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Autophagy-related protein 9

Phospholipid scramblase involved in autophagy by mediating autophagosomal membrane expansion. Cycles between the preautophagosomal structure/phagophore assembly site (PAS) and the cytoplasmic vesicle pool and supplies membrane for the growing autophagosome. Lipid scramblase activity plays a key role in preautophagosomal structure/phagophore assembly by distributing the phospholipids that arrive through ATG2 (ATG2A or ATG2B) from the cytoplasmic to the luminal leaflet of the bilayer, thereby driving autophagosomal membrane expansion. Also required to supply phosphatidylinositol 4-phosphate to the autophagosome initiation site by recruiting the phosphatidylinositol 4-kinase beta (PI4KB) in a process dependent on ARFIP2, but not ARFIP1. In addition to autophagy, also plays a role in necrotic cell death. Phospholipid scramblase involved in autophagy. Cycles between the preautophagosomal structure/phagophore assembly site (PAS) and the cytoplasmic vesicle pool and supplies membrane for the growing autophagosome. Lipid scramblase activity plays a key role in preautophagosomal structure/phagophore assembly by distributing the phospholipids that arrive through ATG2 from the cytoplasmic to the luminal leaflet of the bilayer, thereby driving autophagosomal membrane expansion.

AlphaFold DB , UniProt , Accession A0A087WQ26, Species MOUSE (Mus musculus, Mouse), Gene Atg9a, Length 176 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43.7	Very low	44.1	Very low	256 Å²	256	179.3 Å²	179.3	100%	1.261	87%	0.87	S	S	*	*				0	110.4	0	-99.1	174.5	169	0	0	108.3
2	A	42.1	Very low	43.9	Very low	105 Å²	105	179.7 Å²	179.7	87%	0.868	87%	0.869	S	S	*	*			trans	-153.8	105.7	156.4	0	0	0	0	0	105.5
3	Q	43	Very low	43.8	Very low	160 Å²	160	173.2 Å²	173.2	75%	0.748	86%	0.862	S	S	*	*			trans	-86	136.1	177	-179	170.6	-36	0	0	107.5	D5	Q3-D5 PolarHBondContact NE2-OD2 3.3Å
4	F	43.7	Very low	43.3	Very low	194 Å²	194	168.9 Å²	168.9	85%	0.851	86%	0.858	S	S	*	*			trans	-133.9	94.9	164.1	-113.7	-90.7	0	0	0	107.2
5	D	46.7	Very low	43.2	Very low	124 Å²	124	172.9 Å²	172.9	66%	0.663	86%	0.86	S	S	*	*			trans	-75.5	126.3	161.7	-74.1	-54.7	0	0	0	107.7	Q3	Q3-D5 PolarHBondContact NE2-OD2 3.3Å
6	T	49.9	Very low	42.9	Very low	118 Å²	118	169.1 Å²	169.1	72%	0.724	86%	0.856	S	S	*	*			trans	-131.6	95.3	163.7	1.3	0	0	0	0	109.2
7	E	41.9	Very low	42.8	Very low	189 Å²	189	168.3 Å²	168.3	88%	0.883	85%	0.854	S	S	*	*			trans	-54.7	124.3	171.3	-166.9	172.6	121.3	0	0	110.6	Q9	E7-Q9 PolarHBondContact O-N 2.75Å
8	Y	41.7	Very low	42.6	Very low	233 Å²	233	164.7 Å²	164.7	91%	0.914	85%	0.847	S	S	*	*			trans	-74.6	115.3	175.4	-90	-93.3	0	0	0	110
9	Q	45.1	Very low	42.3	Very low	185 Å²	185	162.1 Å²	162.1	86%	0.864	84%	0.842	S	S	*	*			trans	-73.2	129.9	-176.1	-158.2	159.1	-18.9	0	0	111.7	E7 L11	E7-Q9 PolarHBondContact O-N 2.75Å; Q9-L11 PolarHBondContact O-N 3.14Å
10	R	43.1	Very low	42.5	Very low	236 Å²	236	160.9 Å²	160.9	89%	0.891	85%	0.845	S	S	*	*			trans	-72.3	120.9	178	-170.4	-178.2	179.3	111.4	-1.1	109.6	E12	R10-E12 PolarHBondContact O-N 2.93Å
11	L	44.1	Very low	42.2	Very low	172 Å²	172	156 Å²	156	90%	0.901	83%	0.833	S	S	*	*			trans	-65.5	114.3	174.8	-92.2	145.4	0	0	0	110	Q9	Q9-L11 PolarHBondContact O-N 3.14Å
12	E	42.2	Very low	42.1	Very low	184 Å²	184	153.5 Å²	153.5	86%	0.86	82%	0.818	S	S	*	*			trans	-69	133.4	171.7	-64.5	-143.6	141.8	0	0	110.6	R10 S14	R10-E12 PolarHBondContact O-N 2.93Å; E12-S14 PolarHBondContact O-N 3.3Å; E12-S14 VanDerWaalsContact O-N 3.14Å
13	A	42.6	Very low	42	Very low	95 Å²	95	157.1 Å²	157.1	79%	0.785	82%	0.817	S	S	*	*			trans	-70.4	104.2	175.2	0	0	0	0	0	109.4	Y15	A13-Y15 PolarHBondContact O-N 3.25Å
14	S	36.3	Very low	42	Very low	114 Å²	114	155.6 Å²	155.6	80%	0.797	81%	0.814	S	S	*	*			trans	-77.1	103.7	167.7	-172.9	0	0	0	0	108.9	E12 S16	E12-S14 PolarHBondContact O-N 3.3Å; E12-S14 VanDerWaalsContact O-N 3.14Å; S14-S16 PolarHBondContact O-N 2.69Å
15	Y	42.2	Very low	42	Very low	228 Å²	228	153.3 Å²	153.3	89%	0.894	81%	0.81	S	S	*	*			trans	-62.4	113.4	163.3	-112.8	-99.2	0	0	0	108.3	A13	A13-Y15 PolarHBondContact O-N 3.25Å
16	S	38.7	Very low	41.9	Very low	113 Å²	113	153.7 Å²	153.7	79%	0.79	81%	0.811	S	S	*	*			trans	-114.6	107.6	166.3	-160.8	0	0	0	0	108.7	S14	S14-S16 PolarHBondContact O-N 2.69Å
17	D	41	Very low	41.7	Very low	155 Å²	155	152.9 Å²	152.9	83%	0.829	81%	0.806	S	S	*	*			trans	-77.9	127.7	175	-171.9	19.9	0	0	0	109.9
18	S	38.9	Very low	41.5	Very low	103 Å²	103	152.2 Å²	152.2	72%	0.72	80%	0.802	S	S	*	*			trans	-171.6	156	171	-84.4	0	0	0	0	111.4
19	P	36.8	Very low	41.7	Very low	115 Å²	115	146.6 Å²	146.6	75%	0.747	79%	0.792	S	S	*	*				-90.1	172.5	-123.7	36	-40	0	0	0	116.5	G21	P19-G21 PolarHBondContact O-N 2.71Å
20	P	46.4	Very low	41.8	Very low	139 Å²	139	141.3 Å²	141.3	90%	0.903	78%	0.78	S	S	*	*			trans	-81.3	111.8	-174.5	33.1	-30.7	0	0	0	110.3
21	G	37.1	Very low	41.8	Very low	58 Å²	58	138.6 Å²	138.6	60%	0.598	78%	0.778	S	S	*	*			trans	-151.8	113.6	171.5	0	0	0	0	0	107.8	P19 E23	P19-G21 PolarHBondContact O-N 2.71Å; G21-E23 PolarHBondContact O-N 2.72Å
22	E	41.3	Very low	42.1	Very low	203 Å²	203	133.8 Å²	133.8	95%	0.949	77%	0.769	S	S	*	*			trans	-33.7	94.7	177.4	-64.9	168.8	157.1	0	0	114.2
23	E	40.3	Very low	41.9	Very low	182 Å²	182	129.6 Å²	129.6	85%	0.85	76%	0.76	S	S	*	*			trans	-100.6	89.7	156.2	-57.1	-170.6	-142.6	0	0	105.4	G21 L25	G21-E23 PolarHBondContact O-N 2.72Å; E23-L25 PolarHBondContact O-N 2.97Å
24	D	42.6	Very low	42.2	Very low	127 Å²	127	134.9 Å²	134.9	68%	0.679	77%	0.766	S	S	*	*			trans	-52	93	161.3	-170.2	27.2	0	0	0	106.4	L26	D24-L26 PolarHBondContact O-N 2.8Å; D24-L26 WeakPolarHBondContact OD2-CD2 3.37Å; D24-L26 WeakPolarHBondContact OD2-CG 3.43Å
25	L	42.4	Very low	42.8	Very low	146 Å²	146	131.7 Å²	131.7	76%	0.764	74%	0.743	S	S	*	*			trans	-67	77.1	170.4	-170.2	93.1	0	0	0	104.9	E23 V27	E23-L25 PolarHBondContact O-N 2.97Å; L25-V27 HydrophobicContact CD2-CG2 3.56Å; L25-V27 HydrophobicContact CG-CG2 3.98Å; L25-V27 PolarHBondContact O-N 2.78Å
26	L	45.6	Very low	43.4	Very low	133 Å²	133	126 Å²	126	70%	0.696	73%	0.734	S	S	*	*			trans	-63.9	75.7	161.8	-70.4	169	0	0	0	105.6	D24 H28	D24-L26 PolarHBondContact O-N 2.8Å; D24-L26 WeakPolarHBondContact OD2-CD2 3.37Å; D24-L26 WeakPolarHBondContact OD2-CG 3.43Å; L26-H28 PolarHBondContact O-N 3.49Å
27	V	45.1	Very low	43.9	Very low	100 Å²	100	125.8 Å²	125.8	61%	0.606	72%	0.716	S	S	*	*			trans	-52.2	98.7	149.3	174.5	0	0	0	0	102.8	L25 V29	L25-V27 HydrophobicContact CD2-CG2 3.56Å; L25-V27 HydrophobicContact CG-CG2 3.98Å; L25-V27 PolarHBondContact O-N 2.78Å; V27-V29 HydrophobicContact CG1-CG2 4.2Å; V27-V29 PolarHBondContact O-N 2.8Å
28	H	38.4	Very low	44.3	Very low	175 Å²	175	126.9 Å²	126.9	81%	0.81	72%	0.716	S	S	*	*			trans	-62.4	85.7	165.9	-149.5	65	0	0	0	104	L26 A30	L26-H28 PolarHBondContact O-N 3.49Å; H28-A30 PolarHBondContact O-N 3.23Å
29	V	46.7	Very low	44.8	Very low	115 Å²	115	128.7 Å²	128.7	70%	0.697	71%	0.712	S	S	*	*			trans	-55.8	97.4	154.9	173.8	0	0	0	0	101.2	V27 E31	V27-V29 HydrophobicContact CG1-CG2 4.2Å; V27-V29 PolarHBondContact O-N 2.8Å; V29-E31 VanDerWaalsContact C-N 3.27Å; V29-E31 PolarHBondContact O-N 3Å
30	A	47	Very low	45.6	Very low	75 Å²	75	125.5 Å²	125.5	62%	0.62	69%	0.689	S	S	*	*			trans	-48.9	109.7	167.8	0	0	0	0	0	103.4	H28 G32	H28-A30 PolarHBondContact O-N 3.23Å; A30-G32 PolarHBondContact O-N 2.63Å
31	E	42.5	Very low	46	Very low	179 Å²	179	126 Å²	126	84%	0.836	68%	0.679	S	S	*	*			trans	-42.7	123.4	173.8	-85.3	-177.9	128.5	0	0	104.7	V29 S33	V29-E31 VanDerWaalsContact C-N 3.27Å; V29-E31 PolarHBondContact O-N 3Å; E31-S33 PolarHBondContact O-N 3.32Å
32	G	49.3	Very low	47	Very low	70 Å²	70	128.1 Å²	128.1	72%	0.722	68%	0.677	S	S	*	*			trans	-60.6	77	176.1	0	0	0	0	0	108	A30 K34	A30-G32 PolarHBondContact O-N 2.63Å; G32-K34 VanDerWaalsContact C-N 3.34Å; G32-K34 PolarHBondContact O-N 2.59Å
33	S	39.7	Very low	47.7	Very low	96 Å²	96	122.3 Å²	122.3	67%	0.671	65%	0.652	S	S	*	*			trans	-55.8	113.6	154.7	70.4	0	0	0	0	102.2	E31 S35	E31-S33 PolarHBondContact O-N 3.32Å; S33-S35 PolarHBondContact O-N 3.25Å
34	K	49.1	Very low	48.5	Very low	207 Å²	207	120.3 Å²	120.3	90%	0.9	65%	0.647	S	S	*	*			trans	-62	76.1	171.5	-66.1	172.2	-179.5	172.5	0	105.8	G32 P36	G32-K34 VanDerWaalsContact C-N 3.34Å; G32-K34 PolarHBondContact O-N 2.59Å; K34-P36 WeakPolarHBondContact O-CD 3.36Å
35	S	47.4	Very low	49.1	Very low	47 Å²	47	118.4 Å²	118.4	33%	0.329	64%	0.636	S	S	.	*			trans	-70.1	123.6	171.5	66.7	0	0	0	0	103.7	S33 W37 H38	S33-S35 PolarHBondContact O-N 3.25Å; S35-W37 PolarHBondContact O-N 3.39Å; S35-H38 PolarHBondContact O-N 2.81Å
36	P	55.1	Low	49.7	Very low	107 Å²	107	112.5 Å²	112.5	70%	0.695	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.5	-7.8	175.3	-25.7	34.6	0	0	0	113.5	K34	K34-P36 WeakPolarHBondContact O-CD 3.36Å
37	W	50.2	Low	50.3	Low	110 Å²	110	110.8 Å²	110.8	42%	0.417	59%	0.592	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100	-7.2	-164.5	-48.7	108.9	0	0	0	113.5	S35 H39 I40 F163	S35-W37 PolarHBondContact O-N 3.39Å; W37-H39 PolarHBondContact O-N 2.76Å; W37-I40 HydrophobicContact CB-CD1 4.01Å; W37-I40 HydrophobicContact CD2-CD1 4.48Å; W37-I40 HydrophobicContact CE3-CD1 3.69Å; W37-I40 HydrophobicContact CE3-CG1 4.32Å; W37-I40 WeakPolarHBondContact O-CG1 3.44Å; W37-F163 AromaticContact CE3-CD2 3.95Å; W37-F163 HydrophobicContact CE3-CD2 3.95Å; W37-F163 HydrophobicContact CZ3-CB 4.38Å; W37-F163 AromaticContact CZ3-CD2 3.92Å; W37-F163 HydrophobicContact CZ3-CD2 3.92Å
38	H	48.6	Very low	51	Low	178 Å²	178	109.8 Å²	109.8	82%	0.824	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	-9.3	178.3	-150	-58.5	0	0	0	113	S35	S35-H38 PolarHBondContact O-N 2.81Å
39	H	49.7	Very low	51.9	Low	140 Å²	140	106.3 Å²	106.3	65%	0.648	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.2	29.8	179.8	-146.7	-43.7	0	0	0	112.2	W37 E41	W37-H39 PolarHBondContact O-N 2.76Å; H39-E41 VanDerWaalsContact C-N 3.27Å; H39-E41 IonicContact CE1-OE1 3.25Å; H39-E41 PolarHBondContact CE1-OE1 2.97Å; H39-E41 VanDerWaalsContact CE1-OE1 3.25Å; H39-E41 IonicContact CE1-OE2 3.8Å; H39-E41 IonicContact ND1-OE1 2.63Å; H39-E41 PolarHBondContact O-N 3.33Å
40	I	53.6	Low	52.5	Low	49 Å²	49	102.1 Å²	102.1	25%	0.251	54%	0.543	S	S	.	.			trans	-75.6	86.4	169.1	-57.6	167	0	0	0	107.2	W37 N42 L43 F163	W37-I40 HydrophobicContact CB-CD1 4.01Å; W37-I40 HydrophobicContact CD2-CD1 4.48Å; W37-I40 HydrophobicContact CE3-CD1 3.69Å; W37-I40 HydrophobicContact CE3-CG1 4.32Å; W37-I40 WeakPolarHBondContact O-CG1 3.44Å; I40-N42 PolarHBondContact O-N 3.05Å; I40-L43 HydrophobicContact CG2-CD2 4.38Å; I40-L43 HydrophobicContact CG2-CG 4.14Å; I40-F163 HydrophobicContact CD1-CD2 4.44Å; I40-F163 HydrophobicContact CD1-CE2 4.29Å
41	E	55.5	Low	53	Low	150 Å²	150	105.8 Å²	105.8	70%	0.701	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-3	-169.6	-102.3	179.2	163	0	0	115.4	H39	H39-E41 VanDerWaalsContact C-N 3.27Å; H39-E41 IonicContact CE1-OE1 3.25Å; H39-E41 PolarHBondContact CE1-OE1 2.97Å; H39-E41 VanDerWaalsContact CE1-OE1 3.25Å; H39-E41 IonicContact CE1-OE2 3.8Å; H39-E41 IonicContact ND1-OE1 2.63Å; H39-E41 PolarHBondContact O-N 3.33Å
