A0A087YFX4_POEFO Loading...

Very-long-chain (3R)-3-hydroxyacyl-CoA dehydratase

Catalyzes the third of the four reactions of the long-chain fatty acids elongation cycle. This endoplasmic reticulum-bound enzymatic process, allows the addition of two carbons to the chain of long- and very long-chain fatty acids/VLCFAs per cycle. This enzyme catalyzes the dehydration of the 3-hydroxyacyl-CoA intermediate into trans-2,3-enoyl-CoA, within each cycle of fatty acid elongation. Thereby, it participates to the production of VLCFAs of different chain lengths that are involved in multiple biological processes as precursors of membrane lipids and lipid mediators.

AlphaFold DB , UniProt , Accession A0A087YFX4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 250 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	L	47	Very low	50.5	Low	221 Å²	221	117.5 Å²	117.5	100%	1.157	74%	0.741	S	S	*	*				0	112.9	0	-76.1	156.1	0	0	0	107.2
2	P	50.2	Low	50.8	Low	130 Å²	130	114.2 Å²	114.2	84%	0.844	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-80.6	132	-179.1	31.7	-27.9	0	0	0	109.9
3	H	52.2	Low	51.2	Low	183 Å²	183	116.8 Å²	116.8	85%	0.847	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-68	141.2	170.2	-88.6	-85.9	0	0	0	110.4
4	P	50.3	Low	51.8	Low	118 Å²	118	118.1 Å²	118.1	77%	0.766	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-70.7	132.6	171.4	28.7	-30.3	0	0	0	109.8
5	A	54.1	Low	52.5	Low	84 Å²	84	116.9 Å²	116.9	69%	0.694	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-67.9	136.1	179.1	0	0	0	0	0	111.2	G7	A5-G7 PolarHBondContact O-N 3.46Å
6	P	48.6	Very low	53.3	Low	134 Å²	134	111.8 Å²	111.8	87%	0.87	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	12.2	-174.3	28.7	-33.3	0	0	0	115.2
7	G	51.3	Low	54.3	Low	52 Å²	52	109 Å²	109	54%	0.536	67%	0.665	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.3	-11.9	-169.6	0	0	0	0	0	117	A5	A5-G7 PolarHBondContact O-N 3.46Å
8	A	48.9	Very low	55.2	Low	79 Å²	79	107.4 Å²	107.4	65%	0.653	66%	0.656	S	S	*	*	H	α-helix	trans	-84.9	-27.4	-169.4	0	0	0	0	0	114.7	S12	A8-S12 PolarHBondContact O-OG 3.46Å; A8-S12 VanDerWaalsContact O-OG 3.05Å
9	M	48.7	Very low	56.1	Low	158 Å²	158	107.9 Å²	107.9	78%	0.778	65%	0.65	S	S	*	*	H	α-helix	trans	-80.1	-35.7	179.9	-81.9	-177.9	-177.5	0	0	113.3	S11 S12 E13	M9-S11 PolarHBondContact O-N 3.34Å; M9-S12 PolarHBondContact O-N 3.46Å; M9-S12 PolarHBondContact O-OG 2.85Å; M9-E13 PolarHBondContact O-N 2.89Å
10	A	51.7	Low	57	Low	55 Å²	55	108.7 Å²	108.7	46%	0.455	65%	0.646	S	S	.	*	H	α-helix	trans	-68.5	-36.1	-178.8	0	0	0	0	0	112.9	S12 E14	A10-S12 VanDerWaalsContact C-N 3.31Å; A10-S12 PolarHBondContact O-N 3.46Å; A10-E14 PolarHBondContact O-N 3.31Å; A10-E14 VanDerWaalsContact O-N 3.15Å
11	S	52.9	Low	57.7	Low	78 Å²	78	110.6 Å²	110.6	55%	0.545	65%	0.646	S	S	.	*	H	α-helix	trans	-66.8	-29.3	179.7	173.3	0	0	0	0	113.4	M9 D15	M9-S11 PolarHBondContact O-N 3.34Å; S11-D15 WeakPolarHBondContact O-CB 3.36Å; S11-D15 PolarHBondContact O-N 3.26Å
12	S	53.4	Low	59.1	Low	78 Å²	78	104.7 Å²	104.7	55%	0.545	61%	0.613	S	S	.	*	H	α-helix	trans	-85.5	-30.3	-176.9	25.9	0	0	0	0	112.4	A8 M9 A10 G16	A8-S12 PolarHBondContact O-OG 3.46Å; A8-S12 VanDerWaalsContact O-OG 3.05Å; M9-S12 PolarHBondContact O-N 3.46Å; M9-S12 PolarHBondContact O-OG 2.85Å; A10-S12 VanDerWaalsContact C-N 3.31Å; A10-S12 PolarHBondContact O-N 3.46Å; S12-G16 PolarHBondContact O-N 3.39Å
13	E	56.2	Low	60.3	Low	148 Å²	148	102.4 Å²	102.4	69%	0.692	59%	0.593	S	S	*	*	H	α-helix	trans	-72.8	-41.3	171.4	-70.3	-176.6	158.1	0	0	112.2	M9 T17	M9-E13 PolarHBondContact O-N 2.89Å; E13-T17 VanDerWaalsContact O-CG2 3.32Å; E13-T17 WeakPolarHBondContact O-CG2 3.33Å; E13-T17 PolarHBondContact O-N 3.11Å; E13-T17 VanDerWaalsContact O-N 3.11Å; E13-T17 PolarHBondContact O-OG1 3.48Å
14	E	60	Low	61.6	Low	136 Å²	136	97.4 Å²	97.4	64%	0.636	57%	0.573	S	S	*	*	H	α-helix	trans	-63.7	-43	176.5	-77.5	-173.4	156.8	0	0	112.1	A10 T17 V18	A10-E14 PolarHBondContact O-N 3.31Å; A10-E14 VanDerWaalsContact O-N 3.15Å; E14-T17 PolarHBondContact O-N 3.37Å; E14-T17 PolarHBondContact O-OG1 3.25Å; E14-V18 WeakPolarHBondContact O-CG2 3.23Å; E14-V18 PolarHBondContact O-N 3.37Å; E14-V18 VanDerWaalsContact O-N 3.08Å
15	D	61.9	Low	62.9	Low	99 Å²	99	96.8 Å²	96.8	53%	0.529	56%	0.563	S	S	.	*	H	α-helix	trans	-65.3	-41.7	179.9	-150.4	18.6	0	0	0	111.8	S11 T17 V18 E19	S11-D15 WeakPolarHBondContact O-CB 3.36Å; S11-D15 PolarHBondContact O-N 3.26Å; D15-T17 VanDerWaalsContact C-N 3.35Å; D15-T17 PolarHBondContact O-N 2.91Å; D15-V18 PolarHBondContact O-N 3.26Å; D15-E19 PolarHBondContact O-N 2.9Å
16	G	65.1	Low	63.9	Low	36 Å²	36	97.8 Å²	97.8	37%	0.371	55%	0.552	S	S	.	*	H	α-helix	trans	-61.2	-38.7	173.6	0	0	0	0	0	113.3	S12 E20	S12-G16 PolarHBondContact O-N 3.39Å; G16-E20 VanDerWaalsContact O-CB 3.3Å; G16-E20 WeakPolarHBondContact O-CB 3.33Å; G16-E20 PolarHBondContact O-N 3.4Å
17	T	70.1	Confident	65.2	Low	64 Å²	64	98 Å²	98	39%	0.393	54%	0.539	S	S	.	.	H	α-helix	trans	-72.3	-29.3	177.5	64.1	0	0	0	0	113.5	E13 E14 D15 K21	E13-T17 VanDerWaalsContact O-CG2 3.32Å; E13-T17 WeakPolarHBondContact O-CG2 3.33Å; E13-T17 PolarHBondContact O-N 3.11Å; E13-T17 VanDerWaalsContact O-N 3.11Å; E13-T17 PolarHBondContact O-OG1 3.48Å; E14-T17 PolarHBondContact O-N 3.37Å; E14-T17 PolarHBondContact O-OG1 3.25Å; D15-T17 VanDerWaalsContact C-N 3.35Å; D15-T17 PolarHBondContact O-N 2.91Å; T17-K21 WeakPolarHBondContact O-CB 3.47Å; T17-K21 WeakPolarHBondContact O-CG 3.35Å; T17-K21 PolarHBondContact O-N 2.93Å; T17-K21 VanDerWaalsContact O-N 3.07Å
18	V	71.6	Confident	66.5	Low	81 Å²	81	104.9 Å²	104.9	49%	0.491	55%	0.549	S	S	.	.	H	α-helix	trans	-73.6	-46.6	176.1	173.9	0	0	0	0	110.3	E14 D15 E20 K21 E22	E14-V18 WeakPolarHBondContact O-CG2 3.23Å; E14-V18 PolarHBondContact O-N 3.37Å; E14-V18 VanDerWaalsContact O-N 3.08Å; D15-V18 PolarHBondContact O-N 3.26Å; V18-E20 VanDerWaalsContact C-N 3.32Å; V18-E20 PolarHBondContact O-N 3.21Å; V18-K21 PolarHBondContact O-N 3.11Å; V18-E22 WeakPolarHBondContact O-CB 3.32Å; V18-E22 PolarHBondContact O-N 3.06Å
19	E	72.3	Confident	68	Low	116 Å²	116	104.6 Å²	104.6	54%	0.542	54%	0.539	S	S	.	.	H	α-helix	trans	-61.1	-39.8	175.1	-73.2	-166	157.5	0	0	112.1	D15 E22 N23	D15-E19 PolarHBondContact O-N 2.9Å; E19-E22 PolarHBondContact O-N 3.32Å; E19-N23 VanDerWaalsContact O-CB 3.23Å; E19-N23 WeakPolarHBondContact O-CB 3.31Å; E19-N23 VanDerWaalsContact O-CG 3.3Å; E19-N23 PolarHBondContact O-N 3.18Å; E19-N23 PolarHBondContact O-ND2 3.25Å
20	E	72.9	Confident	69.4	Low	124 Å²	124	104 Å²	104	58%	0.579	53%	0.532	S	S	*	.	H	α-helix	trans	-68	-40.7	177.8	-163.7	178.5	-166.3	0	0	112	G16 V18 N24	G16-E20 VanDerWaalsContact O-CB 3.3Å; G16-E20 WeakPolarHBondContact O-CB 3.33Å; G16-E20 PolarHBondContact O-N 3.4Å; V18-E20 VanDerWaalsContact C-N 3.32Å; V18-E20 PolarHBondContact O-N 3.21Å; E20-N24 VanDerWaalsContact O-CB 3.27Å; E20-N24 WeakPolarHBondContact O-CB 3.4Å; E20-N24 VanDerWaalsContact O-CG 3.26Å; E20-N24 PolarHBondContact O-N 3Å; E20-N24 PolarHBondContact O-ND2 3.24Å
21	K	72.5	Confident	70.9	Confident	148 Å²	148	104.6 Å²	104.6	64%	0.643	53%	0.533	S	S	*	.	H	α-helix	trans	-63.8	-42.8	172.8	-78.8	172.3	-175.5	168.6	0	111.8	T17 V18 N24 N25	T17-K21 WeakPolarHBondContact O-CB 3.47Å; T17-K21 WeakPolarHBondContact O-CG 3.35Å; T17-K21 PolarHBondContact O-N 2.93Å; T17-K21 VanDerWaalsContact O-N 3.07Å; V18-K21 PolarHBondContact O-N 3.11Å; K21-N24 PolarHBondContact O-N 3.34Å; K21-N25 WeakPolarHBondContact O-CB 2.96Å; K21-N25 PolarHBondContact O-N 3.28Å
22	E	75.3	Confident	72.5	Confident	98 Å²	98	103.7 Å²	103.7	46%	0.458	53%	0.53	S	S	.	.	H	α-helix	trans	-67	-42.6	178.8	-161.8	-171.9	157.6	0	0	111.3	V18 E19 N25 K26	V18-E22 WeakPolarHBondContact O-CB 3.32Å; V18-E22 PolarHBondContact O-N 3.06Å; E19-E22 PolarHBondContact O-N 3.32Å; E22-N25 PolarHBondContact O-N 3.33Å; E22-K26 WeakPolarHBondContact O-CB 3.13Å; E22-K26 WeakPolarHBondContact O-CG 3.26Å; E22-K26 PolarHBondContact O-N 2.89Å; E22-K26 WeakPolarHBondContact OE1-CE 3.28Å; E22-K26 IonicContact OE1-NZ 2.65Å; E22-K26 PolarHBondContact OE1-NZ 2.94Å
23	N	76.5	Confident	74.2	Confident	82 Å²	82	105.5 Å²	105.5	44%	0.439	53%	0.533	S	S	.	.	H	α-helix	trans	-63.5	-40.5	174.1	-80.5	-29.6	0	0	0	112.1	E19 K26 K27	E19-N23 VanDerWaalsContact O-CB 3.23Å; E19-N23 WeakPolarHBondContact O-CB 3.31Å; E19-N23 VanDerWaalsContact O-CG 3.3Å; E19-N23 PolarHBondContact O-N 3.18Å; E19-N23 PolarHBondContact O-ND2 3.25Å; N23-K26 PolarHBondContact O-N 2.9Å; N23-K27 WeakPolarHBondContact O-CB 3.38Å; N23-K27 VanDerWaalsContact O-CG 3.25Å; N23-K27 WeakPolarHBondContact O-CG 3.42Å; N23-K27 PolarHBondContact O-N 3.18Å
24	N	78.7	Confident	75.8	Confident	78 Å²	78	101.7 Å²	101.7	42%	0.417	52%	0.517	S	S	.	.	H	α-helix	trans	-66.8	-37.3	174.9	-79.4	-23	0	0	0	112.3	E20 K21 K27 R28	E20-N24 VanDerWaalsContact O-CB 3.27Å; E20-N24 WeakPolarHBondContact O-CB 3.4Å; E20-N24 VanDerWaalsContact O-CG 3.26Å; E20-N24 PolarHBondContact O-N 3Å; E20-N24 PolarHBondContact O-ND2 3.24Å; K21-N24 PolarHBondContact O-N 3.34Å; N24-K27 PolarHBondContact O-N 3.43Å; N24-R28 WeakPolarHBondContact O-CB 3.38Å; N24-R28 WeakPolarHBondContact O-CG 3.23Å; N24-R28 PolarHBondContact O-N 3.37Å
25	N	78.5	Confident	77.2	Confident	104 Å²	104	97.6 Å²	97.6	56%	0.556	50%	0.501	S	S	*	.	H	α-helix	trans	-68.7	-44.3	175.6	-155.8	18.1	0	0	0	111.3	K21 E22 K27 R28 T29	K21-N25 WeakPolarHBondContact O-CB 2.96Å; K21-N25 PolarHBondContact O-N 3.28Å; E22-N25 PolarHBondContact O-N 3.33Å; N25-K27 VanDerWaalsContact C-N 3.34Å; N25-K27 PolarHBondContact O-N 3.32Å; N25-R28 PolarHBondContact O-N 3.38Å; N25-T29 PolarHBondContact O-N 3.39Å; N25-T29 PolarHBondContact O-OG1 3.14Å; N25-T29 VanDerWaalsContact O-OG1 3.05Å
26	K	75.2	Confident	78.6	Confident	105 Å²	105	95.7 Å²	95.7	46%	0.457	50%	0.499	S	S	.	.	H	α-helix	trans	-59.1	-42.5	172.8	-75.2	173.1	-176	163.3	0	111.9	E22 N23 K30	E22-K26 WeakPolarHBondContact O-CB 3.13Å; E22-K26 WeakPolarHBondContact O-CG 3.26Å; E22-K26 PolarHBondContact O-N 2.89Å; E22-K26 WeakPolarHBondContact OE1-CE 3.28Å; E22-K26 IonicContact OE1-NZ 2.65Å; E22-K26 PolarHBondContact OE1-NZ 2.94Å; N23-K26 PolarHBondContact O-N 2.9Å; K26-K30 WeakPolarHBondContact O-CB 3.39Å; K26-K30 WeakPolarHBondContact O-CG 3.46Å; K26-K30 PolarHBondContact O-N 3.21Å
27	K	75.7	Confident	79.9	Confident	140 Å²	140	99.5 Å²	99.5	61%	0.609	50%	0.502	S	S	*	.	H	α-helix	trans	-62.4	-45.7	174.7	-77.7	173.4	-176.6	174.3	0	111.6	N23 N24 N25 K30 S31	N23-K27 WeakPolarHBondContact O-CB 3.38Å; N23-K27 VanDerWaalsContact O-CG 3.25Å; N23-K27 WeakPolarHBondContact O-CG 3.42Å; N23-K27 PolarHBondContact O-N 3.18Å; N24-K27 PolarHBondContact O-N 3.43Å; N25-K27 VanDerWaalsContact C-N 3.34Å; N25-K27 PolarHBondContact O-N 3.32Å; K27-K30 PolarHBondContact O-N 3.49Å; K27-S31 WeakPolarHBondContact O-CB 3.36Å; K27-S31 PolarHBondContact O-N 3.41Å
28	R	79.1	Confident	81	Confident	195 Å²	195	97.1 Å²	97.1	74%	0.736	49%	0.487	S	S	*	.	H	α-helix	trans	-61.3	-46.8	176.4	-83.5	179.4	158.6	-172.6	-4.3	112.2	N24 N25 S31 A32	N24-R28 WeakPolarHBondContact O-CB 3.38Å; N24-R28 WeakPolarHBondContact O-CG 3.23Å; N24-R28 PolarHBondContact O-N 3.37Å; N25-R28 PolarHBondContact O-N 3.38Å; R28-S31 WeakPolarHBondContact O-CB 3.3Å; R28-S31 PolarHBondContact O-N 2.96Å; R28-A32 WeakPolarHBondContact O-CB 3.46Å; R28-A32 PolarHBondContact O-N 2.97Å
29	T	79.3	Confident	81.9	Confident	73 Å²	73	94 Å²	94	45%	0.448	47%	0.468	S	S	.	.	H	α-helix	trans	-63.9	-44.6	178.2	-57.1	0	0	0	0	111.7	N25 S31 A32 L33	N25-T29 PolarHBondContact O-N 3.39Å; N25-T29 PolarHBondContact O-OG1 3.14Å; N25-T29 VanDerWaalsContact O-OG1 3.05Å; T29-S31 VanDerWaalsContact C-N 3.31Å; T29-S31 PolarHBondContact O-N 3.21Å; T29-A32 PolarHBondContact O-N 3.42Å; T29-L33 HydrophobicContact CG2-CD1 4.34Å; T29-L33 WeakPolarHBondContact O-CG 3.4Å; T29-L33 PolarHBondContact O-N 3.14Å
30	K	77.6	Confident	83	Confident	145 Å²	145	94.8 Å²	94.8	63%	0.63	47%	0.47	S	S	*	.	H	α-helix	trans	-58.8	-43.7	173.1	-77.2	-178.3	179.5	-176.9	0	111.5	K26 K27 A32 L33 I34	K26-K30 WeakPolarHBondContact O-CB 3.39Å; K26-K30 WeakPolarHBondContact O-CG 3.46Å; K26-K30 PolarHBondContact O-N 3.21Å; K27-K30 PolarHBondContact O-N 3.49Å; K30-A32 VanDerWaalsContact C-N 3.35Å; K30-A32 PolarHBondContact O-N 3.23Å; K30-L33 PolarHBondContact O-N 3.31Å; K30-I34 WeakPolarHBondContact O-CB 3.27Å; K30-I34 VanDerWaalsContact O-CG1 3.25Å; K30-I34 WeakPolarHBondContact O-CG1 3.38Å; K30-I34 PolarHBondContact O-N 3.45Å
31	S	83.4	Confident	84	Confident	68 Å²	68	89 Å²	89	48%	0.476	44%	0.443	S	S	.	.	H	α-helix	trans	-62	-41.4	176.4	-169.8	0	0	0	0	112.1	K27 R28 T29 I34 T35	K27-S31 WeakPolarHBondContact O-CB 3.36Å; K27-S31 PolarHBondContact O-N 3.41Å; R28-S31 WeakPolarHBondContact O-CB 3.3Å; R28-S31 PolarHBondContact O-N 2.96Å; T29-S31 VanDerWaalsContact C-N 3.31Å; T29-S31 PolarHBondContact O-N 3.21Å; S31-I34 PolarHBondContact O-N 3.05Å; S31-T35 WeakPolarHBondContact O-CB 3.38Å; S31-T35 PolarHBondContact O-N 3.49Å; S31-T35 PolarHBondContact O-OG1 3.14Å; S31-T35 VanDerWaalsContact O-OG1 3.04Å
32	A	87.1	Confident	85	Confident	59 Å²	59	82.5 Å²	82.5	49%	0.488	42%	0.416	S	S	.	.	H	α-helix	trans	-66.1	-43	178	0	0	0	0	0	112	R28 T29 K30 T35 A36	R28-A32 WeakPolarHBondContact O-CB 3.46Å; R28-A32 PolarHBondContact O-N 2.97Å; T29-A32 PolarHBondContact O-N 3.42Å; K30-A32 VanDerWaalsContact C-N 3.35Å; K30-A32 PolarHBondContact O-N 3.23Å; A32-T35 PolarHBondContact O-N 3.01Å; A32-A36 WeakPolarHBondContact O-CB 3.45Å; A32-A36 PolarHBondContact O-N 3.25Å
33	L	90.1	Very high	86	Confident	116 Å²	116	81.9 Å²	81.9	61%	0.607	41%	0.414	S	S	*	.	H	α-helix	trans	-62.7	-42.8	176.1	-70.3	174.2	0	0	0	111.9	T29 K30 A36 W37	T29-L33 HydrophobicContact CG2-CD1 4.34Å; T29-L33 WeakPolarHBondContact O-CG 3.4Å; T29-L33 PolarHBondContact O-N 3.14Å; K30-L33 PolarHBondContact O-N 3.31Å; L33-A36 PolarHBondContact O-N 3.33Å; L33-W37 WeakPolarHBondContact O-CB 3.26Å; L33-W37 PolarHBondContact O-N 3.01Å
34	I	89.2	Confident	86.9	Confident	68 Å²	68	79.6 Å²	79.6	35%	0.349	41%	0.407	S	S	.	.	H	α-helix	trans	-61.3	-48.3	175.4	-72	167.1	0	0	0	110.4	K30 S31 A36 W37 L38 I95	K30-I34 WeakPolarHBondContact O-CB 3.27Å; K30-I34 VanDerWaalsContact O-CG1 3.25Å; K30-I34 WeakPolarHBondContact O-CG1 3.38Å; K30-I34 PolarHBondContact O-N 3.45Å; S31-I34 PolarHBondContact O-N 3.05Å; I34-A36 VanDerWaalsContact C-N 3.33Å; I34-A36 PolarHBondContact O-N 3.35Å; I34-W37 PolarHBondContact O-N 3.16Å; I34-L38 HydrophobicContact CG2-CD1 3.89Å; I34-L38 HydrophobicContact CG2-CG 4.32Å; I34-L38 WeakPolarHBondContact O-CB 3.25Å; I34-L38 VanDerWaalsContact O-CG 3.29Å; I34-L38 WeakPolarHBondContact O-CG 3.41Å; I34-L38 PolarHBondContact O-N 3.39Å; I34-I95 HydrophobicContact CG2-CG2 3.49Å; I34-I95 VanDerWaalsContact CG2-CG2 3.49Å
35	T	88.3	Confident	87.6	Confident	50 Å²	50	75.9 Å²	75.9	31%	0.307	39%	0.387	S	S	.	.	H	α-helix	trans	-61.2	-42.6	178.3	-63.3	0	0	0	0	111.6	S31 A32 L38 T39 L152	S31-T35 WeakPolarHBondContact O-CB 3.38Å; S31-T35 PolarHBondContact O-N 3.49Å; S31-T35 PolarHBondContact O-OG1 3.14Å; S31-T35 VanDerWaalsContact O-OG1 3.04Å; A32-T35 PolarHBondContact O-N 3.01Å; T35-L38 PolarHBondContact O-N 3.21Å; T35-T39 VanDerWaalsContact O-CB 3.29Å; T35-T39 WeakPolarHBondContact O-CB 3.4Å; T35-T39 PolarHBondContact O-N 3.38Å; T35-T39 PolarHBondContact O-OG1 3.32Å; T35-L152 HydrophobicContact CG2-CB 4.5Å; T35-L152 HydrophobicContact CG2-CD2 4.37Å
36	A	91.4	Very high	88.4	Confident	59 Å²	59	71.7 Å²	71.7	49%	0.488	37%	0.365	S	S	.	.	H	α-helix	trans	-62.7	-46.3	177.2	0	0	0	0	0	111.8	A32 L33 I34 T39 F40	A32-A36 WeakPolarHBondContact O-CB 3.45Å; A32-A36 PolarHBondContact O-N 3.25Å; L33-A36 PolarHBondContact O-N 3.33Å; I34-A36 VanDerWaalsContact C-N 3.33Å; I34-A36 PolarHBondContact O-N 3.35Å; A36-T39 PolarHBondContact O-N 3.47Å; A36-F40 WeakPolarHBondContact O-CB 3.32Å; A36-F40 PolarHBondContact O-N 2.92Å
37	W	93.1	Very high	89.4	Confident	116 Å²	116	68.9 Å²	68.9	44%	0.439	36%	0.362	S	S	.	.	H	α-helix	trans	-59.7	-49.7	176	168.9	-106.8	0	0	0	112.2	L33 I34 T39 F40 Y41 H90	L33-W37 WeakPolarHBondContact O-CB 3.26Å; L33-W37 PolarHBondContact O-N 3.01Å; I34-W37 PolarHBondContact O-N 3.16Å; W37-T39 VanDerWaalsContact C-N 3.29Å; W37-T39 PolarHBondContact O-N 3.48Å; W37-F40 HydrophobicContact CZ3-CD1 4.35Å; W37-F40 PolarHBondContact O-N 3.23Å; W37-Y41 WeakPolarHBondContact O-CB 3.46Å; W37-Y41 PolarHBondContact O-N 3.39Å; W37-H90 AromaticContact CD1-NE2 3.79Å; W37-H90 AromaticContact CE2-NE2 3.94Å; W37-H90 AromaticContact NE1-CD2 3.99Å; W37-H90 AromaticContact NE1-CE1 3.59Å; W37-H90 AromaticContact NE1-NE2 2.93Å; W37-H90 PolarHBondContact NE1-NE2 2.87Å
38	L	92.3	Very high	90.3	Very high	15 Å²	15	62.4 Å²	62.4	8%	0.079	33%	0.334	C	S	.	.	H	α-helix	trans	-62.2	-39.4	178.9	-70.3	174.9	0	0	0	111.5	I34 T35 Y41 N42 I95 V96 L152	I34-L38 HydrophobicContact CG2-CD1 3.89Å; I34-L38 HydrophobicContact CG2-CG 4.32Å; I34-L38 WeakPolarHBondContact O-CB 3.25Å; I34-L38 VanDerWaalsContact O-CG 3.29Å; I34-L38 WeakPolarHBondContact O-CG 3.41Å; I34-L38 PolarHBondContact O-N 3.39Å; T35-L38 PolarHBondContact O-N 3.21Å; L38-Y41 PolarHBondContact O-N 2.86Å; L38-N42 WeakPolarHBondContact O-CB 3.34Å; L38-N42 VanDerWaalsContact O-CG 3.24Å; L38-N42 PolarHBondContact O-N 3.07Å; L38-N42 PolarHBondContact O-ND2 3.4Å; L38-I95 HydrophobicContact CD1-CG2 3.77Å; L38-I95 HydrophobicContact CD2-CG2 4.1Å; L38-I95 HydrophobicContact CG-CG2 4.21Å; L38-V96 HydrophobicContact CD1-CG2 4.49Å; L38-V96 HydrophobicContact CD2-CG2 4.32Å; L38-L152 HydrophobicContact CB-CD1 3.61Å; L38-L152 HydrophobicContact CD1-CD2 4.4Å
39	T	92.2	Very high	91.1	Very high	15 Å²	15	53.2 Å²	53.2	9%	0.092	30%	0.3	C	S	.	.	H	α-helix	trans	-62.6	-49.5	176.8	-59.2	0	0	0	0	110.4	T35 A36 W37 Y41 N42 I43 T149 L153	T35-T39 VanDerWaalsContact O-CB 3.29Å; T35-T39 WeakPolarHBondContact O-CB 3.4Å; T35-T39 PolarHBondContact O-N 3.38Å; T35-T39 PolarHBondContact O-OG1 3.32Å; A36-T39 PolarHBondContact O-N 3.47Å; W37-T39 VanDerWaalsContact C-N 3.29Å; W37-T39 PolarHBondContact O-N 3.48Å; T39-Y41 PolarHBondContact O-N 2.93Å; T39-N42 PolarHBondContact O-N 2.7Å; T39-I43 HydrophobicContact CG2-CD1 3.84Å; T39-I43 VanDerWaalsContact O-CG1 3.27Å; T39-I43 WeakPolarHBondContact O-CG1 3.35Å; T39-I43 PolarHBondContact O-N 2.9Å; T39-T149 HydrophobicContact CG2-CG2 4.27Å; T39-L153 HydrophobicContact CG2-CD1 4.47Å; T39-L153 HydrophobicContact CG2-CD2 3.96Å; T39-L153 HydrophobicContact CG2-CG 4.22Å
