46.3	Very low	128 Å²	128	155.5 Å²	155.5	79%	0.785	82%	0.823	S	S	*	*			trans	-122.4	50.2	164.2	33.9	0	0	0	0	109.1	E187 K191	E187-T189 PolarHBondContact O-N 3.2Å; T189-K191 VanDerWaalsContact C-N 3.31Å; T189-K191 PolarHBondContact O-N 2.77Å
190	G	45.1	Very low	46.1	Very low	73 Å²	73	161.9 Å²	161.9	75%	0.753	84%	0.84	S	S	*	*			trans	-75.9	87.9	152.3	0	0	0	0	0	108.1	P192	G190-P192 VanDerWaalsContact O-CD 3.3Å; G190-P192 WeakPolarHBondContact O-CD 3.25Å
191	K	46.4	Very low	46.2	Very low	187 Å²	187	160.7 Å²	160.7	81%	0.813	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-69.5	116	158.8	-80.5	-178.9	175.7	176.9	0	106.7	T189	T189-K191 VanDerWaalsContact C-N 3.31Å; T189-K191 PolarHBondContact O-N 2.77Å
192	P	45.4	Very low	45.8	Very low	116 Å²	116	157.1 Å²	157.1	75%	0.753	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-71.9	131.6	164.7	20.2	-9.8	0	0	0	107.5	G190 A194	G190-P192 VanDerWaalsContact O-CD 3.3Å; G190-P192 WeakPolarHBondContact O-CD 3.25Å; P192-A194 PolarHBondContact O-N 2.66Å
193	F	49.2	Very low	46.1	Very low	215 Å²	215	159.3 Å²	159.3	94%	0.943	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-55.5	122.5	164.2	-73.9	-95.8	0	0	0	108.2
194	A	50	Low	45.8	Very low	97 Å²	97	153.9 Å²	153.9	80%	0.802	85%	0.85	S	S	*	*			trans	-113.2	132.7	165	0	0	0	0	0	107.8	P192	P192-A194 PolarHBondContact O-N 2.66Å
195	S	42.7	Very low	46.1	Very low	201 Å²	201	147.9 Å²	147.9	100%	1.406	85%	0.851	S	S	*	*			trans	-56.3	0	-173.8	-58.6	0	0	0	0	115.9

Retrieved 195 of 195 residues in 520.1 ms (Link to these results)

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