42	N	56.7	Low	53.7	Low	102 Å²	102	101.3 Å²	101.3	55%	0.545	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-149	64.8	-179.5	-80.5	-65.8	0	0	0	114	I40 D44 L45 F46	I40-N42 PolarHBondContact O-N 3.05Å; N42-D44 VanDerWaalsContact C-N 3.27Å; N42-D44 PolarHBondContact O-N 3.43Å; N42-L45 HydrophobicContact CB-CB 3.79Å; N42-L45 PolarHBondContact O-N 3.41Å; N42-F46 WeakPolarHBondContact O-CB 3.25Å; N42-F46 PolarHBondContact O-N 3.43Å
43	L	56.7	Low	54	Low	81 Å²	81	99.6 Å²	99.6	42%	0.424	50%	0.498	S	S	.	.	H	α-helix	trans	-57.5	-35.5	170.8	-77.2	152.2	0	0	0	112.9	I40 F46 F47	I40-L43 HydrophobicContact CG2-CD2 4.38Å; I40-L43 HydrophobicContact CG2-CG 4.14Å; L43-F46 WeakPolarHBondContact O-CB 3.31Å; L43-F46 PolarHBondContact O-N 3.47Å; L43-F47 HydrophobicContact CB-CD2 4.5Å; L43-F47 HydrophobicContact CB-CE2 4.27Å; L43-F47 HydrophobicContact CD2-CE2 4.08Å; L43-F47 HydrophobicContact CD2-CZ 4.46Å; L43-F47 WeakPolarHBondContact O-CD2 3.21Å; L43-F47 PolarHBondContact O-N 3.39Å
44	D	56.7	Low	54.9	Low	139 Å²	139	102.8 Å²	102.8	74%	0.743	50%	0.502	S	S	*	.	H	α-helix	trans	-67.8	-40	176.5	-91.1	-22.7	0	0	0	112.7	N42 F46 F47 S48	N42-D44 VanDerWaalsContact C-N 3.27Å; N42-D44 PolarHBondContact O-N 3.43Å; D44-F46 VanDerWaalsContact C-N 3.29Å; D44-F46 PolarHBondContact O-N 3.06Å; D44-F47 PolarHBondContact O-N 3.45Å; D44-S48 WeakPolarHBondContact O-CB 3.46Å; D44-S48 PolarHBondContact O-N 2.86Å
45	L	56.3	Low	55.4	Low	88 Å²	88	98.1 Å²	98.1	46%	0.461	48%	0.483	S	S	.	.	H	α-helix	trans	-68.4	-34.4	177.6	-150.2	99.1	0	0	0	111.2	N42 R49	N42-L45 HydrophobicContact CB-CB 3.79Å; N42-L45 PolarHBondContact O-N 3.41Å; L45-R49 VanDerWaalsContact O-CG 3.28Å; L45-R49 WeakPolarHBondContact O-CG 3.38Å; L45-R49 PolarHBondContact O-N 3.43Å
46	F	53.8	Low	55.5	Low	21 Å²	21	103.5 Å²	103.5	9%	0.092	50%	0.501	C	S	.	.	H	α-helix	trans	-62.9	-53.2	172.5	169.9	-73.7	0	0	0	111.3	N42 L43 D44 S48 R49 V50 I160 F163 Y164	N42-F46 WeakPolarHBondContact O-CB 3.25Å; N42-F46 PolarHBondContact O-N 3.43Å; L43-F46 WeakPolarHBondContact O-CB 3.31Å; L43-F46 PolarHBondContact O-N 3.47Å; D44-F46 VanDerWaalsContact C-N 3.29Å; D44-F46 PolarHBondContact O-N 3.06Å; F46-S48 VanDerWaalsContact C-N 3.35Å; F46-S48 PolarHBondContact O-N 3.26Å; F46-R49 PolarHBondContact O-N 3.39Å; F46-V50 HydrophobicContact CD1-CG2 4.46Å; F46-V50 HydrophobicContact CE1-CG2 4.27Å; F46-V50 WeakPolarHBondContact O-CG2 3.12Å; F46-V50 PolarHBondContact O-N 3.28Å; F46-I160 HydrophobicContact CD2-CB 4.1Å; F46-I160 HydrophobicContact CD2-CD1 4.28Å; F46-I160 HydrophobicContact CD2-CG1 3.44Å; F46-I160 VanDerWaalsContact CD2-CG1 3.44Å; F46-I160 HydrophobicContact CD2-CG2 4.05Å; F46-I160 HydrophobicContact CE1-CG2 4.39Å; F46-I160 HydrophobicContact CE2-CB 3.74Å; F46-I160 HydrophobicContact CE2-CG1 3.63Å; F46-I160 HydrophobicContact CE2-CG2 3.56Å; F46-I160 HydrophobicContact CG-CG1 4.28Å; F46-I160 HydrophobicContact CZ-CB 4.37Å; F46-I160 HydrophobicContact CZ-CG2 3.7Å; F46-F163 HydrophobicContact CE1-CD1 4.48Å; F46-F163 HydrophobicContact CE2-CB 4.35Å; F46-F163 HydrophobicContact CE2-CD1 4.14Å; F46-F163 HydrophobicContact CE2-CG 4.45Å; F46-F163 HydrophobicContact CZ-CB 4.5Å; F46-F163 AromaticContact CZ-CD1 3.64Å; F46-F163 HydrophobicContact CZ-CD1 3.64Å; F46-F163 HydrophobicContact CZ-CE1 4.26Å; F46-F163 HydrophobicContact CZ-CG 4.37Å; F46-Y164 HydrophobicContact CE1-CD2 4.46Å; F46-Y164 AromaticContact CE1-CE2 3.57Å; F46-Y164 HydrophobicContact CE1-CE2 3.57Å; F46-Y164 AromaticContact CZ-CD2 3.88Å; F46-Y164 HydrophobicContact CZ-CD2 3.88Å; F46-Y164 AromaticContact CZ-CE2 3.42Å; F46-Y164 HydrophobicContact CZ-CE2 3.42Å; F46-Y164 VanDerWaalsContact CZ-CE2 3.42Å
47	F	58.7	Low	55.5	Low	98 Å²	98	106 Å²	106	43%	0.43	51%	0.508	S	S	.	.	H	α-helix	trans	-69.2	-34.6	-178.7	-70.9	-55.2	0	0	0	112	L43 D44 R49 V50 Y51	L43-F47 HydrophobicContact CB-CD2 4.5Å; L43-F47 HydrophobicContact CB-CE2 4.27Å; L43-F47 HydrophobicContact CD2-CE2 4.08Å; L43-F47 HydrophobicContact CD2-CZ 4.46Å; L43-F47 WeakPolarHBondContact O-CD2 3.21Å; L43-F47 PolarHBondContact O-N 3.39Å; D44-F47 PolarHBondContact O-N 3.45Å; F47-R49 VanDerWaalsContact C-N 3.32Å; F47-R49 PolarHBondContact O-N 3.34Å; F47-V50 PolarHBondContact O-N 3.45Å; F47-Y51 WeakPolarHBondContact O-CB 3.35Å; F47-Y51 PolarHBondContact O-N 3.01Å
48	S	59.5	Low	55.8	Low	78 Å²	78	101.5 Å²	101.5	55%	0.545	50%	0.496	S	S	.	.	H	α-helix	trans	-62.9	-37.3	174.4	-154	0	0	0	0	112	D44 F46 N52	D44-S48 WeakPolarHBondContact O-CB 3.46Å; D44-S48 PolarHBondContact O-N 2.86Å; F46-S48 VanDerWaalsContact C-N 3.35Å; F46-S48 PolarHBondContact O-N 3.26Å; S48-N52 WeakPolarHBondContact O-CB 3.02Å; S48-N52 PolarHBondContact O-N 2.89Å
49	R	58.1	Low	56.2	Low	102 Å²	102	95 Å²	95	39%	0.385	47%	0.466	S	S	.	.	H	α-helix	trans	-72.6	-38.9	175.7	-74.2	175.5	-166.4	-177.7	2.1	113.3	L45 F46 F47 N52 L53	L45-R49 VanDerWaalsContact O-CG 3.28Å; L45-R49 WeakPolarHBondContact O-CG 3.38Å; L45-R49 PolarHBondContact O-N 3.43Å; F46-R49 PolarHBondContact O-N 3.39Å; F47-R49 VanDerWaalsContact C-N 3.32Å; F47-R49 PolarHBondContact O-N 3.34Å; R49-N52 PolarHBondContact O-N 3.49Å; R49-L53 VanDerWaalsContact O-CB 3.31Å; R49-L53 WeakPolarHBondContact O-CB 3.43Å; R49-L53 PolarHBondContact O-N 3.31Å
50	V	59.4	Low	56.9	Low	28 Å²	28	91.9 Å²	91.9	17%	0.17	46%	0.457	C	S	.	.	H	α-helix	trans	-67.8	-40.7	175.6	174.3	0	0	0	0	111.3	F46 F47 L53 H54 I160 Y164	F46-V50 HydrophobicContact CD1-CG2 4.46Å; F46-V50 HydrophobicContact CE1-CG2 4.27Å; F46-V50 WeakPolarHBondContact O-CG2 3.12Å; F46-V50 PolarHBondContact O-N 3.28Å; F47-V50 PolarHBondContact O-N 3.45Å; V50-L53 WeakPolarHBondContact O-CB 3.5Å; V50-L53 PolarHBondContact O-N 3.45Å; V50-H54 PolarHBondContact O-N 3.31Å; V50-I160 HydrophobicContact CG2-CG2 3.56Å; V50-Y164 HydrophobicContact CG1-CE2 4.33Å; V50-Y164 HydrophobicContact CG2-CE2 3.92Å
51	Y	55.8	Low	57.7	Low	152 Å²	152	93.2 Å²	93.2	60%	0.596	47%	0.469	S	S	*	.	H	α-helix	trans	-65.1	-42	175.4	-166.7	-102.1	0	0	0	111	F47 L53 H54 Q55	F47-Y51 WeakPolarHBondContact O-CB 3.35Å; F47-Y51 PolarHBondContact O-N 3.01Å; Y51-L53 PolarHBondContact O-N 3.27Å; Y51-H54 PolarHBondContact O-N 3.47Å; Y51-Q55 PolarHBondContact O-N 2.93Å; Y51-Q55 PolarHBondContact OH-NE2 3Å; Y51-Q55 VanDerWaalsContact OH-NE2 3.14Å; Y51-Q55 PolarHBondContact OH-OE1 3.13Å
52	N	57.4	Low	58.6	Low	85 Å²	85	91.6 Å²	91.6	46%	0.455	46%	0.463	S	S	.	.	H	α-helix	trans	-64.7	-37.7	173.2	-132.1	-42.6	0	0	0	112.8	S48 R49 H54 Q55 K56	S48-N52 WeakPolarHBondContact O-CB 3.02Å; S48-N52 PolarHBondContact O-N 2.89Å; R49-N52 PolarHBondContact O-N 3.49Å; N52-H54 VanDerWaalsContact C-N 3.29Å; N52-H54 PolarHBondContact O-N 3.1Å; N52-Q55 PolarHBondContact O-N 2.94Å; N52-K56 WeakPolarHBondContact O-CB 3.39Å; N52-K56 PolarHBondContact O-N 3.24Å; N52-K56 VanDerWaalsContact O-N 3.13Å
53	L	55.8	Low	59.6	Low	34 Å²	34	88.5 Å²	88.5	18%	0.178	45%	0.447	C	S	.	.	H	α-helix	trans	-57.7	-40	173.2	153.5	76.6	0	0	0	111.4	R49 V50 Y51 G58 F59 Y157	R49-L53 VanDerWaalsContact O-CB 3.31Å; R49-L53 WeakPolarHBondContact O-CB 3.43Å; R49-L53 PolarHBondContact O-N 3.31Å; V50-L53 WeakPolarHBondContact O-CB 3.5Å; V50-L53 PolarHBondContact O-N 3.45Å; Y51-L53 PolarHBondContact O-N 3.27Å; L53-G58 WeakPolarHBondContact O-CA 3.2Å; L53-G58 PolarHBondContact O-N 2.87Å; L53-F59 HydrophobicContact CB-CB 3.72Å; L53-F59 HydrophobicContact CD1-CB 3.49Å; L53-F59 VanDerWaalsContact CD1-CB 3.49Å; L53-F59 HydrophobicContact CG-CB 4.11Å; L53-Y157 HydrophobicContact CD1-CE2 4.28Å; L53-Y157 HydrophobicContact CD2-CE2 3.93Å
54	H	58.7	Low	60.8	Low	163 Å²	163	87.8 Å²	87.8	76%	0.755	44%	0.443	S	S	*	.	H	α-helix	trans	-78.8	-36.2	178.6	-167.9	-91.6	0	0	0	112.7	V50 Y51 N52	V50-H54 PolarHBondContact O-N 3.31Å; Y51-H54 PolarHBondContact O-N 3.47Å; N52-H54 VanDerWaalsContact C-N 3.29Å; N52-H54 PolarHBondContact O-N 3.1Å
55	Q	60.3	Low	62.1	Low	109 Å²	109	82.6 Å²	82.6	51%	0.509	42%	0.422	S	S	.	.	H	α-helix	trans	-79.1	-24.2	-175.8	-131.3	106.7	-9	0	0	115	Y51 N52	Y51-Q55 PolarHBondContact O-N 2.93Å; Y51-Q55 PolarHBondContact OH-NE2 3Å; Y51-Q55 VanDerWaalsContact OH-NE2 3.14Å; Y51-Q55 PolarHBondContact OH-OE1 3.13Å; N52-Q55 PolarHBondContact O-N 2.94Å
56	K	49.7	Very low	63.6	Low	159 Å²	159	80.9 Å²	80.9	69%	0.691	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.1	31.1	-170.2	-87.7	-160.6	171.4	-179.7	0	116.2	N52 G58	N52-K56 WeakPolarHBondContact O-CB 3.39Å; N52-K56 PolarHBondContact O-N 3.24Å; N52-K56 VanDerWaalsContact O-N 3.13Å; K56-G58 PolarHBondContact O-N 3.37Å
57	N	53.6	Low	65.1	Low	160 Å²	160	83.1 Å²	83.1	86%	0.856	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	26.2	-172.2	-69.7	13.3	0	0	0	113.6
58	G	57.3	Low	66.7	Low	16 Å²	16	84.5 Å²	84.5	17%	0.165	43%	0.429	C	S	.	.			trans	103.7	126.2	171.4	0	0	0	0	0	115.8	L53 K56 T60 C61 M62	L53-G58 WeakPolarHBondContact O-CA 3.2Å; L53-G58 PolarHBondContact O-N 2.87Å; K56-G58 PolarHBondContact O-N 3.37Å; G58-T60 PolarHBondContact O-N 3.45Å; G58-C61 WeakPolarHBondContact O-CA 3.31Å; G58-C61 WeakPolarHBondContact O-CB 3.49Å; G58-C61 PolarHBondContact O-N 2.83Å; G58-M62 PolarHBondContact O-N 3.3Å
59	F	57.9	Low	68.3	Low	42 Å²	42	85.4 Å²	85.4	18%	0.184	43%	0.425	C	S	.	.	H	α-helix	trans	-51.9	-27.9	156.5	172.3	-88.1	0	0	0	112.2	L53 C61 M62 L63 Y157	L53-F59 HydrophobicContact CB-CB 3.72Å; L53-F59 HydrophobicContact CD1-CB 3.49Å; L53-F59 VanDerWaalsContact CD1-CB 3.49Å; L53-F59 HydrophobicContact CG-CB 4.11Å; F59-C61 VanDerWaalsContact C-N 3.28Å; F59-C61 PolarHBondContact O-N 3.07Å; F59-M62 PolarHBondContact O-N 3.49Å; F59-L63 HydrophobicContact CD1-CB 4.48Å; F59-L63 HydrophobicContact CD1-CD1 4.27Å; F59-L63 HydrophobicContact CE1-CB 4.32Å; F59-L63 HydrophobicContact CE1-CD1 3.54Å; F59-L63 HydrophobicContact CZ-CD1 4.21Å; F59-L63 VanDerWaalsContact O-CB 3.26Å; F59-L63 WeakPolarHBondContact O-CB 3.39Å; F59-L63 PolarHBondContact O-N 3.18Å; F59-Y157 HydrophobicContact CB-CE2 4.25Å; F59-Y157 HydrophobicContact CD1-CD1 4.23Å; F59-Y157 AromaticContact CD1-CD2 3.19Å; F59-Y157 HydrophobicContact CD1-CD2 3.19Å; F59-Y157 HydrophobicContact CD1-CE1 4.28Å; F59-Y157 AromaticContact CD1-CE2 3.22Å; F59-Y157 HydrophobicContact CD1-CE2 3.22Å; F59-Y157 AromaticContact CD1-CG 3.71Å; F59-Y157 HydrophobicContact CD1-CG 3.71Å; F59-Y157 AromaticContact CD1-CZ 3.8Å; F59-Y157 HydrophobicContact CD2-CD2 4.4Å; F59-Y157 VanDerWaalsContact CE1-CB 3.47Å; F59-Y157 AromaticContact CE1-CD1 3.82Å; F59-Y157 HydrophobicContact CE1-CD1 3.82Å; F59-Y157 AromaticContact CE1-CD2 3.09Å; F59-Y157 HydrophobicContact CE1-CD2 3.09Å; F59-Y157 HydrophobicContact CE1-CE1 4.32Å; F59-Y157 AromaticContact CE1-CE2 3.66Å; F59-Y157 HydrophobicContact CE1-CE2 3.66Å; F59-Y157 AromaticContact CE1-CG 3.16Å; F59-Y157 HydrophobicContact CE1-CG 3.16Å; F59-Y157 HydrophobicContact CE2-CD2 4.32Å; F59-Y157 AromaticContact CG-CD2 3.9Å; F59-Y157 HydrophobicContact CG-CD2 3.9Å; F59-Y157 AromaticContact CG-CE2 3.87Å; F59-Y157 HydrophobicContact CG-CE2 3.87Å; F59-Y157 AromaticContact CZ-CD2 3.7Å; F59-Y157 HydrophobicContact CZ-CD2 3.7Å; F59-Y157 AromaticContact CZ-CG 3.82Å; F59-Y157 HydrophobicContact CZ-CG 3.82Å