40	F	94.4	Very high	91.9	Very high	132 Å²	132	53.5 Å²	53.5	58%	0.579	30%	0.298	S	S	*	.	H	α-helix	trans	-58.1	-47.2	175.9	175	-98.6	0	0	0	111.9	A36 W37 N42 I43 A44	A36-F40 WeakPolarHBondContact O-CB 3.32Å; A36-F40 PolarHBondContact O-N 2.92Å; W37-F40 HydrophobicContact CZ3-CD1 4.35Å; W37-F40 PolarHBondContact O-N 3.23Å; F40-N42 PolarHBondContact O-N 3.49Å; F40-I43 PolarHBondContact O-N 2.81Å; F40-A44 WeakPolarHBondContact O-CB 3.3Å; F40-A44 PolarHBondContact O-N 2.97Å
41	Y	94.3	Very high	92.7	Very high	4 Å²	4	50.1 Å²	50.1	2%	0.016	29%	0.29	C	S	.	.	H	α-helix	trans	-56.6	-50.2	177.8	175.3	-92.8	0	0	0	111.9	W37 L38 T39 I43 A44 M45 F83 V86 Y145	W37-Y41 WeakPolarHBondContact O-CB 3.46Å; W37-Y41 PolarHBondContact O-N 3.39Å; L38-Y41 PolarHBondContact O-N 2.86Å; T39-Y41 PolarHBondContact O-N 2.93Å; Y41-I43 PolarHBondContact O-N 3.28Å; Y41-A44 PolarHBondContact O-N 2.93Å; Y41-M45 HydrophobicContact CD1-CG 4.28Å; Y41-M45 HydrophobicContact CE1-CG 3.85Å; Y41-M45 HydrophobicContact CE2-CG 4.21Å; Y41-M45 WeakPolarHBondContact O-CB 3.43Å; Y41-M45 WeakPolarHBondContact O-CG 3.21Å; Y41-M45 PolarHBondContact O-N 3.45Å; Y41-F83 HydrophobicContact CD2-CD1 4.33Å; Y41-F83 AromaticContact CD2-CE1 3.57Å; Y41-F83 HydrophobicContact CD2-CE1 3.57Å; Y41-F83 HydrophobicContact CD2-CZ 4.23Å; Y41-F83 AromaticContact CE2-CD1 3.64Å; Y41-F83 HydrophobicContact CE2-CD1 3.64Å; Y41-F83 AromaticContact CE2-CE1 3.31Å; Y41-F83 HydrophobicContact CE2-CE1 3.31Å; Y41-F83 HydrophobicContact CE2-CZ 4.13Å; Y41-F83 PolarHBondContact OH-O 3.37Å; Y41-V86 HydrophobicContact CD2-CG1 4.34Å; Y41-V86 HydrophobicContact CE2-CB 3.85Å; Y41-V86 HydrophobicContact CE2-CG1 3.93Å; Y41-Y145 HydrophobicContact CE1-CE1 4.02Å
42	N	94.4	Very high	93.2	Very high	11 Å²	11	47 Å²	47	6%	0.059	27%	0.268	C	S	.	.	H	α-helix	trans	-66.5	-36.8	-178.8	-69.3	-47	0	0	0	112	L38 T39 F40 T46 Y145 T149	L38-N42 WeakPolarHBondContact O-CB 3.34Å; L38-N42 VanDerWaalsContact O-CG 3.24Å; L38-N42 PolarHBondContact O-N 3.07Å; L38-N42 PolarHBondContact O-ND2 3.4Å; T39-N42 PolarHBondContact O-N 2.7Å; F40-N42 PolarHBondContact O-N 3.49Å; N42-T46 WeakPolarHBondContact O-CB 3.14Å; N42-T46 PolarHBondContact O-N 2.93Å; N42-T46 PolarHBondContact O-OG1 2.9Å; N42-Y145 HydrophobicContact CB-CD1 4.49Å; N42-Y145 WeakPolarHBondContact OD1-CD1 3.5Å; N42-T149 WeakPolarHBondContact CB-OG1 3.26Å
43	I	94.4	Very high	93.6	Very high	85 Å²	85	45.7 Å²	45.7	44%	0.436	26%	0.256	S	S	.	.	H	α-helix	trans	-63.8	-48.3	173.5	-69.5	169.5	0	0	0	110.5	T39 F40 Y41 M45 T46 A47 T149	T39-I43 HydrophobicContact CG2-CD1 3.84Å; T39-I43 VanDerWaalsContact O-CG1 3.27Å; T39-I43 WeakPolarHBondContact O-CG1 3.35Å; T39-I43 PolarHBondContact O-N 2.9Å; F40-I43 PolarHBondContact O-N 2.81Å; Y41-I43 PolarHBondContact O-N 3.28Å; I43-M45 VanDerWaalsContact C-N 3.32Å; I43-M45 PolarHBondContact O-N 2.88Å; I43-T46 PolarHBondContact O-N 3.41Å; I43-A47 WeakPolarHBondContact O-CB 3.37Å; I43-A47 PolarHBondContact O-N 2.9Å; I43-T149 HydrophobicContact CD1-CG2 3.95Å; I43-T149 HydrophobicContact CG1-CG2 3.54Å
44	A	95.5	Very high	93.8	Very high	34 Å²	34	44.5 Å²	44.5	28%	0.281	25%	0.25	S	C	.	.	H	α-helix	trans	-60.4	-42.8	179	0	0	0	0	0	111.6	F40 Y41 A47 G48	F40-A44 WeakPolarHBondContact O-CB 3.3Å; F40-A44 PolarHBondContact O-N 2.97Å; Y41-A44 PolarHBondContact O-N 2.93Å; A44-A47 PolarHBondContact O-N 3.14Å; A44-G48 PolarHBondContact O-N 3.31Å
45	M	95.3	Very high	94	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-62.9	-46.7	174.4	-72.6	-59.2	-80.9	0	0	111.7	Y41 I43 A47 G48 W49 F80 F83 A84 Y145	Y41-M45 HydrophobicContact CD1-CG 4.28Å; Y41-M45 HydrophobicContact CE1-CG 3.85Å; Y41-M45 HydrophobicContact CE2-CG 4.21Å; Y41-M45 WeakPolarHBondContact O-CB 3.43Å; Y41-M45 WeakPolarHBondContact O-CG 3.21Å; Y41-M45 PolarHBondContact O-N 3.45Å; I43-M45 VanDerWaalsContact C-N 3.32Å; I43-M45 PolarHBondContact O-N 2.88Å; M45-A47 VanDerWaalsContact C-N 3.34Å; M45-A47 PolarHBondContact O-N 3.05Å; M45-G48 PolarHBondContact O-N 3.07Å; M45-W49 PolarHBondContact O-N 3.47Å; M45-F80 WeakPolarHBondContact CE-O 3.31Å; M45-F80 HydrophobicContact SD-CD1 3.76Å; M45-F80 HydrophobicContact SD-CE1 4.47Å; M45-F83 HydrophobicContact SD-CD1 3.65Å; M45-F83 HydrophobicContact SD-CE1 4.44Å; M45-A84 HydrophobicContact CE-CB 4.25Å; M45-Y145 HydrophobicContact CB-CD1 3.89Å; M45-Y145 HydrophobicContact CB-CD2 3.55Å; M45-Y145 HydrophobicContact CB-CE1 3.96Å; M45-Y145 HydrophobicContact CB-CE2 3.58Å; M45-Y145 HydrophobicContact CB-CG 3.69Å; M45-Y145 HydrophobicContact CE-CE2 3.6Å; M45-Y145 WeakPolarHBondContact CE-OH 3.16Å; M45-Y145 HydrophobicContact CG-CD1 4.39Å; M45-Y145 HydrophobicContact CG-CD2 4.48Å; M45-Y145 HydrophobicContact CG-CE1 4.02Å; M45-Y145 HydrophobicContact CG-CE2 4.07Å
46	T	95.1	Very high	94.3	Very high	15 Å²	15	41.6 Å²	41.6	9%	0.092	23%	0.234	C	C	.	.	H	α-helix	trans	-58	-46.7	177.4	-55.5	0	0	0	0	111.2	N42 I43 G48 W49 L50 I142 Y145 S146	N42-T46 WeakPolarHBondContact O-CB 3.14Å; N42-T46 PolarHBondContact O-N 2.93Å; N42-T46 PolarHBondContact O-OG1 2.9Å; I43-T46 PolarHBondContact O-N 3.41Å; T46-G48 VanDerWaalsContact C-N 3.34Å; T46-G48 PolarHBondContact O-N 3.14Å; T46-W49 PolarHBondContact O-N 3.36Å; T46-L50 HydrophobicContact CG2-CD1 4.13Å; T46-L50 WeakPolarHBondContact O-CB 3.37Å; T46-L50 WeakPolarHBondContact O-CG 3.39Å; T46-L50 PolarHBondContact O-N 3.47Å; T46-I142 HydrophobicContact CG2-CG2 4.4Å; T46-Y145 WeakPolarHBondContact OG1-CB 3.22Å; T46-S146 WeakPolarHBondContact CG2-OG 3.49Å; T46-S146 PolarHBondContact OG1-N 3.22Å
47	A	95.4	Very high	94.3	Very high	47 Å²	47	44.9 Å²	44.9	39%	0.388	24%	0.241	S	C	.	.	H	α-helix	trans	-61.7	-41.7	177.3	0	0	0	0	0	111.8	I43 A44 M45 L50 V51	I43-A47 WeakPolarHBondContact O-CB 3.37Å; I43-A47 PolarHBondContact O-N 2.9Å; A44-A47 PolarHBondContact O-N 3.14Å; M45-A47 VanDerWaalsContact C-N 3.34Å; M45-A47 PolarHBondContact O-N 3.05Å; A47-L50 WeakPolarHBondContact O-CB 3.34Å; A47-L50 PolarHBondContact O-N 3.42Å; A47-V51 WeakPolarHBondContact O-CG2 3.07Å; A47-V51 PolarHBondContact O-N 3.11Å
48	G	94.8	Very high	94.3	Very high	3 Å²	3	46.9 Å²	46.9	3%	0.031	25%	0.248	C	C	.	.	H	α-helix	trans	-58.3	-47.9	175.8	0	0	0	0	0	114	A44 M45 T46 V51 L52	A44-G48 PolarHBondContact O-N 3.31Å; M45-G48 PolarHBondContact O-N 3.07Å; T46-G48 VanDerWaalsContact C-N 3.34Å; T46-G48 PolarHBondContact O-N 3.14Å; G48-V51 PolarHBondContact O-N 2.98Å; G48-L52 PolarHBondContact O-N 2.9Å
49	W	95.6	Very high	94.2	Very high	3 Å²	3	47.9 Å²	47.9	1%	0.011	25%	0.252	C	S	.	.	H	α-helix	trans	-69.4	-32.7	176.7	-72.6	105.7	0	0	0	112.6	M45 T46 L52 A53 L77 Q81 W137 T138 E141 I142 Y145	M45-W49 PolarHBondContact O-N 3.47Å; T46-W49 PolarHBondContact O-N 3.36Å; W49-L52 HydrophobicContact CE3-CD2 3.82Å; W49-L52 HydrophobicContact CZ3-CD2 3.76Å; W49-L52 WeakPolarHBondContact O-CB 3.44Å; W49-L52 PolarHBondContact O-N 3.04Å; W49-A53 PolarHBondContact O-N 3.49Å; W49-L77 HydrophobicContact CH2-CD1 3.9Å; W49-L77 HydrophobicContact CZ3-CD1 4.03Å; W49-Q81 HydrophobicContact CH2-CG 4.15Å; W49-Q81 HydrophobicContact CZ2-CG 4.23Å; W49-W137 HydrophobicContact CZ3-CB 4.46Å; W49-T138 HydrophobicContact CE3-CG2 4.42Å; W49-E141 HydrophobicContact CB-CB 4.46Å; W49-E141 HydrophobicContact CD2-CB 3.62Å; W49-E141 HydrophobicContact CD2-CG 4.06Å; W49-E141 HydrophobicContact CE3-CB 4.25Å; W49-E141 HydrophobicContact CG-CB 3.69Å; W49-E141 HydrophobicContact CH2-CG 4.18Å; W49-E141 HydrophobicContact CZ2-CB 4.21Å; W49-E141 HydrophobicContact CZ2-CG 3.71Å; W49-I142 HydrophobicContact CB-CD1 4.4Å; W49-I142 HydrophobicContact CB-CG1 3.68Å; W49-Y145 AromaticContact CD1-CD2 3.99Å; W49-Y145 AromaticContact CD1-CE2 3.92Å; W49-Y145 AromaticContact NE1-CE2 3.73Å
50	L	95.5	Very high	94	Very high	78 Å²	78	54.1 Å²	54.1	41%	0.408	28%	0.275	S	S	.	.	H	α-helix	trans	-64.1	-42.5	171	-78.6	168.5	0	0	0	112.1	T46 A47 L52 A53 I54 I142	T46-L50 HydrophobicContact CG2-CD1 4.13Å; T46-L50 WeakPolarHBondContact O-CB 3.37Å; T46-L50 WeakPolarHBondContact O-CG 3.39Å; T46-L50 PolarHBondContact O-N 3.47Å; A47-L50 WeakPolarHBondContact O-CB 3.34Å; A47-L50 PolarHBondContact O-N 3.42Å; L50-L52 VanDerWaalsContact C-N 3.27Å; L50-L52 PolarHBondContact O-N 3.24Å; L50-A53 WeakPolarHBondContact O-CB 3.48Å; L50-A53 PolarHBondContact O-N 2.62Å; L50-I54 VanDerWaalsContact O-CG1 3.29Å; L50-I54 WeakPolarHBondContact O-CG1 3.45Å; L50-I54 PolarHBondContact O-N 3.36Å; L50-I142 HydrophobicContact CD2-CD1 3.86Å; L50-I142 HydrophobicContact CD2-CG1 4.43Å; L50-I142 HydrophobicContact CD2-CG2 4.39Å; L50-I142 HydrophobicContact CG-CD1 4.18Å; L50-I142 HydrophobicContact CG-CG1 4.32Å
51	V	95.1	Very high	93.9	Very high	75 Å²	75	53.6 Å²	53.6	46%	0.455	28%	0.277	S	S	.	.	H	α-helix	trans	-59.6	-41.8	173.6	168.9	0	0	0	0	110.4	A47 G48 T55	A47-V51 WeakPolarHBondContact O-CG2 3.07Å; A47-V51 PolarHBondContact O-N 3.11Å; G48-V51 PolarHBondContact O-N 2.98Å; V51-T55 WeakPolarHBondContact O-CB 3.24Å; V51-T55 PolarHBondContact O-N 3.06Å; V51-T55 PolarHBondContact O-OG1 3.12Å
52	L	94.6	Very high	93.6	Very high	3 Å²	3	59.8 Å²	59.8	2%	0.016	31%	0.306	C	S	.	.	H	α-helix	trans	-60.2	-48.4	174.9	-157.6	94.1	0	0	0	111.2	G48 W49 L50 I54 T55 M56 I73 T76 L77 T138	G48-L52 PolarHBondContact O-N 2.9Å; W49-L52 HydrophobicContact CE3-CD2 3.82Å; W49-L52 HydrophobicContact CZ3-CD2 3.76Å; W49-L52 WeakPolarHBondContact O-CB 3.44Å; W49-L52 PolarHBondContact O-N 3.04Å; L50-L52 VanDerWaalsContact C-N 3.27Å; L50-L52 PolarHBondContact O-N 3.24Å; L52-I54 PolarHBondContact O-N 2.65Å; L52-T55 PolarHBondContact O-N 3.22Å; L52-M56 HydrophobicContact CD2-SD 4.21Å; L52-M56 HydrophobicContact CG-SD 4.48Å; L52-M56 WeakPolarHBondContact O-CG 3.3Å; L52-M56 PolarHBondContact O-N 3.2Å; L52-I73 HydrophobicContact CD1-CB 3.97Å; L52-T76 HydrophobicContact CD1-CG2 3.84Å; L52-L77 HydrophobicContact CD1-CB 4.01Å; L52-L77 HydrophobicContact CD2-CD1 4.24Å; L52-T138 WeakPolarHBondContact CD2-OG1 3.41Å
53	A	95.2	Very high	93.3	Very high	30 Å²	30	65.9 Å²	65.9	25%	0.248	33%	0.332	C	S	.	.	H	α-helix	trans	-57.9	-49.3	178.6	0	0	0	0	0	112	W49 L50 T55 M56 M57 T138 I142	W49-A53 PolarHBondContact O-N 3.49Å; L50-A53 WeakPolarHBondContact O-CB 3.48Å; L50-A53 PolarHBondContact O-N 2.62Å; A53-T55 VanDerWaalsContact C-N 3.32Å; A53-T55 PolarHBondContact O-N 2.97Å; A53-M56 PolarHBondContact O-N 3.4Å; A53-M57 WeakPolarHBondContact O-CB 3.39Å; A53-M57 PolarHBondContact O-N 2.81Å; A53-T138 HydrophobicContact CB-CG2 3.61Å; A53-I142 HydrophobicContact CB-CD1 4.23Å
54	I	94.4	Very high	92.8	Very high	92 Å²	92	64.7 Å²	64.7	47%	0.472	34%	0.341	S	S	.	.	H	α-helix	trans	-62.8	-41.7	178.8	-67.3	165.5	0	0	0	110.2	L50 L52 M57 R58	L50-I54 VanDerWaalsContact O-CG1 3.29Å; L50-I54 WeakPolarHBondContact O-CG1 3.45Å; L50-I54 PolarHBondContact O-N 3.36Å; L52-I54 PolarHBondContact O-N 2.65Å; I54-M57 PolarHBondContact O-N 3.13Å; I54-R58 HydrophobicContact CG2-CG 4.16Å; I54-R58 WeakPolarHBondContact O-CB 3.39Å; I54-R58 VanDerWaalsContact O-CG 3.25Å; I54-R58 WeakPolarHBondContact O-CG 3.42Å; I54-R58 PolarHBondContact O-N 3.3Å
55	T	93.4	Very high	92.3	Very high	39 Å²	39	65.5 Å²	65.5	24%	0.239	34%	0.343	C	S	.	.	H	α-helix	trans	-63.4	-43.6	178.2	-55.9	0	0	0	0	111	V51 L52 A53 F59 I73	V51-T55 WeakPolarHBondContact O-CB 3.24Å; V51-T55 PolarHBondContact O-N 3.06Å; V51-T55 PolarHBondContact O-OG1 3.12Å; L52-T55 PolarHBondContact O-N 3.22Å; A53-T55 VanDerWaalsContact C-N 3.32Å; A53-T55 PolarHBondContact O-N 2.97Å; T55-F59 WeakPolarHBondContact O-CB 3.49Å; T55-F59 PolarHBondContact O-N 2.84Å; T55-I73 HydrophobicContact CG2-CG2 3.83Å
56	M	93.2	Very high	91.7	Very high	18 Å²	18	67.4 Å²	67.4	9%	0.089	35%	0.351	C	S	.	.	H	α-helix	trans	-61.2	-47.1	175.5	-70.3	175.1	61.1	0	0	111.9	L52 A53 F59 Y60 L69 I73 L134 V135	L52-M56 HydrophobicContact CD2-SD 4.21Å; L52-M56 HydrophobicContact CG-SD 4.48Å; L52-M56 WeakPolarHBondContact O-CG 3.3Å; L52-M56 PolarHBondContact O-N 3.2Å; A53-M56 PolarHBondContact O-N 3.4Å; M56-F59 PolarHBondContact O-N 3.02Å; M56-Y60 PolarHBondContact O-N 3.09Å; M56-L69 HydrophobicContact CB-CD1 4.3Å; M56-L69 HydrophobicContact CE-CD2 4.29Å; M56-L69 HydrophobicContact CG-CD1 4.08Å; M56-L69 HydrophobicContact CG-CD2 4.26Å; M56-I73 HydrophobicContact CG-CD1 4.17Å; M56-I73 HydrophobicContact CG-CG2 3.95Å; M56-I73 HydrophobicContact SD-CD1 4.27Å; M56-L134 HydrophobicContact CE-CB 3.99Å; M56-L134 HydrophobicContact SD-CB 4.4Å; M56-V135 HydrophobicContact CE-CG2 3.5Å
57	M	92.1	Very high	91.3	Very high	128 Å²	128	73.2 Å²	73.2	63%	0.631	38%	0.375	S	S	*	.	H	α-helix	trans	-63.1	-47.3	179.5	-172.4	178	-172.9	0	0	111.8	A53 I54 F59 Y60 I61	A53-M57 WeakPolarHBondContact O-CB 3.39Å; A53-M57 PolarHBondContact O-N 2.81Å; I54-M57 PolarHBondContact O-N 3.13Å; M57-F59 PolarHBondContact O-N 2.98Å; M57-Y60 PolarHBondContact O-N 2.87Å; M57-I61 HydrophobicContact CE-CD1 4.13Å; M57-I61 HydrophobicContact CG-CD1 3.84Å; M57-I61 VanDerWaalsContact O-CG1 3.3Å; M57-I61 WeakPolarHBondContact O-CG1 2.93Å; M57-I61 PolarHBondContact O-N 3.31Å
58	R	92.1	Very high	90.8	Very high	157 Å²	157	72.2 Å²	72.2	59%	0.592	37%	0.369	S	S	*	.	H	α-helix	trans	-61.5	-43.1	178	-72.8	-179.7	77.6	166.5	6.6	111.8	I54 Y60 I61 Q62	I54-R58 HydrophobicContact CG2-CG 4.16Å; I54-R58 WeakPolarHBondContact O-CB 3.39Å; I54-R58 VanDerWaalsContact O-CG 3.25Å; I54-R58 WeakPolarHBondContact O-CG 3.42Å; I54-R58 PolarHBondContact O-N 3.3Å; R58-Y60 VanDerWaalsContact C-N 3.35Å; R58-Y60 PolarHBondContact O-N 3.23Å; R58-I61 PolarHBondContact O-N 3.07Å; R58-Q62 WeakPolarHBondContact O-CB 3.4Å; R58-Q62 VanDerWaalsContact O-CG 3.24Å; R58-Q62 WeakPolarHBondContact O-CG 3.26Å; R58-Q62 PolarHBondContact O-N 3.24Å
59	F	91.3	Very high	90.5	Very high	36 Å²	36	72.6 Å²	72.6	16%	0.158	37%	0.37	C	S	.	.	H	α-helix	trans	-61.2	-45.4	177.5	-173.6	-84.8	0	0	0	111.3	T55 M56 M57 Q62 K63 T65 L69	T55-F59 WeakPolarHBondContact O-CB 3.49Å; T55-F59 PolarHBondContact O-N 2.84Å; M56-F59 PolarHBondContact O-N 3.02Å; M57-F59 PolarHBondContact O-N 2.98Å; F59-Q62 PolarHBondContact O-N 3.09Å; F59-K63 HydrophobicContact CD2-CG 4.48Å; F59-K63 HydrophobicContact CE1-CB 4.22Å; F59-K63 HydrophobicContact CE1-CG 4.25Å; F59-K63 HydrophobicContact CE2-CG 4.19Å; F59-K63 HydrophobicContact CZ-CB 4.47Å; F59-K63 HydrophobicContact CZ-CG 4.07Å; F59-K63 WeakPolarHBondContact O-CB 3.4Å; F59-K63 PolarHBondContact O-N 3.04Å; F59-T65 WeakPolarHBondContact CE1-O 3.38Å; F59-L69 HydrophobicContact CB-CD1 3.67Å; F59-L69 HydrophobicContact CD1-CB 3.81Å; F59-L69 HydrophobicContact CD1-CD1 3.7Å; F59-L69 HydrophobicContact CD1-CG 4.32Å; F59-L69 HydrophobicContact CD2-CD1 4.48Å; F59-L69 HydrophobicContact CE1-CB 3.79Å; F59-L69 HydrophobicContact CE1-CD1 4.49Å; F59-L69 HydrophobicContact CG-CB 4.48Å; F59-L69 HydrophobicContact CG-CD1 3.69Å; F59-L69 HydrophobicContact CZ-CB 4.45Å
60	Y	89	Confident	90.2	Very high	147 Å²	147	72.7 Å²	72.7	58%	0.576	37%	0.371	S	S	*	.	H	α-helix	trans	-62.9	-45.7	179.4	-170.7	-98.6	0	0	0	112	M56 M57 R58 Q62 G64	M56-Y60 PolarHBondContact O-N 3.09Å; M57-Y60 PolarHBondContact O-N 2.87Å; R58-Y60 VanDerWaalsContact C-N 3.35Å; R58-Y60 PolarHBondContact O-N 3.23Å; Y60-Q62 VanDerWaalsContact C-N 3.34Å; Y60-Q62 PolarHBondContact O-N 3.25Å; Y60-G64 WeakPolarHBondContact O-CA 3.45Å; Y60-G64 PolarHBondContact O-N 3.31Å
61	I	90.9	Very high	89.9	Confident	121 Å²	121	76.8 Å²	76.8	62%	0.621	38%	0.381	S	S	*	.	H	α-helix	trans	-62.6	-40.1	177.7	-67.1	167.8	0	0	0	111.5	M57 R58	M57-I61 HydrophobicContact CE-CD1 4.13Å; M57-I61 HydrophobicContact CG-CD1 3.84Å; M57-I61 VanDerWaalsContact O-CG1 3.3Å; M57-I61 WeakPolarHBondContact O-CG1 2.93Å; M57-I61 PolarHBondContact O-N 3.31Å; R58-I61 PolarHBondContact O-N 3.07Å
62	Q	89.1	Confident	89.6	Confident	133 Å²	133	76.1 Å²	76.1	62%	0.621	38%	0.38	S	S	*	.	H	α-helix	trans	-78.2	-34.6	-176.3	-73.6	178	-10.1	0	0	114.2	R58 F59 Y60	R58-Q62 WeakPolarHBondContact O-CB 3.4Å; R58-Q62 VanDerWaalsContact O-CG 3.24Å; R58-Q62 WeakPolarHBondContact O-CG 3.26Å; R58-Q62 PolarHBondContact O-N 3.24Å; F59-Q62 PolarHBondContact O-N 3.09Å; Y60-Q62 VanDerWaalsContact C-N 3.34Å; Y60-Q62 PolarHBondContact O-N 3.25Å
63	K	87.3	Confident	89.5	Confident	139 Å²	139	76 Å²	76	60%	0.604	38%	0.379	S	S	*	.	H	α-helix	trans	-106.3	-18	-172.1	-64.1	-65.3	-177.1	-176.7	0	113.3	F59 T65	F59-K63 HydrophobicContact CD2-CG 4.48Å; F59-K63 HydrophobicContact CE1-CB 4.22Å; F59-K63 HydrophobicContact CE1-CG 4.25Å; F59-K63 HydrophobicContact CE2-CG 4.19Å; F59-K63 HydrophobicContact CZ-CB 4.47Å; F59-K63 HydrophobicContact CZ-CG 4.07Å; F59-K63 WeakPolarHBondContact O-CB 3.4Å; F59-K63 PolarHBondContact O-N 3.04Å; K63-T65 HydrophobicContact CB-CG2 4.14Å; K63-T65 PolarHBondContact O-N 2.84Å
64	G	83.6	Confident	89.3	Confident	61 Å²	61	75.2 Å²	75.2	63%	0.629	37%	0.372	S	S	*	.	S	Bend	trans	61.9	9.3	-175.2	0	0	0	0	0	114.1	Y60	Y60-G64 WeakPolarHBondContact O-CA 3.45Å; Y60-G64 PolarHBondContact O-N 3.31Å
65	T	85.7	Confident	89.2	Confident	51 Å²	51	81.1 Å²	81.1	31%	0.313	39%	0.389	S	S	.	.	S	Bend	trans	-141.4	154.8	-178.1	-171.2	0	0	0	0	110.4	F59 K63 K67	F59-T65 WeakPolarHBondContact CE1-O 3.38Å; K63-T65 HydrophobicContact CB-CG2 4.14Å; K63-T65 PolarHBondContact O-N 2.84Å; T65-K67 HydrophobicContact CG2-CB 4.4Å; T65-K67 PolarHBondContact OG1-N 3.1Å
66	H	82.8	Confident	89.2	Confident	39 Å²	39	81.1 Å²	81.1	18%	0.181	39%	0.389	C	S	.	.			trans	-89.2	-13.2	173.5	58.1	-101.1	0	0	0	113.2	G68 L69 N126 I131	H66-G68 PolarHBondContact O-N 3.46Å; H66-L69 WeakPolarHBondContact O-CB 3.49Å; H66-L69 PolarHBondContact O-N 3.39Å; H66-N126 PolarHBondContact CD2-O 2.83Å; H66-N126 PolarHBondContact NE2-O 2.97Å; H66-I131 HydrophobicContact CB-CD1 3.12Å; H66-I131 HydrophobicContact CB-CG1 3.94Å
67	K	85.4	Confident	89.2	Confident	138 Å²	138	80.3 Å²	80.3	60%	0.6	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	123.2	-177.9	-65.4	-174.8	178.8	179.1	0	109.8	T65 N126	T65-K67 HydrophobicContact CG2-CB 4.4Å; T65-K67 PolarHBondContact OG1-N 3.1Å; K67-N126 HydrophobicContact CG-CB 4.43Å
68	G	86	Confident	89.3	Confident	25 Å²	25	77 Å²	77	26%	0.258	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.2	-4.4	-175.6	0	0	0	0	0	115.4	H66 Y70 R71 N126	H66-G68 PolarHBondContact O-N 3.46Å; G68-Y70 VanDerWaalsContact C-N 3.32Å; G68-Y70 PolarHBondContact O-N 3.23Å; G68-R71 WeakPolarHBondContact O-CB 3.44Å; G68-R71 PolarHBondContact O-N 3.46Å; G68-R71 VanDerWaalsContact O-N 3.15Å; G68-N126 PolarHBondContact N-OD1 2.9Å
69	L	89.1	Confident	89.4	Confident	11 Å²	11	75.6 Å²	75.6	6%	0.058	37%	0.365	C	S	.	.	H	α-helix	trans	-55.3	-48.5	177.2	171.8	63	0	0	0	111.2	M56 F59 H66 R71 S72 I73	M56-L69 HydrophobicContact CB-CD1 4.3Å; M56-L69 HydrophobicContact CE-CD2 4.29Å; M56-L69 HydrophobicContact CG-CD1 4.08Å; M56-L69 HydrophobicContact CG-CD2 4.26Å; F59-L69 HydrophobicContact CB-CD1 3.67Å; F59-L69 HydrophobicContact CD1-CB 3.81Å; F59-L69 HydrophobicContact CD1-CD1 3.7Å; F59-L69 HydrophobicContact CD1-CG 4.32Å; F59-L69 HydrophobicContact CD2-CD1 4.48Å; F59-L69 HydrophobicContact CE1-CB 3.79Å; F59-L69 HydrophobicContact CE1-CD1 4.49Å; F59-L69 HydrophobicContact CG-CB 4.48Å; F59-L69 HydrophobicContact CG-CD1 3.69Å; F59-L69 HydrophobicContact CZ-CB 4.45Å; H66-L69 WeakPolarHBondContact O-CB 3.49Å; H66-L69 PolarHBondContact O-N 3.39Å; L69-R71 PolarHBondContact O-N 3.41Å; L69-R71 VanDerWaalsContact O-N 3.12Å; L69-S72 WeakPolarHBondContact O-CB 3.39Å; L69-S72 PolarHBondContact O-N 3.01Å; L69-I73 HydrophobicContact CD1-CG2 4.11Å; L69-I73 HydrophobicContact CG-CD1 4.34Å; L69-I73 PolarHBondContact O-N 3.24Å
70	Y	89.5	Confident	89.5	Confident	5 Å²	5	75.4 Å²	75.4	2%	0.02	37%	0.365	C	S	.	.	H	α-helix	trans	-53.4	-38	-178.8	-172.4	-94.2	0	0	0	111.9	G68 S72 I73 A74 L77 V114 T118 S119 Q125 V130 L134	G68-Y70 VanDerWaalsContact C-N 3.32Å; G68-Y70 PolarHBondContact O-N 3.23Å; Y70-S72 VanDerWaalsContact C-N 3.28Å; Y70-S72 PolarHBondContact O-N 2.86Å; Y70-I73 PolarHBondContact O-N 2.97Å; Y70-A74 HydrophobicContact CD1-CB 3.94Å; Y70-A74 HydrophobicContact CE1-CB 3.69Å; Y70-A74 WeakPolarHBondContact O-CA 3.3Å; Y70-A74 WeakPolarHBondContact O-CB 3.3Å; Y70-A74 PolarHBondContact O-N 3.24Å; Y70-L77 HydrophobicContact CE2-CD2 3.94Å; Y70-V114 PolarHBondContact OH-O 2.91Å; Y70-T118 WeakPolarHBondContact OH-CB 3.32Å; Y70-T118 PolarHBondContact OH-OG1 3.36Å; Y70-S119 PolarHBondContact OH-N 3.46Å; Y70-S119 PolarHBondContact OH-OG 3.38Å; Y70-Q125 HydrophobicContact CD1-CB 3.91Å; Y70-Q125 HydrophobicContact CD1-CG 3.47Å; Y70-Q125 VanDerWaalsContact CD1-CG 3.47Å; Y70-Q125 HydrophobicContact CE1-CG 3.82Å; Y70-Q125 HydrophobicContact CG-CB 4.01Å; Y70-Q125 HydrophobicContact CG-CG 4Å; Y70-V130 HydrophobicContact CD2-CG1 3.93Å; Y70-V130 HydrophobicContact CE2-CG1 4.47Å; Y70-L134 HydrophobicContact CD2-CD1 4.31Å
71	R	88.6	Confident	89.7	Confident	165 Å²	165	68.5 Å²	68.5	62%	0.623	34%	0.337	S	S	*	.	H	α-helix	trans	-63.5	-34.3	179.8	-169.6	173.2	-63.4	160.7	7.8	112.7	G68 L69	G68-R71 WeakPolarHBondContact O-CB 3.44Å; G68-R71 PolarHBondContact O-N 3.46Å; G68-R71 VanDerWaalsContact O-N 3.15Å; L69-R71 PolarHBondContact O-N 3.41Å; L69-R71 VanDerWaalsContact O-N 3.12Å
72	S	88.4	Confident	89.8	Confident	61 Å²	61	65.3 Å²	65.3	43%	0.427	32%	0.324	S	S	.	.	H	α-helix	trans	-72.4	-39.9	177.9	-178	0	0	0	0	111.6	L69 Y70	L69-S72 WeakPolarHBondContact O-CB 3.39Å; L69-S72 PolarHBondContact O-N 3.01Å; Y70-S72 VanDerWaalsContact C-N 3.28Å; Y70-S72 PolarHBondContact O-N 2.86Å
73	I	92.1	Very high	90.1	Very high	1 Å²	1	62.4 Å²	62.4	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-93.9	-17.4	-174.1	64.9	171.6	0	0	0	114.1	L52 T55 M56 L69 Y70 R75 T76 L77 L134	L52-I73 HydrophobicContact CD1-CB 3.97Å; T55-I73 HydrophobicContact CG2-CG2 3.83Å; M56-I73 HydrophobicContact CG-CD1 4.17Å; M56-I73 HydrophobicContact CG-CG2 3.95Å; M56-I73 HydrophobicContact SD-CD1 4.27Å; L69-I73 HydrophobicContact CD1-CG2 4.11Å; L69-I73 HydrophobicContact CG-CD1 4.34Å; L69-I73 PolarHBondContact O-N 3.24Å; Y70-I73 PolarHBondContact O-N 2.97Å; I73-R75 VanDerWaalsContact C-N 3.27Å; I73-R75 PolarHBondContact O-N 3.25Å; I73-R75 VanDerWaalsContact O-N 3.15Å; I73-T76 PolarHBondContact O-N 3.08Å; I73-T76 VanDerWaalsContact O-N 3.1Å; I73-L77 WeakPolarHBondContact O-CB 3.16Å; I73-L77 PolarHBondContact O-N 2.96Å; I73-L134 HydrophobicContact CD1-CD1 3.57Å; I73-L134 HydrophobicContact CD1-CD2 4.3Å; I73-L134 HydrophobicContact CD1-CG 4.5Å
74	A	91.6	Very high	90.3	Very high	13 Å²	13	55.9 Å²	55.9	11%	0.107	28%	0.281	C	S	.	.	H	α-helix	trans	-57.6	-36.5	-168.7	0	0	0	0	0	113.4	Y70 K78	Y70-A74 HydrophobicContact CD1-CB 3.94Å; Y70-A74 HydrophobicContact CE1-CB 3.69Å; Y70-A74 WeakPolarHBondContact O-CA 3.3Å; Y70-A74 WeakPolarHBondContact O-CB 3.3Å; Y70-A74 PolarHBondContact O-N 3.24Å; A74-K78 VanDerWaalsContact O-CB 3.27Å; A74-K78 WeakPolarHBondContact O-CB 3.35Å; A74-K78 VanDerWaalsContact O-CE 3.3Å; A74-K78 WeakPolarHBondContact O-CE 3.49Å; A74-K78 VanDerWaalsContact O-CG 3.29Å; A74-K78 WeakPolarHBondContact O-CG 3.4Å; A74-K78 PolarHBondContact O-N 3.31Å
75	R	92.3	Very high	90.7	Very high	215 Å²	215	56.6 Å²	56.6	81%	0.811	27%	0.27	S	S	*	.	H	α-helix	trans	-65.6	-50.6	178.5	-171.6	-177.4	-67.7	165.6	-2.1	110.5	I73 K78 F79	I73-R75 VanDerWaalsContact C-N 3.27Å; I73-R75 PolarHBondContact O-N 3.25Å; I73-R75 VanDerWaalsContact O-N 3.15Å; R75-K78 PolarHBondContact O-N 2.73Å; R75-F79 WeakPolarHBondContact O-CB 3.42Å; R75-F79 PolarHBondContact O-N 2.79Å
76	T	92.7	Very high	90.9	Very high	40 Å²	40	56.5 Å²	56.5	25%	0.245	27%	0.269	C	S	.	.	H	α-helix	trans	-62.3	-47.6	178.5	-51.1	0	0	0	0	111.1	L52 I73 K78 F79 F80	L52-T76 HydrophobicContact CD1-CG2 3.84Å; I73-T76 PolarHBondContact O-N 3.08Å; I73-T76 VanDerWaalsContact O-N 3.1Å; T76-K78 PolarHBondContact O-N 3.08Å; T76-F79 PolarHBondContact O-N 3.19Å; T76-F80 HydrophobicContact CG2-CD2 3.75Å; T76-F80 HydrophobicContact CG2-CE2 3.72Å; T76-F80 VanDerWaalsContact O-CD2 3.29Å; T76-F80 WeakPolarHBondContact O-CD2 3.47Å; T76-F80 PolarHBondContact O-N 3.01Å
77	L	94.1	Very high	91.2	Very high	1 Å²	1	55.6 Å²	55.6	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-57.5	-50.4	177.9	178.6	67	0	0	0	111.9	W49 L52 Y70 I73 F79 F80 Q81 V114 L134	W49-L77 HydrophobicContact CH2-CD1 3.9Å; W49-L77 HydrophobicContact CZ3-CD1 4.03Å; L52-L77 HydrophobicContact CD1-CB 4.01Å; L52-L77 HydrophobicContact CD2-CD1 4.24Å; Y70-L77 HydrophobicContact CE2-CD2 3.94Å; I73-L77 WeakPolarHBondContact O-CB 3.16Å; I73-L77 PolarHBondContact O-N 2.96Å; L77-F79 VanDerWaalsContact C-N 3.32Å; L77-F79 PolarHBondContact O-N 3.49Å; L77-F80 PolarHBondContact O-N 3.48Å; L77-Q81 HydrophobicContact CD1-CG 4.17Å; L77-Q81 WeakPolarHBondContact O-CB 3.34Å; L77-Q81 PolarHBondContact O-N 3.09Å; L77-V114 HydrophobicContact CD1-CG2 4.49Å; L77-V114 HydrophobicContact CD2-CG1 4.03Å; L77-V114 HydrophobicContact CD2-CG2 3.98Å; L77-V114 HydrophobicContact CG-CG1 4.11Å; L77-V114 HydrophobicContact CG-CG2 4.11Å; L77-L134 HydrophobicContact CD1-CD2 3.94Å; L77-L134 HydrophobicContact CD2-CD2 3.46Å; L77-L134 VanDerWaalsContact CD2-CD2 3.46Å; L77-L134 HydrophobicContact CG-CD2 4.33Å
78	K	94.1	Very high	91.3	Very high	59 Å²	59	50.4 Å²	50.4	26%	0.257	25%	0.245	S	C	.	.	H	α-helix	trans	-61.4	-41.7	179.5	-81	-174.3	-66.5	179.8	0	112	A74 R75 T76 T82 V114 W115	A74-K78 VanDerWaalsContact O-CB 3.27Å; A74-K78 WeakPolarHBondContact O-CB 3.35Å; A74-K78 VanDerWaalsContact O-CE 3.3Å; A74-K78 WeakPolarHBondContact O-CE 3.49Å; A74-K78 VanDerWaalsContact O-CG 3.29Å; A74-K78 WeakPolarHBondContact O-CG 3.4Å; A74-K78 PolarHBondContact O-N 3.31Å; R75-K78 PolarHBondContact O-N 2.73Å; T76-K78 PolarHBondContact O-N 3.08Å; K78-T82 VanDerWaalsContact O-CB 3.31Å; K78-T82 WeakPolarHBondContact O-CB 3.44Å; K78-T82 PolarHBondContact O-N 3.45Å; K78-T82 PolarHBondContact O-OG1 3.25Å; K78-V114 HydrophobicContact CG-CG1 3.5Å; K78-V114 VanDerWaalsContact CG-CG1 3.5Å; K78-W115 HydrophobicContact CB-CZ2 3.93Å; K78-W115 HydrophobicContact CD-CD2 4.07Å; K78-W115 HydrophobicContact CD-CE3 4.02Å; K78-W115 HydrophobicContact CD-CH2 3.88Å; K78-W115 HydrophobicContact CD-CZ2 3.9Å; K78-W115 HydrophobicContact CD-CZ3 3.93Å; K78-W115 HydrophobicContact CG-CD2 4.39Å; K78-W115 HydrophobicContact CG-CZ2 4.11Å
79	F	94.8	Very high	91.3	Very high	126 Å²	126	50.8 Å²	50.8	55%	0.553	25%	0.249	S	C	*	.	H	α-helix	trans	-60.6	-56.8	178.7	178.6	-96.5	0	0	0	110.9	R75 T76 L77 Q81 T82 F83	R75-F79 WeakPolarHBondContact O-CB 3.42Å; R75-F79 PolarHBondContact O-N 2.79Å; T76-F79 PolarHBondContact O-N 3.19Å; L77-F79 VanDerWaalsContact C-N 3.32Å; L77-F79 PolarHBondContact O-N 3.49Å; F79-Q81 PolarHBondContact O-N 3.37Å; F79-T82 PolarHBondContact O-N 3.06Å; F79-F83 WeakPolarHBondContact O-CB 3.5Å; F79-F83 PolarHBondContact O-N 3.05Å
80	F	93.3	Very high	91.3	Very high	33 Å²	33	51 Å²	51	15%	0.145	25%	0.25	C	C	.	.	H	α-helix	trans	-66.5	-35.4	-177.6	-75.3	-68.1	0	0	0	112.9	M45 T76 L77 F83 A84	M45-F80 WeakPolarHBondContact CE-O 3.31Å; M45-F80 HydrophobicContact SD-CD1 3.76Å; M45-F80 HydrophobicContact SD-CE1 4.47Å; T76-F80 HydrophobicContact CG2-CD2 3.75Å; T76-F80 HydrophobicContact CG2-CE2 3.72Å; T76-F80 VanDerWaalsContact O-CD2 3.29Å; T76-F80 WeakPolarHBondContact O-CD2 3.47Å; T76-F80 PolarHBondContact O-N 3.01Å; L77-F80 PolarHBondContact O-N 3.48Å; F80-F83 PolarHBondContact O-N 2.96Å; F80-A84 PolarHBondContact O-N 2.97Å
81	Q	93.3	Very high	91.1	Very high	1 Å²	1	51 Å²	51	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-67.9	-37.7	175	-81.2	-66.7	21.2	0	0	113.3	W49 L77 F79 F83 A84 R110 V114 W137	W49-Q81 HydrophobicContact CH2-CG 4.15Å; W49-Q81 HydrophobicContact CZ2-CG 4.23Å; L77-Q81 HydrophobicContact CD1-CG 4.17Å; L77-Q81 WeakPolarHBondContact O-CB 3.34Å; L77-Q81 PolarHBondContact O-N 3.09Å; F79-Q81 PolarHBondContact O-N 3.37Å; Q81-F83 VanDerWaalsContact C-N 3.32Å; Q81-A84 WeakPolarHBondContact O-CB 2.98Å; Q81-A84 PolarHBondContact O-N 2.94Å; Q81-R110 VanDerWaalsContact NE2-CD 3.32Å; Q81-V114 HydrophobicContact CG-CG2 4.14Å; Q81-W137 HydrophobicContact CG-CZ3 4.46Å; Q81-W137 VanDerWaalsContact NE2-CE3 3.32Å; Q81-W137 VanDerWaalsContact NE2-CZ3 3.27Å
82	T	93.2	Very high	90.7	Very high	55 Å²	55	46.3 Å²	46.3	34%	0.337	25%	0.247	S	C	.	.	H	α-helix	trans	-69.5	-36.9	175.2	-50.3	0	0	0	0	110.4	K78 F79 A84 L85 W115	K78-T82 VanDerWaalsContact O-CB 3.31Å; K78-T82 WeakPolarHBondContact O-CB 3.44Å; K78-T82 PolarHBondContact O-N 3.45Å; K78-T82 PolarHBondContact O-OG1 3.25Å; F79-T82 PolarHBondContact O-N 3.06Å; T82-A84 PolarHBondContact O-N 3.09Å; T82-L85 HydrophobicContact CG2-CD1 4.29Å; T82-L85 VanDerWaalsContact O-CB 3.29Å; T82-L85 WeakPolarHBondContact O-CB 3.33Å; T82-L85 WeakPolarHBondContact O-CG 3.2Å; T82-L85 PolarHBondContact O-N 2.97Å; T82-W115 PolarHBondContact OG1-NE1 3.11Å; T82-W115 VanDerWaalsContact OG1-NE1 3.1Å
83	F	93.4	Very high	90.4	Very high	72 Å²	72	48.8 Å²	48.8	32%	0.316	26%	0.259	S	S	.	.	H	α-helix	trans	-67.2	-19.6	176.9	-159.7	-109.6	0	0	0	113.3	Y41 M45 F79 F80 Q81 L85 V86	Y41-F83 HydrophobicContact CD2-CD1 4.33Å; Y41-F83 AromaticContact CD2-CE1 3.57Å; Y41-F83 HydrophobicContact CD2-CE1 3.57Å; Y41-F83 HydrophobicContact CD2-CZ 4.23Å; Y41-F83 AromaticContact CE2-CD1 3.64Å; Y41-F83 HydrophobicContact CE2-CD1 3.64Å; Y41-F83 AromaticContact CE2-CE1 3.31Å; Y41-F83 HydrophobicContact CE2-CE1 3.31Å; Y41-F83 HydrophobicContact CE2-CZ 4.13Å; Y41-F83 PolarHBondContact OH-O 3.37Å; M45-F83 HydrophobicContact SD-CD1 3.65Å; M45-F83 HydrophobicContact SD-CE1 4.44Å; F79-F83 WeakPolarHBondContact O-CB 3.5Å; F79-F83 PolarHBondContact O-N 3.05Å; F80-F83 PolarHBondContact O-N 2.96Å; Q81-F83 VanDerWaalsContact C-N 3.32Å; F83-L85 PolarHBondContact O-N 3.49Å; F83-V86 HydrophobicContact CD2-CG2 4.18Å; F83-V86 HydrophobicContact CE2-CG2 4.14Å; F83-V86 HydrophobicContact CZ-CG2 4.5Å; F83-V86 WeakPolarHBondContact O-CB 3.47Å; F83-V86 WeakPolarHBondContact O-CG2 3.12Å; F83-V86 PolarHBondContact O-N 3.3Å
84	A	91.6	Very high	89.6	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.008	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-17.2	170.5	0	0	0	0	0	113.1	M45 F80 Q81 T82 V86 E87 V107	M45-A84 HydrophobicContact CE-CB 4.25Å; F80-A84 PolarHBondContact O-N 2.97Å; Q81-A84 WeakPolarHBondContact O-CB 2.98Å; Q81-A84 PolarHBondContact O-N 2.94Å; T82-A84 PolarHBondContact O-N 3.09Å; A84-V86 PolarHBondContact O-N 3.35Å; A84-E87 WeakPolarHBondContact O-CB 3.29Å; A84-E87 PolarHBondContact O-N 3.4Å; A84-V107 HydrophobicContact CB-CG1 3.91Å; A84-V107 HydrophobicContact CB-CG2 4.34Å
85	L	92.2	Very high	88.9	Confident	77 Å²	77	53.6 Å²	53.6	40%	0.403	30%	0.296	S	S	.	.	H	α-helix	trans	-60.3	-28.1	171.9	-71.3	173.5	0	0	0	112.8	T82 F83 E87 V88 G89 V107 I111	T82-L85 HydrophobicContact CG2-CD1 4.29Å; T82-L85 VanDerWaalsContact O-CB 3.29Å; T82-L85 WeakPolarHBondContact O-CB 3.33Å; T82-L85 WeakPolarHBondContact O-CG 3.2Å; T82-L85 PolarHBondContact O-N 2.97Å; F83-L85 PolarHBondContact O-N 3.49Å; L85-E87 PolarHBondContact O-N 3.11Å; L85-V88 WeakPolarHBondContact O-CB 3.21Å; L85-V88 PolarHBondContact O-N 3.19Å; L85-G89 PolarHBondContact O-N 2.98Å; L85-G89 VanDerWaalsContact O-N 3.15Å; L85-V107 HydrophobicContact CD2-CG1 3.96Å; L85-V107 HydrophobicContact CG-CG1 4.42Å; L85-I111 HydrophobicContact CD1-CD1 3.89Å; L85-I111 HydrophobicContact CD2-CD1 3.46Å; L85-I111 VanDerWaalsContact CD2-CD1 3.46Å; L85-I111 HydrophobicContact CG-CD1 3.44Å; L85-I111 VanDerWaalsContact CG-CD1 3.44Å
86	V	91.6	Very high	88.1	Confident	48 Å²	48	45.7 Å²	45.7	29%	0.291	27%	0.272	S	S	.	.	H	α-helix	trans	-59.9	-31.4	174.9	-178.6	0	0	0	0	110.6	Y41 F83 A84 V88 G89 H90	Y41-V86 HydrophobicContact CD2-CG1 4.34Å; Y41-V86 HydrophobicContact CE2-CB 3.85Å; Y41-V86 HydrophobicContact CE2-CG1 3.93Å; F83-V86 HydrophobicContact CD2-CG2 4.18Å; F83-V86 HydrophobicContact CE2-CG2 4.14Å; F83-V86 HydrophobicContact CZ-CG2 4.5Å; F83-V86 WeakPolarHBondContact O-CB 3.47Å; F83-V86 WeakPolarHBondContact O-CG2 3.12Å; F83-V86 PolarHBondContact O-N 3.3Å; A84-V86 PolarHBondContact O-N 3.35Å; V86-V88 VanDerWaalsContact C-N 3.35Å; V86-V88 PolarHBondContact O-N 3.45Å; V86-G89 CarbonylContact O-C 3.59Å; V86-G89 WeakPolarHBondContact O-CA 3.35Å; V86-G89 PolarHBondContact O-N 2.98Å; V86-G89 VanDerWaalsContact O-N 3.14Å; V86-H90 WeakPolarHBondContact CG1-NE2 3.38Å; V86-H90 VanDerWaalsContact O-CG 3.31Å; V86-H90 PolarHBondContact O-N 3.45Å
87	E	88.6	Confident	86.6	Confident	20 Å²	20	56 Å²	56	9%	0.093	31%	0.306	C	S	.	.	H	α-helix	trans	-64.8	-38.1	175.3	-164.6	-179.6	166	0	0	112.3	A84 L85 G89 H90 C91 T103 R144 Y145	A84-E87 WeakPolarHBondContact O-CB 3.29Å; A84-E87 PolarHBondContact O-N 3.4Å; L85-E87 PolarHBondContact O-N 3.11Å; E87-G89 VanDerWaalsContact C-N 3.28Å; E87-G89 PolarHBondContact O-N 3.16Å; E87-H90 PolarHBondContact O-N 3.35Å; E87-C91 PolarHBondContact O-N 3.38Å; E87-C91 PolarHBondContact O-SG 2.86Å; E87-T103 HydrophobicContact CG-CG2 4.04Å; E87-R144 IonicContact OE1-CZ 3.47Å; E87-R144 IonicContact OE1-NH1 2.63Å; E87-R144 PolarHBondContact OE1-NH1 3.43Å; E87-R144 IonicContact OE2-CZ 3.5Å; E87-R144 VanDerWaalsContact OE2-CZ 3.28Å; E87-R144 IonicContact OE2-NH1 3.22Å; E87-R144 PolarHBondContact OE2-NH1 2.9Å; E87-R144 IonicContact OE2-NH2 2.91Å; E87-R144 PolarHBondContact OE2-NH2 3.28Å; E87-Y145 PolarHBondContact OE2-OH 2.91Å
88	V	87.9	Confident	85.4	Confident	29 Å²	29	59 Å²	59	18%	0.176	32%	0.324	C	S	.	.	H	α-helix	trans	-63.3	-41.3	173.2	-173.1	0	0	0	0	109.7	L85 V86 C91 A92 V100 T103 V107	L85-V88 WeakPolarHBondContact O-CB 3.21Å; L85-V88 PolarHBondContact O-N 3.19Å; V86-V88 VanDerWaalsContact C-N 3.35Å; V86-V88 PolarHBondContact O-N 3.45Å; V88-C91 PolarHBondContact O-N 3.04Å; V88-A92 WeakPolarHBondContact O-CB 3.07Å; V88-A92 PolarHBondContact O-N 2.8Å; V88-V100 HydrophobicContact CG1-CG1 4.26Å; V88-T103 HydrophobicContact CG2-CG2 4.3Å; V88-V107 HydrophobicContact CG2-CB 3.98Å; V88-V107 HydrophobicContact CG2-CG1 4.28Å; V88-V107 HydrophobicContact CG2-CG2 4.09Å
89	G	86	Confident	84.6	Confident	34 Å²	34	59.2 Å²	59.2	35%	0.351	33%	0.333	S	S	.	.	H	α-helix	trans	-59.6	-45.1	172.9	0	0	0	0	0	113	L85 V86 E87 C91 A92 V93	L85-G89 PolarHBondContact O-N 2.98Å; L85-G89 VanDerWaalsContact O-N 3.15Å; V86-G89 CarbonylContact O-C 3.59Å; V86-G89 WeakPolarHBondContact O-CA 3.35Å; V86-G89 PolarHBondContact O-N 2.98Å; V86-G89 VanDerWaalsContact O-N 3.14Å; E87-G89 VanDerWaalsContact C-N 3.28Å; E87-G89 PolarHBondContact O-N 3.16Å; G89-C91 VanDerWaalsContact C-N 3.29Å; G89-C91 PolarHBondContact O-N 2.95Å; G89-A92 PolarHBondContact O-N 3.48Å; G89-A92 VanDerWaalsContact O-N 3.15Å; G89-V93 WeakPolarHBondContact O-CG2 3.43Å; G89-V93 PolarHBondContact O-N 2.95Å
90	H	88.5	Confident	83.9	Confident	14 Å²	14	56 Å²	56	7%	0.065	32%	0.324	C	S	.	.	H	α-helix	trans	-59.8	-39.4	175.8	-62.3	156.1	0	0	0	112.4	W37 V86 E87 I95 V96	W37-H90 AromaticContact CD1-NE2 3.79Å; W37-H90 AromaticContact CE2-NE2 3.94Å; W37-H90 AromaticContact NE1-CD2 3.99Å; W37-H90 AromaticContact NE1-CE1 3.59Å; W37-H90 AromaticContact NE1-NE2 2.93Å; W37-H90 PolarHBondContact NE1-NE2 2.87Å; V86-H90 WeakPolarHBondContact CG1-NE2 3.38Å; V86-H90 VanDerWaalsContact O-CG 3.31Å; V86-H90 PolarHBondContact O-N 3.45Å; E87-H90 PolarHBondContact O-N 3.35Å; H90-I95 WeakPolarHBondContact O-CB 3.14Å; H90-I95 PolarHBondContact O-N 3.43Å; H90-V96 HydrophobicContact CB-CG2 4.05Å; H90-V96 PolarHBondContact O-N 3.23Å
91	C	84.8	Confident	83.3	Confident	6 Å²	6	60.7 Å²	60.7	4%	0.041	35%	0.349	C	S	.	.	H	α-helix	trans	-68.4	-42.7	175	-59.6	0	0	0	0	111	E87 V88 G89 V93 G94 V100	E87-C91 PolarHBondContact O-N 3.38Å; E87-C91 PolarHBondContact O-SG 2.86Å; V88-C91 PolarHBondContact O-N 3.04Å; G89-C91 VanDerWaalsContact C-N 3.29Å; G89-C91 PolarHBondContact O-N 2.95Å; C91-V93 PolarHBondContact O-N 3.23Å; C91-G94 PolarHBondContact O-N 3.47Å; C91-V100 HydrophobicContact CB-CB 4.38Å; C91-V100 HydrophobicContact CB-CG2 3.96Å; C91-V100 WeakPolarHBondContact O-CG2 3.44Å