60	T	64.6	Low	70	Confident	74 Å²	74	81 Å²	81	45%	0.454	41%	0.409	S	S	.	.	H	α-helix	trans	-56.2	-40.8	168	-53.8	0	0	0	0	111.9	G58 L63 I64	G58-T60 PolarHBondContact O-N 3.45Å; T60-L63 PolarHBondContact O-N 3.38Å; T60-I64 HydrophobicContact CG2-CD1 3.65Å; T60-I64 HydrophobicContact CG2-CG1 4.33Å; T60-I64 WeakPolarHBondContact O-CB 3.32Å; T60-I64 WeakPolarHBondContact O-CD1 3.4Å; T60-I64 WeakPolarHBondContact O-CG1 3.49Å; T60-I64 PolarHBondContact O-N 3.12Å
61	C	70.1	Confident	71.6	Confident	77 Å²	77	85.3 Å²	85.3	52%	0.52	43%	0.428	S	S	.	.	H	α-helix	trans	-66.7	-41.4	175.4	-173.1	0	0	0	0	111.7	G58 F59 I64 G65	G58-C61 WeakPolarHBondContact O-CA 3.31Å; G58-C61 WeakPolarHBondContact O-CB 3.49Å; G58-C61 PolarHBondContact O-N 2.83Å; F59-C61 VanDerWaalsContact C-N 3.28Å; F59-C61 PolarHBondContact O-N 3.07Å; C61-I64 PolarHBondContact O-N 3.44Å; C61-G65 PolarHBondContact O-N 3.23Å
62	M	73.4	Confident	73.5	Confident	116 Å²	116	84.3 Å²	84.3	57%	0.571	43%	0.429	S	S	*	.	H	α-helix	trans	-63.9	-43.9	174.9	-175.7	174.2	-179.8	0	0	112.2	G58 F59 G65 E66	G58-M62 PolarHBondContact O-N 3.3Å; F59-M62 PolarHBondContact O-N 3.49Å; M62-G65 WeakPolarHBondContact O-CA 3.28Å; M62-G65 PolarHBondContact O-N 3.05Å; M62-E66 PolarHBondContact O-N 3.42Å
63	L	76.9	Confident	75.3	Confident	37 Å²	37	82.7 Å²	82.7	19%	0.194	42%	0.418	C	S	.	.	H	α-helix	trans	-66.9	-41.7	177.7	-176.3	153.3	0	0	0	111.7	F59 T60 G65 E66 M67 F150 I154	F59-L63 HydrophobicContact CD1-CB 4.48Å; F59-L63 HydrophobicContact CD1-CD1 4.27Å; F59-L63 HydrophobicContact CE1-CB 4.32Å; F59-L63 HydrophobicContact CE1-CD1 3.54Å; F59-L63 HydrophobicContact CZ-CD1 4.21Å; F59-L63 VanDerWaalsContact O-CB 3.26Å; F59-L63 WeakPolarHBondContact O-CB 3.39Å; F59-L63 PolarHBondContact O-N 3.18Å; T60-L63 PolarHBondContact O-N 3.38Å; L63-G65 VanDerWaalsContact C-N 3.28Å; L63-G65 PolarHBondContact O-N 2.85Å; L63-E66 PolarHBondContact O-N 3.43Å; L63-M67 VanDerWaalsContact O-CB 3.25Å; L63-M67 WeakPolarHBondContact O-CB 3.37Å; L63-M67 PolarHBondContact O-N 3.45Å; L63-F150 HydrophobicContact CD2-CE2 4.39Å; L63-F150 HydrophobicContact CD2-CZ 4.11Å; L63-F150 HydrophobicContact CG-CE2 3.94Å; L63-F150 HydrophobicContact CG-CZ 4.12Å; L63-F150 WeakPolarHBondContact O-CE2 3.12Å; L63-I154 HydrophobicContact CD1-CD1 4.21Å; L63-I154 HydrophobicContact CD1-CG1 3.65Å; L63-I154 HydrophobicContact CG-CD1 4.44Å; L63-I154 HydrophobicContact CG-CG1 4.26Å
64	I	82.1	Confident	77.2	Confident	66 Å²	66	85.4 Å²	85.4	34%	0.338	43%	0.432	S	S	.	.	H	α-helix	trans	-62.1	-39.7	171.5	-73.3	166.5	0	0	0	110.2	T60 C61 M67 F68	T60-I64 HydrophobicContact CG2-CD1 3.65Å; T60-I64 HydrophobicContact CG2-CG1 4.33Å; T60-I64 WeakPolarHBondContact O-CB 3.32Å; T60-I64 WeakPolarHBondContact O-CD1 3.4Å; T60-I64 WeakPolarHBondContact O-CG1 3.49Å; T60-I64 PolarHBondContact O-N 3.12Å; C61-I64 PolarHBondContact O-N 3.44Å; I64-M67 HydrophobicContact CG2-CE 4.42Å; I64-M67 WeakPolarHBondContact O-CB 3.43Å; I64-M67 PolarHBondContact O-N 3.03Å; I64-F68 HydrophobicContact CG2-CD2 3.5Å; I64-F68 HydrophobicContact CG2-CE2 3.39Å; I64-F68 WeakPolarHBondContact O-CB 3.18Å; I64-F68 WeakPolarHBondContact O-CD2 3.39Å; I64-F68 PolarHBondContact O-N 3.42Å
65	G	85.4	Confident	78.9	Confident	30 Å²	30	83.7 Å²	83.7	31%	0.309	42%	0.423	S	S	.	.	H	α-helix	trans	-58.5	-55.8	172.8	0	0	0	0	0	112	C61 M62 L63 M67 F68 E69	C61-G65 PolarHBondContact O-N 3.23Å; M62-G65 WeakPolarHBondContact O-CA 3.28Å; M62-G65 PolarHBondContact O-N 3.05Å; L63-G65 VanDerWaalsContact C-N 3.28Å; L63-G65 PolarHBondContact O-N 2.85Å; G65-M67 VanDerWaalsContact C-N 3.25Å; G65-M67 PolarHBondContact O-N 3.47Å; G65-F68 PolarHBondContact O-N 3.24Å; G65-F68 VanDerWaalsContact O-N 3.13Å; G65-E69 WeakPolarHBondContact O-CG 3.37Å; G65-E69 PolarHBondContact O-N 3.01Å
66	E	86.8	Confident	80.7	Confident	52 Å²	52	82.1 Å²	82.1	24%	0.243	42%	0.421	C	S	.	.	H	α-helix	trans	-58.7	-36.8	177.3	-71.5	-171.7	-170.1	0	0	112.1	M62 L63 E69 L70 F150 N153	M62-E66 PolarHBondContact O-N 3.42Å; L63-E66 PolarHBondContact O-N 3.43Å; E66-E69 PolarHBondContact O-N 3.42Å; E66-L70 WeakPolarHBondContact O-CG 3.42Å; E66-L70 PolarHBondContact O-N 3.46Å; E66-F150 HydrophobicContact CB-CD2 3.77Å; E66-F150 HydrophobicContact CB-CE2 3.83Å; E66-N153 PolarHBondContact OE2-ND2 2.79Å
67	M	86.3	Confident	82.8	Confident	67 Å²	67	76.4 Å²	76.4	33%	0.33	40%	0.399	S	S	.	.	H	α-helix	trans	-64.9	-46	174.5	-177.1	-170.2	69.4	0	0	112	L63 I64 G65 E69 L70 M71 F150	L63-M67 VanDerWaalsContact O-CB 3.25Å; L63-M67 WeakPolarHBondContact O-CB 3.37Å; L63-M67 PolarHBondContact O-N 3.45Å; I64-M67 HydrophobicContact CG2-CE 4.42Å; I64-M67 WeakPolarHBondContact O-CB 3.43Å; I64-M67 PolarHBondContact O-N 3.03Å; G65-M67 VanDerWaalsContact C-N 3.25Å; G65-M67 PolarHBondContact O-N 3.47Å; M67-E69 VanDerWaalsContact C-N 3.3Å; M67-E69 PolarHBondContact O-N 3.48Å; M67-L70 WeakPolarHBondContact O-CB 3.32Å; M67-L70 PolarHBondContact O-N 3.32Å; M67-M71 PolarHBondContact O-N 3.18Å; M67-F150 HydrophobicContact CB-CE2 4.32Å; M67-F150 HydrophobicContact CB-CZ 3.89Å; M67-F150 HydrophobicContact CG-CZ 4.5Å
68	F	91.8	Very high	84.7	Confident	128 Å²	128	71.4 Å²	71.4	56%	0.561	38%	0.38	S	S	*	.	H	α-helix	trans	-62.9	-39	176.4	-87.6	-60.8	0	0	0	111.5	I64 G65 L70 M71 Q72	I64-F68 HydrophobicContact CG2-CD2 3.5Å; I64-F68 HydrophobicContact CG2-CE2 3.39Å; I64-F68 WeakPolarHBondContact O-CB 3.18Å; I64-F68 WeakPolarHBondContact O-CD2 3.39Å; I64-F68 PolarHBondContact O-N 3.42Å; G65-F68 PolarHBondContact O-N 3.24Å; G65-F68 VanDerWaalsContact O-N 3.13Å; F68-L70 VanDerWaalsContact C-N 3.34Å; F68-L70 PolarHBondContact O-N 2.81Å; F68-M71 PolarHBondContact O-N 3.38Å; F68-Q72 VanDerWaalsContact O-CB 3.27Å; F68-Q72 WeakPolarHBondContact O-CB 3.4Å; F68-Q72 PolarHBondContact O-N 3.11Å
69	E	93.1	Very high	86.5	Confident	97 Å²	97	75.3 Å²	75.3	45%	0.453	39%	0.393	S	S	.	.	H	α-helix	trans	-66.2	-36.1	176.1	-63.7	179.8	163.8	0	0	112.5	G65 E66 M67 F73 R146	G65-E69 WeakPolarHBondContact O-CG 3.37Å; G65-E69 PolarHBondContact O-N 3.01Å; E66-E69 PolarHBondContact O-N 3.42Å; M67-E69 VanDerWaalsContact C-N 3.3Å; M67-E69 PolarHBondContact O-N 3.48Å; E69-F73 PolarHBondContact O-N 3.41Å; E69-F73 VanDerWaalsContact O-N 3.1Å; E69-R146 PolarHBondContact O-NH1 2.78Å; E69-R146 IonicContact OE2-CZ 3.89Å; E69-R146 IonicContact OE2-NH2 3.83Å; E69-R146 PolarHBondContact OE2-NH2 3.32Å
70	L	93.7	Very high	88.2	Confident	10 Å²	10	76.9 Å²	76.9	5%	0.052	41%	0.405	C	S	.	.	H	α-helix	trans	-65.4	-43	172.9	-82.4	170.1	0	0	0	111.9	E66 M67 F68 L74 W143 R146 L147 F150	E66-L70 WeakPolarHBondContact O-CG 3.42Å; E66-L70 PolarHBondContact O-N 3.46Å; M67-L70 WeakPolarHBondContact O-CB 3.32Å; M67-L70 PolarHBondContact O-N 3.32Å; F68-L70 VanDerWaalsContact C-N 3.34Å; F68-L70 PolarHBondContact O-N 2.81Å; L70-L74 PolarHBondContact O-N 2.86Å; L70-L74 VanDerWaalsContact O-N 3.14Å; L70-W143 PolarHBondContact O-NE1 3.34Å; L70-R146 HydrophobicContact CD2-CB 3.94Å; L70-R146 HydrophobicContact CD2-CG 3.72Å; L70-R146 HydrophobicContact CG-CG 4.49Å; L70-L147 HydrophobicContact CD1-CD1 4.32Å; L70-F150 HydrophobicContact CD1-CB 3.74Å; L70-F150 HydrophobicContact CD1-CD1 3.74Å; L70-F150 HydrophobicContact CD1-CD2 4.19Å; L70-F150 HydrophobicContact CD1-CE1 4.34Å; L70-F150 HydrophobicContact CD1-CG 3.63Å
71	M	93.2	Very high	89.5	Confident	118 Å²	118	74.5 Å²	74.5	58%	0.581	39%	0.391	S	S	*	.	H	α-helix	trans	-66.8	-41.3	176.3	-76.8	-151.7	165	0	0	112	M67 F68 F73 L74 F75	M67-M71 PolarHBondContact O-N 3.18Å; F68-M71 PolarHBondContact O-N 3.38Å; M71-F73 VanDerWaalsContact C-N 3.33Å; M71-F73 PolarHBondContact O-N 3.19Å; M71-L74 PolarHBondContact O-N 2.8Å; M71-F75 VanDerWaalsContact O-CB 3.29Å; M71-F75 WeakPolarHBondContact O-CB 3.39Å; M71-F75 PolarHBondContact O-N 3.34Å
72	Q	95.1	Very high	90.6	Very high	130 Å²	130	74.2 Å²	74.2	61%	0.607	38%	0.381	S	S	*	.	H	α-helix	trans	-61	-44.1	177.4	-173.8	-179.5	11.4	0	0	110.9	F68 F75 V76	F68-Q72 VanDerWaalsContact O-CB 3.27Å; F68-Q72 WeakPolarHBondContact O-CB 3.4Å; F68-Q72 PolarHBondContact O-N 3.11Å; Q72-F75 PolarHBondContact O-N 3.19Å; Q72-V76 VanDerWaalsContact O-CG2 3.28Å; Q72-V76 WeakPolarHBondContact O-CG2 3.49Å; Q72-V76 PolarHBondContact O-N 2.95Å
73	F	95.3	Very high	91.4	Very high	52 Å²	52	71.4 Å²	71.4	23%	0.228	37%	0.368	C	S	.	.	H	α-helix	trans	-59	-49.9	175.3	-177.9	-84	0	0	0	111.5	E69 M71 F75 V76 V77 A139 F142 W143	E69-F73 PolarHBondContact O-N 3.41Å; E69-F73 VanDerWaalsContact O-N 3.1Å; M71-F73 VanDerWaalsContact C-N 3.33Å; M71-F73 PolarHBondContact O-N 3.19Å; F73-F75 VanDerWaalsContact C-N 3.33Å; F73-F75 PolarHBondContact O-N 3.32Å; F73-V76 PolarHBondContact O-N 3.45Å; F73-V77 HydrophobicContact CD1-CG2 4.17Å; F73-V77 HydrophobicContact CE1-CG2 3.78Å; F73-V77 HydrophobicContact CZ-CG2 3.98Å; F73-V77 WeakPolarHBondContact O-CG2 3.46Å; F73-V77 PolarHBondContact O-N 2.84Å; F73-A139 HydrophobicContact CE1-CB 4.33Å; F73-A139 HydrophobicContact CZ-CB 4.05Å; F73-F142 HydrophobicContact CD2-CD1 4.46Å; F73-F142 HydrophobicContact CD2-CE1 4.28Å; F73-F142 AromaticContact CE2-CD1 3.73Å; F73-F142 HydrophobicContact CE2-CD1 3.73Å; F73-F142 AromaticContact CE2-CE1 3.88Å; F73-F142 HydrophobicContact CE2-CE1 3.88Å; F73-F142 AromaticContact CZ-CD1 3.76Å; F73-F142 HydrophobicContact CZ-CD1 3.76Å; F73-F142 HydrophobicContact CZ-CE1 4.37Å; F73-W143 HydrophobicContact CD1-CB 4.11Å; F73-W143 AromaticContact CD1-CD1 3.43Å; F73-W143 VanDerWaalsContact CD1-CD1 3.43Å; F73-W143 HydrophobicContact CD1-CG 4.09Å; F73-W143 HydrophobicContact CE1-CB 3.82Å; F73-W143 HydrophobicContact CE1-CG 4.28Å
74	L	95.1	Very high	92	Very high	90 Å²	90	73.4 Å²	73.4	47%	0.471	38%	0.381	S	S	.	.	H	α-helix	trans	-60.9	-44.4	179.7	-176.8	66.3	0	0	0	111.4	L70 M71 V77 A78	L70-L74 PolarHBondContact O-N 2.86Å; L70-L74 VanDerWaalsContact O-N 3.14Å; M71-L74 PolarHBondContact O-N 2.8Å; L74-V77 PolarHBondContact O-N 3.37Å; L74-A78 WeakPolarHBondContact O-CB 3.25Å; L74-A78 PolarHBondContact O-N 2.82Å
75	F	95.9	Very high	92.3	Very high	127 Å²	127	70.3 Å²	70.3	56%	0.557	37%	0.366	S	S	*	.	H	α-helix	trans	-59.2	-49.3	178.3	176.1	-99.9	0	0	0	111.4	M71 Q72 F73 A78 F79	M71-F75 VanDerWaalsContact O-CB 3.29Å; M71-F75 WeakPolarHBondContact O-CB 3.39Å; M71-F75 PolarHBondContact O-N 3.34Å; Q72-F75 PolarHBondContact O-N 3.19Å; F73-F75 VanDerWaalsContact C-N 3.33Å; F73-F75 PolarHBondContact O-N 3.32Å; F75-A78 PolarHBondContact O-N 3.1Å; F75-F79 HydrophobicContact CE2-CB 4.44Å; F75-F79 HydrophobicContact CZ-CB 4.36Å; F75-F79 HydrophobicContact CZ-CG 4.25Å; F75-F79 WeakPolarHBondContact O-CB 3.5Å; F75-F79 PolarHBondContact O-N 2.76Å
76	V	96.8	Very high	92.4	Very high	77 Å²	77	69.8 Å²	69.8	47%	0.467	36%	0.357	S	S	.	.	H	α-helix	trans	-60.1	-50.5	179.5	171.6	0	0	0	0	110.6	Q72 F73 A78 T80	Q72-V76 VanDerWaalsContact O-CG2 3.28Å; Q72-V76 WeakPolarHBondContact O-CG2 3.49Å; Q72-V76 PolarHBondContact O-N 2.95Å; F73-V76 PolarHBondContact O-N 3.45Å; V76-A78 PolarHBondContact O-N 3.01Å; V76-T80 VanDerWaalsContact O-CB 3.26Å; V76-T80 WeakPolarHBondContact O-CB 3.49Å; V76-T80 PolarHBondContact O-N 3.31Å; V76-T80 PolarHBondContact O-OG1 2.9Å