92	A	81.3	Confident	82.8	Confident	67 Å²	67	63 Å²	63	55%	0.554	36%	0.363	S	S	*	.	H	α-helix	trans	-64.3	-37	-177.7	0	0	0	0	0	113.2	V88 G89 G94 V100	V88-A92 WeakPolarHBondContact O-CB 3.07Å; V88-A92 PolarHBondContact O-N 2.8Å; G89-A92 PolarHBondContact O-N 3.48Å; G89-A92 VanDerWaalsContact O-N 3.15Å; A92-G94 PolarHBondContact O-N 3.03Å; A92-V100 HydrophobicContact CB-CG1 4.08Å
93	V	81.8	Confident	82.4	Confident	112 Å²	112	60.7 Å²	60.7	68%	0.679	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-5.4	175.8	-177.6	0	0	0	0	111.8	G89 C91 I95	G89-V93 WeakPolarHBondContact O-CG2 3.43Å; G89-V93 PolarHBondContact O-N 2.95Å; C91-V93 PolarHBondContact O-N 3.23Å; V93-I95 VanDerWaalsContact C-N 3.25Å; V93-I95 HydrophobicContact CB-CD1 4.15Å; V93-I95 HydrophobicContact CB-CG1 4.19Å; V93-I95 HydrophobicContact CG1-CD1 3.92Å; V93-I95 HydrophobicContact CG1-CG1 3.95Å; V93-I95 PolarHBondContact O-N 2.82Å
94	G	75.2	Confident	82	Confident	57 Å²	57	57.8 Å²	57.8	59%	0.588	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.3	13.2	-178.5	0	0	0	0	0	113.9	C91 A92 V96	C91-G94 PolarHBondContact O-N 3.47Å; A92-G94 PolarHBondContact O-N 3.03Å; G94-V96 VanDerWaalsContact C-N 3.26Å; G94-V96 PolarHBondContact O-N 3.45Å
95	I	76.3	Confident	81.8	Confident	59 Å²	59	61.1 Å²	61.1	30%	0.303	36%	0.36	S	S	.	.	S	Bend	trans	-66.2	-33.8	175.8	-68	170.2	0	0	0	110.4	I34 L38 H90 V93	I34-I95 HydrophobicContact CG2-CG2 3.49Å; I34-I95 VanDerWaalsContact CG2-CG2 3.49Å; L38-I95 HydrophobicContact CD1-CG2 3.77Å; L38-I95 HydrophobicContact CD2-CG2 4.1Å; L38-I95 HydrophobicContact CG-CG2 4.21Å; H90-I95 WeakPolarHBondContact O-CB 3.14Å; H90-I95 PolarHBondContact O-N 3.43Å; V93-I95 VanDerWaalsContact C-N 3.25Å; V93-I95 HydrophobicContact CB-CD1 4.15Å; V93-I95 HydrophobicContact CB-CG1 4.19Å; V93-I95 HydrophobicContact CG1-CD1 3.92Å; V93-I95 HydrophobicContact CG1-CG1 3.95Å; V93-I95 PolarHBondContact O-N 2.82Å
96	V	75	Confident	81.5	Confident	48 Å²	48	60.5 Å²	60.5	29%	0.291	36%	0.355	S	S	.	.	S	Bend	trans	-118.2	129	178.7	-179.8	0	0	0	0	109.7	L38 H90 G94 T98	L38-V96 HydrophobicContact CD1-CG2 4.49Å; L38-V96 HydrophobicContact CD2-CG2 4.32Å; H90-V96 HydrophobicContact CB-CG2 4.05Å; H90-V96 PolarHBondContact O-N 3.23Å; G94-V96 VanDerWaalsContact C-N 3.26Å; G94-V96 PolarHBondContact O-N 3.45Å; V96-T98 PolarHBondContact O-N 3.35Å
97	R	60.9	Low	81.5	Confident	258 Å²	258	58.4 Å²	58.4	97%	0.974	34%	0.342	S	S	*	.			trans	-77	58.5	178.6	-60.1	-175.2	-165.9	174	3.8	112.3
98	T	69.8	Low	81.5	Confident	63 Å²	63	60.6 Å²	60.6	39%	0.387	36%	0.359	S	S	.	.	S	Bend	trans	-126.8	147.3	174.3	-59	0	0	0	0	109.2	V96 V100 T103	V96-T98 PolarHBondContact O-N 3.35Å; T98-V100 PolarHBondContact O-N 2.99Å; T98-V100 VanDerWaalsContact O-N 3.14Å; T98-T103 VanDerWaalsContact CG2-OG1 3.31Å; T98-T103 WeakPolarHBondContact CG2-OG1 3.27Å
99	S	77.5	Confident	81.6	Confident	63 Å²	63	60.9 Å²	60.9	44%	0.441	36%	0.362	S	S	.	.			trans	-59.2	118.2	175	173.9	0	0	0	0	110.9	I101 V102 T103	S99-I101 PolarHBondContact O-N 3.46Å; S99-V102 PolarHBondContact O-N 2.88Å; S99-V102 VanDerWaalsContact O-N 3.15Å; S99-V102 PolarHBondContact OG-N 3.39Å; S99-T103 PolarHBondContact O-N 3.23Å; S99-T103 PolarHBondContact O-OG1 3.44Å
100	V	80.8	Confident	81.8	Confident	58 Å²	58	60.7 Å²	60.7	35%	0.352	35%	0.351	S	S	.	.	H	α-helix	trans	-56.1	-40.3	178.1	-171.3	0	0	0	0	111	V88 C91 A92 T98 G104	V88-V100 HydrophobicContact CG1-CG1 4.26Å; C91-V100 HydrophobicContact CB-CB 4.38Å; C91-V100 HydrophobicContact CB-CG2 3.96Å; C91-V100 WeakPolarHBondContact O-CG2 3.44Å; A92-V100 HydrophobicContact CB-CG1 4.08Å; T98-V100 PolarHBondContact O-N 2.99Å; T98-V100 VanDerWaalsContact O-N 3.14Å; V100-G104 WeakPolarHBondContact O-CA 3.22Å; V100-G104 PolarHBondContact O-N 2.74Å
101	I	79.8	Confident	82.1	Confident	133 Å²	133	61.2 Å²	61.2	68%	0.682	35%	0.354	S	S	*	.	H	α-helix	trans	-64.6	-45.4	-179.7	-61.4	175.3	0	0	0	110.1	S99 G104 V105	S99-I101 PolarHBondContact O-N 3.46Å; I101-G104 PolarHBondContact O-N 2.99Å; I101-V105 HydrophobicContact CG2-CG2 4.39Å; I101-V105 WeakPolarHBondContact O-CB 3.33Å; I101-V105 VanDerWaalsContact O-CG2 3.29Å; I101-V105 WeakPolarHBondContact O-CG2 3.07Å; I101-V105 PolarHBondContact O-N 3.47Å
102	V	82.6	Confident	82.4	Confident	50 Å²	50	62.5 Å²	62.5	30%	0.303	36%	0.358	S	S	.	.	H	α-helix	trans	-65.5	-48.4	-179	176.5	0	0	0	0	110.8	S99 G104 V105 Q106 L228	S99-V102 PolarHBondContact O-N 2.88Å; S99-V102 VanDerWaalsContact O-N 3.15Å; S99-V102 PolarHBondContact OG-N 3.39Å; V102-G104 VanDerWaalsContact C-N 3.32Å; V102-G104 PolarHBondContact O-N 3.32Å; V102-V105 PolarHBondContact O-N 3.3Å; V102-Q106 WeakPolarHBondContact O-CB 3.33Å; V102-Q106 VanDerWaalsContact O-CG 3.27Å; V102-Q106 WeakPolarHBondContact O-CG 3.43Å; V102-Q106 PolarHBondContact O-N 3.22Å; V102-Q106 VanDerWaalsContact O-N 3.08Å; V102-L228 HydrophobicContact CG1-CD2 3.9Å
103	T	85	Confident	82.9	Confident	5 Å²	5	59.3 Å²	59.3	3%	0.031	33%	0.331	C	S	.	.	H	α-helix	trans	-62	-42.5	176.7	-53.5	0	0	0	0	111.1	E87 V88 T98 S99 Q106 V107	E87-T103 HydrophobicContact CG-CG2 4.04Å; V88-T103 HydrophobicContact CG2-CG2 4.3Å; T98-T103 VanDerWaalsContact CG2-OG1 3.31Å; T98-T103 WeakPolarHBondContact CG2-OG1 3.27Å; S99-T103 PolarHBondContact O-N 3.23Å; S99-T103 PolarHBondContact O-OG1 3.44Å; T103-Q106 PolarHBondContact O-N 3.45Å; T103-V107 HydrophobicContact CG2-CG2 4.31Å; T103-V107 WeakPolarHBondContact O-CG2 3.49Å; T103-V107 PolarHBondContact O-N 3.42Å
104	G	86.1	Confident	83.5	Confident	12 Å²	12	54 Å²	54	12%	0.124	30%	0.299	C	S	.	.	H	α-helix	trans	-59.5	-52.5	178.2	0	0	0	0	0	112.2	V100 I101 V102 Q106 V107 C108	V100-G104 WeakPolarHBondContact O-CA 3.22Å; V100-G104 PolarHBondContact O-N 2.74Å; I101-G104 PolarHBondContact O-N 2.99Å; V102-G104 VanDerWaalsContact C-N 3.32Å; V102-G104 PolarHBondContact O-N 3.32Å; G104-Q106 VanDerWaalsContact C-N 3.3Å; G104-Q106 PolarHBondContact O-N 3.05Å; G104-V107 PolarHBondContact O-N 3.47Å; G104-C108 WeakPolarHBondContact O-CB 3.09Å; G104-C108 PolarHBondContact O-N 2.91Å; G104-C108 PolarHBondContact O-SG 2.95Å
105	V	86.3	Confident	84.3	Confident	71 Å²	71	56.1 Å²	56.1	43%	0.43	29%	0.29	S	S	.	.	H	α-helix	trans	-59.1	-42.6	178	170.4	0	0	0	0	111.2	I101 V102 S109	I101-V105 HydrophobicContact CG2-CG2 4.39Å; I101-V105 WeakPolarHBondContact O-CB 3.33Å; I101-V105 VanDerWaalsContact O-CG2 3.29Å; I101-V105 WeakPolarHBondContact O-CG2 3.07Å; I101-V105 PolarHBondContact O-N 3.47Å; V102-V105 PolarHBondContact O-N 3.3Å; V105-S109 VanDerWaalsContact O-CB 3.27Å; V105-S109 WeakPolarHBondContact O-CB 3.44Å; V105-S109 PolarHBondContact O-N 2.66Å
106	Q	86.3	Confident	84.8	Confident	63 Å²	63	57.8 Å²	57.8	29%	0.294	30%	0.295	S	S	.	.	H	α-helix	trans	-63.6	-47.4	178.6	-73.6	177.9	-7.5	0	0	112.6	V102 T103 G104 R110	V102-Q106 WeakPolarHBondContact O-CB 3.33Å; V102-Q106 VanDerWaalsContact O-CG 3.27Å; V102-Q106 WeakPolarHBondContact O-CG 3.43Å; V102-Q106 PolarHBondContact O-N 3.22Å; V102-Q106 VanDerWaalsContact O-N 3.08Å; T103-Q106 PolarHBondContact O-N 3.45Å; G104-Q106 VanDerWaalsContact C-N 3.3Å; G104-Q106 PolarHBondContact O-N 3.05Å; Q106-R110 WeakPolarHBondContact O-CG 3.13Å; Q106-R110 PolarHBondContact O-N 3.12Å
107	V	90.7	Very high	85.5	Confident	4 Å²	4	55.5 Å²	55.5	2%	0.024	28%	0.281	C	S	.	.	H	α-helix	trans	-70.2	-45	-179.4	174.3	0	0	0	0	110.8	A84 L85 V88 T103 G104 S109 R110 I111	A84-V107 HydrophobicContact CB-CG1 3.91Å; A84-V107 HydrophobicContact CB-CG2 4.34Å; L85-V107 HydrophobicContact CD2-CG1 3.96Å; L85-V107 HydrophobicContact CG-CG1 4.42Å; V88-V107 HydrophobicContact CG2-CB 3.98Å; V88-V107 HydrophobicContact CG2-CG1 4.28Å; V88-V107 HydrophobicContact CG2-CG2 4.09Å; T103-V107 HydrophobicContact CG2-CG2 4.31Å; T103-V107 WeakPolarHBondContact O-CG2 3.49Å; T103-V107 PolarHBondContact O-N 3.42Å; G104-V107 PolarHBondContact O-N 3.47Å; V107-S109 PolarHBondContact O-N 3.24Å; V107-R110 PolarHBondContact O-N 3.15Å; V107-I111 HydrophobicContact CG1-CD1 3.75Å; V107-I111 HydrophobicContact CG1-CG1 4.37Å; V107-I111 WeakPolarHBondContact O-CG1 3.44Å; V107-I111 PolarHBondContact O-N 3.22Å
108	C	89.1	Confident	86.9	Confident	67 Å²	67	43.2 Å²	43.2	45%	0.453	24%	0.235	S	C	.	.	H	α-helix	trans	-61.9	-40.3	178.8	-70.5	0	0	0	0	112.3	G104 R110 I111 Y112	G104-C108 WeakPolarHBondContact O-CB 3.09Å; G104-C108 PolarHBondContact O-N 2.91Å; G104-C108 PolarHBondContact O-SG 2.95Å; C108-R110 VanDerWaalsContact C-N 3.3Å; C108-R110 PolarHBondContact O-N 3.38Å; C108-I111 PolarHBondContact O-N 3.46Å; C108-Y112 VanDerWaalsContact O-CB 3.28Å; C108-Y112 WeakPolarHBondContact O-CB 3.48Å; C108-Y112 PolarHBondContact O-N 3.43Å
109	S	89.5	Confident	87.8	Confident	34 Å²	34	41.6 Å²	41.6	24%	0.238	23%	0.226	C	C	.	.	H	α-helix	trans	-58.6	-42.5	175.5	-175.5	0	0	0	0	111.8	V105 V107 Y112 M113 Y221	V105-S109 VanDerWaalsContact O-CB 3.27Å; V105-S109 WeakPolarHBondContact O-CB 3.44Å; V105-S109 PolarHBondContact O-N 2.66Å; V107-S109 PolarHBondContact O-N 3.24Å; S109-Y112 WeakPolarHBondContact O-CB 3.47Å; S109-Y112 PolarHBondContact O-N 2.94Å; S109-M113 WeakPolarHBondContact O-CG 3.1Å; S109-M113 PolarHBondContact O-N 2.81Å; S109-Y221 PolarHBondContact OG-OH 2.98Å; S109-Y221 VanDerWaalsContact OG-OH 3.09Å
110	R	91.4	Very high	88.2	Confident	31 Å²	31	40.1 Å²	40.1	12%	0.117	22%	0.216	C	C	.	.	H	α-helix	trans	-72.6	-39.4	179.8	-62.5	-171.4	-144.3	-176.1	14.3	112.9	Q81 Q106 V107 C108 Y112 M113 V114 W137 E141	Q81-R110 VanDerWaalsContact NE2-CD 3.32Å; Q106-R110 WeakPolarHBondContact O-CG 3.13Å; Q106-R110 PolarHBondContact O-N 3.12Å; V107-R110 PolarHBondContact O-N 3.15Å; C108-R110 VanDerWaalsContact C-N 3.3Å; C108-R110 PolarHBondContact O-N 3.38Å; R110-Y112 VanDerWaalsContact C-N 3.25Å; R110-Y112 PolarHBondContact O-N 3.43Å; R110-M113 PolarHBondContact O-N 3.04Å; R110-V114 WeakPolarHBondContact O-CG2 3.27Å; R110-V114 PolarHBondContact O-N 2.86Å; R110-W137 HydrophobicContact CB-CH2 3.6Å; R110-W137 HydrophobicContact CB-CZ2 3.96Å; R110-W137 HydrophobicContact CB-CZ3 4.07Å; R110-W137 HydrophobicContact CG-CH2 3.84Å; R110-W137 HydrophobicContact CG-CZ2 3.65Å; R110-W137 HydrophobicContact CG-CZ3 4.42Å; R110-E141 IonicContact CZ-OE1 3.28Å; R110-E141 VanDerWaalsContact CZ-OE1 3.22Å; R110-E141 IonicContact NH1-OE1 3.78Å; R110-E141 PolarHBondContact NH1-OE1 3.42Å; R110-E141 IonicContact NH1-OE2 2.93Å; R110-E141 IonicContact NH2-OE1 2.68Å; R110-E141 PolarHBondContact NH2-OE1 3.28Å
111	I	93.1	Very high	88.5	Confident	24 Å²	24	37.5 Å²	37.5	12%	0.123	20%	0.2	C	C	.	.	H	α-helix	trans	-59.8	-43.4	172.6	-71.5	173	0	0	0	109.7	L85 V107 C108 M113 V114 W115	L85-I111 HydrophobicContact CD1-CD1 3.89Å; L85-I111 HydrophobicContact CD2-CD1 3.46Å; L85-I111 VanDerWaalsContact CD2-CD1 3.46Å; L85-I111 HydrophobicContact CG-CD1 3.44Å; L85-I111 VanDerWaalsContact CG-CD1 3.44Å; V107-I111 HydrophobicContact CG1-CD1 3.75Å; V107-I111 HydrophobicContact CG1-CG1 4.37Å; V107-I111 WeakPolarHBondContact O-CG1 3.44Å; V107-I111 PolarHBondContact O-N 3.22Å; C108-I111 PolarHBondContact O-N 3.46Å; I111-M113 PolarHBondContact O-N 2.81Å; I111-V114 PolarHBondContact O-N 3.13Å; I111-W115 WeakPolarHBondContact O-CB 3.29Å; I111-W115 PolarHBondContact O-N 3.36Å
112	Y	91.1	Very high	88.8	Confident	33 Å²	33	38.8 Å²	38.8	13%	0.129	20%	0.196	C	C	.	.	H	α-helix	trans	-56.2	-51.8	175.2	174.6	-103.4	0	0	0	111.6	C108 S109 R110 V114 F116 I117 Y210 F213 L214 V217	C108-Y112 VanDerWaalsContact O-CB 3.28Å; C108-Y112 WeakPolarHBondContact O-CB 3.48Å; C108-Y112 PolarHBondContact O-N 3.43Å; S109-Y112 WeakPolarHBondContact O-CB 3.47Å; S109-Y112 PolarHBondContact O-N 2.94Å; R110-Y112 VanDerWaalsContact C-N 3.25Å; R110-Y112 PolarHBondContact O-N 3.43Å; Y112-V114 PolarHBondContact O-N 3.14Å; Y112-F116 HydrophobicContact CD2-CB 3.76Å; Y112-F116 AromaticContact CD2-CD2 3.91Å; Y112-F116 HydrophobicContact CD2-CD2 3.91Å; Y112-F116 HydrophobicContact CD2-CG 4.01Å; Y112-F116 HydrophobicContact CE2-CB 3.65Å; Y112-F116 HydrophobicContact CE2-CG 4.18Å; Y112-F116 WeakPolarHBondContact O-CA 3.07Å; Y112-F116 WeakPolarHBondContact O-CB 3.48Å; Y112-F116 PolarHBondContact O-N 3.49Å; Y112-I117 HydrophobicContact CD1-CG1 4.39Å; Y112-I117 HydrophobicContact CE1-CD1 3.97Å; Y112-I117 HydrophobicContact CE1-CG1 3.87Å; Y112-I117 PolarHBondContact O-N 3.04Å; Y112-Y210 HydrophobicContact CE2-CE2 4.31Å; Y112-Y210 WeakPolarHBondContact OH-CE2 3.45Å; Y112-Y210 PolarHBondContact OH-OH 3.46Å; Y112-F213 AromaticContact CE2-CE1 3.83Å; Y112-F213 HydrophobicContact CE2-CE1 3.83Å; Y112-F213 AromaticContact CZ-CE1 3.75Å; Y112-F213 WeakPolarHBondContact OH-CE1 3.48Å; Y112-L214 WeakPolarHBondContact OH-CD2 3.14Å; Y112-V217 HydrophobicContact CE1-CG1 4.34Å
113	M	93	Very high	89	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.206	C	C	.	.	I	π-helix	trans	-56.9	-46.3	176.4	-77.7	-60.8	-62.9	0	0	112.9	S109 R110 I111 I117 T118 F133 W137 E179 T182 I183	S109-M113 WeakPolarHBondContact O-CG 3.1Å; S109-M113 PolarHBondContact O-N 2.81Å; R110-M113 PolarHBondContact O-N 3.04Å; I111-M113 PolarHBondContact O-N 2.81Å; M113-I117 HydrophobicContact CE-CG2 4.4Å; M113-I117 WeakPolarHBondContact O-CB 3.36Å; M113-I117 PolarHBondContact O-N 2.93Å; M113-I117 HydrophobicContact SD-CB 4.4Å; M113-I117 HydrophobicContact SD-CG1 3.98Å; M113-T118 PolarHBondContact O-N 3.08Å; M113-T118 PolarHBondContact O-OG1 3.49Å; M113-F133 HydrophobicContact CE-CE1 4.29Å; M113-W137 HydrophobicContact CB-CH2 3.83Å; M113-W137 HydrophobicContact CB-CZ2 4.27Å; M113-E179 HydrophobicContact CE-CB 3.99Å; M113-E179 HydrophobicContact CE-CG 4.08Å; M113-E179 HydrophobicContact CG-CG 4.29Å; M113-E179 HydrophobicContact SD-CB 4.38Å; M113-T182 HydrophobicContact CE-CG2 4.03Å; M113-I183 HydrophobicContact CE-CG1 4.2Å; M113-I183 HydrophobicContact SD-CD1 3.69Å; M113-I183 HydrophobicContact SD-CG1 3.63Å
114	V	93.6	Very high	89.2	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.204	C	C	.	.	I	π-helix	trans	-72.1	-44.9	-176.8	176.1	0	0	0	0	112.4	Y70 L77 K78 Q81 R110 I111 Y112 T118 S119 W137	Y70-V114 PolarHBondContact OH-O 2.91Å; L77-V114 HydrophobicContact CD1-CG2 4.49Å; L77-V114 HydrophobicContact CD2-CG1 4.03Å; L77-V114 HydrophobicContact CD2-CG2 3.98Å; L77-V114 HydrophobicContact CG-CG1 4.11Å; L77-V114 HydrophobicContact CG-CG2 4.11Å; K78-V114 HydrophobicContact CG-CG1 3.5Å; K78-V114 VanDerWaalsContact CG-CG1 3.5Å; Q81-V114 HydrophobicContact CG-CG2 4.14Å; R110-V114 WeakPolarHBondContact O-CG2 3.27Å; R110-V114 PolarHBondContact O-N 2.86Å; I111-V114 PolarHBondContact O-N 3.13Å; Y112-V114 PolarHBondContact O-N 3.14Å; V114-T118 WeakPolarHBondContact CA-OG1 3.29Å; V114-T118 PolarHBondContact O-OG1 3.46Å; V114-S119 WeakPolarHBondContact O-CB 3.13Å; V114-S119 PolarHBondContact O-N 3.16Å; V114-S119 PolarHBondContact O-OG 3.38Å; V114-W137 HydrophobicContact CG2-CH2 4Å; V114-W137 HydrophobicContact CG2-CZ3 3.54Å
115	W	92.3	Very high	89.4	Confident	103 Å²	103	42 Å²	42	39%	0.39	20%	0.204	S	C	.	.	I	π-helix	trans	-85.8	-45.3	-171.8	-77.3	95.8	0	0	0	112.8	K78 T82 I111 S119 S120	K78-W115 HydrophobicContact CB-CZ2 3.93Å; K78-W115 HydrophobicContact CD-CD2 4.07Å; K78-W115 HydrophobicContact CD-CE3 4.02Å; K78-W115 HydrophobicContact CD-CH2 3.88Å; K78-W115 HydrophobicContact CD-CZ2 3.9Å; K78-W115 HydrophobicContact CD-CZ3 3.93Å; K78-W115 HydrophobicContact CG-CD2 4.39Å; K78-W115 HydrophobicContact CG-CZ2 4.11Å; T82-W115 PolarHBondContact OG1-NE1 3.11Å; T82-W115 VanDerWaalsContact OG1-NE1 3.1Å; I111-W115 WeakPolarHBondContact O-CB 3.29Å; I111-W115 PolarHBondContact O-N 3.36Å; W115-S119 WeakPolarHBondContact O-CB 3.46Å; W115-S120 PolarHBondContact O-OG 2.89Å; W115-S120 VanDerWaalsContact O-OG 3.12Å
116	F	88	Confident	89.5	Confident	93 Å²	93	41.6 Å²	41.6	41%	0.408	20%	0.199	S	C	.	.	I	π-helix	trans	-100.1	-16.8	-169.2	-64.1	-90.7	0	0	0	113.9	Y112 Y210	Y112-F116 HydrophobicContact CD2-CB 3.76Å; Y112-F116 AromaticContact CD2-CD2 3.91Å; Y112-F116 HydrophobicContact CD2-CD2 3.91Å; Y112-F116 HydrophobicContact CD2-CG 4.01Å; Y112-F116 HydrophobicContact CE2-CB 3.65Å; Y112-F116 HydrophobicContact CE2-CG 4.18Å; Y112-F116 WeakPolarHBondContact O-CA 3.07Å; Y112-F116 WeakPolarHBondContact O-CB 3.48Å; Y112-F116 PolarHBondContact O-N 3.49Å; F116-Y210 PolarHBondContact O-OH 2.83Å; F116-Y210 VanDerWaalsContact O-OH 3.11Å
117	I	89.4	Confident	89.7	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.204	C	C	.	.	I	π-helix	trans	-102.4	-78.5	173.8	-53.3	-63.3	0	0	0	109	Y112 M113 S119 S120 I121 I124 T182 A186 Y210 L214	Y112-I117 HydrophobicContact CD1-CG1 4.39Å; Y112-I117 HydrophobicContact CE1-CD1 3.97Å; Y112-I117 HydrophobicContact CE1-CG1 3.87Å; Y112-I117 PolarHBondContact O-N 3.04Å; M113-I117 HydrophobicContact CE-CG2 4.4Å; M113-I117 WeakPolarHBondContact O-CB 3.36Å; M113-I117 PolarHBondContact O-N 2.93Å; M113-I117 HydrophobicContact SD-CB 4.4Å; M113-I117 HydrophobicContact SD-CG1 3.98Å; I117-S119 PolarHBondContact O-N 3.33Å; I117-S120 PolarHBondContact O-N 3.35Å; I117-I121 PolarHBondContact O-N 3.39Å; I117-I121 VanDerWaalsContact O-N 3.16Å; I117-I124 HydrophobicContact CG2-CD1 3.43Å; I117-I124 VanDerWaalsContact CG2-CD1 3.43Å; I117-T182 HydrophobicContact CG2-CG2 3.92Å; I117-A186 HydrophobicContact CG2-CB 4.21Å; I117-Y210 WeakPolarHBondContact CD1-OH 3.48Å; I117-L214 HydrophobicContact CD1-CD2 3.47Å; I117-L214 VanDerWaalsContact CD1-CD2 3.47Å
118	T	89.9	Confident	89.6	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	23%	0.234	C	C	.	.	I	π-helix	trans	-69	-34.2	-168.1	54	0	0	0	0	113.9	Y70 M113 V114 I124 Q125 V130 F133 T182	Y70-T118 WeakPolarHBondContact OH-CB 3.32Å; Y70-T118 PolarHBondContact OH-OG1 3.36Å; M113-T118 PolarHBondContact O-N 3.08Å; M113-T118 PolarHBondContact O-OG1 3.49Å; V114-T118 WeakPolarHBondContact CA-OG1 3.29Å; V114-T118 PolarHBondContact O-OG1 3.46Å; T118-I124 HydrophobicContact CG2-CD1 4.19Å; T118-Q125 WeakPolarHBondContact O-CG 3.34Å; T118-Q125 PolarHBondContact O-NE2 2.84Å; T118-V130 HydrophobicContact CG2-CG1 4.35Å; T118-V130 HydrophobicContact CG2-CG2 3.91Å; T118-F133 HydrophobicContact CG2-CE1 3.96Å; T118-F133 HydrophobicContact CG2-CZ 3.75Å; T118-T182 HydrophobicContact CG2-CG2 3.88Å
119	S	88.9	Confident	89.8	Confident	29 Å²	29	46.5 Å²	46.5	20%	0.203	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-33.3	177.7	-62.7	0	0	0	0	113.3	Y70 V114 W115 I117	Y70-S119 PolarHBondContact OH-N 3.46Å; Y70-S119 PolarHBondContact OH-OG 3.38Å; V114-S119 WeakPolarHBondContact O-CB 3.13Å; V114-S119 PolarHBondContact O-N 3.16Å; V114-S119 PolarHBondContact O-OG 3.38Å; W115-S119 WeakPolarHBondContact O-CB 3.46Å; I117-S119 PolarHBondContact O-N 3.33Å
120	S	85.4	Confident	89.9	Confident	33 Å²	33	45 Å²	45	23%	0.231	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-31	-178.3	-61.5	0	0	0	0	113.2	W115 I117 Y196	W115-S120 PolarHBondContact O-OG 2.89Å; W115-S120 VanDerWaalsContact O-OG 3.12Å; I117-S120 PolarHBondContact O-N 3.35Å; S120-Y196 PolarHBondContact OG-OH 3.35Å
121	I	87.2	Confident	89.9	Confident	2 Å²	2	45.4 Å²	45.4	1%	0.01	21%	0.21	C	C	.	.			trans	-113.2	102.1	-176.3	-57.5	165.1	0	0	0	109.2	I117 Q123 I124 A186 F189 V190 M195	I117-I121 PolarHBondContact O-N 3.39Å; I117-I121 VanDerWaalsContact O-N 3.16Å; I121-Q123 HydrophobicContact CG2-CB 4.31Å; I121-Q123 PolarHBondContact O-N 3.19Å; I121-I124 HydrophobicContact CB-CD1 4.09Å; I121-I124 HydrophobicContact CB-CG1 3.82Å; I121-I124 HydrophobicContact CG2-CB 4.42Å; I121-I124 HydrophobicContact CG2-CG1 3.94Å; I121-I124 HydrophobicContact CG2-CG2 3.9Å; I121-I124 WeakPolarHBondContact O-CG1 3.47Å; I121-I124 PolarHBondContact O-N 3.42Å; I121-A186 HydrophobicContact CD1-CB 3.69Å; I121-F189 HydrophobicContact CG2-CB 4.02Å; I121-F189 HydrophobicContact CG2-CD2 4.17Å; I121-F189 HydrophobicContact CG2-CG 4.1Å; I121-V190 HydrophobicContact CD1-CG2 3.79Å; I121-M195 HydrophobicContact CD1-CE 4.49Å; I121-M195 HydrophobicContact CG1-CE 3.63Å
122	R	86.5	Confident	89.9	Confident	160 Å²	160	47 Å²	47	60%	0.604	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64	-28	-176.7	-70.3	179.4	72.5	164.6	1.5	113.3	Q125	R122-Q125 WeakPolarHBondContact O-CB 3.42Å; R122-Q125 PolarHBondContact O-N 2.95Å
123	Q	86	Confident	90	Very high	110 Å²	110	45.4 Å²	45.4	51%	0.514	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-42.7	-177.4	-65.8	84	-16.5	0	0	111.2	I121 Q125 F189	I121-Q123 HydrophobicContact CG2-CB 4.31Å; I121-Q123 PolarHBondContact O-N 3.19Å; Q123-Q125 VanDerWaalsContact C-N 3.25Å; Q123-Q125 PolarHBondContact O-N 3.43Å; Q123-F189 HydrophobicContact CB-CD1 4.23Å; Q123-F189 HydrophobicContact CB-CE1 3.72Å; Q123-F189 HydrophobicContact CB-CE2 4.11Å; Q123-F189 HydrophobicContact CB-CZ 3.65Å; Q123-F189 HydrophobicContact CG-CD1 4.16Å; Q123-F189 HydrophobicContact CG-CE1 3.72Å; Q123-F189 HydrophobicContact CG-CZ 4.16Å
124	I	89	Confident	90	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-73.6	-16.3	-177.8	63.4	164.7	0	0	0	113.2	I117 T118 I121 N126 E127 V130 T182 A185 A186 F189	I117-I124 HydrophobicContact CG2-CD1 3.43Å; I117-I124 VanDerWaalsContact CG2-CD1 3.43Å; T118-I124 HydrophobicContact CG2-CD1 4.19Å; I121-I124 HydrophobicContact CB-CD1 4.09Å; I121-I124 HydrophobicContact CB-CG1 3.82Å; I121-I124 HydrophobicContact CG2-CB 4.42Å; I121-I124 HydrophobicContact CG2-CG1 3.94Å; I121-I124 HydrophobicContact CG2-CG2 3.9Å; I121-I124 WeakPolarHBondContact O-CG1 3.47Å; I121-I124 PolarHBondContact O-N 3.42Å; I124-N126 PolarHBondContact O-N 3.37Å; I124-E127 HydrophobicContact CB-CG 4.29Å; I124-E127 VanDerWaalsContact O-CB 3.31Å; I124-E127 WeakPolarHBondContact O-CB 3.29Å; I124-E127 PolarHBondContact O-N 3.46Å; I124-V130 WeakPolarHBondContact O-CG2 3.37Å; I124-T182 HydrophobicContact CD1-CG2 3.92Å; I124-A185 HydrophobicContact CG2-CB 4.28Å; I124-A186 HydrophobicContact CD1-CB 4.27Å; I124-A186 HydrophobicContact CG2-CB 4.37Å; I124-F189 HydrophobicContact CG2-CD2 3.98Å; I124-F189 HydrophobicContact CG2-CE2 3.99Å
125	Q	90.4	Very high	90	Very high	26 Å²	26	48.8 Å²	48.8	12%	0.121	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-61.1	-19.6	-178.3	-68	178.5	-1.2	0	0	113.8	Y70 T118 R122 Q123	Y70-Q125 HydrophobicContact CD1-CB 3.91Å; Y70-Q125 HydrophobicContact CD1-CG 3.47Å; Y70-Q125 VanDerWaalsContact CD1-CG 3.47Å; Y70-Q125 HydrophobicContact CE1-CG 3.82Å; Y70-Q125 HydrophobicContact CG-CB 4.01Å; Y70-Q125 HydrophobicContact CG-CG 4Å; T118-Q125 WeakPolarHBondContact O-CG 3.34Å; T118-Q125 PolarHBondContact O-NE2 2.84Å; R122-Q125 WeakPolarHBondContact O-CB 3.42Å; R122-Q125 PolarHBondContact O-N 2.95Å; Q123-Q125 VanDerWaalsContact C-N 3.25Å; Q123-Q125 PolarHBondContact O-N 3.43Å
126	N	88.7	Confident	90.2	Very high	61 Å²	61	44.1 Å²	44.1	33%	0.326	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-102.7	2.7	178.3	-60.4	-56.4	0	0	0	112.9	H66 K67 G68 I124	H66-N126 PolarHBondContact CD2-O 2.83Å; H66-N126 PolarHBondContact NE2-O 2.97Å; K67-N126 HydrophobicContact CG-CB 4.43Å; G68-N126 PolarHBondContact N-OD1 2.9Å; I124-N126 PolarHBondContact O-N 3.37Å
127	E	90.2	Very high	90.5	Very high	86 Å²	86	40.1 Å²	40.1	40%	0.402	20%	0.198	S	C	.	.	S	Bend	trans	-71	145.7	177.5	-68.3	-65.7	147.2	0	0	110.8	I124 S129 V130 A185	I124-E127 HydrophobicContact CB-CG 4.29Å; I124-E127 VanDerWaalsContact O-CB 3.31Å; I124-E127 WeakPolarHBondContact O-CB 3.29Å; I124-E127 PolarHBondContact O-N 3.46Å; E127-S129 PolarHBondContact O-N 2.88Å; E127-V130 HydrophobicContact CB-CG2 4.45Å; E127-V130 WeakPolarHBondContact O-CB 3.44Å; E127-V130 PolarHBondContact O-N 3.12Å; E127-A185 HydrophobicContact CG-CB 4.4Å
128	E	89.5	Confident	90.7	Very high	139 Å²	139	40.4 Å²	40.4	65%	0.65	20%	0.2	S	C	*	.	H	α-helix	trans	-63.3	-30.8	179.5	-63.1	-174.1	168.5	0	0	111.9	V130 I131 L132	E128-V130 PolarHBondContact O-N 2.87Å; E128-I131 PolarHBondContact O-N 3.3Å; E128-I131 VanDerWaalsContact O-N 3.14Å; E128-L132 PolarHBondContact O-N 2.94Å
129	S	92.1	Very high	90.9	Very high	13 Å²	13	42.9 Å²	42.9	9%	0.091	22%	0.215	C	C	.	.	H	α-helix	trans	-58.2	-33.6	174.9	66.8	0	0	0	0	112.4	E127 L132 F133 T182	E127-S129 PolarHBondContact O-N 2.88Å; S129-L132 PolarHBondContact O-N 3.41Å; S129-F133 VanDerWaalsContact O-CD1 3.27Å; S129-F133 WeakPolarHBondContact O-CD1 3.32Å; S129-F133 PolarHBondContact O-N 2.8Å; S129-T182 VanDerWaalsContact CB-OG1 3.3Å; S129-T182 WeakPolarHBondContact CB-OG1 3.37Å; S129-T182 WeakPolarHBondContact OG-CA 3.32Å; S129-T182 PolarHBondContact OG-OG1 2.86Å
130	V	91.3	Very high	91.1	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.006	22%	0.218	C	C	.	.	H	α-helix	trans	-67.4	-43.6	178	174.4	0	0	0	0	110.8	Y70 T118 I124 E127 E128 L132 F133 L134 T182	Y70-V130 HydrophobicContact CD2-CG1 3.93Å; Y70-V130 HydrophobicContact CE2-CG1 4.47Å; T118-V130 HydrophobicContact CG2-CG1 4.35Å; T118-V130 HydrophobicContact CG2-CG2 3.91Å; I124-V130 WeakPolarHBondContact O-CG2 3.37Å; E127-V130 HydrophobicContact CB-CG2 4.45Å; E127-V130 WeakPolarHBondContact O-CB 3.44Å; E127-V130 PolarHBondContact O-N 3.12Å; E128-V130 PolarHBondContact O-N 2.87Å; V130-L132 VanDerWaalsContact C-N 3.3Å; V130-L132 PolarHBondContact O-N 3.49Å; V130-F133 VanDerWaalsContact CA-CE1 3.46Å; V130-F133 HydrophobicContact CB-CE1 4.02Å; V130-F133 HydrophobicContact CG1-CE1 4.01Å; V130-F133 HydrophobicContact CG1-CZ 4.07Å; V130-F133 HydrophobicContact CG2-CE1 4Å; V130-L134 HydrophobicContact CG1-CD1 3.66Å; V130-L134 HydrophobicContact CG1-CG 4.29Å; V130-L134 WeakPolarHBondContact O-CB 3.33Å; V130-L134 WeakPolarHBondContact O-CD1 3.4Å; V130-L134 WeakPolarHBondContact O-CG 3.4Å; V130-L134 PolarHBondContact O-N 3.23Å; V130-L134 VanDerWaalsContact O-N 3.08Å; V130-T182 HydrophobicContact CG2-CG2 3.78Å
131	I	91.9	Very high	91.5	Very high	41 Å²	41	42.1 Å²	42.1	21%	0.21	21%	0.207	C	C	.	.	H	α-helix	trans	-64	-42.7	177.6	-50.7	159.2	0	0	0	110.1	H66 E128 L134 V135	H66-I131 HydrophobicContact CB-CD1 3.12Å; H66-I131 HydrophobicContact CB-CG1 3.94Å; E128-I131 PolarHBondContact O-N 3.3Å; E128-I131 VanDerWaalsContact O-N 3.14Å; I131-L134 PolarHBondContact O-N 2.65Å; I131-V135 HydrophobicContact CG2-CG2 4.12Å; I131-V135 WeakPolarHBondContact O-CG2 3.24Å; I131-V135 PolarHBondContact O-N 3.04Å
132	L	92.9	Very high	91.8	Very high	57 Å²	57	43.6 Å²	43.6	30%	0.298	22%	0.215	S	C	.	.	H	α-helix	trans	-55.7	-56.7	-178.8	177.9	62.1	0	0	0	110.9	E128 S129 V130 L134 V135 V136	E128-L132 PolarHBondContact O-N 2.94Å; S129-L132 PolarHBondContact O-N 3.41Å; V130-L132 VanDerWaalsContact C-N 3.3Å; V130-L132 PolarHBondContact O-N 3.49Å; L132-L134 VanDerWaalsContact C-N 3.3Å; L132-L134 PolarHBondContact O-N 2.88Å; L132-V135 PolarHBondContact O-N 3.39Å; L132-V136 HydrophobicContact CD1-CG2 4.38Å; L132-V136 WeakPolarHBondContact O-CB 3.41Å; L132-V136 WeakPolarHBondContact O-CG2 3.22Å; L132-V136 PolarHBondContact O-N 3.22Å; L132-V136 VanDerWaalsContact O-N 3.1Å
133	F	93.5	Very high	92.1	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-67.4	-32.7	-179.2	81.1	-109.6	0	0	0	111.7	M113 T118 S129 V130 V136 W137 E179 T182	M113-F133 HydrophobicContact CE-CE1 4.29Å; T118-F133 HydrophobicContact CG2-CE1 3.96Å; T118-F133 HydrophobicContact CG2-CZ 3.75Å; S129-F133 VanDerWaalsContact O-CD1 3.27Å; S129-F133 WeakPolarHBondContact O-CD1 3.32Å; S129-F133 PolarHBondContact O-N 2.8Å; V130-F133 VanDerWaalsContact CA-CE1 3.46Å; V130-F133 HydrophobicContact CB-CE1 4.02Å; V130-F133 HydrophobicContact CG1-CE1 4.01Å; V130-F133 HydrophobicContact CG1-CZ 4.07Å; V130-F133 HydrophobicContact CG2-CE1 4Å; F133-V136 PolarHBondContact O-N 2.99Å; F133-W137 AromaticContact CD2-CD2 3.77Å; F133-W137 HydrophobicContact CD2-CD2 3.77Å; F133-W137 AromaticContact CD2-CE2 3.72Å; F133-W137 AromaticContact CD2-CE3 3.96Å; F133-W137 HydrophobicContact CD2-CE3 3.96Å; F133-W137 HydrophobicContact CD2-CG 4.34Å; F133-W137 HydrophobicContact CD2-CH2 4.08Å; F133-W137 AromaticContact CD2-CZ2 3.89Å; F133-W137 HydrophobicContact CD2-CZ2 3.89Å; F133-W137 HydrophobicContact CD2-CZ3 4.11Å; F133-W137 HydrophobicContact CE2-CD2 4.33Å; F133-W137 HydrophobicContact CE2-CE3 4.05Å; F133-W137 AromaticContact CE2-CH2 3.95Å; F133-W137 HydrophobicContact CE2-CH2 3.95Å; F133-W137 HydrophobicContact CE2-CZ2 4.22Å; F133-W137 AromaticContact CE2-CZ3 3.85Å; F133-W137 HydrophobicContact CE2-CZ3 3.85Å; F133-W137 WeakPolarHBondContact O-CB 3.18Å; F133-W137 VanDerWaalsContact O-CD1 3.24Å; F133-W137 PolarHBondContact O-N 2.94Å; F133-E179 HydrophobicContact CB-CG 4.23Å; F133-E179 HydrophobicContact CG-CG 4.46Å; F133-T182 HydrophobicContact CE1-CG2 4.11Å
134	L	93.8	Very high	92.4	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-64.4	-45.9	178.1	-74.8	170.4	0	0	0	112.7	M56 Y70 I73 L77 V130 I131 L132 V136 T138	M56-L134 HydrophobicContact CE-CB 3.99Å; M56-L134 HydrophobicContact SD-CB 4.4Å; Y70-L134 HydrophobicContact CD2-CD1 4.31Å; I73-L134 HydrophobicContact CD1-CD1 3.57Å; I73-L134 HydrophobicContact CD1-CD2 4.3Å; I73-L134 HydrophobicContact CD1-CG 4.5Å; L77-L134 HydrophobicContact CD1-CD2 3.94Å; L77-L134 HydrophobicContact CD2-CD2 3.46Å; L77-L134 VanDerWaalsContact CD2-CD2 3.46Å; L77-L134 HydrophobicContact CG-CD2 4.33Å; V130-L134 HydrophobicContact CG1-CD1 3.66Å; V130-L134 HydrophobicContact CG1-CG 4.29Å; V130-L134 WeakPolarHBondContact O-CB 3.33Å; V130-L134 WeakPolarHBondContact O-CD1 3.4Å; V130-L134 WeakPolarHBondContact O-CG 3.4Å; V130-L134 PolarHBondContact O-N 3.23Å; V130-L134 VanDerWaalsContact O-N 3.08Å; I131-L134 PolarHBondContact O-N 2.65Å; L132-L134 VanDerWaalsContact C-N 3.3Å; L132-L134 PolarHBondContact O-N 2.88Å; L134-V136 VanDerWaalsContact C-N 3.35Å; L134-T138 VanDerWaalsContact O-CB 3.3Å; L134-T138 WeakPolarHBondContact O-CB 3.3Å; L134-T138 PolarHBondContact O-N 2.8Å; L134-T138 PolarHBondContact O-OG1 3.45Å
135	V	93.7	Very high	92.6	Very high	69 Å²	69	32.8 Å²	32.8	42%	0.418	17%	0.172	S	C	.	.	H	α-helix	trans	-62.1	-48.3	176.6	171.3	0	0	0	0	109.5	M56 I131 L132 W137 T138 V139	M56-V135 HydrophobicContact CE-CG2 3.5Å; I131-V135 HydrophobicContact CG2-CG2 4.12Å; I131-V135 WeakPolarHBondContact O-CG2 3.24Å; I131-V135 PolarHBondContact O-N 3.04Å; L132-V135 PolarHBondContact O-N 3.39Å; V135-W137 PolarHBondContact O-N 3.29Å; V135-T138 PolarHBondContact O-N 3.34Å; V135-V139 WeakPolarHBondContact O-CG2 3.41Å; V135-V139 PolarHBondContact O-N 3.42Å
136	V	94.8	Very high	92.7	Very high	6 Å²	6	32.4 Å²	32.4	4%	0.036	17%	0.172	C	C	.	.	H	α-helix	trans	-58.5	-49.4	179.5	167.9	0	0	0	0	111.6	L132 F133 L134 T138 V139 T140 L171 L174	L132-V136 HydrophobicContact CD1-CG2 4.38Å; L132-V136 WeakPolarHBondContact O-CB 3.41Å; L132-V136 WeakPolarHBondContact O-CG2 3.22Å; L132-V136 PolarHBondContact O-N 3.22Å; L132-V136 VanDerWaalsContact O-N 3.1Å; F133-V136 PolarHBondContact O-N 2.99Å; L134-V136 VanDerWaalsContact C-N 3.35Å; V136-T138 VanDerWaalsContact C-N 3.33Å; V136-T138 PolarHBondContact O-N 3.31Å; V136-V139 PolarHBondContact O-N 3.1Å; V136-T140 VanDerWaalsContact O-CB 3.32Å; V136-T140 WeakPolarHBondContact O-CB 3.42Å; V136-T140 PolarHBondContact O-N 3.48Å; V136-T140 PolarHBondContact O-OG1 3.37Å; V136-L171 HydrophobicContact CG1-CB 4.02Å; V136-L171 HydrophobicContact CG1-CD2 4.29Å; V136-L171 WeakPolarHBondContact CG1-O 3.44Å; V136-L171 HydrophobicContact CG2-CD2 4.21Å; V136-L174 HydrophobicContact CG2-CB 3.8Å
137	W	94.6	Very high	92.8	Very high	9 Å²	9	30.5 Å²	30.5	3%	0.034	16%	0.16	C	C	.	.	H	α-helix	trans	-60.6	-44.4	177.6	-75.7	10.7	0	0	0	111.1	W49 Q81 R110 M113 V114 F133 V135 V139 T140 E141 E179	W49-W137 HydrophobicContact CZ3-CB 4.46Å; Q81-W137 HydrophobicContact CG-CZ3 4.46Å; Q81-W137 VanDerWaalsContact NE2-CE3 3.32Å; Q81-W137 VanDerWaalsContact NE2-CZ3 3.27Å; R110-W137 HydrophobicContact CB-CH2 3.6Å; R110-W137 HydrophobicContact CB-CZ2 3.96Å; R110-W137 HydrophobicContact CB-CZ3 4.07Å; R110-W137 HydrophobicContact CG-CH2 3.84Å; R110-W137 HydrophobicContact CG-CZ2 3.65Å; R110-W137 HydrophobicContact CG-CZ3 4.42Å; M113-W137 HydrophobicContact CB-CH2 3.83Å; M113-W137 HydrophobicContact CB-CZ2 4.27Å; V114-W137 HydrophobicContact CG2-CH2 4Å; V114-W137 HydrophobicContact CG2-CZ3 3.54Å; F133-W137 AromaticContact CD2-CD2 3.77Å; F133-W137 HydrophobicContact CD2-CD2 3.77Å; F133-W137 AromaticContact CD2-CE2 3.72Å; F133-W137 AromaticContact CD2-CE3 3.96Å; F133-W137 HydrophobicContact CD2-CE3 3.96Å; F133-W137 HydrophobicContact CD2-CG 4.34Å; F133-W137 HydrophobicContact CD2-CH2 4.08Å; F133-W137 AromaticContact CD2-CZ2 3.89Å; F133-W137 HydrophobicContact CD2-CZ2 3.89Å; F133-W137 HydrophobicContact CD2-CZ3 4.11Å; F133-W137 HydrophobicContact CE2-CD2 4.33Å; F133-W137 HydrophobicContact CE2-CE3 4.05Å; F133-W137 AromaticContact CE2-CH2 3.95Å; F133-W137 HydrophobicContact CE2-CH2 3.95Å; F133-W137 HydrophobicContact CE2-CZ2 4.22Å; F133-W137 AromaticContact CE2-CZ3 3.85Å; F133-W137 HydrophobicContact CE2-CZ3 3.85Å; F133-W137 WeakPolarHBondContact O-CB 3.18Å; F133-W137 VanDerWaalsContact O-CD1 3.24Å; F133-W137 PolarHBondContact O-N 2.94Å; V135-W137 PolarHBondContact O-N 3.29Å; W137-V139 PolarHBondContact O-N 3.17Å; W137-T140 PolarHBondContact O-N 2.86Å; W137-E141 WeakPolarHBondContact O-CB 3.34Å; W137-E141 WeakPolarHBondContact O-CG 3.41Å; W137-E141 PolarHBondContact O-N 3.35Å; W137-E179 HydrophobicContact CZ2-CG 4.1Å; W137-E179 WeakPolarHBondContact CZ2-OE1 3.1Å; W137-E179 PolarHBondContact NE1-OE1 3.5Å
138	T	94.9	Very high	92.7	Very high	6 Å²	6	29.2 Å²	29.2	4%	0.037	15%	0.152	C	C	.	.	H	α-helix	trans	-59	-48.3	-179.1	-58.9	0	0	0	0	111.5	W49 L52 A53 L134 V135 V136 E141 I142	W49-T138 HydrophobicContact CE3-CG2 4.42Å; L52-T138 WeakPolarHBondContact CD2-OG1 3.41Å; A53-T138 HydrophobicContact CB-CG2 3.61Å; L134-T138 VanDerWaalsContact O-CB 3.3Å; L134-T138 WeakPolarHBondContact O-CB 3.3Å; L134-T138 PolarHBondContact O-N 2.8Å; L134-T138 PolarHBondContact O-OG1 3.45Å; V135-T138 PolarHBondContact O-N 3.34Å; V136-T138 VanDerWaalsContact C-N 3.33Å; V136-T138 PolarHBondContact O-N 3.31Å; T138-E141 PolarHBondContact O-N 3.21Å; T138-I142 HydrophobicContact CG2-CD1 3.81Å; T138-I142 WeakPolarHBondContact O-CD1 3.28Å; T138-I142 VanDerWaalsContact O-CG1 3.23Å; T138-I142 WeakPolarHBondContact O-CG1 3.35Å; T138-I142 PolarHBondContact O-N 2.97Å
139	V	94.1	Very high	92.7	Very high	52 Å²	52	23.1 Å²	23.1	32%	0.315	12%	0.124	S	C	.	.	H	α-helix	trans	-65.4	-41.9	177.8	-179.7	0	0	0	0	111.2	V135 V136 W137 E141 T143 F167 L171	V135-V139 WeakPolarHBondContact O-CG2 3.41Å; V135-V139 PolarHBondContact O-N 3.42Å; V136-V139 PolarHBondContact O-N 3.1Å; W137-V139 PolarHBondContact O-N 3.17Å; V139-E141 VanDerWaalsContact C-N 3.34Å; V139-E141 PolarHBondContact O-N 2.89Å; V139-T143 WeakPolarHBondContact O-CG2 3.41Å; V139-T143 PolarHBondContact O-N 2.99Å; V139-T143 VanDerWaalsContact O-N 3.12Å; V139-T143 PolarHBondContact O-OG1 2.89Å; V139-F167 HydrophobicContact CG1-CD2 3.98Å; V139-F167 HydrophobicContact CG1-CE2 4.2Å; V139-L171 HydrophobicContact CB-CD1 3.91Å; V139-L171 HydrophobicContact CG1-CD1 3.6Å
140	T	92.8	Very high	92.6	Very high	44 Å²	44	25.6 Å²	25.6	27%	0.27	13%	0.133	S	C	.	.	H	α-helix	trans	-61.5	-43.2	178.7	-58.2	0	0	0	0	111.4	V136 W137 T143 R144	V136-T140 VanDerWaalsContact O-CB 3.32Å; V136-T140 WeakPolarHBondContact O-CB 3.42Å; V136-T140 PolarHBondContact O-N 3.48Å; V136-T140 PolarHBondContact O-OG1 3.37Å; W137-T140 PolarHBondContact O-N 2.86Å; T140-T143 PolarHBondContact O-OG1 2.97Å; T140-R144 WeakPolarHBondContact O-CB 3.35Å; T140-R144 PolarHBondContact O-N 3.12Å
141	E	92.8	Very high	92.4	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-74	-41.7	-176.9	-69.7	-59.9	118.2	0	0	112.5	W49 R110 W137 T138 V139 T143 R144 Y145	W49-E141 HydrophobicContact CB-CB 4.46Å; W49-E141 HydrophobicContact CD2-CB 3.62Å; W49-E141 HydrophobicContact CD2-CG 4.06Å; W49-E141 HydrophobicContact CE3-CB 4.25Å; W49-E141 HydrophobicContact CG-CB 3.69Å; W49-E141 HydrophobicContact CH2-CG 4.18Å; W49-E141 HydrophobicContact CZ2-CB 4.21Å; W49-E141 HydrophobicContact CZ2-CG 3.71Å; R110-E141 IonicContact CZ-OE1 3.28Å; R110-E141 VanDerWaalsContact CZ-OE1 3.22Å; R110-E141 IonicContact NH1-OE1 3.78Å; R110-E141 PolarHBondContact NH1-OE1 3.42Å; R110-E141 IonicContact NH1-OE2 2.93Å; R110-E141 IonicContact NH2-OE1 2.68Å; R110-E141 PolarHBondContact NH2-OE1 3.28Å; W137-E141 WeakPolarHBondContact O-CB 3.34Å; W137-E141 WeakPolarHBondContact O-CG 3.41Å; W137-E141 PolarHBondContact O-N 3.35Å; T138-E141 PolarHBondContact O-N 3.21Å; V139-E141 VanDerWaalsContact C-N 3.34Å; V139-E141 PolarHBondContact O-N 2.89Å; E141-T143 VanDerWaalsContact C-N 3.31Å; E141-T143 PolarHBondContact O-N 3.31Å; E141-R144 PolarHBondContact O-N 3.41Å; E141-R144 IonicContact OE1-CZ 3.95Å; E141-R144 IonicContact OE1-NE 3.03Å; E141-R144 PolarHBondContact OE1-NE 3.45Å; E141-R144 IonicContact OE1-NH2 3.32Å; E141-R144 PolarHBondContact OE1-NH2 2.91Å; E141-R144 IonicContact OE2-CZ 2.82Å; E141-R144 IonicContact OE2-NE 3.22Å; E141-R144 PolarHBondContact OE2-NE 3.03Å; E141-R144 IonicContact OE2-NH2 2.76Å; E141-R144 PolarHBondContact OE2-NH2 3.44Å; E141-Y145 HydrophobicContact CB-CD2 4.29Å; E141-Y145 HydrophobicContact CB-CE2 4.31Å; E141-Y145 WeakPolarHBondContact O-CD2 3.27Å; E141-Y145 PolarHBondContact O-N 2.93Å; E141-Y145 WeakPolarHBondContact OE2-CE2 3.48Å