77	V	95.7	Very high	92.4	Very high	39 Å²	39	68 Å²	68	24%	0.236	35%	0.35	C	S	.	.	H	α-helix	trans	-63.1	-47.2	-178.3	174.7	0	0	0	0	111.4	F73 L74 T81 L136 A139	F73-V77 HydrophobicContact CD1-CG2 4.17Å; F73-V77 HydrophobicContact CE1-CG2 3.78Å; F73-V77 HydrophobicContact CZ-CG2 3.98Å; F73-V77 WeakPolarHBondContact O-CG2 3.46Å; F73-V77 PolarHBondContact O-N 2.84Å; L74-V77 PolarHBondContact O-N 3.37Å; V77-T81 VanDerWaalsContact O-CB 3.31Å; V77-T81 WeakPolarHBondContact O-CB 3.47Å; V77-T81 PolarHBondContact O-N 3.05Å; V77-T81 PolarHBondContact O-OG1 3.44Å; V77-L136 HydrophobicContact CG1-CD2 3.74Å; V77-A139 HydrophobicContact CG1-CB 4.35Å; V77-A139 HydrophobicContact CG2-CB 4.35Å
78	A	92.9	Very high	92.2	Very high	55 Å²	55	67.1 Å²	67.1	46%	0.455	35%	0.347	S	S	.	.	H	α-helix	trans	-66.7	-45.8	-179.1	0	0	0	0	0	111.9	L74 F75 V76 T81 F82	L74-A78 WeakPolarHBondContact O-CB 3.25Å; L74-A78 PolarHBondContact O-N 2.82Å; F75-A78 PolarHBondContact O-N 3.1Å; V76-A78 PolarHBondContact O-N 3.01Å; A78-T81 PolarHBondContact O-N 3Å; A78-F82 VanDerWaalsContact O-CB 3.31Å; A78-F82 WeakPolarHBondContact O-CB 3.47Å; A78-F82 PolarHBondContact O-N 3.42Å
79	F	94.3	Very high	91.6	Very high	98 Å²	98	65.6 Å²	65.6	43%	0.43	34%	0.338	S	S	.	.	H	α-helix	trans	-66	-43.7	-179.1	-174.9	-112.4	0	0	0	111.7	F75 T81 F82 L83	F75-F79 HydrophobicContact CE2-CB 4.44Å; F75-F79 HydrophobicContact CZ-CB 4.36Å; F75-F79 HydrophobicContact CZ-CG 4.25Å; F75-F79 WeakPolarHBondContact O-CB 3.5Å; F75-F79 PolarHBondContact O-N 2.76Å; F79-T81 VanDerWaalsContact C-N 3.35Å; F79-T81 PolarHBondContact O-N 3.48Å; F79-F82 PolarHBondContact O-N 3.35Å; F79-L83 HydrophobicContact CD1-CD1 4.03Å; F79-L83 HydrophobicContact CE1-CD1 3.52Å; F79-L83 HydrophobicContact CE1-CG 4.21Å; F79-L83 HydrophobicContact CE2-CD2 4.4Å; F79-L83 HydrophobicContact CE2-CG 4.37Å; F79-L83 HydrophobicContact CZ-CD1 3.79Å; F79-L83 HydrophobicContact CZ-CD2 4.22Å; F79-L83 HydrophobicContact CZ-CG 4.12Å; F79-L83 WeakPolarHBondContact O-CG 3.38Å; F79-L83 PolarHBondContact O-N 2.85Å
80	T	93.9	Very high	90.6	Very high	74 Å²	74	65.5 Å²	65.5	45%	0.454	34%	0.34	S	S	.	.	H	α-helix	trans	-62.2	-42.8	174.5	-61.5	0	0	0	0	111.4	V76 F82 L83 V84	V76-T80 VanDerWaalsContact O-CB 3.26Å; V76-T80 WeakPolarHBondContact O-CB 3.49Å; V76-T80 PolarHBondContact O-N 3.31Å; V76-T80 PolarHBondContact O-OG1 2.9Å; T80-F82 VanDerWaalsContact C-N 3.34Å; T80-F82 PolarHBondContact O-N 3.49Å; T80-L83 PolarHBondContact O-N 3.22Å; T80-V84 HydrophobicContact CG2-CG2 4.46Å; T80-V84 VanDerWaalsContact O-CG2 3.27Å; T80-V84 WeakPolarHBondContact O-CG2 3.31Å; T80-V84 PolarHBondContact O-N 3.23Å
81	T	92.9	Very high	89.5	Confident	24 Å²	24	67.3 Å²	67.3	15%	0.147	35%	0.349	C	S	.	.	H	α-helix	trans	-63.6	-41.5	177.5	-56.8	0	0	0	0	111.9	V77 A78 F79 V84 S85 I126 L136	V77-T81 VanDerWaalsContact O-CB 3.31Å; V77-T81 WeakPolarHBondContact O-CB 3.47Å; V77-T81 PolarHBondContact O-N 3.05Å; V77-T81 PolarHBondContact O-OG1 3.44Å; A78-T81 PolarHBondContact O-N 3Å; F79-T81 VanDerWaalsContact C-N 3.35Å; F79-T81 PolarHBondContact O-N 3.48Å; T81-V84 PolarHBondContact O-N 3.42Å; T81-S85 WeakPolarHBondContact O-CB 3.47Å; T81-S85 PolarHBondContact O-N 3.36Å; T81-S85 PolarHBondContact O-OG 3.22Å; T81-I126 HydrophobicContact CG2-CD1 3.94Å; T81-I126 HydrophobicContact CG2-CG1 4.32Å; T81-L136 HydrophobicContact CG2-CD1 4.02Å; T81-L136 HydrophobicContact CG2-CD2 4.36Å; T81-L136 WeakPolarHBondContact OG1-CD2 3.31Å
82	F	91.3	Very high	88.4	Confident	71 Å²	71	65.1 Å²	65.1	31%	0.311	34%	0.34	S	S	.	.	H	α-helix	trans	-60.6	-48	176.1	173.9	-95.6	0	0	0	111.6	A78 F79 T80 V84 S85 C86 V87 F116	A78-F82 VanDerWaalsContact O-CB 3.31Å; A78-F82 WeakPolarHBondContact O-CB 3.47Å; A78-F82 PolarHBondContact O-N 3.42Å; F79-F82 PolarHBondContact O-N 3.35Å; T80-F82 VanDerWaalsContact C-N 3.34Å; T80-F82 PolarHBondContact O-N 3.49Å; F82-V84 VanDerWaalsContact C-N 3.35Å; F82-V84 PolarHBondContact O-N 2.93Å; F82-S85 PolarHBondContact O-N 2.79Å; F82-C86 HydrophobicContact CD2-CB 3.49Å; F82-C86 VanDerWaalsContact CD2-CB 3.49Å; F82-C86 HydrophobicContact CE2-CB 3.61Å; F82-C86 HydrophobicContact CG-CB 4.19Å; F82-C86 HydrophobicContact CZ-CB 4.4Å; F82-C86 WeakPolarHBondContact O-CA 3.17Å; F82-C86 VanDerWaalsContact O-CB 3.31Å; F82-C86 WeakPolarHBondContact O-CB 3.33Å; F82-C86 PolarHBondContact O-N 3.48Å; F82-V87 HydrophobicContact CD1-CG2 4.14Å; F82-V87 HydrophobicContact CE1-CG2 3.73Å; F82-V87 HydrophobicContact CZ-CG2 4.27Å; F82-F116 HydrophobicContact CE1-CD1 4.12Å; F82-F116 AromaticContact CE1-CE1 3.85Å; F82-F116 HydrophobicContact CE1-CE1 3.85Å; F82-F116 HydrophobicContact CE1-CZ 4.49Å; F82-F116 AromaticContact CZ-CD1 3.54Å; F82-F116 HydrophobicContact CZ-CD1 3.54Å; F82-F116 AromaticContact CZ-CE1 3.68Å; F82-F116 HydrophobicContact CZ-CE1 3.68Å; F82-F116 HydrophobicContact CZ-CG 4.04Å; F82-F116 HydrophobicContact CZ-CZ 4.28Å
83	L	91.1	Very high	87.2	Confident	57 Å²	57	65.8 Å²	65.8	30%	0.298	34%	0.341	S	S	.	.	H	α-helix	trans	-61.3	-43.8	177.4	-71	-177.7	0	0	0	111.8	F79 T80 V87 Y89	F79-L83 HydrophobicContact CD1-CD1 4.03Å; F79-L83 HydrophobicContact CE1-CD1 3.52Å; F79-L83 HydrophobicContact CE1-CG 4.21Å; F79-L83 HydrophobicContact CE2-CD2 4.4Å; F79-L83 HydrophobicContact CE2-CG 4.37Å; F79-L83 HydrophobicContact CZ-CD1 3.79Å; F79-L83 HydrophobicContact CZ-CD2 4.22Å; F79-L83 HydrophobicContact CZ-CG 4.12Å; F79-L83 WeakPolarHBondContact O-CG 3.38Å; F79-L83 PolarHBondContact O-N 2.85Å; T80-L83 PolarHBondContact O-N 3.22Å; L83-V87 HydrophobicContact CD2-CG2 4.01Å; L83-Y89 VanDerWaalsContact O-CE2 3.28Å; L83-Y89 WeakPolarHBondContact O-CE2 3.47Å; L83-Y89 PolarHBondContact O-OH 3.16Å
84	V	89.8	Confident	85.8	Confident	79 Å²	79	67 Å²	67	48%	0.479	36%	0.36	S	S	.	.	H	α-helix	trans	-68.6	-37	-178.1	172.3	0	0	0	0	112.6	T80 T81 F82 L132	T80-V84 HydrophobicContact CG2-CG2 4.46Å; T80-V84 VanDerWaalsContact O-CG2 3.27Å; T80-V84 WeakPolarHBondContact O-CG2 3.31Å; T80-V84 PolarHBondContact O-N 3.23Å; T81-V84 PolarHBondContact O-N 3.42Å; F82-V84 VanDerWaalsContact C-N 3.35Å; F82-V84 PolarHBondContact O-N 2.93Å; V84-L132 HydrophobicContact CG1-CD1 3.8Å; V84-L132 HydrophobicContact CG1-CD2 4.43Å
85	S	87.5	Confident	84.1	Confident	2 Å²	2	69.2 Å²	69.2	1%	0.014	37%	0.373	C	S	.	.	H	α-helix	trans	-114.7	-26.2	-167.2	-51.4	0	0	0	0	115.2	T81 F82 C122 R125 I126	T81-S85 WeakPolarHBondContact O-CB 3.47Å; T81-S85 PolarHBondContact O-N 3.36Å; T81-S85 PolarHBondContact O-OG 3.22Å; F82-S85 PolarHBondContact O-N 2.79Å; S85-C122 VanDerWaalsContact C-SG 3.53Å; S85-R125 WeakPolarHBondContact O-CD 3.16Å; S85-I126 VanDerWaalsContact CB-CG1 3.44Å; S85-I126 WeakPolarHBondContact OG-CG1 3.36Å
86	C	88.4	Confident	82	Confident	18 Å²	18	70.3 Å²	70.3	12%	0.122	38%	0.377	C	S	.	.	H	α-helix	trans	-109.2	-1.2	-172.9	-52.7	0	0	0	0	114.1	F82 L117 C122	F82-C86 HydrophobicContact CD2-CB 3.49Å; F82-C86 VanDerWaalsContact CD2-CB 3.49Å; F82-C86 HydrophobicContact CE2-CB 3.61Å; F82-C86 HydrophobicContact CG-CB 4.19Å; F82-C86 HydrophobicContact CZ-CB 4.4Å; F82-C86 WeakPolarHBondContact O-CA 3.17Å; F82-C86 VanDerWaalsContact O-CB 3.31Å; F82-C86 WeakPolarHBondContact O-CB 3.33Å; F82-C86 PolarHBondContact O-N 3.48Å; C86-L117 WeakPolarHBondContact O-CD1 3.21Å; C86-L117 PolarHBondContact O-N 3.4Å; C86-C122 WeakPolarHBondContact CA-SG 3.36Å; C86-C122 HydrophobicContact CB-CB 3.84Å; C86-C122 WeakPolarHBondContact CB-SG 3.09Å; C86-C122 PolarHBondContact N-SG 2.63Å; C86-C122 WeakPolarHBondContact SG-CB 3.15Å; C86-C122 CovalentContact SG-SG 2.02Å; C86-C122 PolarHBondContact SG-SG 3.43Å
87	V	87.4	Confident	79.8	Confident	14 Å²	14	74.7 Å²	74.7	9%	0.085	40%	0.395	C	S	.	.	B	Isolated β-bridge	trans	-107.2	122.8	179.4	180	0	0	0	0	110.1	F82 L83 Y89 L92 F116	F82-V87 HydrophobicContact CD1-CG2 4.14Å; F82-V87 HydrophobicContact CE1-CG2 3.73Å; F82-V87 HydrophobicContact CZ-CG2 4.27Å; L83-V87 HydrophobicContact CD2-CG2 4.01Å; V87-Y89 HydrophobicContact CB-CE2 4.31Å; V87-Y89 HydrophobicContact CG1-CD1 4.15Å; V87-Y89 HydrophobicContact CG1-CE1 3.98Å; V87-Y89 HydrophobicContact CG1-CE2 4.45Å; V87-Y89 HydrophobicContact CG1-CG 4.48Å; V87-Y89 PolarHBondContact O-N 2.89Å; V87-L92 HydrophobicContact CG1-CD2 4.2Å; V87-F116 HydrophobicContact CG2-CD1 4.37Å; V87-F116 HydrophobicContact CG2-CE1 4.42Å
88	D	80.9	Confident	77.8	Confident	50 Å²	50	77.5 Å²	77.5	27%	0.267	41%	0.412	S	S	.	.			trans	-83.2	97.2	171.8	-163.7	-34.8	0	0	0	109.8	D90 I91 L92 A115 L117	D88-D90 VanDerWaalsContact C-N 3.28Å; D88-D90 PolarHBondContact O-N 3.14Å; D88-D90 WeakPolarHBondContact OD1-CB 3.25Å; D88-D90 PolarHBondContact OD1-N 3.4Å; D88-I91 HydrophobicContact CB-CB 4.4Å; D88-I91 HydrophobicContact CB-CD1 4.05Å; D88-I91 HydrophobicContact CB-CG1 4.3Å; D88-I91 PolarHBondContact OD1-N 3.42Å; D88-I91 WeakPolarHBondContact OD2-CD1 3.3Å; D88-L92 WeakPolarHBondContact O-CB 3.33Å; D88-L92 PolarHBondContact O-N 2.99Å; D88-L92 VanDerWaalsContact O-N 3.14Å; D88-A115 PolarHBondContact N-O 3Å; D88-L117 HydrophobicContact CB-CD1 3.81Å
89	Y	78.9	Confident	75.8	Confident	95 Å²	95	81.7 Å²	81.7	37%	0.373	43%	0.426	S	S	.	.	H	α-helix	trans	-69.3	-23.1	179.6	-67.3	-73.5	0	0	0	113.4	L83 V87 L92 F93	L83-Y89 VanDerWaalsContact O-CE2 3.28Å; L83-Y89 WeakPolarHBondContact O-CE2 3.47Å; L83-Y89 PolarHBondContact O-OH 3.16Å; V87-Y89 HydrophobicContact CB-CE2 4.31Å; V87-Y89 HydrophobicContact CG1-CD1 4.15Å; V87-Y89 HydrophobicContact CG1-CE1 3.98Å; V87-Y89 HydrophobicContact CG1-CE2 4.45Å; V87-Y89 HydrophobicContact CG1-CG 4.48Å; V87-Y89 PolarHBondContact O-N 2.89Å; Y89-L92 HydrophobicContact CD1-CD2 4.22Å; Y89-L92 PolarHBondContact O-N 3.35Å; Y89-F93 HydrophobicContact CD1-CD2 4.4Å; Y89-F93 AromaticContact CD1-CE2 3.77Å; Y89-F93 HydrophobicContact CD1-CE2 3.77Å; Y89-F93 HydrophobicContact CG-CE2 4.42Å; Y89-F93 WeakPolarHBondContact O-CB 3.32Å; Y89-F93 WeakPolarHBondContact O-CD2 3.5Å; Y89-F93 PolarHBondContact O-N 3.42Å
90	D	73.7	Confident	73.6	Confident	95 Å²	95	84.9 Å²	84.9	51%	0.508	44%	0.442	S	S	.	.	H	α-helix	trans	-72.1	-36.2	-179.2	-69.4	-40.1	0	0	0	111.4	D88 A94 N95 K96	D88-D90 VanDerWaalsContact C-N 3.28Å; D88-D90 PolarHBondContact O-N 3.14Å; D88-D90 WeakPolarHBondContact OD1-CB 3.25Å; D88-D90 PolarHBondContact OD1-N 3.4Å; D90-A94 PolarHBondContact O-N 3.24Å; D90-N95 PolarHBondContact O-N 2.9Å; D90-N95 VanDerWaalsContact O-N 3.1Å; D90-K96 PolarHBondContact O-N 3.13Å
91	I	70.3	Confident	71.4	Confident	48 Å²	48	86.1 Å²	86.1	25%	0.246	45%	0.454	C	S	.	.	H	α-helix	trans	-74.1	-41.8	172.7	-59.4	174.6	0	0	0	110.1	D88 F93 A94	D88-I91 HydrophobicContact CB-CB 4.4Å; D88-I91 HydrophobicContact CB-CD1 4.05Å; D88-I91 HydrophobicContact CB-CG1 4.3Å; D88-I91 PolarHBondContact OD1-N 3.42Å; D88-I91 WeakPolarHBondContact OD2-CD1 3.3Å; I91-F93 PolarHBondContact O-N 3.05Å; I91-A94 PolarHBondContact O-N 3.29Å