142	I	94.2	Very high	92.2	Very high	33 Å²	33	29.3 Å²	29.3	17%	0.169	15%	0.154	C	C	.	.	H	α-helix	trans	-57.5	-48.2	174.6	-69.4	166.2	0	0	0	110	T46 W49 L50 A53 T138 S146	T46-I142 HydrophobicContact CG2-CG2 4.4Å; W49-I142 HydrophobicContact CB-CD1 4.4Å; W49-I142 HydrophobicContact CB-CG1 3.68Å; L50-I142 HydrophobicContact CD2-CD1 3.86Å; L50-I142 HydrophobicContact CD2-CG1 4.43Å; L50-I142 HydrophobicContact CD2-CG2 4.39Å; L50-I142 HydrophobicContact CG-CD1 4.18Å; L50-I142 HydrophobicContact CG-CG1 4.32Å; A53-I142 HydrophobicContact CB-CD1 4.23Å; T138-I142 HydrophobicContact CG2-CD1 3.81Å; T138-I142 WeakPolarHBondContact O-CD1 3.28Å; T138-I142 VanDerWaalsContact O-CG1 3.23Å; T138-I142 WeakPolarHBondContact O-CG1 3.35Å; T138-I142 PolarHBondContact O-N 2.97Å; I142-S146 WeakPolarHBondContact O-CB 3.4Å; I142-S146 PolarHBondContact O-N 3.47Å; I142-S146 PolarHBondContact O-OG 2.68Å
143	T	93.1	Very high	91.8	Very high	19 Å²	19	31.1 Å²	31.1	12%	0.117	16%	0.163	C	C	.	.	H	α-helix	trans	-67.6	-39.5	-179.7	52.8	0	0	0	0	112.6	V139 T140 E141 Y147 A163 F167	V139-T143 WeakPolarHBondContact O-CG2 3.41Å; V139-T143 PolarHBondContact O-N 2.99Å; V139-T143 VanDerWaalsContact O-N 3.12Å; V139-T143 PolarHBondContact O-OG1 2.89Å; T140-T143 PolarHBondContact O-OG1 2.97Å; E141-T143 VanDerWaalsContact C-N 3.31Å; E141-T143 PolarHBondContact O-N 3.31Å; T143-Y147 WeakPolarHBondContact O-CB 3.17Å; T143-Y147 PolarHBondContact O-N 2.96Å; T143-A163 HydrophobicContact CG2-CB 4.24Å; T143-F167 HydrophobicContact CG2-CD2 3.82Å; T143-F167 HydrophobicContact CG2-CE2 4.02Å
144	R	92.2	Very high	91.3	Very high	25 Å²	25	39.8 Å²	39.8	9%	0.094	20%	0.203	C	C	.	.	H	α-helix	trans	-62.7	-53.3	178.5	-178.2	173.3	78.8	119	2.4	112.2	E87 T140 E141 Y147 Y148	E87-R144 IonicContact OE1-CZ 3.47Å; E87-R144 IonicContact OE1-NH1 2.63Å; E87-R144 PolarHBondContact OE1-NH1 3.43Å; E87-R144 IonicContact OE2-CZ 3.5Å; E87-R144 VanDerWaalsContact OE2-CZ 3.28Å; E87-R144 IonicContact OE2-NH1 3.22Å; E87-R144 PolarHBondContact OE2-NH1 2.9Å; E87-R144 IonicContact OE2-NH2 2.91Å; E87-R144 PolarHBondContact OE2-NH2 3.28Å; T140-R144 WeakPolarHBondContact O-CB 3.35Å; T140-R144 PolarHBondContact O-N 3.12Å; E141-R144 PolarHBondContact O-N 3.41Å; E141-R144 IonicContact OE1-CZ 3.95Å; E141-R144 IonicContact OE1-NE 3.03Å; E141-R144 PolarHBondContact OE1-NE 3.45Å; E141-R144 IonicContact OE1-NH2 3.32Å; E141-R144 PolarHBondContact OE1-NH2 2.91Å; E141-R144 IonicContact OE2-CZ 2.82Å; E141-R144 IonicContact OE2-NE 3.22Å; E141-R144 PolarHBondContact OE2-NE 3.03Å; E141-R144 IonicContact OE2-NH2 2.76Å; E141-R144 PolarHBondContact OE2-NH2 3.44Å; R144-Y147 WeakPolarHBondContact O-CB 3.44Å; R144-Y147 PolarHBondContact O-N 2.83Å; R144-Y148 HydrophobicContact CG-CD2 4.13Å; R144-Y148 HydrophobicContact CG-CE2 3.55Å; R144-Y148 WeakPolarHBondContact O-CD2 3.24Å; R144-Y148 PolarHBondContact O-N 3.32Å
145	Y	92.6	Very high	90.9	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-71	-37.3	-178.1	-70.5	-58.7	0	0	0	112.1	Y41 N42 M45 T46 W49 E87 E141 Y147 Y148 T149	Y41-Y145 HydrophobicContact CE1-CE1 4.02Å; N42-Y145 HydrophobicContact CB-CD1 4.49Å; N42-Y145 WeakPolarHBondContact OD1-CD1 3.5Å; M45-Y145 HydrophobicContact CB-CD1 3.89Å; M45-Y145 HydrophobicContact CB-CD2 3.55Å; M45-Y145 HydrophobicContact CB-CE1 3.96Å; M45-Y145 HydrophobicContact CB-CE2 3.58Å; M45-Y145 HydrophobicContact CB-CG 3.69Å; M45-Y145 HydrophobicContact CE-CE2 3.6Å; M45-Y145 WeakPolarHBondContact CE-OH 3.16Å; M45-Y145 HydrophobicContact CG-CD1 4.39Å; M45-Y145 HydrophobicContact CG-CD2 4.48Å; M45-Y145 HydrophobicContact CG-CE1 4.02Å; M45-Y145 HydrophobicContact CG-CE2 4.07Å; T46-Y145 WeakPolarHBondContact OG1-CB 3.22Å; W49-Y145 AromaticContact CD1-CD2 3.99Å; W49-Y145 AromaticContact CD1-CE2 3.92Å; W49-Y145 AromaticContact NE1-CE2 3.73Å; E87-Y145 PolarHBondContact OE2-OH 2.91Å; E141-Y145 HydrophobicContact CB-CD2 4.29Å; E141-Y145 HydrophobicContact CB-CE2 4.31Å; E141-Y145 WeakPolarHBondContact O-CD2 3.27Å; E141-Y145 PolarHBondContact O-N 2.93Å; E141-Y145 WeakPolarHBondContact OE2-CE2 3.48Å; Y145-Y147 VanDerWaalsContact C-N 3.32Å; Y145-Y147 PolarHBondContact O-N 3.1Å; Y145-Y148 HydrophobicContact CD1-CD2 4.22Å; Y145-Y148 PolarHBondContact O-N 2.93Å; Y145-Y148 VanDerWaalsContact O-N 3.15Å; Y145-T149 PolarHBondContact O-N 3.13Å; Y145-T149 PolarHBondContact O-OG1 3.03Å; Y145-T149 VanDerWaalsContact O-OG1 3.11Å
146	S	92	Very high	90.5	Very high	17 Å²	17	44.6 Å²	44.6	12%	0.119	22%	0.222	C	C	.	.	H	α-helix	trans	-58	-46.4	172	-61.8	0	0	0	0	111.1	T46 I142 Y148 T149 F150	T46-S146 WeakPolarHBondContact CG2-OG 3.49Å; T46-S146 PolarHBondContact OG1-N 3.22Å; I142-S146 WeakPolarHBondContact O-CB 3.4Å; I142-S146 PolarHBondContact O-N 3.47Å; I142-S146 PolarHBondContact O-OG 2.68Å; S146-Y148 VanDerWaalsContact C-N 3.34Å; S146-Y148 PolarHBondContact O-N 2.91Å; S146-T149 PolarHBondContact O-N 2.63Å; S146-F150 WeakPolarHBondContact O-CD2 3.45Å; S146-F150 PolarHBondContact O-N 2.94Å
147	Y	90.9	Very high	90.2	Very high	22 Å²	22	46.3 Å²	46.3	9%	0.086	23%	0.233	C	C	.	.	H	α-helix	trans	-58.4	-46	175.5	178.2	-78.9	0	0	0	111.6	T143 R144 Y145 T149 F150 N151 L156 K161 R164 Y165	T143-Y147 WeakPolarHBondContact O-CB 3.17Å; T143-Y147 PolarHBondContact O-N 2.96Å; R144-Y147 WeakPolarHBondContact O-CB 3.44Å; R144-Y147 PolarHBondContact O-N 2.83Å; Y145-Y147 VanDerWaalsContact C-N 3.32Å; Y145-Y147 PolarHBondContact O-N 3.1Å; Y147-T149 PolarHBondContact O-N 3.15Å; Y147-F150 PolarHBondContact O-N 2.76Å; Y147-N151 HydrophobicContact CD1-CB 4.23Å; Y147-N151 HydrophobicContact CE1-CB 4.05Å; Y147-N151 WeakPolarHBondContact O-CB 3.3Å; Y147-N151 PolarHBondContact O-N 3.27Å; Y147-L156 HydrophobicContact CD2-CD1 3.91Å; Y147-L156 HydrophobicContact CD2-CD2 4.19Å; Y147-L156 HydrophobicContact CE2-CD1 4.2Å; Y147-L156 HydrophobicContact CE2-CD2 3.62Å; Y147-L156 HydrophobicContact CG-CD1 4.44Å; Y147-K161 HydrophobicContact CE2-CB 4.38Å; Y147-K161 HydrophobicContact CE2-CG 4.25Å; Y147-R164 HydrophobicContact CD2-CB 4.18Å; Y147-R164 HydrophobicContact CD2-CG 4.4Å; Y147-Y165 AromaticContact CE2-CE2 3.9Å; Y147-Y165 HydrophobicContact CE2-CE2 3.9Å
148	Y	88.9	Confident	89.7	Confident	59 Å²	59	53.9 Å²	53.9	23%	0.231	26%	0.262	C	S	.	.	H	α-helix	trans	-62.4	-42.5	-179.9	-67.3	-32.5	0	0	0	112.2	R144 Y145 S146 L152 R164	R144-Y148 HydrophobicContact CG-CD2 4.13Å; R144-Y148 HydrophobicContact CG-CE2 3.55Å; R144-Y148 WeakPolarHBondContact O-CD2 3.24Å; R144-Y148 PolarHBondContact O-N 3.32Å; Y145-Y148 HydrophobicContact CD1-CD2 4.22Å; Y145-Y148 PolarHBondContact O-N 2.93Å; Y145-Y148 VanDerWaalsContact O-N 3.15Å; S146-Y148 VanDerWaalsContact C-N 3.34Å; S146-Y148 PolarHBondContact O-N 2.91Å; Y148-L152 WeakPolarHBondContact O-CB 3.45Å; Y148-L152 WeakPolarHBondContact O-CD1 3.32Å; Y148-L152 VanDerWaalsContact O-CG 3.28Å; Y148-L152 WeakPolarHBondContact O-CG 3.35Å; Y148-L152 PolarHBondContact O-N 3.34Å; Y148-R164 VanDerWaalsContact CD1-NH1 3.31Å; Y148-R164 VanDerWaalsContact CE1-NH2 3.29Å; Y148-R164 PolarHBondContact OH-NH2 3.48Å; Y148-R164 VanDerWaalsContact OH-NH2 3.13Å
149	T	90.6	Very high	89.3	Confident	10 Å²	10	59.8 Å²	59.8	6%	0.061	29%	0.288	C	S	.	.	H	α-helix	trans	-57.7	-56.4	173.9	-59.5	0	0	0	0	111.5	T39 N42 I43 Y145 S146 Y147 N151 L152 L153	T39-T149 HydrophobicContact CG2-CG2 4.27Å; N42-T149 WeakPolarHBondContact CB-OG1 3.26Å; I43-T149 HydrophobicContact CD1-CG2 3.95Å; I43-T149 HydrophobicContact CG1-CG2 3.54Å; Y145-T149 PolarHBondContact O-N 3.13Å; Y145-T149 PolarHBondContact O-OG1 3.03Å; Y145-T149 VanDerWaalsContact O-OG1 3.11Å; S146-T149 PolarHBondContact O-N 2.63Å; Y147-T149 PolarHBondContact O-N 3.15Å; T149-N151 VanDerWaalsContact C-N 3.29Å; T149-N151 PolarHBondContact O-N 2.76Å; T149-L152 PolarHBondContact O-N 2.82Å; T149-L152 VanDerWaalsContact O-N 3.15Å; T149-L153 HydrophobicContact CG2-CD1 4Å; T149-L153 WeakPolarHBondContact O-CG 3.36Å; T149-L153 PolarHBondContact O-N 2.92Å
150	F	88.8	Confident	89	Confident	66 Å²	66	58.7 Å²	58.7	29%	0.289	28%	0.28	S	S	.	.	H	α-helix	trans	-67	-31.5	-175.7	-76.6	-61.3	0	0	0	112.9	S146 Y147 L153 H154 H155 L156 P157 I160	S146-F150 WeakPolarHBondContact O-CD2 3.45Å; S146-F150 PolarHBondContact O-N 2.94Å; Y147-F150 PolarHBondContact O-N 2.76Å; F150-L153 PolarHBondContact O-N 3.41Å; F150-H154 PolarHBondContact O-N 3.49Å; F150-H155 WeakPolarHBondContact CB-O 3.35Å; F150-H155 VanDerWaalsContact CD1-O 3.28Å; F150-H155 WeakPolarHBondContact CD1-O 3.49Å; F150-H155 CarbonylContact O-C 3.37Å; F150-H155 PolarHBondContact O-N 3.48Å; F150-L156 HydrophobicContact CB-CD1 3.78Å; F150-P157 HydrophobicContact CD1-CG 4.25Å; F150-P157 HydrophobicContact CE1-CG 4.36Å; F150-P157 HydrophobicContact CG-CG 4.34Å; F150-I160 HydrophobicContact CD2-CG1 4.14Å; F150-I160 HydrophobicContact CD2-CG2 4.33Å; F150-I160 HydrophobicContact CE2-CG1 4.21Å
151	N	87.4	Confident	88.7	Confident	80 Å²	80	59.7 Å²	59.7	43%	0.428	28%	0.28	S	S	.	.	H	α-helix	trans	-69.3	-35.5	174.3	-169.6	81.2	0	0	0	112.1	Y147 T149 H154	Y147-N151 HydrophobicContact CD1-CB 4.23Å; Y147-N151 HydrophobicContact CE1-CB 4.05Å; Y147-N151 WeakPolarHBondContact O-CB 3.3Å; Y147-N151 PolarHBondContact O-N 3.27Å; T149-N151 VanDerWaalsContact C-N 3.29Å; T149-N151 PolarHBondContact O-N 2.76Å; N151-H154 PolarHBondContact O-N 3.44Å
152	L	86.9	Confident	88.4	Confident	40 Å²	40	64.2 Å²	64.2	21%	0.209	30%	0.298	C	S	.	.	H	α-helix	trans	-71.4	-32.9	174.4	-74.6	166.1	0	0	0	112.6	T35 L38 Y148 T149 H154	T35-L152 HydrophobicContact CG2-CB 4.5Å; T35-L152 HydrophobicContact CG2-CD2 4.37Å; L38-L152 HydrophobicContact CB-CD1 3.61Å; L38-L152 HydrophobicContact CD1-CD2 4.4Å; Y148-L152 WeakPolarHBondContact O-CB 3.45Å; Y148-L152 WeakPolarHBondContact O-CD1 3.32Å; Y148-L152 VanDerWaalsContact O-CG 3.28Å; Y148-L152 WeakPolarHBondContact O-CG 3.35Å; Y148-L152 PolarHBondContact O-N 3.34Å; T149-L152 PolarHBondContact O-N 2.82Å; T149-L152 VanDerWaalsContact O-N 3.15Å; L152-H154 PolarHBondContact O-N 3Å
153	L	86.2	Confident	88.1	Confident	94 Å²	94	62.7 Å²	62.7	49%	0.492	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	3.5	177.5	-66.2	176.6	0	0	0	113.7	T39 T149 F150 H155	T39-L153 HydrophobicContact CG2-CD1 4.47Å; T39-L153 HydrophobicContact CG2-CD2 3.96Å; T39-L153 HydrophobicContact CG2-CG 4.22Å; T149-L153 HydrophobicContact CG2-CD1 4Å; T149-L153 WeakPolarHBondContact O-CG 3.36Å; T149-L153 PolarHBondContact O-N 2.92Å; F150-L153 PolarHBondContact O-N 3.41Å; L153-H155 PolarHBondContact O-N 3.5Å
154	H	82.8	Confident	87.9	Confident	182 Å²	182	63.2 Å²	63.2	84%	0.843	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	12.4	-174.5	-61.4	-75.2	0	0	0	115.3	F150 N151 L152	F150-H154 PolarHBondContact O-N 3.49Å; N151-H154 PolarHBondContact O-N 3.44Å; L152-H154 PolarHBondContact O-N 3Å
155	H	83.9	Confident	87.5	Confident	133 Å²	133	62.6 Å²	62.6	62%	0.616	29%	0.287	S	S	*	.			trans	-122	84.6	177.7	-176.7	73.5	0	0	0	108.3	F150 L153 P157	F150-H155 WeakPolarHBondContact CB-O 3.35Å; F150-H155 VanDerWaalsContact CD1-O 3.28Å; F150-H155 WeakPolarHBondContact CD1-O 3.49Å; F150-H155 CarbonylContact O-C 3.37Å; F150-H155 PolarHBondContact O-N 3.48Å; L153-H155 PolarHBondContact O-N 3.5Å; H155-P157 VanDerWaalsContact O-CD 3.29Å; H155-P157 WeakPolarHBondContact O-CD 3.42Å
156	L	85.5	Confident	87.3	Confident	39 Å²	39	64 Å²	64	20%	0.204	30%	0.295	C	S	.	.			trans	-99.7	104.6	-177.3	-177.8	59.7	0	0	0	111.4	Y147 F150 Y158 I160 K161	Y147-L156 HydrophobicContact CD2-CD1 3.91Å; Y147-L156 HydrophobicContact CD2-CD2 4.19Å; Y147-L156 HydrophobicContact CE2-CD1 4.2Å; Y147-L156 HydrophobicContact CE2-CD2 3.62Å; Y147-L156 HydrophobicContact CG-CD1 4.44Å; F150-L156 HydrophobicContact CB-CD1 3.78Å; L156-Y158 PolarHBondContact O-N 3.14Å; L156-I160 HydrophobicContact CD1-CB 4.49Å; L156-I160 HydrophobicContact CD1-CG2 4.35Å; L156-K161 HydrophobicContact CD2-CB 4.12Å; L156-K161 HydrophobicContact CD2-CD 4.39Å; L156-K161 HydrophobicContact CD2-CG 4.33Å; L156-K161 HydrophobicContact CG-CB 4.2Å
157	P	88.2	Confident	87.1	Confident	41 Å²	41	66.5 Å²	66.5	27%	0.266	30%	0.304	S	S	.	.			trans	-60.9	138.6	176.7	-20.6	32.8	0	0	0	110.8	F150 H155 F159 I160 K161	F150-P157 HydrophobicContact CD1-CG 4.25Å; F150-P157 HydrophobicContact CE1-CG 4.36Å; F150-P157 HydrophobicContact CG-CG 4.34Å; H155-P157 VanDerWaalsContact O-CD 3.29Å; H155-P157 WeakPolarHBondContact O-CD 3.42Å; P157-F159 PolarHBondContact O-N 3.28Å; P157-I160 HydrophobicContact CB-CG1 4.26Å; P157-I160 HydrophobicContact CG-CG1 4.3Å; P157-I160 PolarHBondContact O-N 3.15Å; P157-I160 VanDerWaalsContact O-N 3.17Å; P157-K161 PolarHBondContact O-N 3.23Å
158	Y	85.4	Confident	86.9	Confident	168 Å²	168	66.3 Å²	66.3	66%	0.659	30%	0.304	S	S	*	.	H	α-helix	trans	-55.4	-40.5	179.1	178.2	-96.7	0	0	0	111.8	L156 I160 K161 W162	L156-Y158 PolarHBondContact O-N 3.14Å; Y158-I160 PolarHBondContact O-N 2.87Å; Y158-K161 PolarHBondContact O-N 2.66Å; Y158-W162 HydrophobicContact CD1-CB 4.45Å; Y158-W162 HydrophobicContact CE1-CB 4.11Å; Y158-W162 HydrophobicContact CE1-CG 4.4Å; Y158-W162 VanDerWaalsContact O-CB 3.29Å; Y158-W162 WeakPolarHBondContact O-CB 3.46Å; Y158-W162 PolarHBondContact O-N 3.1Å
159	F	86.6	Confident	86.9	Confident	131 Å²	131	66.3 Å²	66.3	58%	0.575	31%	0.307	S	S	*	.	H	α-helix	trans	-58.4	-45.6	178.9	178.7	-103.2	0	0	0	113.1	P157 W162 A163	P157-F159 PolarHBondContact O-N 3.28Å; F159-W162 PolarHBondContact O-N 2.97Å; F159-A163 VanDerWaalsContact O-CB 3.26Å; F159-A163 WeakPolarHBondContact O-CB 3.23Å; F159-A163 PolarHBondContact O-N 2.92Å
160	I	87.9	Confident	86.9	Confident	28 Å²	28	70.2 Å²	70.2	14%	0.144	33%	0.33	C	S	.	.	H	α-helix	trans	-67.9	-40.6	-179.4	-60.6	-63.2	0	0	0	110.9	F150 L156 P157 Y158 R164	F150-I160 HydrophobicContact CD2-CG1 4.14Å; F150-I160 HydrophobicContact CD2-CG2 4.33Å; F150-I160 HydrophobicContact CE2-CG1 4.21Å; L156-I160 HydrophobicContact CD1-CB 4.49Å; L156-I160 HydrophobicContact CD1-CG2 4.35Å; P157-I160 HydrophobicContact CB-CG1 4.26Å; P157-I160 HydrophobicContact CG-CG1 4.3Å; P157-I160 PolarHBondContact O-N 3.15Å; P157-I160 VanDerWaalsContact O-N 3.17Å; Y158-I160 PolarHBondContact O-N 2.87Å; I160-R164 PolarHBondContact O-N 3.3Å; I160-R164 VanDerWaalsContact O-N 3.1Å
161	K	85.8	Confident	87.1	Confident	65 Å²	65	68.2 Å²	68.2	28%	0.283	32%	0.323	S	S	.	.	H	α-helix	trans	-59.6	-51	172.7	-176.4	-175.6	-65.3	-178.9	0	110.7	Y147 L156 P157 Y158 A163 R164 Y165 V239 L240	Y147-K161 HydrophobicContact CE2-CB 4.38Å; Y147-K161 HydrophobicContact CE2-CG 4.25Å; L156-K161 HydrophobicContact CD2-CB 4.12Å; L156-K161 HydrophobicContact CD2-CD 4.39Å; L156-K161 HydrophobicContact CD2-CG 4.33Å; L156-K161 HydrophobicContact CG-CB 4.2Å; P157-K161 PolarHBondContact O-N 3.23Å; Y158-K161 PolarHBondContact O-N 2.66Å; K161-A163 PolarHBondContact O-N 3.24Å; K161-R164 PolarHBondContact O-N 3.43Å; K161-Y165 HydrophobicContact CG-CD2 4.14Å; K161-Y165 HydrophobicContact CG-CE2 4.34Å; K161-Y165 VanDerWaalsContact O-CD2 3.24Å; K161-Y165 WeakPolarHBondContact O-CD2 3.36Å; K161-Y165 PolarHBondContact O-N 2.86Å; K161-V239 HydrophobicContact CD-CG1 4.33Å; K161-L240 HydrophobicContact CD-CD2 4.21Å; K161-L240 HydrophobicContact CG-CD2 4.14Å
162	W	87.6	Confident	87.1	Confident	96 Å²	96	67.2 Å²	67.2	36%	0.364	31%	0.314	S	S	.	.	H	α-helix	trans	-60.2	-45.5	179.2	177.2	93.7	0	0	0	111.9	Y158 F159 R164 Y165 N166 F167	Y158-W162 HydrophobicContact CD1-CB 4.45Å; Y158-W162 HydrophobicContact CE1-CB 4.11Å; Y158-W162 HydrophobicContact CE1-CG 4.4Å; Y158-W162 VanDerWaalsContact O-CB 3.29Å; Y158-W162 WeakPolarHBondContact O-CB 3.46Å; Y158-W162 PolarHBondContact O-N 3.1Å; F159-W162 PolarHBondContact O-N 2.97Å; W162-R164 PolarHBondContact O-N 3.33Å; W162-Y165 CarbonylContact O-C 3.55Å; W162-Y165 PolarHBondContact O-N 3.48Å; W162-N166 HydrophobicContact CD2-CB 4.46Å; W162-N166 HydrophobicContact CZ2-CB 4.19Å; W162-N166 PolarHBondContact NE1-ND2 3.2Å; W162-N166 VanDerWaalsContact NE1-ND2 3.19Å; W162-N166 WeakPolarHBondContact O-CB 3.34Å; W162-N166 PolarHBondContact O-N 3.41Å; W162-N166 PolarHBondContact O-ND2 3.43Å; W162-F167 HydrophobicContact CH2-CE1 4.37Å; W162-F167 AromaticContact CZ3-CE1 3.88Å; W162-F167 HydrophobicContact CZ3-CE1 3.88Å; W162-F167 HydrophobicContact CZ3-CZ 4.48Å
163	A	87.8	Confident	87.3	Confident	1 Å²	1	67.3 Å²	67.3	1%	0.008	32%	0.317	C	S	.	.	H	α-helix	trans	-59.8	-48.3	-179.7	0	0	0	0	0	111	T143 F159 K161 Y165 N166 F167	T143-A163 HydrophobicContact CG2-CB 4.24Å; F159-A163 VanDerWaalsContact O-CB 3.26Å; F159-A163 WeakPolarHBondContact O-CB 3.23Å; F159-A163 PolarHBondContact O-N 2.92Å; K161-A163 PolarHBondContact O-N 3.24Å; A163-Y165 VanDerWaalsContact C-N 3.3Å; A163-Y165 PolarHBondContact O-N 3.36Å; A163-N166 PolarHBondContact O-N 3.42Å; A163-F167 HydrophobicContact CB-CD2 4.07Å; A163-F167 HydrophobicContact CB-CE2 3.88Å; A163-F167 HydrophobicContact CB-CZ 4.18Å; A163-F167 WeakPolarHBondContact O-CB 3.47Å; A163-F167 WeakPolarHBondContact O-CG 2.89Å; A163-F167 PolarHBondContact O-N 2.68Å
164	R	87.6	Confident	87.6	Confident	31 Å²	31	66.1 Å²	66.1	12%	0.117	31%	0.31	C	S	.	.	H	α-helix	trans	-55.9	-43.8	176.8	177.7	179.7	178.3	130.9	1.2	112.4	Y147 Y148 I160 K161 W162	Y147-R164 HydrophobicContact CD2-CB 4.18Å; Y147-R164 HydrophobicContact CD2-CG 4.4Å; Y148-R164 VanDerWaalsContact CD1-NH1 3.31Å; Y148-R164 VanDerWaalsContact CE1-NH2 3.29Å; Y148-R164 PolarHBondContact OH-NH2 3.48Å; Y148-R164 VanDerWaalsContact OH-NH2 3.13Å; I160-R164 PolarHBondContact O-N 3.3Å; I160-R164 VanDerWaalsContact O-N 3.1Å; K161-R164 PolarHBondContact O-N 3.43Å; W162-R164 PolarHBondContact O-N 3.33Å
165	Y	84.7	Confident	88	Confident	11 Å²	11	57.7 Å²	57.7	4%	0.043	27%	0.272	C	S	.	.	H	α-helix	trans	-92.6	3.5	-173.9	-72.1	-67.5	0	0	0	114.6	Y147 K161 W162 A163 F168 Q235 R236 V239 L240	Y147-Y165 AromaticContact CE2-CE2 3.9Å; Y147-Y165 HydrophobicContact CE2-CE2 3.9Å; K161-Y165 HydrophobicContact CG-CD2 4.14Å; K161-Y165 HydrophobicContact CG-CE2 4.34Å; K161-Y165 VanDerWaalsContact O-CD2 3.24Å; K161-Y165 WeakPolarHBondContact O-CD2 3.36Å; K161-Y165 PolarHBondContact O-N 2.86Å; W162-Y165 CarbonylContact O-C 3.55Å; W162-Y165 PolarHBondContact O-N 3.48Å; A163-Y165 VanDerWaalsContact C-N 3.3Å; A163-Y165 PolarHBondContact O-N 3.36Å; Y165-F168 WeakPolarHBondContact O-CE1 3.37Å; Y165-Q235 HydrophobicContact CE1-CB 4.09Å; Y165-R236 HydrophobicContact CD1-CB 4.07Å; Y165-R236 WeakPolarHBondContact O-CD 3.43Å; Y165-R236 PolarHBondContact O-NE 3.3Å; Y165-V239 HydrophobicContact CD2-CG1 4.23Å; Y165-V239 HydrophobicContact CE1-CB 4.44Å; Y165-V239 HydrophobicContact CE1-CG2 4.5Å; Y165-V239 HydrophobicContact CE2-CB 3.97Å; Y165-V239 HydrophobicContact CE2-CG1 3.58Å; Y165-V239 HydrophobicContact CE2-CG2 4.39Å; Y165-L240 HydrophobicContact CD2-CD2 4.44Å; Y165-L240 HydrophobicContact CD2-CG 4.43Å; Y165-L240 HydrophobicContact CG-CD1 4.47Å; Y165-L240 HydrophobicContact CG-CG 4.36Å
166	N	87.1	Confident	88.4	Confident	30 Å²	30	52.2 Å²	52.2	16%	0.16	25%	0.248	C	C	.	.	H	α-helix	trans	-122.7	-38	172.1	-69.5	-79.9	0	0	0	112.4	W162 A163 F168 I169 R236	W162-N166 HydrophobicContact CD2-CB 4.46Å; W162-N166 HydrophobicContact CZ2-CB 4.19Å; W162-N166 PolarHBondContact NE1-ND2 3.2Å; W162-N166 VanDerWaalsContact NE1-ND2 3.19Å; W162-N166 WeakPolarHBondContact O-CB 3.34Å; W162-N166 PolarHBondContact O-N 3.41Å; W162-N166 PolarHBondContact O-ND2 3.43Å; A163-N166 PolarHBondContact O-N 3.42Å; N166-F168 PolarHBondContact O-N 2.98Å; N166-I169 WeakPolarHBondContact O-CB 3.18Å; N166-I169 WeakPolarHBondContact O-CG1 3.2Å; N166-I169 PolarHBondContact O-N 3.34Å; N166-I169 VanDerWaalsContact O-N 3.09Å; N166-R236 PolarHBondContact OD1-NH2 2.85Å
167	F	89	Confident	88.7	Confident	70 Å²	70	53.7 Å²	53.7	31%	0.307	26%	0.259	S	S	.	.	H	α-helix	trans	-61.2	-33.8	179	-71.8	-6.3	0	0	0	112.6	V139 T143 W162 A163 I169 V170 L171	V139-F167 HydrophobicContact CG1-CD2 3.98Å; V139-F167 HydrophobicContact CG1-CE2 4.2Å; T143-F167 HydrophobicContact CG2-CD2 3.82Å; T143-F167 HydrophobicContact CG2-CE2 4.02Å; W162-F167 HydrophobicContact CH2-CE1 4.37Å; W162-F167 AromaticContact CZ3-CE1 3.88Å; W162-F167 HydrophobicContact CZ3-CE1 3.88Å; W162-F167 HydrophobicContact CZ3-CZ 4.48Å; A163-F167 HydrophobicContact CB-CD2 4.07Å; A163-F167 HydrophobicContact CB-CE2 3.88Å; A163-F167 HydrophobicContact CB-CZ 4.18Å; A163-F167 WeakPolarHBondContact O-CB 3.47Å; A163-F167 WeakPolarHBondContact O-CG 2.89Å; A163-F167 PolarHBondContact O-N 2.68Å; F167-I169 PolarHBondContact O-N 3.43Å; F167-I169 VanDerWaalsContact O-N 3.09Å; F167-V170 PolarHBondContact O-N 2.72Å; F167-V170 VanDerWaalsContact O-N 3.14Å; F167-L171 HydrophobicContact CB-CD1 3.74Å; F167-L171 HydrophobicContact CB-CG 4.21Å; F167-L171 HydrophobicContact CD2-CD1 4.44Å; F167-L171 HydrophobicContact CG-CD1 4.43Å; F167-L171 VanDerWaalsContact O-CB 3.29Å; F167-L171 WeakPolarHBondContact O-CB 3.3Å; F167-L171 WeakPolarHBondContact O-CG 3.31Å; F167-L171 PolarHBondContact O-N 3.05Å
168	F	87.3	Confident	88.9	Confident	17 Å²	17	51.8 Å²	51.8	8%	0.075	25%	0.246	C	C	.	.	H	α-helix	trans	-58.6	-26.4	178.4	87.3	-93.3	0	0	0	112.9	Y165 N166 V170 Y172 Y229 M232 L233 R236	Y165-F168 WeakPolarHBondContact O-CE1 3.37Å; N166-F168 PolarHBondContact O-N 2.98Å; F168-V170 PolarHBondContact O-N 3.46Å; F168-Y172 WeakPolarHBondContact O-CB 3.4Å; F168-Y172 PolarHBondContact O-N 2.99Å; F168-Y229 HydrophobicContact CD2-CD2 4.41Å; F168-Y229 HydrophobicContact CD2-CE2 4.15Å; F168-Y229 HydrophobicContact CE2-CD2 4.41Å; F168-Y229 HydrophobicContact CE2-CE2 4.09Å; F168-M232 HydrophobicContact CB-CE 4.32Å; F168-M232 HydrophobicContact CD1-CE 4.41Å; F168-M232 HydrophobicContact CD2-CB 3.74Å; F168-M232 HydrophobicContact CD2-CG 4.48Å; F168-M232 HydrophobicContact CE2-CB 3.55Å; F168-M232 HydrophobicContact CG-CB 4.37Å; F168-M232 HydrophobicContact CG-CE 4.21Å; F168-M232 HydrophobicContact CZ-CB 4.02Å; F168-L233 HydrophobicContact CE2-CD2 4.11Å; F168-L233 HydrophobicContact CE2-CG 4.13Å; F168-L233 HydrophobicContact CZ-CD2 3.83Å; F168-L233 HydrophobicContact CZ-CG 4.18Å; F168-R236 HydrophobicContact CE1-CB 4.1Å; F168-R236 HydrophobicContact CE1-CG 4.44Å; F168-R236 HydrophobicContact CZ-CB 4.25Å
169	I	87.8	Confident	89.3	Confident	60 Å²	60	44.4 Å²	44.4	31%	0.308	22%	0.218	S	C	.	.	H	α-helix	trans	-60.5	-38.5	-178.9	-62.5	173.6	0	0	0	110.4	N166 F167 P173	N166-I169 WeakPolarHBondContact O-CB 3.18Å; N166-I169 WeakPolarHBondContact O-CG1 3.2Å; N166-I169 PolarHBondContact O-N 3.34Å; N166-I169 VanDerWaalsContact O-N 3.09Å; F167-I169 PolarHBondContact O-N 3.43Å; F167-I169 VanDerWaalsContact O-N 3.09Å; I169-P173 VanDerWaalsContact O-CD 3.25Å; I169-P173 WeakPolarHBondContact O-CD 3.36Å; I169-P173 WeakPolarHBondContact O-CG 3.06Å
170	V	91.2	Very high	89.6	Confident	91 Å²	91	40.2 Å²	40.2	55%	0.552	20%	0.201	S	C	*	.	H	α-helix	trans	-99.3	-45.3	-178.2	179	0	0	0	0	111.5	F167 F168 Y172 P173 L174	F167-V170 PolarHBondContact O-N 2.72Å; F167-V170 VanDerWaalsContact O-N 3.14Å; F168-V170 PolarHBondContact O-N 3.46Å; V170-Y172 VanDerWaalsContact C-N 3.34Å; V170-Y172 PolarHBondContact O-N 3.39Å; V170-P173 WeakPolarHBondContact O-CD 3.33Å; V170-L174 HydrophobicContact CG1-CD1 3.71Å; V170-L174 HydrophobicContact CG1-CG 4.39Å; V170-L174 WeakPolarHBondContact O-CB 3.29Å; V170-L174 VanDerWaalsContact O-CG 3.32Å; V170-L174 WeakPolarHBondContact O-CG 3.27Å; V170-L174 PolarHBondContact O-N 2.93Å
171	L	91.7	Very high	89.9	Confident	25 Å²	25	43 Å²	43	13%	0.131	22%	0.216	C	C	.	.	H	α-helix	trans	-66.1	-35.7	-176.7	-67.6	-174.8	0	0	0	112.2	V136 V139 F167 L174 G175	V136-L171 HydrophobicContact CG1-CB 4.02Å; V136-L171 HydrophobicContact CG1-CD2 4.29Å; V136-L171 WeakPolarHBondContact CG1-O 3.44Å; V136-L171 HydrophobicContact CG2-CD2 4.21Å; V139-L171 HydrophobicContact CB-CD1 3.91Å; V139-L171 HydrophobicContact CG1-CD1 3.6Å; F167-L171 HydrophobicContact CB-CD1 3.74Å; F167-L171 HydrophobicContact CB-CG 4.21Å; F167-L171 HydrophobicContact CD2-CD1 4.44Å; F167-L171 HydrophobicContact CG-CD1 4.43Å; F167-L171 VanDerWaalsContact O-CB 3.29Å; F167-L171 WeakPolarHBondContact O-CB 3.3Å; F167-L171 WeakPolarHBondContact O-CG 3.31Å; F167-L171 PolarHBondContact O-N 3.05Å; L171-L174 PolarHBondContact O-N 3.27Å; L171-G175 PolarHBondContact O-N 3.15Å
172	Y	88.6	Confident	90.2	Very high	59 Å²	59	40 Å²	40	23%	0.231	20%	0.203	C	C	.	.	H	α-helix	trans	-67.1	-50.4	-176	-166	-93.4	0	0	0	112.3	F168 V170 L174 G175 V176 F225 L228 Y229	F168-Y172 WeakPolarHBondContact O-CB 3.4Å; F168-Y172 PolarHBondContact O-N 2.99Å; V170-Y172 VanDerWaalsContact C-N 3.34Å; V170-Y172 PolarHBondContact O-N 3.39Å; Y172-L174 PolarHBondContact O-N 2.7Å; Y172-G175 PolarHBondContact O-N 3.34Å; Y172-V176 PolarHBondContact O-N 2.89Å; Y172-F225 AromaticContact CD1-CD2 3.77Å; Y172-F225 HydrophobicContact CD1-CD2 3.77Å; Y172-F225 AromaticContact CD1-CE2 3.43Å; Y172-F225 HydrophobicContact CD1-CE2 3.43Å; Y172-F225 VanDerWaalsContact CD1-CE2 3.43Å; Y172-F225 HydrophobicContact CD1-CZ 4.43Å; Y172-F225 AromaticContact CE1-CD2 3.4Å; Y172-F225 HydrophobicContact CE1-CD2 3.4Å; Y172-F225 VanDerWaalsContact CE1-CD2 3.4Å; Y172-F225 AromaticContact CE1-CE2 3.61Å; Y172-F225 HydrophobicContact CE1-CE2 3.61Å; Y172-F225 HydrophobicContact CE1-CG 4.42Å; Y172-L228 WeakPolarHBondContact OH-CB 3.27Å; Y172-L228 VanDerWaalsContact OH-CD1 3.29Å; Y172-L228 WeakPolarHBondContact OH-CD1 3.45Å; Y172-Y229 AromaticContact CD1-CD2 3.68Å; Y172-Y229 HydrophobicContact CD1-CD2 3.68Å; Y172-Y229 HydrophobicContact CD1-CG 4.4Å; Y172-Y229 HydrophobicContact CE1-CD2 4.4Å; Y172-Y229 HydrophobicContact CG-CD2 4.28Å
173	P	91.1	Very high	90.4	Very high	42 Å²	42	35.4 Å²	35.4	27%	0.273	19%	0.185	S	C	.	.	H	α-helix	trans	-60	-43.2	171.7	-22.3	32.3	0	0	0	113.5	I169 V170 G175 V176 V177 F225 Y229	I169-P173 VanDerWaalsContact O-CD 3.25Å; I169-P173 WeakPolarHBondContact O-CD 3.36Å; I169-P173 WeakPolarHBondContact O-CG 3.06Å; V170-P173 WeakPolarHBondContact O-CD 3.33Å; P173-G175 VanDerWaalsContact C-N 3.3Å; P173-G175 PolarHBondContact O-N 3.11Å; P173-V176 PolarHBondContact O-N 2.91Å; P173-V177 WeakPolarHBondContact O-CG2 3.25Å; P173-V177 PolarHBondContact O-N 3.01Å; P173-F225 HydrophobicContact CB-CE2 4.45Å; P173-F225 HydrophobicContact CB-CZ 4.25Å; P173-F225 HydrophobicContact CG-CE2 4.42Å; P173-F225 HydrophobicContact CG-CZ 4.12Å; P173-Y229 HydrophobicContact CG-CE2 4.34Å
174	L	92.8	Very high	90.6	Very high	69 Å²	69	42.5 Å²	42.5	36%	0.361	21%	0.213	S	C	.	.	H	α-helix	trans	-63.1	-37.1	179.9	-74.8	178.5	0	0	0	112.6	V136 V170 L171 Y172 V177 G178	V136-L174 HydrophobicContact CG2-CB 3.8Å; V170-L174 HydrophobicContact CG1-CD1 3.71Å; V170-L174 HydrophobicContact CG1-CG 4.39Å; V170-L174 WeakPolarHBondContact O-CB 3.29Å; V170-L174 VanDerWaalsContact O-CG 3.32Å; V170-L174 WeakPolarHBondContact O-CG 3.27Å; V170-L174 PolarHBondContact O-N 2.93Å; L171-L174 PolarHBondContact O-N 3.27Å; Y172-L174 PolarHBondContact O-N 2.7Å; L174-V177 PolarHBondContact O-N 3.14Å; L174-G178 PolarHBondContact O-N 3.05Å
175	G	91.3	Very high	90.8	Very high	4 Å²	4	42 Å²	42	4%	0.041	22%	0.216	C	C	.	.	H	α-helix	trans	-63.2	-48.6	176.7	0	0	0	0	0	111.3	L171 Y172 P173 V177 G178 E179	L171-G175 PolarHBondContact O-N 3.15Å; Y172-G175 PolarHBondContact O-N 3.34Å; P173-G175 VanDerWaalsContact C-N 3.3Å; P173-G175 PolarHBondContact O-N 3.11Å; G175-V177 PolarHBondContact O-N 3.34Å; G175-G178 PolarHBondContact O-N 2.92Å; G175-E179 WeakPolarHBondContact O-CG 3.36Å; G175-E179 PolarHBondContact O-N 3.21Å
176	V	91.1	Very high	91	Very high	19 Å²	19	41.5 Å²	41.5	12%	0.115	21%	0.214	C	C	.	.	H	α-helix	trans	-62.4	-42.6	177.3	168.5	0	0	0	0	112	Y172 P173 G178 E179 L180 Y221 F225	Y172-V176 PolarHBondContact O-N 2.89Å; P173-V176 PolarHBondContact O-N 2.91Å; V176-G178 PolarHBondContact O-N 2.89Å; V176-E179 PolarHBondContact O-N 3.07Å; V176-L180 HydrophobicContact CG1-CD1 3.77Å; V176-L180 HydrophobicContact CG1-CG 4.25Å; V176-L180 WeakPolarHBondContact O-CB 3.09Å; V176-L180 WeakPolarHBondContact O-CG 3.15Å; V176-L180 PolarHBondContact O-N 3.19Å; V176-Y221 HydrophobicContact CB-CD1 4.35Å; V176-Y221 HydrophobicContact CG1-CD1 3.56Å; V176-Y221 HydrophobicContact CG1-CE1 4.18Å; V176-Y221 HydrophobicContact CG1-CG 4.45Å; V176-Y221 HydrophobicContact CG2-CD1 4.06Å; V176-Y221 HydrophobicContact CG2-CE1 4.14Å; V176-F225 HydrophobicContact CB-CD2 4.25Å; V176-F225 HydrophobicContact CB-CE2 4.44Å; V176-F225 HydrophobicContact CG1-CD2 4.32Å; V176-F225 HydrophobicContact CG2-CD2 3.78Å; V176-F225 HydrophobicContact CG2-CE2 4.22Å
177	V	93.1	Very high	91.1	Very high	70 Å²	70	40.9 Å²	40.9	42%	0.424	21%	0.21	S	C	.	.	H	α-helix	trans	-60.8	-46	175	169.9	0	0	0	0	110.8	P173 L174 G175 E179 L180 L181	P173-V177 WeakPolarHBondContact O-CG2 3.25Å; P173-V177 PolarHBondContact O-N 3.01Å; L174-V177 PolarHBondContact O-N 3.14Å; G175-V177 PolarHBondContact O-N 3.34Å; V177-E179 PolarHBondContact O-N 3.47Å; V177-L180 PolarHBondContact O-N 3.07Å; V177-L181 HydrophobicContact CG1-CD1 3.71Å; V177-L181 HydrophobicContact CG1-CG 4.2Å; V177-L181 WeakPolarHBondContact O-CB 3.12Å; V177-L181 VanDerWaalsContact O-CG 3.23Å; V177-L181 WeakPolarHBondContact O-CG 3.4Å; V177-L181 PolarHBondContact O-N 3.05Å
178	G	92	Very high	91	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-62	-40.3	177.9	0	0	0	0	0	113.3	L174 G175 V176 T182	L174-G178 PolarHBondContact O-N 3.05Å; G175-G178 PolarHBondContact O-N 2.92Å; V176-G178 PolarHBondContact O-N 2.89Å; G178-T182 WeakPolarHBondContact O-CB 3.29Å; G178-T182 PolarHBondContact O-N 3.24Å; G178-T182 VanDerWaalsContact O-N 3.07Å; G178-T182 PolarHBondContact O-OG1 3.3Å
179	E	92.8	Very high	90.9	Very high	14 Å²	14	42 Å²	42	7%	0.065	22%	0.22	C	C	.	.	H	α-helix	trans	-65.2	-50.2	175.3	-71.4	168.7	-170.1	0	0	111.5	M113 F133 W137 G175 V176 V177 L181 T182 I183 Y221	M113-E179 HydrophobicContact CE-CB 3.99Å; M113-E179 HydrophobicContact CE-CG 4.08Å; M113-E179 HydrophobicContact CG-CG 4.29Å; M113-E179 HydrophobicContact SD-CB 4.38Å; F133-E179 HydrophobicContact CB-CG 4.23Å; F133-E179 HydrophobicContact CG-CG 4.46Å; W137-E179 HydrophobicContact CZ2-CG 4.1Å; W137-E179 WeakPolarHBondContact CZ2-OE1 3.1Å; W137-E179 PolarHBondContact NE1-OE1 3.5Å; G175-E179 WeakPolarHBondContact O-CG 3.36Å; G175-E179 PolarHBondContact O-N 3.21Å; V176-E179 PolarHBondContact O-N 3.07Å; V177-E179 PolarHBondContact O-N 3.47Å; E179-L181 PolarHBondContact O-N 3.25Å; E179-T182 WeakPolarHBondContact O-CB 3.37Å; E179-T182 PolarHBondContact O-N 3.35Å; E179-T182 VanDerWaalsContact O-N 3.14Å; E179-I183 WeakPolarHBondContact O-CG1 3.29Å; E179-I183 PolarHBondContact O-N 3.48Å; E179-Y221 WeakPolarHBondContact OE2-CE1 3.29Å; E179-Y221 PolarHBondContact OE2-OH 3.05Å
180	L	93.3	Very high	90.7	Very high	43 Å²	43	39.1 Å²	39.1	23%	0.225	21%	0.206	C	C	.	.	H	α-helix	trans	-62.4	-42.4	-180	-73.7	175	0	0	0	112.4	V176 V177 T182 I183 Y184 M218 Y221	V176-L180 HydrophobicContact CG1-CD1 3.77Å; V176-L180 HydrophobicContact CG1-CG 4.25Å; V176-L180 WeakPolarHBondContact O-CB 3.09Å; V176-L180 WeakPolarHBondContact O-CG 3.15Å; V176-L180 PolarHBondContact O-N 3.19Å; V177-L180 PolarHBondContact O-N 3.07Å; L180-T182 VanDerWaalsContact C-N 3.3Å; L180-T182 PolarHBondContact O-N 3.28Å; L180-I183 PolarHBondContact O-N 3.49Å; L180-Y184 VanDerWaalsContact O-CB 3.31Å; L180-Y184 WeakPolarHBondContact O-CB 3.4Å; L180-Y184 PolarHBondContact O-N 3.05Å; L180-M218 HydrophobicContact CD2-CB 3.98Å; L180-M218 HydrophobicContact CD2-CE 4.4Å; L180-M218 HydrophobicContact CD2-CG 3.93Å; L180-Y221 HydrophobicContact CD2-CD2 3.93Å; L180-Y221 HydrophobicContact CD2-CE2 4.48Å; L180-Y221 HydrophobicContact CD2-CG 3.99Å; L180-Y221 HydrophobicContact CG-CG 4.41Å
181	L	93.6	Very high	90.3	Very high	87 Å²	87	43.4 Å²	43.4	46%	0.455	21%	0.212	S	C	.	.	H	α-helix	trans	-63	-38.5	174.9	-72.7	175.4	0	0	0	111.4	V177 E179 Y184 A185	V177-L181 HydrophobicContact CG1-CD1 3.71Å; V177-L181 HydrophobicContact CG1-CG 4.2Å; V177-L181 WeakPolarHBondContact O-CB 3.12Å; V177-L181 VanDerWaalsContact O-CG 3.23Å; V177-L181 WeakPolarHBondContact O-CG 3.4Å; V177-L181 PolarHBondContact O-N 3.05Å; E179-L181 PolarHBondContact O-N 3.25Å; L181-Y184 PolarHBondContact O-N 3.23Å; L181-A185 WeakPolarHBondContact O-CB 3.48Å; L181-A185 PolarHBondContact O-N 3.06Å
182	T	93.2	Very high	89.7	Confident	0 Å²	0	52 Å²	52	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-66.8	-42.3	176.8	-58.6	0	0	0	0	111.7	M113 I117 T118 I124 S129 V130 F133 G178 E179 L180 A185 A186	M113-T182 HydrophobicContact CE-CG2 4.03Å; I117-T182 HydrophobicContact CG2-CG2 3.92Å; T118-T182 HydrophobicContact CG2-CG2 3.88Å; I124-T182 HydrophobicContact CD1-CG2 3.92Å; S129-T182 VanDerWaalsContact CB-OG1 3.3Å; S129-T182 WeakPolarHBondContact CB-OG1 3.37Å; S129-T182 WeakPolarHBondContact OG-CA 3.32Å; S129-T182 PolarHBondContact OG-OG1 2.86Å; V130-T182 HydrophobicContact CG2-CG2 3.78Å; F133-T182 HydrophobicContact CE1-CG2 4.11Å; G178-T182 WeakPolarHBondContact O-CB 3.29Å; G178-T182 PolarHBondContact O-N 3.24Å; G178-T182 VanDerWaalsContact O-N 3.07Å; G178-T182 PolarHBondContact O-OG1 3.3Å; E179-T182 WeakPolarHBondContact O-CB 3.37Å; E179-T182 PolarHBondContact O-N 3.35Å; E179-T182 VanDerWaalsContact O-N 3.14Å; L180-T182 VanDerWaalsContact C-N 3.3Å; L180-T182 PolarHBondContact O-N 3.28Å; T182-A185 PolarHBondContact O-N 3.27Å; T182-A186 WeakPolarHBondContact O-CB 3.49Å; T182-A186 PolarHBondContact O-N 2.98Å
183	I	92.3	Very high	89	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-64.7	-43	175.1	-64.2	167.1	0	0	0	110.3	M113 E179 L180 A185 A186 L187 L214 V217 M218	M113-I183 HydrophobicContact CE-CG1 4.2Å; M113-I183 HydrophobicContact SD-CD1 3.69Å; M113-I183 HydrophobicContact SD-CG1 3.63Å; E179-I183 WeakPolarHBondContact O-CG1 3.29Å; E179-I183 PolarHBondContact O-N 3.48Å; L180-I183 PolarHBondContact O-N 3.49Å; I183-A185 PolarHBondContact O-N 3.35Å; I183-A186 WeakPolarHBondContact O-CA 3.33Å; I183-A186 VanDerWaalsContact O-CB 3.3Å; I183-A186 WeakPolarHBondContact O-CB 3.49Å; I183-A186 PolarHBondContact O-N 3.03Å; I183-L187 PolarHBondContact O-N 3.14Å; I183-L187 VanDerWaalsContact O-N 3.11Å; I183-L214 HydrophobicContact CG2-CB 4.09Å; I183-L214 HydrophobicContact CG2-CD1 4.49Å; I183-L214 HydrophobicContact CG2-CD2 4.07Å; I183-L214 HydrophobicContact CG2-CG 4.45Å; I183-V217 HydrophobicContact CD1-CG1 4.11Å; I183-M218 HydrophobicContact CB-CG 4.19Å; I183-M218 HydrophobicContact CB-SD 4.37Å; I183-M218 HydrophobicContact CD1-CG 4.5Å; I183-M218 HydrophobicContact CG2-CG 3.62Å; I183-M218 HydrophobicContact CG2-SD 3.75Å
184	Y	92.1	Very high	87.8	Confident	151 Å²	151	51.8 Å²	51.8	59%	0.592	26%	0.256	S	S	*	.	H	α-helix	trans	-60.4	-44.9	177.3	-178.7	-99.6	0	0	0	111.8	L180 L181 A186 L187 P188 M218	L180-Y184 VanDerWaalsContact O-CB 3.31Å; L180-Y184 WeakPolarHBondContact O-CB 3.4Å; L180-Y184 PolarHBondContact O-N 3.05Å; L181-Y184 PolarHBondContact O-N 3.23Å; Y184-A186 PolarHBondContact O-N 3.18Å; Y184-L187 HydrophobicContact CD2-CD1 4.03Å; Y184-L187 WeakPolarHBondContact O-CB 3.34Å; Y184-L187 PolarHBondContact O-N 3.25Å; Y184-P188 WeakPolarHBondContact O-CD 3.49Å; Y184-M218 HydrophobicContact CD2-CE 4.36Å
185	A	90.9	Very high	86.5	Confident	21 Å²	21	51.5 Å²	51.5	17%	0.174	25%	0.254	C	S	.	.	H	α-helix	trans	-62.6	-28.9	174.1	0	0	0	0	0	112.5	I124 E127 L181 T182 I183 P188 F189	I124-A185 HydrophobicContact CG2-CB 4.28Å; E127-A185 HydrophobicContact CG-CB 4.4Å; L181-A185 WeakPolarHBondContact O-CB 3.48Å; L181-A185 PolarHBondContact O-N 3.06Å; T182-A185 PolarHBondContact O-N 3.27Å; I183-A185 PolarHBondContact O-N 3.35Å; A185-P188 WeakPolarHBondContact O-CD 3.05Å; A185-P188 WeakPolarHBondContact O-CG 3.29Å; A185-F189 WeakPolarHBondContact O-CD2 3.47Å; A185-F189 VanDerWaalsContact O-CE2 3.26Å; A185-F189 WeakPolarHBondContact O-CE2 3.37Å