92	L	70.3	Confident	69.3	Low	73 Å²	73	92.4 Å²	92.4	38%	0.382	49%	0.486	S	S	.	.	H	α-helix	trans	-65	-35.8	-178.6	-167.7	68.3	0	0	0	113	V87 D88 Y89 A115	V87-L92 HydrophobicContact CG1-CD2 4.2Å; D88-L92 WeakPolarHBondContact O-CB 3.33Å; D88-L92 PolarHBondContact O-N 2.99Å; D88-L92 VanDerWaalsContact O-N 3.14Å; Y89-L92 HydrophobicContact CD1-CD2 4.22Å; Y89-L92 PolarHBondContact O-N 3.35Å; L92-A115 HydrophobicContact CB-CB 4.44Å; L92-A115 HydrophobicContact CD1-CB 4.08Å
93	F	69.8	Low	67	Low	143 Å²	143	96.6 Å²	96.6	63%	0.627	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	9.2	178	-68.9	-63.5	0	0	0	114.1	Y89 I91 N95	Y89-F93 HydrophobicContact CD1-CD2 4.4Å; Y89-F93 AromaticContact CD1-CE2 3.77Å; Y89-F93 HydrophobicContact CD1-CE2 3.77Å; Y89-F93 HydrophobicContact CG-CE2 4.42Å; Y89-F93 WeakPolarHBondContact O-CB 3.32Å; Y89-F93 WeakPolarHBondContact O-CD2 3.5Å; Y89-F93 PolarHBondContact O-N 3.42Å; I91-F93 PolarHBondContact O-N 3.05Å; F93-N95 PolarHBondContact O-N 3.48Å; F93-N95 VanDerWaalsContact O-N 3.09Å
94	A	64.8	Low	65.1	Low	77 Å²	77	100 Å²	100	64%	0.636	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	27.5	178.9	0	0	0	0	0	114.4	D90 I91 K96	D90-A94 PolarHBondContact O-N 3.24Å; I91-A94 PolarHBondContact O-N 3.29Å; A94-K96 PolarHBondContact O-N 3.37Å
95	N	60.1	Low	63.1	Low	137 Å²	137	101 Å²	101	73%	0.733	54%	0.539	S	S	*	.			trans	-74.2	-16.3	174	-95.5	-33.8	0	0	0	112	D90 F93	D90-N95 PolarHBondContact O-N 2.9Å; D90-N95 VanDerWaalsContact O-N 3.1Å; F93-N95 PolarHBondContact O-N 3.48Å; F93-N95 VanDerWaalsContact O-N 3.09Å
96	K	51.4	Low	61.2	Low	150 Å²	150	109.1 Å²	109.1	65%	0.652	58%	0.576	S	S	*	*	S	Bend	trans	-119.6	110.9	174	-145.7	178.8	-172.8	-178.8	0	108.9	D90 A94 V98	D90-K96 PolarHBondContact O-N 3.13Å; A94-K96 PolarHBondContact O-N 3.37Å; K96-V98 PolarHBondContact O-N 3.46Å
97	M	50.4	Low	59.3	Low	169 Å²	169	114.3 Å²	114.3	83%	0.833	61%	0.609	S	S	*	*			trans	-61.8	119.2	165.1	-66.7	-177.7	163.2	0	0	107	N99	M97-N99 PolarHBondContact O-N 2.95Å
98	V	53.2	Low	57.9	Low	98 Å²	98	119.4 Å²	119.4	59%	0.594	64%	0.641	S	S	*	*			trans	-57.7	103.6	171.4	172.4	0	0	0	0	106.7	K96 H100	K96-V98 PolarHBondContact O-N 3.46Å; V98-H100 HydrophobicContact CG1-CB 4.29Å; V98-H100 WeakPolarHBondContact CG1-CD2 3.46Å; V98-H100 PolarHBondContact O-N 3.13Å
99	N	50.9	Low	56.6	Low	143 Å²	143	125.8 Å²	125.8	77%	0.765	67%	0.666	S	S	*	*			trans	-71.5	66.3	170.5	-77.6	-26.7	0	0	0	108.4	M97 S101	M97-N99 PolarHBondContact O-N 2.95Å; N99-S101 PolarHBondContact O-N 2.83Å
100	H	48.2	Very low	55.5	Low	165 Å²	165	125.9 Å²	125.9	76%	0.764	68%	0.676	S	S	*	*			trans	-74.2	77.4	153.1	-93.5	-62.3	0	0	0	107	V98 L102	V98-H100 HydrophobicContact CG1-CB 4.29Å; V98-H100 WeakPolarHBondContact CG1-CD2 3.46Å; V98-H100 PolarHBondContact O-N 3.13Å; H100-L102 PolarHBondContact O-N 2.77Å
101	S	47.6	Very low	54.8	Low	101 Å²	101	125 Å²	125	71%	0.706	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	75.8	167.2	-51.2	0	0	0	0	109.2	N99	N99-S101 PolarHBondContact O-N 2.83Å
102	L	49.3	Very low	54.5	Low	156 Å²	156	128.4 Å²	128.4	82%	0.817	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-166.9	-2.3	148.7	-138.9	72.3	0	0	0	118	H100	H100-L102 PolarHBondContact O-N 2.77Å
103	H	43	Very low	54.2	Low	159 Å²	159	128.8 Å²	128.8	74%	0.736	70%	0.699	S	S	*	*			trans	-151	109.9	173.3	-125.2	-92.1	0	0	0	112.7	T105	H103-T105 VanDerWaalsContact C-N 3.29Å; H103-T105 PolarHBondContact ND1-OG1 3.36Å; H103-T105 PolarHBondContact O-N 3.27Å; H103-T105 VanDerWaalsContact O-N 3.13Å
104	P	50.5	Low	54	Low	129 Å²	129	126.5 Å²	126.5	84%	0.838	69%	0.694	S	S	*	*			trans	-89.6	57.7	-174.9	37	-33.9	0	0	0	111.2
105	T	49.8	Very low	54.2	Low	100 Å²	100	123 Å²	123	61%	0.613	66%	0.664	S	S	*	*			trans	-144.7	120.9	174.3	15.5	0	0	0	0	110.7	H103	H103-T105 VanDerWaalsContact C-N 3.29Å; H103-T105 PolarHBondContact ND1-OG1 3.36Å; H103-T105 PolarHBondContact O-N 3.27Å; H103-T105 VanDerWaalsContact O-N 3.13Å
106	E	45.5	Very low	55.3	Low	172 Å²	172	121.3 Å²	121.3	80%	0.804	65%	0.65	S	S	*	*	S	Bend	trans	98	127.8	172.5	-51.4	-162.1	171.9	0	0	116.6	V108	E106-V108 VanDerWaalsContact C-N 3.32Å; E106-V108 PolarHBondContact O-N 3.32Å
107	P	49.3	Very low	56.7	Low	126 Å²	126	115.9 Å²	115.9	82%	0.818	63%	0.628	S	S	*	*			trans	-68.6	94.1	171.7	29.3	-31.4	0	0	0	107.8	K109	P107-K109 PolarHBondContact O-N 2.9Å
108	V	58.1	Low	58.4	Low	122 Å²	122	111.7 Å²	111.7	74%	0.739	61%	0.614	S	S	*	*			trans	-58.9	108.6	174.4	179	0	0	0	0	107.1	E106 V110	E106-V108 VanDerWaalsContact C-N 3.32Å; E106-V108 PolarHBondContact O-N 3.32Å; V108-V110 PolarHBondContact O-N 3.03Å
109	K	53.2	Low	59.8	Low	183 Å²	183	111 Å²	111	80%	0.796	62%	0.619	S	S	*	*			trans	-57.8	114.5	173.5	-78.5	179.4	174.9	177.2	0	107.1	P107 T111	P107-K109 PolarHBondContact O-N 2.9Å; K109-T111 PolarHBondContact O-N 3.34Å; K109-T111 PolarHBondContact O-OG1 3.32Å
110	V	56.1	Low	61.5	Low	97 Å²	97	112 Å²	112	59%	0.588	62%	0.619	S	S	*	*			trans	-60.8	109.4	173.2	-177.2	0	0	0	0	106.8	V108	V108-V110 PolarHBondContact O-N 3.03Å
111	T	60.2	Low	63.4	Low	76 Å²	76	107.6 Å²	107.6	47%	0.466	60%	0.603	S	S	.	*			trans	-90.1	136.3	-179.4	-29.5	0	0	0	0	107	K109 P113 D114	K109-T111 PolarHBondContact O-N 3.34Å; K109-T111 PolarHBondContact O-OG1 3.32Å; T111-P113 VanDerWaalsContact C-N 3.27Å; T111-P113 HydrophobicContact CG2-CG 3.94Å; T111-P113 VanDerWaalsContact O-N 3.1Å; T111-D114 PolarHBondContact N-OD2 2.89Å; T111-D114 WeakPolarHBondContact O-CB 3.26Å; T111-D114 PolarHBondContact O-N 3.46Å; T111-D114 PolarHBondContact OG1-OD2 2.9Å
112	L	62.8	Low	65.4	Low	121 Å²	121	103 Å²	103	63%	0.634	57%	0.571	S	S	*	*	G	3₁₀ helix	trans	-43	-38.9	175.1	-78.3	148.3	0	0	0	115.9	D114 A115	L112-D114 PolarHBondContact O-N 3.35Å; L112-A115 PolarHBondContact O-N 3.22Å
113	P	64.8	Low	67.2	Low	80 Å²	80	98.3 Å²	98.3	52%	0.519	55%	0.551	S	S	.	*	G	3₁₀ helix	trans	-65.6	-20.9	176.2	25.3	-36.5	0	0	0	114.7	T111 A115 F116	T111-P113 VanDerWaalsContact C-N 3.27Å; T111-P113 HydrophobicContact CG2-CG 3.94Å; T111-P113 VanDerWaalsContact O-N 3.1Å; P113-A115 PolarHBondContact O-N 3.1Å; P113-F116 PolarHBondContact O-N 3.1Å
114	D	64.3	Low	69.5	Low	96 Å²	96	92.7 Å²	92.7	51%	0.513	53%	0.532	S	S	.	.	G	3₁₀ helix	trans	-71.9	-17.7	176.6	-60	-38.2	0	0	0	112	T111 L112	T111-D114 PolarHBondContact N-OD2 2.89Å; T111-D114 WeakPolarHBondContact O-CB 3.26Å; T111-D114 PolarHBondContact O-N 3.46Å; T111-D114 PolarHBondContact OG1-OD2 2.9Å; L112-D114 PolarHBondContact O-N 3.35Å
115	A	69.8	Low	71.4	Confident	2 Å²	2	92.7 Å²	92.7	2%	0.017	52%	0.515	C	S	.	.	G	3₁₀ helix	trans	-88.9	-9	176.8	0	0	0	0	0	113.3	D88 L92 L112 P113	D88-A115 PolarHBondContact N-O 3Å; L92-A115 HydrophobicContact CB-CB 4.44Å; L92-A115 HydrophobicContact CD1-CB 4.08Å; L112-A115 PolarHBondContact O-N 3.22Å; P113-A115 PolarHBondContact O-N 3.1Å
116	F	82.3	Confident	73.3	Confident	102 Å²	102	89.4 Å²	89.4	45%	0.447	49%	0.494	S	S	.	.	B	Isolated β-bridge	trans	-90	117.2	178.6	-60.3	-29.4	0	0	0	110.2	F82 V87 P113	F82-F116 HydrophobicContact CE1-CD1 4.12Å; F82-F116 AromaticContact CE1-CE1 3.85Å; F82-F116 HydrophobicContact CE1-CE1 3.85Å; F82-F116 HydrophobicContact CE1-CZ 4.49Å; F82-F116 AromaticContact CZ-CD1 3.54Å; F82-F116 HydrophobicContact CZ-CD1 3.54Å; F82-F116 AromaticContact CZ-CE1 3.68Å; F82-F116 HydrophobicContact CZ-CE1 3.68Å; F82-F116 HydrophobicContact CZ-CG 4.04Å; F82-F116 HydrophobicContact CZ-CZ 4.28Å; V87-F116 HydrophobicContact CG2-CD1 4.37Å; V87-F116 HydrophobicContact CG2-CE1 4.42Å; P113-F116 PolarHBondContact O-N 3.1Å
117	L	80.7	Confident	75.4	Confident	36 Å²	36	88.2 Å²	88.2	19%	0.188	49%	0.488	C	S	.	.	P	Polyproline II helix	trans	-65.9	147	176.4	-74.1	90.3	0	0	0	110.5	C86 D88 V121	C86-L117 WeakPolarHBondContact O-CD1 3.21Å; C86-L117 PolarHBondContact O-N 3.4Å; D88-L117 HydrophobicContact CB-CD1 3.81Å; L117-V121 HydrophobicContact CD2-CB 4.42Å; L117-V121 HydrophobicContact CD2-CG1 3.72Å
118	P	86	Confident	77.4	Confident	81 Å²	81	89.9 Å²	89.9	53%	0.526	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-59.8	144.1	173.1	25	-33.2	0	0	0	110.7	Q120 V121 C122	P118-Q120 PolarHBondContact O-N 3.12Å; P118-V121 HydrophobicContact CG-CB 4.14Å; P118-V121 HydrophobicContact CG-CG2 3.78Å; P118-V121 PolarHBondContact O-N 2.99Å; P118-C122 PolarHBondContact O-N 2.82Å; P118-C122 VanDerWaalsContact O-N 3.08Å
119	A	84.1	Confident	79	Confident	85 Å²	85	87.1 Å²	87.1	70%	0.702	47%	0.466	S	S	*	.	H	α-helix	trans	-53.8	-32.9	-173	0	0	0	0	0	113.9	S123	A119-S123 WeakPolarHBondContact O-CB 3.21Å; A119-S123 PolarHBondContact O-N 3.3Å; A119-S123 PolarHBondContact O-OG 3.14Å
120	Q	86.1	Confident	80.8	Confident	164 Å²	164	80.5 Å²	80.5	77%	0.766	45%	0.45	S	S	*	.	H	α-helix	trans	-65.3	-38.7	177.4	-64.1	174	-12	0	0	113	P118 S123 A124	P118-Q120 PolarHBondContact O-N 3.12Å; Q120-S123 PolarHBondContact O-OG 3.24Å; Q120-S123 VanDerWaalsContact O-OG 3.06Å; Q120-A124 PolarHBondContact O-N 3.48Å
121	V	87.7	Confident	82.6	Confident	72 Å²	72	79.8 Å²	79.8	44%	0.436	45%	0.449	S	S	.	.	H	α-helix	trans	-79.6	-36.5	179.2	-179.7	0	0	0	0	110.1	L117 P118 A124 R125	L117-V121 HydrophobicContact CD2-CB 4.42Å; L117-V121 HydrophobicContact CD2-CG1 3.72Å; P118-V121 HydrophobicContact CG-CB 4.14Å; P118-V121 HydrophobicContact CG-CG2 3.78Å; P118-V121 PolarHBondContact O-N 2.99Å; V121-A124 PolarHBondContact O-N 3.03Å; V121-R125 WeakPolarHBondContact O-CB 3.46Å; V121-R125 PolarHBondContact O-N 3.46Å
122	C	89.8	Confident	84.1	Confident	4 Å²	4	78 Å²	78	3%	0.027	44%	0.437	C	S	.	.	H	α-helix	trans	-64.3	-43.9	175.7	-172.7	0	0	0	0	112.1	S85 C86 P118 A124 R125 I126	S85-C122 VanDerWaalsContact C-SG 3.53Å; C86-C122 WeakPolarHBondContact CA-SG 3.36Å; C86-C122 HydrophobicContact CB-CB 3.84Å; C86-C122 WeakPolarHBondContact CB-SG 3.09Å; C86-C122 PolarHBondContact N-SG 2.63Å; C86-C122 WeakPolarHBondContact SG-CB 3.15Å; C86-C122 CovalentContact SG-SG 2.02Å; C86-C122 PolarHBondContact SG-SG 3.43Å; P118-C122 PolarHBondContact O-N 2.82Å; P118-C122 VanDerWaalsContact O-N 3.08Å; C122-A124 VanDerWaalsContact C-N 3.35Å; C122-A124 PolarHBondContact O-N 2.92Å; C122-R125 PolarHBondContact O-N 2.86Å; C122-I126 VanDerWaalsContact O-CG1 3.31Å; C122-I126 WeakPolarHBondContact O-CG1 3.49Å; C122-I126 PolarHBondContact O-N 3.28Å
123	S	87.9	Confident	85.6	Confident	58 Å²	58	75.5 Å²	75.5	41%	0.406	42%	0.423	S	S	.	.	H	α-helix	trans	-63.6	-40.4	177.8	61.8	0	0	0	0	112.3	A119 Q120 I126 Q127	A119-S123 WeakPolarHBondContact O-CB 3.21Å; A119-S123 PolarHBondContact O-N 3.3Å; A119-S123 PolarHBondContact O-OG 3.14Å; Q120-S123 PolarHBondContact O-OG 3.24Å; Q120-S123 VanDerWaalsContact O-OG 3.06Å; S123-I126 PolarHBondContact O-N 3.28Å; S123-Q127 WeakPolarHBondContact O-CG 3.36Å; S123-Q127 PolarHBondContact O-N 3.45Å
124	A	90.9	Very high	87	Confident	40 Å²	40	75.6 Å²	75.6	33%	0.331	42%	0.422	S	S	.	.	H	α-helix	trans	-59.7	-46.5	173.9	0	0	0	0	0	111.6	Q120 V121 C122 I126 Q127 E128	Q120-A124 PolarHBondContact O-N 3.48Å; V121-A124 PolarHBondContact O-N 3.03Å; C122-A124 VanDerWaalsContact C-N 3.35Å; C122-A124 PolarHBondContact O-N 2.92Å; A124-I126 VanDerWaalsContact C-N 3.34Å; A124-I126 PolarHBondContact O-N 3.38Å; A124-Q127 PolarHBondContact O-N 3.4Å; A124-Q127 VanDerWaalsContact O-N 3.12Å; A124-E128 WeakPolarHBondContact O-CG 3.48Å; A124-E128 PolarHBondContact O-N 3.49Å
125	R	89.4	Confident	88.4	Confident	129 Å²	129	76.1 Å²	76.1	49%	0.487	42%	0.424	S	S	.	.	H	α-helix	trans	-63.3	-36.3	177.1	-177.7	172.5	-76.5	-134.6	1.6	113	S85 V121 C122 Q127 N129	S85-R125 WeakPolarHBondContact O-CD 3.16Å; V121-R125 WeakPolarHBondContact O-CB 3.46Å; V121-R125 PolarHBondContact O-N 3.46Å; C122-R125 PolarHBondContact O-N 2.86Å; R125-Q127 VanDerWaalsContact C-N 3.34Å; R125-N129 PolarHBondContact O-N 2.79Å; R125-N129 PolarHBondContact O-ND2 3.18Å
126	I	90.1	Very high	89.6	Confident	31 Å²	31	78.2 Å²	78.2	16%	0.159	43%	0.434	C	S	.	.	H	α-helix	trans	-65.3	-41.7	173.9	-68.3	166	0	0	0	110.3	T81 S85 C122 S123 A124 N129 L136	T81-I126 HydrophobicContact CG2-CD1 3.94Å; T81-I126 HydrophobicContact CG2-CG1 4.32Å; S85-I126 VanDerWaalsContact CB-CG1 3.44Å; S85-I126 WeakPolarHBondContact OG-CG1 3.36Å; C122-I126 VanDerWaalsContact O-CG1 3.31Å; C122-I126 WeakPolarHBondContact O-CG1 3.49Å; C122-I126 PolarHBondContact O-N 3.28Å; S123-I126 PolarHBondContact O-N 3.28Å; A124-I126 VanDerWaalsContact C-N 3.34Å; A124-I126 PolarHBondContact O-N 3.38Å; I126-N129 PolarHBondContact O-N 3.48Å; I126-L136 HydrophobicContact CG2-CD1 3.86Å
127	Q	89.5	Confident	90.3	Very high	147 Å²	147	77.4 Å²	77.4	69%	0.687	44%	0.438	S	S	*	.	H	α-helix	trans	-69.8	-34.2	-179.2	-74.3	179.2	-25.6	0	0	113.3	S123 A124 R125 N129	S123-Q127 WeakPolarHBondContact O-CG 3.36Å; S123-Q127 PolarHBondContact O-N 3.45Å; A124-Q127 PolarHBondContact O-N 3.4Å; A124-Q127 VanDerWaalsContact O-N 3.12Å; R125-Q127 VanDerWaalsContact C-N 3.34Å; Q127-N129 PolarHBondContact O-N 2.86Å
128	E	91.8	Very high	91	Very high	162 Å²	162	81.1 Å²	81.1	76%	0.757	46%	0.457	S	S	*	.	H	α-helix	trans	-65.7	-28	174	-74	178.9	173.6	0	0	112.3	A124 G130	A124-E128 WeakPolarHBondContact O-CG 3.48Å; A124-E128 PolarHBondContact O-N 3.49Å; E128-G130 PolarHBondContact O-N 3.38Å
129	N	91.5	Very high	91.5	Very high	64 Å²	64	78 Å²	78	34%	0.342	44%	0.438	S	S	.	.			trans	-86.8	86.9	-179.7	-73.4	-52.7	0	0	0	112.3	R125 I126 Q127 S131 L132 I133	R125-N129 PolarHBondContact O-N 2.79Å; R125-N129 PolarHBondContact O-ND2 3.18Å; I126-N129 PolarHBondContact O-N 3.48Å; Q127-N129 PolarHBondContact O-N 2.86Å; N129-S131 VanDerWaalsContact C-N 3.26Å; N129-S131 PolarHBondContact O-N 2.83Å; N129-L132 HydrophobicContact CB-CB 3.94Å; N129-L132 HydrophobicContact CB-CD1 3.74Å; N129-L132 HydrophobicContact CB-CG 4.01Å; N129-L132 PolarHBondContact O-N 3.21Å; N129-L132 VanDerWaalsContact O-N 3.1Å; N129-I133 PolarHBondContact O-N 3.5Å
130	G	91.4	Very high	92.1	Very high	43 Å²	43	75.5 Å²	75.5	44%	0.443	42%	0.42	S	S	.	.	H	α-helix	trans	-53.8	-33.7	179.3	0	0	0	0	0	115.6	E128 I133 T134	E128-G130 PolarHBondContact O-N 3.38Å; G130-I133 WeakPolarHBondContact O-CG2 3.42Å; G130-T134 PolarHBondContact O-N 3.22Å; G130-T134 PolarHBondContact O-OG1 3.19Å
131	S	92.7	Very high	92.6	Very high	82 Å²	82	72.3 Å²	72.3	57%	0.573	41%	0.412	S	S	*	.	H	α-helix	trans	-71.3	-44.7	176.1	53.5	0	0	0	0	112.2	N129 T134 I135	N129-S131 VanDerWaalsContact C-N 3.26Å; N129-S131 PolarHBondContact O-N 2.83Å; S131-T134 PolarHBondContact O-N 3.24Å; S131-I135 WeakPolarHBondContact O-CG1 3.39Å; S131-I135 PolarHBondContact O-N 2.83Å; S131-I135 VanDerWaalsContact O-N 3.1Å
132	L	92.1	Very high	93	Very high	40 Å²	40	73.9 Å²	73.9	21%	0.209	41%	0.413	C	S	.	.	H	α-helix	trans	-64.2	-44.5	178.5	-70.9	178	0	0	0	111.3	V84 N129 T134 I135 L136	V84-L132 HydrophobicContact CG1-CD1 3.8Å; V84-L132 HydrophobicContact CG1-CD2 4.43Å; N129-L132 HydrophobicContact CB-CB 3.94Å; N129-L132 HydrophobicContact CB-CD1 3.74Å; N129-L132 HydrophobicContact CB-CG 4.01Å; N129-L132 PolarHBondContact O-N 3.21Å; N129-L132 VanDerWaalsContact O-N 3.1Å; L132-T134 VanDerWaalsContact C-N 3.28Å; L132-T134 PolarHBondContact O-N 3.06Å; L132-I135 PolarHBondContact O-N 3.18Å; L132-L136 WeakPolarHBondContact O-CB 3.45Å; L132-L136 WeakPolarHBondContact O-CG 3.47Å; L132-L136 PolarHBondContact O-N 3.18Å
133	I	93.8	Very high	93.3	Very high	68 Å²	68	76.6 Å²	76.6	35%	0.349	42%	0.423	S	S	.	.	H	α-helix	trans	-62	-38	178.1	-166.9	66.3	0	0	0	111.5	N129 G130 L136 V137	N129-I133 PolarHBondContact O-N 3.5Å; G130-I133 WeakPolarHBondContact O-CG2 3.42Å; I133-L136 PolarHBondContact O-N 3.39Å; I133-V137 HydrophobicContact CG1-CG2 4.5Å; I133-V137 WeakPolarHBondContact O-CG2 3.31Å; I133-V137 PolarHBondContact O-N 2.87Å
134	T	94.5	Very high	93.7	Very high	81 Å²	81	77.8 Å²	77.8	50%	0.497	42%	0.423	S	S	.	.	H	α-helix	trans	-63.1	-45.2	176.5	-57	0	0	0	0	111.3	G130 S131 L132 V137 I138	G130-T134 PolarHBondContact O-N 3.22Å; G130-T134 PolarHBondContact O-OG1 3.19Å; S131-T134 PolarHBondContact O-N 3.24Å; L132-T134 VanDerWaalsContact C-N 3.28Å; L132-T134 PolarHBondContact O-N 3.06Å; T134-V137 PolarHBondContact O-N 3.1Å; T134-I138 HydrophobicContact CG2-CD1 4.16Å; T134-I138 WeakPolarHBondContact O-CG1 3.29Å; T134-I138 PolarHBondContact O-N 2.68Å; T134-I138 VanDerWaalsContact O-N 3.1Å
135	I	94.8	Very high	93.9	Very high	107 Å²	107	81.7 Å²	81.7	55%	0.549	43%	0.434	S	S	.	.	H	α-helix	trans	-62.4	-43.9	176.3	-66.5	166.8	0	0	0	110.7	S131 L132 V137 I138 A139	S131-I135 WeakPolarHBondContact O-CG1 3.39Å; S131-I135 PolarHBondContact O-N 2.83Å; S131-I135 VanDerWaalsContact O-N 3.1Å; L132-I135 PolarHBondContact O-N 3.18Å; I135-V137 VanDerWaalsContact C-N 3.35Å; I135-V137 PolarHBondContact O-N 2.8Å; I135-I138 PolarHBondContact O-N 3.01Å; I135-A139 WeakPolarHBondContact O-CB 3.39Å; I135-A139 PolarHBondContact O-N 3.15Å
136	L	95	Very high	94.1	Very high	46 Å²	46	78.8 Å²	78.8	24%	0.241	42%	0.423	C	S	.	.	H	α-helix	trans	-62.2	-39.6	177.7	-75.1	176.8	0	0	0	112.5	V77 T81 I126 L132 I133 G140	V77-L136 HydrophobicContact CG1-CD2 3.74Å; T81-L136 HydrophobicContact CG2-CD1 4.02Å; T81-L136 HydrophobicContact CG2-CD2 4.36Å; T81-L136 WeakPolarHBondContact OG1-CD2 3.31Å; I126-L136 HydrophobicContact CG2-CD1 3.86Å; L132-L136 WeakPolarHBondContact O-CB 3.45Å; L132-L136 WeakPolarHBondContact O-CG 3.47Å; L132-L136 PolarHBondContact O-N 3.18Å; I133-L136 PolarHBondContact O-N 3.39Å; L136-G140 PolarHBondContact O-N 3.19Å
137	V	96.2	Very high	94.3	Very high	85 Å²	85	79.4 Å²	79.4	52%	0.515	43%	0.427	S	S	.	.	H	α-helix	trans	-63.9	-47.7	176.1	172.8	0	0	0	0	110.7	I133 T134 I135 A139 G140 V141	I133-V137 HydrophobicContact CG1-CG2 4.5Å; I133-V137 WeakPolarHBondContact O-CG2 3.31Å; I133-V137 PolarHBondContact O-N 2.87Å; T134-V137 PolarHBondContact O-N 3.1Å; I135-V137 VanDerWaalsContact C-N 3.35Å; I135-V137 PolarHBondContact O-N 2.8Å; V137-A139 PolarHBondContact O-N 3.29Å; V137-G140 PolarHBondContact O-N 3.43Å; V137-V141 WeakPolarHBondContact O-CG2 3.48Å; V137-V141 PolarHBondContact O-N 2.93Å
138	I	96.5	Very high	94.4	Very high	115 Å²	115	77.5 Å²	77.5	59%	0.59	42%	0.42	S	S	*	.	H	α-helix	trans	-62.1	-46.5	179	-64.7	166.2	0	0	0	110.6	T134 I135 G140 V141 F142	T134-I138 HydrophobicContact CG2-CD1 4.16Å; T134-I138 WeakPolarHBondContact O-CG1 3.29Å; T134-I138 PolarHBondContact O-N 2.68Å; T134-I138 VanDerWaalsContact O-N 3.1Å; I135-I138 PolarHBondContact O-N 3.01Å; I138-G140 VanDerWaalsContact C-N 3.3Å; I138-G140 PolarHBondContact O-N 3.44Å; I138-V141 PolarHBondContact O-N 3.07Å; I138-F142 WeakPolarHBondContact O-CB 3.2Å; I138-F142 PolarHBondContact O-N 3.46Å
139	A	96	Very high	94.3	Very high	16 Å²	16	76 Å²	76	13%	0.132	41%	0.411	C	S	.	.	H	α-helix	trans	-60.6	-40.3	176.3	0	0	0	0	0	111.7	F73 V77 I135 V137 F142 W143	F73-A139 HydrophobicContact CE1-CB 4.33Å; F73-A139 HydrophobicContact CZ-CB 4.05Å; V77-A139 HydrophobicContact CG1-CB 4.35Å; V77-A139 HydrophobicContact CG2-CB 4.35Å; I135-A139 WeakPolarHBondContact O-CB 3.39Å; I135-A139 PolarHBondContact O-N 3.15Å; V137-A139 PolarHBondContact O-N 3.29Å; A139-F142 PolarHBondContact O-N 3.1Å; A139-W143 VanDerWaalsContact O-CB 3.3Å; A139-W143 WeakPolarHBondContact O-CB 3.27Å; A139-W143 PolarHBondContact O-N 3.26Å
140	G	96.1	Very high	94.1	Very high	32 Å²	32	74 Å²	74	33%	0.33	40%	0.4	S	S	.	.	H	α-helix	trans	-62.4	-49	175.8	0	0	0	0	0	112.4	L136 V137 I138 F142 W143 I144	L136-G140 PolarHBondContact O-N 3.19Å; V137-G140 PolarHBondContact O-N 3.43Å; I138-G140 VanDerWaalsContact C-N 3.3Å; I138-G140 PolarHBondContact O-N 3.44Å; G140-F142 VanDerWaalsContact C-N 3.34Å; G140-F142 PolarHBondContact O-N 3.4Å; G140-W143 PolarHBondContact O-N 3.37Å; G140-I144 WeakPolarHBondContact O-CB 3.5Å; G140-I144 VanDerWaalsContact O-CG1 3.25Å; G140-I144 WeakPolarHBondContact O-CG1 3.27Å; G140-I144 PolarHBondContact O-N 3.45Å
141	V	97.1	Very high	93.9	Very high	96 Å²	96	75.8 Å²	75.8	58%	0.582	40%	0.398	S	S	*	.	H	α-helix	trans	-60.1	-45.3	177.3	172.3	0	0	0	0	111.1	V137 I138 W143 I144 H145	V137-V141 WeakPolarHBondContact O-CG2 3.48Å; V137-V141 PolarHBondContact O-N 2.93Å; I138-V141 PolarHBondContact O-N 3.07Å; V141-W143 VanDerWaalsContact C-N 3.35Å; V141-W143 PolarHBondContact O-N 3Å; V141-I144 PolarHBondContact O-N 2.98Å; V141-H145 WeakPolarHBondContact O-CB 3.26Å; V141-H145 PolarHBondContact O-N 2.81Å
142	F	96.5	Very high	93.6	Very high	106 Å²	106	78.8 Å²	78.8	47%	0.465	40%	0.398	S	S	.	.	H	α-helix	trans	-61.1	-43.8	176.7	176.6	-101.2	0	0	0	112.1	F73 I138 A139 G140 H145 R146	F73-F142 HydrophobicContact CD2-CD1 4.46Å; F73-F142 HydrophobicContact CD2-CE1 4.28Å; F73-F142 AromaticContact CE2-CD1 3.73Å; F73-F142 HydrophobicContact CE2-CD1 3.73Å; F73-F142 AromaticContact CE2-CE1 3.88Å; F73-F142 HydrophobicContact CE2-CE1 3.88Å; F73-F142 AromaticContact CZ-CD1 3.76Å; F73-F142 HydrophobicContact CZ-CD1 3.76Å; F73-F142 HydrophobicContact CZ-CE1 4.37Å; I138-F142 WeakPolarHBondContact O-CB 3.2Å; I138-F142 PolarHBondContact O-N 3.46Å; A139-F142 PolarHBondContact O-N 3.1Å; G140-F142 VanDerWaalsContact C-N 3.34Å; G140-F142 PolarHBondContact O-N 3.4Å; F142-H145 PolarHBondContact O-N 3.27Å; F142-R146 WeakPolarHBondContact O-CB 3.2Å; F142-R146 PolarHBondContact O-N 2.93Å
143	W	96.5	Very high	93	Very high	61 Å²	61	79 Å²	79	23%	0.231	40%	0.399	C	S	.	.	H	α-helix	trans	-64.3	-43.2	177.6	-173.5	83.1	0	0	0	112	L70 F73 A139 G140 V141 R146 L147	L70-W143 PolarHBondContact O-NE1 3.34Å; F73-W143 HydrophobicContact CD1-CB 4.11Å; F73-W143 AromaticContact CD1-CD1 3.43Å; F73-W143 VanDerWaalsContact CD1-CD1 3.43Å; F73-W143 HydrophobicContact CD1-CG 4.09Å; F73-W143 HydrophobicContact CE1-CB 3.82Å; F73-W143 HydrophobicContact CE1-CG 4.28Å; A139-W143 VanDerWaalsContact O-CB 3.3Å; A139-W143 WeakPolarHBondContact O-CB 3.27Å; A139-W143 PolarHBondContact O-N 3.26Å; G140-W143 PolarHBondContact O-N 3.37Å; V141-W143 VanDerWaalsContact C-N 3.35Å; V141-W143 PolarHBondContact O-N 3Å; W143-R146 PolarHBondContact O-N 3.46Å; W143-L147 HydrophobicContact CE3-CD2 4.45Å; W143-L147 HydrophobicContact CH2-CD1 4.45Å; W143-L147 HydrophobicContact CH2-CD2 3.75Å; W143-L147 HydrophobicContact CZ3-CB 4.49Å; W143-L147 HydrophobicContact CZ3-CD2 3.66Å; W143-L147 WeakPolarHBondContact O-CB 3.49Å; W143-L147 PolarHBondContact O-N 3.45Å
144	I	96.1	Very high	92.4	Very high	82 Å²	82	78.1 Å²	78.1	42%	0.421	40%	0.395	S	S	.	.	H	α-helix	trans	-62.6	-44.9	176.4	-67.9	-66.8	0	0	0	111.1	G140 V141 R146 L147 I148	G140-I144 WeakPolarHBondContact O-CB 3.5Å; G140-I144 VanDerWaalsContact O-CG1 3.25Å; G140-I144 WeakPolarHBondContact O-CG1 3.27Å; G140-I144 PolarHBondContact O-N 3.45Å; V141-I144 PolarHBondContact O-N 2.98Å; I144-R146 VanDerWaalsContact C-N 3.29Å; I144-R146 PolarHBondContact O-N 2.88Å; I144-L147 WeakPolarHBondContact O-CB 3.49Å; I144-L147 PolarHBondContact O-N 3.5Å; I144-I148 HydrophobicContact CG2-CD1 3.83Å; I144-I148 HydrophobicContact CG2-CG1 4.36Å; I144-I148 VanDerWaalsContact O-CG1 3.31Å; I144-I148 WeakPolarHBondContact O-CG1 3.4Å; I144-I148 PolarHBondContact O-N 3.4Å
145	H	95.3	Very high	91.7	Very high	122 Å²	122	77.7 Å²	77.7	57%	0.565	39%	0.394	S	S	*	.	H	α-helix	trans	-57	-44.9	174.6	169.6	-95.3	0	0	0	111.5	V141 F142 I148 K149	V141-H145 WeakPolarHBondContact O-CB 3.26Å; V141-H145 PolarHBondContact O-N 2.81Å; F142-H145 PolarHBondContact O-N 3.27Å; H145-I148 PolarHBondContact O-N 2.95Å; H145-K149 PolarHBondContact O-N 2.85Å; H145-K149 VanDerWaalsContact O-N 3.12Å
146	R	93.4	Very high	90.7	Very high	68 Å²	68	73.6 Å²	73.6	26%	0.257	38%	0.375	S	S	.	.	H	α-helix	trans	-66	-38.1	177.2	-164.3	-179.2	178.1	-178.3	11.4	112.1	E69 L70 F142 W143 I144 K149 F150	E69-R146 PolarHBondContact O-NH1 2.78Å; E69-R146 IonicContact OE2-CZ 3.89Å; E69-R146 IonicContact OE2-NH2 3.83Å; E69-R146 PolarHBondContact OE2-NH2 3.32Å; L70-R146 HydrophobicContact CD2-CB 3.94Å; L70-R146 HydrophobicContact CD2-CG 3.72Å; L70-R146 HydrophobicContact CG-CG 4.49Å; F142-R146 WeakPolarHBondContact O-CB 3.2Å; F142-R146 PolarHBondContact O-N 2.93Å; W143-R146 PolarHBondContact O-N 3.46Å; I144-R146 VanDerWaalsContact C-N 3.29Å; I144-R146 PolarHBondContact O-N 2.88Å; R146-K149 PolarHBondContact O-N 3.08Å; R146-F150 WeakPolarHBondContact O-CB 3.28Å; R146-F150 PolarHBondContact O-N 2.96Å
147	L	92.9	Very high	89.4	Confident	44 Å²	44	73.7 Å²	73.7	23%	0.23	37%	0.372	C	S	.	.	H	α-helix	trans	-64.7	-44.2	175.8	-178.8	68.8	0	0	0	111.5	L70 W143 I144 K149 F150 I151	L70-L147 HydrophobicContact CD1-CD1 4.32Å; W143-L147 HydrophobicContact CE3-CD2 4.45Å; W143-L147 HydrophobicContact CH2-CD1 4.45Å; W143-L147 HydrophobicContact CH2-CD2 3.75Å; W143-L147 HydrophobicContact CZ3-CB 4.49Å; W143-L147 HydrophobicContact CZ3-CD2 3.66Å; W143-L147 WeakPolarHBondContact O-CB 3.49Å; W143-L147 PolarHBondContact O-N 3.45Å; I144-L147 WeakPolarHBondContact O-CB 3.49Å; I144-L147 PolarHBondContact O-N 3.5Å; L147-K149 VanDerWaalsContact C-N 3.31Å; L147-K149 PolarHBondContact O-N 2.92Å; L147-F150 HydrophobicContact CD1-CD1 4.41Å; L147-F150 WeakPolarHBondContact O-CB 3.37Å; L147-F150 PolarHBondContact O-N 3.03Å; L147-F150 VanDerWaalsContact O-N 3.16Å; L147-I151 HydrophobicContact CD1-CD1 4.2Å; L147-I151 HydrophobicContact CD1-CG1 4.33Å; L147-I151 HydrophobicContact CD2-CD1 4.27Å; L147-I151 HydrophobicContact CG-CD1 3.81Å; L147-I151 HydrophobicContact CG-CG1 4.33Å; L147-I151 WeakPolarHBondContact O-CG1 3.42Å; L147-I151 PolarHBondContact O-N 3.32Å
148	I	93.1	Very high	88	Confident	107 Å²	107	78.2 Å²	78.2	55%	0.549	38%	0.38	S	S	.	.	H	α-helix	trans	-59.6	-45.2	176.8	-69.1	165.2	0	0	0	110.1	I144 H145 F150 I151 Y152	I144-I148 HydrophobicContact CG2-CD1 3.83Å; I144-I148 HydrophobicContact CG2-CG1 4.36Å; I144-I148 VanDerWaalsContact O-CG1 3.31Å; I144-I148 WeakPolarHBondContact O-CG1 3.4Å; I144-I148 PolarHBondContact O-N 3.4Å; H145-I148 PolarHBondContact O-N 2.95Å; I148-F150 VanDerWaalsContact C-N 3.31Å; I148-F150 PolarHBondContact O-N 3.47Å; I148-I151 PolarHBondContact O-N 3.37Å; I148-Y152 WeakPolarHBondContact O-CB 3.31Å; I148-Y152 PolarHBondContact O-N 3.13Å
149	K	89.1	Confident	86.7	Confident	131 Å²	131	78.7 Å²	78.7	57%	0.57	38%	0.38	S	S	*	.	H	α-helix	trans	-59	-43.3	175.6	-176.5	178.1	178.9	-179.3	0	111.7	H145 R146 L147 Y152 N153	H145-K149 PolarHBondContact O-N 2.85Å; H145-K149 VanDerWaalsContact O-N 3.12Å; R146-K149 PolarHBondContact O-N 3.08Å; L147-K149 VanDerWaalsContact C-N 3.31Å; L147-K149 PolarHBondContact O-N 2.92Å; K149-Y152 PolarHBondContact O-N 3.03Å; K149-N153 PolarHBondContact O-N 3.37Å; K149-N153 PolarHBondContact O-ND2 3.46Å; K149-N153 PolarHBondContact O-OD1 3.38Å
150	F	87.4	Confident	85.2	Confident	22 Å²	22	78.8 Å²	78.8	10%	0.096	38%	0.378	C	S	.	.	H	α-helix	trans	-64.4	-46	176.8	177.1	-108.1	0	0	0	112.3	L63 E66 M67 L70 R146 L147 I148 Y152 N153 I154	L63-F150 HydrophobicContact CD2-CE2 4.39Å; L63-F150 HydrophobicContact CD2-CZ 4.11Å; L63-F150 HydrophobicContact CG-CE2 3.94Å; L63-F150 HydrophobicContact CG-CZ 4.12Å; L63-F150 WeakPolarHBondContact O-CE2 3.12Å; E66-F150 HydrophobicContact CB-CD2 3.77Å; E66-F150 HydrophobicContact CB-CE2 3.83Å; M67-F150 HydrophobicContact CB-CE2 4.32Å; M67-F150 HydrophobicContact CB-CZ 3.89Å; M67-F150 HydrophobicContact CG-CZ 4.5Å; L70-F150 HydrophobicContact CD1-CB 3.74Å; L70-F150 HydrophobicContact CD1-CD1 3.74Å; L70-F150 HydrophobicContact CD1-CD2 4.19Å; L70-F150 HydrophobicContact CD1-CE1 4.34Å; L70-F150 HydrophobicContact CD1-CG 3.63Å; R146-F150 WeakPolarHBondContact O-CB 3.28Å; R146-F150 PolarHBondContact O-N 2.96Å; L147-F150 HydrophobicContact CD1-CD1 4.41Å; L147-F150 WeakPolarHBondContact O-CB 3.37Å; L147-F150 PolarHBondContact O-N 3.03Å; L147-F150 VanDerWaalsContact O-N 3.16Å; I148-F150 VanDerWaalsContact C-N 3.31Å; I148-F150 PolarHBondContact O-N 3.47Å; F150-Y152 VanDerWaalsContact C-N 3.34Å; F150-Y152 PolarHBondContact O-N 2.93Å; F150-N153 WeakPolarHBondContact O-CB 3.31Å; F150-N153 PolarHBondContact O-N 2.02Å; F150-I154 HydrophobicContact CD1-CD1 3.79Å; F150-I154 HydrophobicContact CE1-CD1 3.24Å; F150-I154 HydrophobicContact CE1-CG1 4.31Å; F150-I154 HydrophobicContact CE2-CD1 4.08Å; F150-I154 HydrophobicContact CE2-CG1 4.46Å; F150-I154 HydrophobicContact CG-CD1 4.43Å; F150-I154 HydrophobicContact CZ-CD1 3.42Å; F150-I154 VanDerWaalsContact CZ-CD1 3.42Å; F150-I154 HydrophobicContact CZ-CG1 4.26Å; F150-I154 WeakPolarHBondContact O-CG1 3.11Å; F150-I154 PolarHBondContact O-N 3.45Å
151	I	86.9	Confident	83.6	Confident	80 Å²	80	80 Å²	80	41%	0.41	38%	0.375	S	S	.	.	H	α-helix	trans	-62.2	-43	176.9	-67.6	169.2	0	0	0	110.6	L147 I148 N153 I154 C155	L147-I151 HydrophobicContact CD1-CD1 4.2Å; L147-I151 HydrophobicContact CD1-CG1 4.33Å; L147-I151 HydrophobicContact CD2-CD1 4.27Å; L147-I151 HydrophobicContact CG-CD1 3.81Å; L147-I151 HydrophobicContact CG-CG1 4.33Å; L147-I151 WeakPolarHBondContact O-CG1 3.42Å; L147-I151 PolarHBondContact O-N 3.32Å; I148-I151 PolarHBondContact O-N 3.37Å; I151-N153 VanDerWaalsContact C-N 3.31Å; I151-N153 PolarHBondContact O-N 3.48Å; I151-I154 CarbonylContact O-C 3.59Å; I151-I154 WeakPolarHBondContact O-CB 3.37Å; I151-I154 PolarHBondContact O-N 2.96Å; I151-I154 VanDerWaalsContact O-N 3.11Å; I151-C155 PolarHBondContact O-N 3.47Å; I151-C155 PolarHBondContact O-SG 2.96Å; I151-C155 VanDerWaalsContact O-SG 3.34Å
152	Y	86.3	Confident	82	Confident	146 Å²	146	77.1 Å²	77.1	57%	0.573	36%	0.359	S	S	*	.	H	α-helix	trans	-57.6	-45.8	175	178.9	-97.5	0	0	0	111.4	I148 K149 F150 I154 C155 C156	I148-Y152 WeakPolarHBondContact O-CB 3.31Å; I148-Y152 PolarHBondContact O-N 3.13Å; K149-Y152 PolarHBondContact O-N 3.03Å; F150-Y152 VanDerWaalsContact C-N 3.34Å; F150-Y152 PolarHBondContact O-N 2.93Å; Y152-I154 VanDerWaalsContact C-N 3.3Å; Y152-I154 PolarHBondContact O-N 2.96Å; Y152-C155 PolarHBondContact O-N 3.5Å; Y152-C156 PolarHBondContact O-N 2.85Å; Y152-C156 PolarHBondContact O-SG 2.98Å; Y152-C156 VanDerWaalsContact O-SG 3.34Å
153	N	80.4	Confident	80.5	Confident	43 Å²	43	73.8 Å²	73.8	23%	0.23	34%	0.344	C	S	.	.	H	α-helix	trans	-59.2	-40.5	175.1	-69.3	-16.1	0	0	0	112	E66 K149 F150 I151 Y157	E66-N153 PolarHBondContact OE2-ND2 2.79Å; K149-N153 PolarHBondContact O-N 3.37Å; K149-N153 PolarHBondContact O-ND2 3.46Å; K149-N153 PolarHBondContact O-OD1 3.38Å; F150-N153 WeakPolarHBondContact O-CB 3.31Å; F150-N153 PolarHBondContact O-N 2.02Å; I151-N153 VanDerWaalsContact C-N 3.31Å; I151-N153 PolarHBondContact O-N 3.48Å; N153-Y157 PolarHBondContact O-N 3.3Å
154	I	79.9	Confident	78.7	Confident	50 Å²	50	73.1 Å²	73.1	26%	0.256	34%	0.342	S	S	.	.	H	α-helix	trans	-67.5	-47	176.3	-68.8	-179.9	0	0	0	111.9	L63 F150 I151 Y152 C156 Y157 W158	L63-I154 HydrophobicContact CD1-CD1 4.21Å; L63-I154 HydrophobicContact CD1-CG1 3.65Å; L63-I154 HydrophobicContact CG-CD1 4.44Å; L63-I154 HydrophobicContact CG-CG1 4.26Å; F150-I154 HydrophobicContact CD1-CD1 3.79Å; F150-I154 HydrophobicContact CE1-CD1 3.24Å; F150-I154 HydrophobicContact CE1-CG1 4.31Å; F150-I154 HydrophobicContact CE2-CD1 4.08Å; F150-I154 HydrophobicContact CE2-CG1 4.46Å; F150-I154 HydrophobicContact CG-CD1 4.43Å; F150-I154 HydrophobicContact CZ-CD1 3.42Å; F150-I154 VanDerWaalsContact CZ-CD1 3.42Å; F150-I154 HydrophobicContact CZ-CG1 4.26Å; F150-I154 WeakPolarHBondContact O-CG1 3.11Å; F150-I154 PolarHBondContact O-N 3.45Å; I151-I154 CarbonylContact O-C 3.59Å; I151-I154 WeakPolarHBondContact O-CB 3.37Å; I151-I154 PolarHBondContact O-N 2.96Å; I151-I154 VanDerWaalsContact O-N 3.11Å; Y152-I154 VanDerWaalsContact C-N 3.3Å; Y152-I154 PolarHBondContact O-N 2.96Å; I154-C156 VanDerWaalsContact C-N 3.33Å; I154-C156 PolarHBondContact O-N 2.82Å; I154-Y157 CarbonylContact O-C 3.54Å; I154-Y157 WeakPolarHBondContact O-CA 3.28Å; I154-Y157 WeakPolarHBondContact O-CB 3.42Å; I154-Y157 PolarHBondContact O-N 2.99Å; I154-W158 PolarHBondContact O-N 3.37Å
155	C	80.8	Confident	77.1	Confident	72 Å²	72	72.8 Å²	72.8	49%	0.486	34%	0.341	S	S	.	.	H	α-helix	trans	-61.3	-44.7	-178.7	-71.6	0	0	0	0	110.9	I151 Y152 Y157 W158 E159	I151-C155 PolarHBondContact O-N 3.47Å; I151-C155 PolarHBondContact O-SG 2.96Å; I151-C155 VanDerWaalsContact O-SG 3.34Å; Y152-C155 PolarHBondContact O-N 3.5Å; C155-Y157 PolarHBondContact O-N 3.3Å; C155-W158 PolarHBondContact O-N 3.33Å; C155-W158 VanDerWaalsContact O-N 3.13Å; C155-E159 PolarHBondContact O-N 3.02Å
156	C	73.4	Confident	75.6	Confident	21 Å²	21	73.6 Å²	73.6	14%	0.142	35%	0.345	C	S	.	.	H	α-helix	trans	-57	-39.5	172.2	-69.5	0	0	0	0	111.6	Y152 I154 I160	Y152-C156 PolarHBondContact O-N 2.85Å; Y152-C156 PolarHBondContact O-SG 2.98Å; Y152-C156 VanDerWaalsContact O-SG 3.34Å; I154-C156 VanDerWaalsContact C-N 3.33Å; I154-C156 PolarHBondContact O-N 2.82Å; C156-I160 VanDerWaalsContact O-CD1 3.31Å; C156-I160 WeakPolarHBondContact O-CD1 3.03Å; C156-I160 WeakPolarHBondContact O-CG1 3.4Å; C156-I160 PolarHBondContact O-N 2.98Å
157	Y	68.1	Low	74.3	Confident	49 Å²	49	73.3 Å²	73.3	19%	0.192	36%	0.357	C	S	.	.	H	α-helix	trans	-68.4	-38	176.2	-176.9	-98.9	0	0	0	113.3	L53 F59 N153 I154 C155 I160 H161	L53-Y157 HydrophobicContact CD1-CE2 4.28Å; L53-Y157 HydrophobicContact CD2-CE2 3.93Å; F59-Y157 HydrophobicContact CB-CE2 4.25Å; F59-Y157 HydrophobicContact CD1-CD1 4.23Å; F59-Y157 AromaticContact CD1-CD2 3.19Å; F59-Y157 HydrophobicContact CD1-CD2 3.19Å; F59-Y157 HydrophobicContact CD1-CE1 4.28Å; F59-Y157 AromaticContact CD1-CE2 3.22Å; F59-Y157 HydrophobicContact CD1-CE2 3.22Å; F59-Y157 AromaticContact CD1-CG 3.71Å; F59-Y157 HydrophobicContact CD1-CG 3.71Å; F59-Y157 AromaticContact CD1-CZ 3.8Å; F59-Y157 HydrophobicContact CD2-CD2 4.4Å; F59-Y157 VanDerWaalsContact CE1-CB 3.47Å; F59-Y157 AromaticContact CE1-CD1 3.82Å; F59-Y157 HydrophobicContact CE1-CD1 3.82Å; F59-Y157 AromaticContact CE1-CD2 3.09Å; F59-Y157 HydrophobicContact CE1-CD2 3.09Å; F59-Y157 HydrophobicContact CE1-CE1 4.32Å; F59-Y157 AromaticContact CE1-CE2 3.66Å; F59-Y157 HydrophobicContact CE1-CE2 3.66Å; F59-Y157 AromaticContact CE1-CG 3.16Å; F59-Y157 HydrophobicContact CE1-CG 3.16Å; F59-Y157 HydrophobicContact CE2-CD2 4.32Å; F59-Y157 AromaticContact CG-CD2 3.9Å; F59-Y157 HydrophobicContact CG-CD2 3.9Å; F59-Y157 AromaticContact CG-CE2 3.87Å; F59-Y157 HydrophobicContact CG-CE2 3.87Å; F59-Y157 AromaticContact CZ-CD2 3.7Å; F59-Y157 HydrophobicContact CZ-CD2 3.7Å; F59-Y157 AromaticContact CZ-CG 3.82Å; F59-Y157 HydrophobicContact CZ-CG 3.82Å; N153-Y157 PolarHBondContact O-N 3.3Å; I154-Y157 CarbonylContact O-C 3.54Å; I154-Y157 WeakPolarHBondContact O-CA 3.28Å; I154-Y157 WeakPolarHBondContact O-CB 3.42Å; I154-Y157 PolarHBondContact O-N 2.99Å; C155-Y157 PolarHBondContact O-N 3.3Å; Y157-I160 WeakPolarHBondContact O-CB 3.45Å; Y157-I160 PolarHBondContact O-N 3.43Å; Y157-H161 PolarHBondContact O-N 3.31Å
158	W	66	Low	72.7	Confident	180 Å²	180	75 Å²	75	68%	0.682	37%	0.366	S	S	*	.	H	α-helix	trans	-66.6	-40.4	179.3	-166.9	-82.7	0	0	0	112	I154 C155 I160 H161 S162	I154-W158 PolarHBondContact O-N 3.37Å; C155-W158 PolarHBondContact O-N 3.33Å; C155-W158 VanDerWaalsContact O-N 3.13Å; W158-I160 VanDerWaalsContact C-N 3.3Å; W158-I160 PolarHBondContact O-N 3.14Å; W158-H161 PolarHBondContact O-N 2.88Å; W158-S162 WeakPolarHBondContact O-CB 3.21Å; W158-S162 PolarHBondContact O-N 3.37Å
159	E	69.5	Low	70.9	Confident	125 Å²	125	80.5 Å²	80.5	58%	0.584	38%	0.379	S	S	*	.	H	α-helix	trans	-60.8	-42.4	174.5	-169.4	177.7	178.8	0	0	111	C155 H161 S162 F163	C155-E159 PolarHBondContact O-N 3.02Å; E159-H161 PolarHBondContact O-N 3.45Å; E159-S162 PolarHBondContact O-N 3.43Å; E159-F163 PolarHBondContact O-N 2.94Å; E159-F163 VanDerWaalsContact O-N 3.1Å
160	I	64.8	Low	69.6	Low	17 Å²	17	78.7 Å²	78.7	9%	0.087	38%	0.375	C	S	.	.	H	α-helix	trans	-58.4	-49.7	173.7	-64.7	166.9	0	0	0	110.8	F46 V50 C156 Y157 W158 S162 F163 Y164	F46-I160 HydrophobicContact CD2-CB 4.1Å; F46-I160 HydrophobicContact CD2-CD1 4.28Å; F46-I160 HydrophobicContact CD2-CG1 3.44Å; F46-I160 VanDerWaalsContact CD2-CG1 3.44Å; F46-I160 HydrophobicContact CD2-CG2 4.05Å; F46-I160 HydrophobicContact CE1-CG2 4.39Å; F46-I160 HydrophobicContact CE2-CB 3.74Å; F46-I160 HydrophobicContact CE2-CG1 3.63Å; F46-I160 HydrophobicContact CE2-CG2 3.56Å; F46-I160 HydrophobicContact CG-CG1 4.28Å; F46-I160 HydrophobicContact CZ-CB 4.37Å; F46-I160 HydrophobicContact CZ-CG2 3.7Å; V50-I160 HydrophobicContact CG2-CG2 3.56Å; C156-I160 VanDerWaalsContact O-CD1 3.31Å; C156-I160 WeakPolarHBondContact O-CD1 3.03Å; C156-I160 WeakPolarHBondContact O-CG1 3.4Å; C156-I160 PolarHBondContact O-N 2.98Å; Y157-I160 WeakPolarHBondContact O-CB 3.45Å; Y157-I160 PolarHBondContact O-N 3.43Å; W158-I160 VanDerWaalsContact C-N 3.3Å; W158-I160 PolarHBondContact O-N 3.14Å; I160-S162 PolarHBondContact O-N 3.21Å; I160-F163 PolarHBondContact O-N 3.32Å; I160-Y164 HydrophobicContact CG2-CD2 4.26Å; I160-Y164 HydrophobicContact CG2-CE2 4.19Å; I160-Y164 WeakPolarHBondContact O-CD2 3.43Å; I160-Y164 PolarHBondContact O-N 3.5Å
161	H	61.8	Low	67.8	Low	57 Å²	57	82.5 Å²	82.5	26%	0.264	40%	0.402	S	S	.	.	H	α-helix	trans	-64.1	-39.7	-179.1	-172.6	-100.5	0	0	0	112.8	Y157 W158 E159 F163 Y164 L165	Y157-H161 PolarHBondContact O-N 3.31Å; W158-H161 PolarHBondContact O-N 2.88Å; E159-H161 PolarHBondContact O-N 3.45Å; H161-F163 VanDerWaalsContact C-N 3.32Å; H161-F163 PolarHBondContact O-N 2.85Å; H161-Y164 PolarHBondContact O-N 3.5Å; H161-L165 WeakPolarHBondContact CE1-CD1 3.2Å; H161-L165 PolarHBondContact O-N 3.1Å
162	S	63.7	Low	66.2	Low	36 Å²	36	83.9 Å²	83.9	25%	0.252	41%	0.408	S	S	.	.	H	α-helix	trans	-62.2	-40	177.3	-171.5	0	0	0	0	111.8	W158 E159 I160 L165 H166	W158-S162 WeakPolarHBondContact O-CB 3.21Å; W158-S162 PolarHBondContact O-N 3.37Å; E159-S162 PolarHBondContact O-N 3.43Å; I160-S162 PolarHBondContact O-N 3.21Å; S162-L165 PolarHBondContact O-N 3.09Å; S162-H166 WeakPolarHBondContact O-CB 3.43Å; S162-H166 PolarHBondContact O-N 3.4Å; S162-H166 VanDerWaalsContact O-N 3.07Å; S162-H166 PolarHBondContact O-ND1 3.27Å; S162-H166 PolarHBondContact OG-ND1 3.44Å
163	F	64.8	Low	64.3	Low	36 Å²	36	79.9 Å²	79.9	16%	0.158	41%	0.411	C	S	.	.	H	α-helix	trans	-61.8	-44.3	175.4	179.3	-96.3	0	0	0	112.3	W37 I40 F46 E159 I160 H161 L165 H166 A167 L168	W37-F163 AromaticContact CE3-CD2 3.95Å; W37-F163 HydrophobicContact CE3-CD2 3.95Å; W37-F163 HydrophobicContact CZ3-CB 4.38Å; W37-F163 AromaticContact CZ3-CD2 3.92Å; W37-F163 HydrophobicContact CZ3-CD2 3.92Å; I40-F163 HydrophobicContact CD1-CD2 4.44Å; I40-F163 HydrophobicContact CD1-CE2 4.29Å; F46-F163 HydrophobicContact CE1-CD1 4.48Å; F46-F163 HydrophobicContact CE2-CB 4.35Å; F46-F163 HydrophobicContact CE2-CD1 4.14Å; F46-F163 HydrophobicContact CE2-CG 4.45Å; F46-F163 HydrophobicContact CZ-CB 4.5Å; F46-F163 AromaticContact CZ-CD1 3.64Å; F46-F163 HydrophobicContact CZ-CD1 3.64Å; F46-F163 HydrophobicContact CZ-CE1 4.26Å; F46-F163 HydrophobicContact CZ-CG 4.37Å; E159-F163 PolarHBondContact O-N 2.94Å; E159-F163 VanDerWaalsContact O-N 3.1Å; I160-F163 PolarHBondContact O-N 3.32Å; H161-F163 VanDerWaalsContact C-N 3.32Å; H161-F163 PolarHBondContact O-N 2.85Å; F163-L165 PolarHBondContact O-N 3.18Å; F163-H166 PolarHBondContact O-N 2.97Å; F163-A167 HydrophobicContact CD2-CB 3.85Å; F163-A167 HydrophobicContact CE1-CB 4.38Å; F163-A167 HydrophobicContact CE2-CB 3.66Å; F163-A167 HydrophobicContact CG-CB 4.29Å; F163-A167 HydrophobicContact CZ-CB 3.95Å; F163-A167 VanDerWaalsContact O-CB 3.25Å; F163-A167 WeakPolarHBondContact O-CB 3.33Å; F163-A167 PolarHBondContact O-N 3.05Å; F163-L168 HydrophobicContact CD1-CD1 3.99Å; F163-L168 HydrophobicContact CE1-CD1 3.46Å; F163-L168 VanDerWaalsContact CE1-CD1 3.46Å; F163-L168 HydrophobicContact CZ-CD1 4.12Å
164	Y	59.1	Low	62.6	Low	48 Å²	48	87.2 Å²	87.2	19%	0.188	44%	0.442	C	S	.	.	H	α-helix	trans	-60.3	-42.1	178.1	-90.6	-86.3	0	0	0	113.2	F46 V50 I160 H161 L168 R169	F46-Y164 HydrophobicContact CE1-CD2 4.46Å; F46-Y164 AromaticContact CE1-CE2 3.57Å; F46-Y164 HydrophobicContact CE1-CE2 3.57Å; F46-Y164 AromaticContact CZ-CD2 3.88Å; F46-Y164 HydrophobicContact CZ-CD2 3.88Å; F46-Y164 AromaticContact CZ-CE2 3.42Å; F46-Y164 HydrophobicContact CZ-CE2 3.42Å; F46-Y164 VanDerWaalsContact CZ-CE2 3.42Å; V50-Y164 HydrophobicContact CG1-CE2 4.33Å; V50-Y164 HydrophobicContact CG2-CE2 3.92Å; I160-Y164 HydrophobicContact CG2-CD2 4.26Å; I160-Y164 HydrophobicContact CG2-CE2 4.19Å; I160-Y164 WeakPolarHBondContact O-CD2 3.43Å; I160-Y164 PolarHBondContact O-N 3.5Å; H161-Y164 PolarHBondContact O-N 3.5Å; Y164-L168 PolarHBondContact O-N 3.01Å; Y164-R169 PolarHBondContact O-N 2.79Å
165	L	61.6	Low	60.5	Low	74 Å²	74	90.8 Å²	90.8	39%	0.387	47%	0.471	S	S	.	.	H	α-helix	trans	-69.3	-43.7	179.3	-87	162.8	0	0	0	112.7	H161 S162 F163	H161-L165 WeakPolarHBondContact CE1-CD1 3.2Å; H161-L165 PolarHBondContact O-N 3.1Å; S162-L165 PolarHBondContact O-N 3.09Å; F163-L165 PolarHBondContact O-N 3.18Å
166	H	64.5	Low	58.3	Low	140 Å²	140	96.4 Å²	96.4	65%	0.648	50%	0.502	S	S	*	.	H	α-helix	trans	-91.1	-36.2	-170.6	-64.5	89.1	0	0	0	113.6	S162 F163	S162-H166 WeakPolarHBondContact O-CB 3.43Å; S162-H166 PolarHBondContact O-N 3.4Å; S162-H166 VanDerWaalsContact O-N 3.07Å; S162-H166 PolarHBondContact O-ND1 3.27Å; S162-H166 PolarHBondContact OG-ND1 3.44Å; F163-H166 PolarHBondContact O-N 2.97Å
167	A	65.4	Low	57.6	Low	61 Å²	61	100.2 Å²	100.2	50%	0.504	52%	0.52	S	S	.	.	H	α-helix	trans	-91.6	-38.9	-176.2	0	0	0	0	0	112.9	F163	F163-A167 HydrophobicContact CD2-CB 3.85Å; F163-A167 HydrophobicContact CE1-CB 4.38Å; F163-A167 HydrophobicContact CE2-CB 3.66Å; F163-A167 HydrophobicContact CG-CB 4.29Å; F163-A167 HydrophobicContact CZ-CB 3.95Å; F163-A167 VanDerWaalsContact O-CB 3.25Å; F163-A167 WeakPolarHBondContact O-CB 3.33Å; F163-A167 PolarHBondContact O-N 3.05Å
168	L	60.3	Low	57	Low	80 Å²	80	102.8 Å²	102.8	42%	0.419	54%	0.538	S	S	.	.	S	Bend	trans	-98	-12.4	-177.5	-78	89.1	0	0	0	114.1	F163 Y164 I170	F163-L168 HydrophobicContact CD1-CD1 3.99Å; F163-L168 HydrophobicContact CE1-CD1 3.46Å; F163-L168 VanDerWaalsContact CE1-CD1 3.46Å; F163-L168 HydrophobicContact CZ-CD1 4.12Å; Y164-L168 PolarHBondContact O-N 3.01Å; L168-I170 HydrophobicContact CB-CD1 4.27Å; L168-I170 HydrophobicContact CB-CG1 4.23Å; L168-I170 HydrophobicContact CD2-CD1 4.23Å; L168-I170 PolarHBondContact O-N 2.85Å
169	R	56.2	Low	56.5	Low	222 Å²	222	98.6 Å²	98.6	84%	0.838	53%	0.53	S	S	*	.			trans	49.4	28.9	-176.5	-71.5	-173.2	175.6	150.6	-0.2	113.9	Y164 P171	Y164-R169 PolarHBondContact O-N 2.79Å; R169-P171 WeakPolarHBondContact O-CD 3.35Å
170	I	60.7	Low	55.7	Low	94 Å²	94	97 Å²	97	48%	0.482	53%	0.526	S	S	.	.			trans	-90.3	108.1	171.6	-58.8	172.9	0	0	0	105.9	L168 M172	L168-I170 HydrophobicContact CB-CD1 4.27Å; L168-I170 HydrophobicContact CB-CG1 4.23Å; L168-I170 HydrophobicContact CD2-CD1 4.23Å; L168-I170 PolarHBondContact O-N 2.85Å; I170-M172 PolarHBondContact O-N 3.13Å; I170-M172 VanDerWaalsContact O-N 3.1Å
171	P	50.3	Low	55.2	Low	102 Å²	102	102 Å²	102	66%	0.662	55%	0.554	S	S	*	*			trans	-63.3	118.3	171.2	25.9	-30.6	0	0	0	107.1	R169 G173	R169-P171 WeakPolarHBondContact O-CD 3.35Å; P171-G173 PolarHBondContact O-N 3.23Å
172	M	53.8	Low	54.7	Low	109 Å²	109	105 Å²	105	54%	0.537	57%	0.573	S	S	.	*			trans	-69.4	72.5	164	-72.4	-88.3	-84.1	0	0	107	I170 F174	I170-M172 PolarHBondContact O-N 3.13Å; I170-M172 VanDerWaalsContact O-N 3.1Å; M172-F174 PolarHBondContact O-N 2.95Å; M172-F174 VanDerWaalsContact O-N 3.13Å
173	G	44.5	Very low	54.1	Low	62 Å²	62	109.9 Å²	109.9	64%	0.639	60%	0.596	S	S	*	*			trans	-61.1	113.6	166.9	0	0	0	0	0	106.9	P171 S175	P171-G173 PolarHBondContact O-N 3.23Å; G173-S175 PolarHBondContact O-N 2.88Å
174	F	46.2	Very low	53.3	Low	197 Å²	197	115.6 Å²	115.6	86%	0.864	63%	0.63	S	S	*	*			trans	-56.6	91.7	153.8	-98	-94.1	0	0	0	106.7	M172 V176	M172-F174 PolarHBondContact O-N 2.95Å; M172-F174 VanDerWaalsContact O-N 3.13Å; F174-V176 HydrophobicContact CD1-CG2 3.99Å; F174-V176 PolarHBondContact O-N 3.4Å; F174-V176 VanDerWaalsContact O-N 3.15Å
175	S	34.2	Very low	52.8	Low	124 Å²	124	121.3 Å²	121.3	87%	0.867	67%	0.667	S	S	*	*			trans	-76.6	87.8	153.4	-98.4	0	0	0	0	106.2	G173	G173-S175 PolarHBondContact O-N 2.88Å
176	V	35.8	Very low	52	Low	190 Å²	190	125.5 Å²	125.5	100%	1.152	69%	0.692	S	S	*	*			trans	-81.5	0	146.7	-178.9	0	0	0	0	107	F174	F174-V176 HydrophobicContact CD1-CG2 3.99Å; F174-V176 PolarHBondContact O-N 3.4Å; F174-V176 VanDerWaalsContact O-N 3.15Å

Retrieved 176 of 176 residues in 189.2 ms (Link to these results)

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