186	A	89.6	Confident	85.2	Confident	0 Å²	0	57 Å²	57	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-74.2	-31.1	177	0	0	0	0	0	113.9	I117 I121 I124 T182 I183 Y184 F189 V190	I117-A186 HydrophobicContact CG2-CB 4.21Å; I121-A186 HydrophobicContact CD1-CB 3.69Å; I124-A186 HydrophobicContact CD1-CB 4.27Å; I124-A186 HydrophobicContact CG2-CB 4.37Å; T182-A186 WeakPolarHBondContact O-CB 3.49Å; T182-A186 PolarHBondContact O-N 2.98Å; I183-A186 WeakPolarHBondContact O-CA 3.33Å; I183-A186 VanDerWaalsContact O-CB 3.3Å; I183-A186 WeakPolarHBondContact O-CB 3.49Å; I183-A186 PolarHBondContact O-N 3.03Å; Y184-A186 PolarHBondContact O-N 3.18Å; A186-F189 WeakPolarHBondContact O-CB 3.45Å; A186-F189 PolarHBondContact O-N 2.89Å; A186-V190 PolarHBondContact O-N 3.26Å
187	L	88.2	Confident	83.9	Confident	16 Å²	16	57.2 Å²	57.2	8%	0.084	28%	0.276	C	S	.	.	H	α-helix	trans	-48.9	-51.5	-177	-73.5	174	0	0	0	114.9	I183 Y184 F189 V190 R191 Y211 L214 I215 M218	I183-L187 PolarHBondContact O-N 3.14Å; I183-L187 VanDerWaalsContact O-N 3.11Å; Y184-L187 HydrophobicContact CD2-CD1 4.03Å; Y184-L187 WeakPolarHBondContact O-CB 3.34Å; Y184-L187 PolarHBondContact O-N 3.25Å; L187-F189 VanDerWaalsContact C-N 3.27Å; L187-F189 PolarHBondContact O-N 3.36Å; L187-V190 PolarHBondContact O-N 3.44Å; L187-R191 WeakPolarHBondContact O-CB 3.15Å; L187-R191 PolarHBondContact O-N 2.98Å; L187-Y211 HydrophobicContact CB-CD2 4.5Å; L187-Y211 HydrophobicContact CB-CE2 4.04Å; L187-Y211 HydrophobicContact CD2-CD2 3.89Å; L187-Y211 HydrophobicContact CD2-CE2 3.84Å; L187-Y211 HydrophobicContact CG-CE2 4.45Å; L187-L214 HydrophobicContact CD2-CB 3.68Å; L187-L214 HydrophobicContact CD2-CD1 3.95Å; L187-L214 HydrophobicContact CD2-CG 4.46Å; L187-I215 HydrophobicContact CD2-CG1 4.24Å; L187-M218 HydrophobicContact CD1-SD 4.14Å
188	P	86.6	Confident	82.3	Confident	54 Å²	54	59.1 Å²	59.1	35%	0.351	28%	0.282	S	S	.	.	H	α-helix	trans	-63.6	-32.7	-179.8	24.3	-35	0	0	0	112.6	Y184 A185 R192	Y184-P188 WeakPolarHBondContact O-CD 3.49Å; A185-P188 WeakPolarHBondContact O-CD 3.05Å; A185-P188 WeakPolarHBondContact O-CG 3.29Å; P188-R192 VanDerWaalsContact O-CG 3.27Å; P188-R192 WeakPolarHBondContact O-CG 3.42Å; P188-R192 PolarHBondContact O-N 3.15Å
189	F	85.3	Confident	80.6	Confident	56 Å²	56	68.1 Å²	68.1	25%	0.246	32%	0.316	C	S	.	.	H	α-helix	trans	-72.1	-42.8	177.4	-60.7	-72.7	0	0	0	111.5	I121 Q123 I124 A185 A186 L187 R192 S193	I121-F189 HydrophobicContact CG2-CB 4.02Å; I121-F189 HydrophobicContact CG2-CD2 4.17Å; I121-F189 HydrophobicContact CG2-CG 4.1Å; Q123-F189 HydrophobicContact CB-CD1 4.23Å; Q123-F189 HydrophobicContact CB-CE1 3.72Å; Q123-F189 HydrophobicContact CB-CE2 4.11Å; Q123-F189 HydrophobicContact CB-CZ 3.65Å; Q123-F189 HydrophobicContact CG-CD1 4.16Å; Q123-F189 HydrophobicContact CG-CE1 3.72Å; Q123-F189 HydrophobicContact CG-CZ 4.16Å; I124-F189 HydrophobicContact CG2-CD2 3.98Å; I124-F189 HydrophobicContact CG2-CE2 3.99Å; A185-F189 WeakPolarHBondContact O-CD2 3.47Å; A185-F189 VanDerWaalsContact O-CE2 3.26Å; A185-F189 WeakPolarHBondContact O-CE2 3.37Å; A186-F189 WeakPolarHBondContact O-CB 3.45Å; A186-F189 PolarHBondContact O-N 2.89Å; L187-F189 VanDerWaalsContact C-N 3.27Å; L187-F189 PolarHBondContact O-N 3.36Å; F189-R192 PolarHBondContact O-N 3.41Å; F189-S193 VanDerWaalsContact O-CB 3.3Å; F189-S193 WeakPolarHBondContact O-CB 3.37Å; F189-S193 PolarHBondContact O-N 3.34Å; F189-S193 PolarHBondContact O-OG 3.5Å
190	V	84.3	Confident	78.9	Confident	1 Å²	1	70.9 Å²	70.9	1%	0.006	33%	0.331	C	S	.	.	H	α-helix	trans	-61.7	-45.3	175.7	171	0	0	0	0	110.8	I121 A186 L187 R192 S193 G194 Y210 L214	I121-V190 HydrophobicContact CD1-CG2 3.79Å; A186-V190 PolarHBondContact O-N 3.26Å; L187-V190 PolarHBondContact O-N 3.44Å; V190-R192 VanDerWaalsContact C-N 3.34Å; V190-R192 PolarHBondContact O-N 3.04Å; V190-S193 PolarHBondContact O-N 3.15Å; V190-S193 PolarHBondContact O-OG 3.23Å; V190-G194 PolarHBondContact O-N 2.96Å; V190-Y210 HydrophobicContact CB-CD1 4.39Å; V190-Y210 HydrophobicContact CG1-CD1 3.56Å; V190-Y210 HydrophobicContact CG1-CE1 4.47Å; V190-Y210 HydrophobicContact CG1-CG 4.23Å; V190-Y210 HydrophobicContact CG2-CD1 3.87Å; V190-Y210 HydrophobicContact CG2-CE1 3.98Å; V190-L214 HydrophobicContact CB-CD1 4.23Å; V190-L214 HydrophobicContact CG1-CD1 4.38Å; V190-L214 HydrophobicContact CG2-CD1 3.78Å
191	R	81.9	Confident	76.9	Confident	181 Å²	181	75.1 Å²	75.1	68%	0.683	36%	0.361	S	S	*	.	H	α-helix	trans	-61.3	-39.5	178.9	-172.3	173.6	177.9	169	-0.5	113.1	L187 Y211	L187-R191 WeakPolarHBondContact O-CB 3.15Å; L187-R191 PolarHBondContact O-N 2.98Å; R191-Y211 HydrophobicContact CB-CD2 3.81Å; R191-Y211 HydrophobicContact CB-CE2 4.07Å; R191-Y211 HydrophobicContact CG-CD2 4.41Å
192	R	79.3	Confident	75.2	Confident	205 Å²	205	74.3 Å²	74.3	77%	0.774	36%	0.357	S	S	*	.	H	α-helix	trans	-75.8	-38.8	179.8	-71.2	178.5	-157.6	169.2	6.2	112.9	P188 F189 V190	P188-R192 VanDerWaalsContact O-CG 3.27Å; P188-R192 WeakPolarHBondContact O-CG 3.42Å; P188-R192 PolarHBondContact O-N 3.15Å; F189-R192 PolarHBondContact O-N 3.41Å; V190-R192 VanDerWaalsContact C-N 3.34Å; V190-R192 PolarHBondContact O-N 3.04Å
193	S	74.1	Confident	73.3	Confident	65 Å²	65	83.3 Å²	83.3	46%	0.455	40%	0.396	S	S	.	.	H	α-helix	trans	-87	-20.6	-174.6	60.2	0	0	0	0	113.7	F189 V190 M195	F189-S193 VanDerWaalsContact O-CB 3.3Å; F189-S193 WeakPolarHBondContact O-CB 3.37Å; F189-S193 PolarHBondContact O-N 3.34Å; F189-S193 PolarHBondContact O-OG 3.5Å; V190-S193 PolarHBondContact O-N 3.15Å; V190-S193 PolarHBondContact O-OG 3.23Å; S193-M195 PolarHBondContact O-N 3.04Å; S193-M195 WeakPolarHBondContact OG-CG 3.36Å
194	G	66.4	Low	71.8	Confident	31 Å²	31	91.9 Å²	91.9	32%	0.32	43%	0.43	S	S	.	.			trans	62.3	18	-173.5	0	0	0	0	0	113.5	V190 Y196 S197	V190-G194 PolarHBondContact O-N 2.96Å; G194-Y196 PolarHBondContact O-N 3.46Å; G194-S197 WeakPolarHBondContact O-CB 3.31Å; G194-S197 PolarHBondContact O-N 3.15Å; G194-S197 VanDerWaalsContact O-N 3.12Å
195	M	65.4	Low	70.1	Confident	64 Å²	64	91 Å²	91	32%	0.315	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	133.2	-175.6	-76.7	-160.5	-51.9	0	0	111.4	I121 S193 S197 Y210	I121-M195 HydrophobicContact CD1-CE 4.49Å; I121-M195 HydrophobicContact CG1-CE 3.63Å; S193-M195 PolarHBondContact O-N 3.04Å; S193-M195 WeakPolarHBondContact OG-CG 3.36Å; M195-S197 PolarHBondContact O-N 3.45Å; M195-Y210 VanDerWaalsContact O-CB 3.3Å; M195-Y210 WeakPolarHBondContact O-CB 3.28Å; M195-Y210 WeakPolarHBondContact O-CD1 3.27Å
196	Y	62.7	Low	68.5	Low	118 Å²	118	94.2 Å²	94.2	46%	0.463	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.8	10	-176.8	-50.9	-66.7	0	0	0	115.7	S120 G194 F208 Y210	S120-Y196 PolarHBondContact OG-OH 3.35Å; G194-Y196 PolarHBondContact O-N 3.46Å; Y196-F208 WeakPolarHBondContact O-CD1 3.29Å; Y196-Y210 AromaticContact CD2-CD1 3.93Å; Y196-Y210 HydrophobicContact CD2-CD1 3.93Å; Y196-Y210 AromaticContact CD2-CE1 3.81Å; Y196-Y210 HydrophobicContact CD2-CE1 3.81Å; Y196-Y210 HydrophobicContact CD2-CG 4.4Å
197	S	63.8	Low	67.2	Low	25 Å²	25	97.7 Å²	97.7	18%	0.175	48%	0.477	C	S	.	.			trans	-88.1	120.7	172.8	-60.1	0	0	0	0	110.5	G194 M195 F208 D209 Y210	G194-S197 WeakPolarHBondContact O-CB 3.31Å; G194-S197 PolarHBondContact O-N 3.15Å; G194-S197 VanDerWaalsContact O-N 3.12Å; M195-S197 PolarHBondContact O-N 3.45Å; S197-F208 CarbonylContact C-O 3.38Å; S197-F208 WeakPolarHBondContact CA-O 3.38Å; S197-D209 PolarHBondContact OG-OD1 2.97Å; S197-Y210 PolarHBondContact OG-N 3.31Å
198	M	59.8	Low	66.4	Low	110 Å²	110	101 Å²	101	54%	0.542	49%	0.491	S	S	.	.	B	Isolated β-bridge	trans	-98.4	109.9	175.5	-173.1	174.3	-78.8	0	0	108.7	S207 F208	M198-S207 WeakPolarHBondContact O-CA 3.36Å; M198-F208 PolarHBondContact N-O 3.46Å; M198-F208 PolarHBondContact O-N 2.85Å
199	R	56.5	Low	66	Low	189 Å²	189	100.5 Å²	100.5	71%	0.713	49%	0.485	S	S	*	.			trans	-99.8	149.2	177.8	-65.9	-175.5	176	170.9	0.3	111
200	L	57.1	Low	65.7	Low	72 Å²	72	98.3 Å²	98.3	38%	0.377	48%	0.475	S	S	.	.	S	Bend	trans	-68.3	159.1	-175.2	-82.6	151.2	0	0	0	114.6	N205	L200-N205 VanDerWaalsContact CD2-CA 3.46Å; L200-N205 HydrophobicContact CD2-CB 4.4Å; L200-N205 VanDerWaalsContact CD2-OD1 3.26Å; L200-N205 WeakPolarHBondContact CD2-OD1 3.41Å
201	P	52.8	Low	65.7	Low	131 Å²	131	100.6 Å²	100.6	85%	0.851	48%	0.484	S	S	*	.			cis	-107.8	96.2	16.6	35.7	-23.1	0	0	0	113.2
202	N	57.8	Low	65.8	Low	70 Å²	70	99.2 Å²	99.2	37%	0.374	48%	0.48	S	S	.	.			trans	-79.8	149.4	167	-169.4	8.1	0	0	0	110	Y204 N205	N202-Y204 PolarHBondContact O-N 2.88Å; N202-N205 PolarHBondContact O-N 3.41Å
203	K	52.8	Low	66.1	Low	190 Å²	190	92.8 Å²	92.8	83%	0.826	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-18	-175.1	-167.1	176.3	-179.5	-179.3	0	115.1
204	Y	59.8	Low	66.7	Low	180 Å²	180	89.7 Å²	89.7	71%	0.706	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.2	5.9	-177.6	-62.7	-74.7	0	0	0	115	N202 V206	N202-Y204 PolarHBondContact O-N 2.88Å; Y204-V206 WeakPolarHBondContact O-CG2 3.35Å; Y204-V206 PolarHBondContact O-N 3.03Å; Y204-V206 VanDerWaalsContact O-N 3.13Å
205	N	57.4	Low	67.8	Low	133 Å²	133	90.8 Å²	90.8	71%	0.711	43%	0.434	S	S	*	.			trans	55.1	23.6	-178.6	-153.3	30.7	0	0	0	116.4	L200 N202	L200-N205 VanDerWaalsContact CD2-CA 3.46Å; L200-N205 HydrophobicContact CD2-CB 4.4Å; L200-N205 VanDerWaalsContact CD2-OD1 3.26Å; L200-N205 WeakPolarHBondContact CD2-OD1 3.41Å; N202-N205 PolarHBondContact O-N 3.41Å
206	V	56.3	Low	68.9	Low	88 Å²	88	93 Å²	93	53%	0.533	45%	0.446	S	S	.	.			trans	-98.2	120.7	-178.6	-176.7	0	0	0	0	110.8	Y204	Y204-V206 WeakPolarHBondContact O-CG2 3.35Å; Y204-V206 PolarHBondContact O-N 3.03Å; Y204-V206 VanDerWaalsContact O-N 3.13Å
207	S	63.2	Low	70.1	Confident	72 Å²	72	88.4 Å²	88.4	50%	0.503	43%	0.43	S	S	.	.			trans	-97.7	110.9	164.8	-171.1	0	0	0	0	108.4	M198	M198-S207 WeakPolarHBondContact O-CA 3.36Å
208	F	70.3	Confident	71.4	Confident	87 Å²	87	89.2 Å²	89.2	38%	0.382	43%	0.432	S	S	.	.	B	Isolated β-bridge	trans	-101.5	118.5	173.8	179.6	-100.1	0	0	0	108.5	Y196 S197 M198 Y210 F213	Y196-F208 WeakPolarHBondContact O-CD1 3.29Å; S197-F208 CarbonylContact C-O 3.38Å; S197-F208 WeakPolarHBondContact CA-O 3.38Å; M198-F208 PolarHBondContact N-O 3.46Å; M198-F208 PolarHBondContact O-N 2.85Å; F208-Y210 HydrophobicContact CE1-CD2 4.12Å; F208-Y210 HydrophobicContact CZ-CD2 4.37Å; F208-F213 HydrophobicContact CE2-CB 4Å; F208-F213 AromaticContact CE2-CD2 3.99Å; F208-F213 HydrophobicContact CE2-CD2 3.99Å; F208-F213 HydrophobicContact CE2-CG 4.11Å; F208-F213 HydrophobicContact CZ-CB 3.7Å; F208-F213 HydrophobicContact CZ-CD1 4.3Å; F208-F213 AromaticContact CZ-CD2 3.99Å; F208-F213 HydrophobicContact CZ-CD2 3.99Å; F208-F213 AromaticContact CZ-CG 3.73Å; F208-F213 HydrophobicContact CZ-CG 3.73Å
209	D	78.4	Confident	72.9	Confident	43 Å²	43	88.8 Å²	88.8	23%	0.23	43%	0.431	C	S	.	.			trans	-110.4	115	174.8	-163.4	-25.6	0	0	0	109.7	S197 Y211 Y212 F213	S197-D209 PolarHBondContact OG-OD1 2.97Å; D209-Y211 PolarHBondContact O-N 2.94Å; D209-Y211 WeakPolarHBondContact OD1-CB 3.28Å; D209-Y211 PolarHBondContact OD1-N 2.9Å; D209-Y212 HydrophobicContact CB-CD2 3.78Å; D209-Y212 HydrophobicContact CB-CE2 4.49Å; D209-Y212 PolarHBondContact O-N 3.45Å; D209-F213 PolarHBondContact O-N 3.42Å; D209-F213 VanDerWaalsContact O-N 3.14Å
210	Y	80.1	Confident	74.4	Confident	10 Å²	10	81.8 Å²	81.8	4%	0.039	41%	0.411	C	S	.	.	H	α-helix	trans	-61.7	-27.9	-178.5	-168.3	-127.4	0	0	0	112.1	Y112 F116 I117 V190 M195 Y196 S197 F208 F213 L214	Y112-Y210 HydrophobicContact CE2-CE2 4.31Å; Y112-Y210 WeakPolarHBondContact OH-CE2 3.45Å; Y112-Y210 PolarHBondContact OH-OH 3.46Å; F116-Y210 PolarHBondContact O-OH 2.83Å; F116-Y210 VanDerWaalsContact O-OH 3.11Å; I117-Y210 WeakPolarHBondContact CD1-OH 3.48Å; V190-Y210 HydrophobicContact CB-CD1 4.39Å; V190-Y210 HydrophobicContact CG1-CD1 3.56Å; V190-Y210 HydrophobicContact CG1-CE1 4.47Å; V190-Y210 HydrophobicContact CG1-CG 4.23Å; V190-Y210 HydrophobicContact CG2-CD1 3.87Å; V190-Y210 HydrophobicContact CG2-CE1 3.98Å; M195-Y210 VanDerWaalsContact O-CB 3.3Å; M195-Y210 WeakPolarHBondContact O-CB 3.28Å; M195-Y210 WeakPolarHBondContact O-CD1 3.27Å; Y196-Y210 AromaticContact CD2-CD1 3.93Å; Y196-Y210 HydrophobicContact CD2-CD1 3.93Å; Y196-Y210 AromaticContact CD2-CE1 3.81Å; Y196-Y210 HydrophobicContact CD2-CE1 3.81Å; Y196-Y210 HydrophobicContact CD2-CG 4.4Å; S197-Y210 PolarHBondContact OG-N 3.31Å; F208-Y210 HydrophobicContact CE1-CD2 4.12Å; F208-Y210 HydrophobicContact CZ-CD2 4.37Å; Y210-F213 HydrophobicContact CD2-CB 4.44Å; Y210-F213 AromaticContact CD2-CD1 3.87Å; Y210-F213 HydrophobicContact CD2-CD1 3.87Å; Y210-F213 AromaticContact CE2-CD1 3.76Å; Y210-F213 HydrophobicContact CE2-CD1 3.76Å; Y210-F213 HydrophobicContact CE2-CE1 4.22Å; Y210-F213 WeakPolarHBondContact O-CB 3.4Å; Y210-F213 PolarHBondContact O-N 3.35Å; Y210-L214 HydrophobicContact CE1-CD1 4.3Å; Y210-L214 HydrophobicContact CE1-CD2 4.3Å; Y210-L214 HydrophobicContact CE1-CG 4.36Å; Y210-L214 HydrophobicContact CE2-CD2 4.36Å; Y210-L214 WeakPolarHBondContact O-CG 3.5Å; Y210-L214 PolarHBondContact O-N 2.93Å
211	Y	83.4	Confident	75.8	Confident	48 Å²	48	79.6 Å²	79.6	19%	0.188	40%	0.398	C	S	.	.	H	α-helix	trans	-61.9	-48.7	175.7	178.6	-93.4	0	0	0	112.3	L187 R191 D209 F213 L214 I215	L187-Y211 HydrophobicContact CB-CD2 4.5Å; L187-Y211 HydrophobicContact CB-CE2 4.04Å; L187-Y211 HydrophobicContact CD2-CD2 3.89Å; L187-Y211 HydrophobicContact CD2-CE2 3.84Å; L187-Y211 HydrophobicContact CG-CE2 4.45Å; R191-Y211 HydrophobicContact CB-CD2 3.81Å; R191-Y211 HydrophobicContact CB-CE2 4.07Å; R191-Y211 HydrophobicContact CG-CD2 4.41Å; D209-Y211 PolarHBondContact O-N 2.94Å; D209-Y211 WeakPolarHBondContact OD1-CB 3.28Å; D209-Y211 PolarHBondContact OD1-N 2.9Å; Y211-F213 VanDerWaalsContact C-N 3.32Å; Y211-L214 PolarHBondContact O-N 3.31Å; Y211-I215 HydrophobicContact CD1-CD1 3.96Å; Y211-I215 HydrophobicContact CE1-CD1 3.41Å; Y211-I215 VanDerWaalsContact CE1-CD1 3.41Å; Y211-I215 HydrophobicContact CE1-CG1 4.48Å; Y211-I215 PolarHBondContact O-N 2.86Å
212	Y	83.6	Confident	77.4	Confident	152 Å²	152	79 Å²	79	60%	0.596	39%	0.386	S	S	*	.	H	α-helix	trans	-68.9	-34.1	177.8	-69.3	-63.1	0	0	0	111.5	D209 L214 I215 I216	D209-Y212 HydrophobicContact CB-CD2 3.78Å; D209-Y212 HydrophobicContact CB-CE2 4.49Å; D209-Y212 PolarHBondContact O-N 3.45Å; Y212-L214 PolarHBondContact O-N 2.87Å; Y212-I215 HydrophobicContact CD1-CD1 4.4Å; Y212-I215 PolarHBondContact O-N 2.93Å; Y212-I216 WeakPolarHBondContact O-CG1 3.42Å; Y212-I216 PolarHBondContact O-N 3.28Å
213	F	86.5	Confident	78.8	Confident	70 Å²	70	79.2 Å²	79.2	31%	0.307	39%	0.391	S	S	.	.	H	α-helix	trans	-59	-45	172.5	178.8	-100.7	0	0	0	112.1	Y112 F208 D209 Y210 Y211 I215 I216 V217	Y112-F213 AromaticContact CE2-CE1 3.83Å; Y112-F213 HydrophobicContact CE2-CE1 3.83Å; Y112-F213 AromaticContact CZ-CE1 3.75Å; Y112-F213 WeakPolarHBondContact OH-CE1 3.48Å; F208-F213 HydrophobicContact CE2-CB 4Å; F208-F213 AromaticContact CE2-CD2 3.99Å; F208-F213 HydrophobicContact CE2-CD2 3.99Å; F208-F213 HydrophobicContact CE2-CG 4.11Å; F208-F213 HydrophobicContact CZ-CB 3.7Å; F208-F213 HydrophobicContact CZ-CD1 4.3Å; F208-F213 AromaticContact CZ-CD2 3.99Å; F208-F213 HydrophobicContact CZ-CD2 3.99Å; F208-F213 AromaticContact CZ-CG 3.73Å; F208-F213 HydrophobicContact CZ-CG 3.73Å; D209-F213 PolarHBondContact O-N 3.42Å; D209-F213 VanDerWaalsContact O-N 3.14Å; Y210-F213 HydrophobicContact CD2-CB 4.44Å; Y210-F213 AromaticContact CD2-CD1 3.87Å; Y210-F213 HydrophobicContact CD2-CD1 3.87Å; Y210-F213 AromaticContact CE2-CD1 3.76Å; Y210-F213 HydrophobicContact CE2-CD1 3.76Å; Y210-F213 HydrophobicContact CE2-CE1 4.22Å; Y210-F213 WeakPolarHBondContact O-CB 3.4Å; Y210-F213 PolarHBondContact O-N 3.35Å; Y211-F213 VanDerWaalsContact C-N 3.32Å; F213-I215 VanDerWaalsContact C-N 3.3Å; F213-I215 PolarHBondContact O-N 3.42Å; F213-I216 PolarHBondContact O-N 2.94Å; F213-V217 HydrophobicContact CD1-CG2 4.15Å; F213-V217 HydrophobicContact CE1-CG2 3.7Å; F213-V217 HydrophobicContact CE2-CG2 4.27Å; F213-V217 HydrophobicContact CZ-CG2 3.77Å; F213-V217 WeakPolarHBondContact O-CG2 3.37Å; F213-V217 PolarHBondContact O-N 3.04Å
214	L	86.9	Confident	80.3	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-59.4	-39.8	175.5	-70	-175.7	0	0	0	112.8	Y112 I117 I183 L187 V190 Y210 Y211 Y212 V217 M218	Y112-L214 WeakPolarHBondContact OH-CD2 3.14Å; I117-L214 HydrophobicContact CD1-CD2 3.47Å; I117-L214 VanDerWaalsContact CD1-CD2 3.47Å; I183-L214 HydrophobicContact CG2-CB 4.09Å; I183-L214 HydrophobicContact CG2-CD1 4.49Å; I183-L214 HydrophobicContact CG2-CD2 4.07Å; I183-L214 HydrophobicContact CG2-CG 4.45Å; L187-L214 HydrophobicContact CD2-CB 3.68Å; L187-L214 HydrophobicContact CD2-CD1 3.95Å; L187-L214 HydrophobicContact CD2-CG 4.46Å; V190-L214 HydrophobicContact CB-CD1 4.23Å; V190-L214 HydrophobicContact CG1-CD1 4.38Å; V190-L214 HydrophobicContact CG2-CD1 3.78Å; Y210-L214 HydrophobicContact CE1-CD1 4.3Å; Y210-L214 HydrophobicContact CE1-CD2 4.3Å; Y210-L214 HydrophobicContact CE1-CG 4.36Å; Y210-L214 HydrophobicContact CE2-CD2 4.36Å; Y210-L214 WeakPolarHBondContact O-CG 3.5Å; Y210-L214 PolarHBondContact O-N 2.93Å; Y211-L214 PolarHBondContact O-N 3.31Å; Y212-L214 PolarHBondContact O-N 2.87Å; L214-V217 PolarHBondContact O-N 3.43Å; L214-M218 WeakPolarHBondContact O-CG 3.29Å; L214-M218 PolarHBondContact O-N 3.47Å
215	I	88.3	Confident	81.5	Confident	55 Å²	55	67.6 Å²	67.6	28%	0.282	35%	0.348	S	S	.	.	H	α-helix	trans	-63.7	-45	176.2	-65.8	172.2	0	0	0	110.5	L187 Y211 Y212 F213 V217 M218 L219	L187-I215 HydrophobicContact CD2-CG1 4.24Å; Y211-I215 HydrophobicContact CD1-CD1 3.96Å; Y211-I215 HydrophobicContact CE1-CD1 3.41Å; Y211-I215 VanDerWaalsContact CE1-CD1 3.41Å; Y211-I215 HydrophobicContact CE1-CG1 4.48Å; Y211-I215 PolarHBondContact O-N 2.86Å; Y212-I215 HydrophobicContact CD1-CD1 4.4Å; Y212-I215 PolarHBondContact O-N 2.93Å; F213-I215 VanDerWaalsContact C-N 3.3Å; F213-I215 PolarHBondContact O-N 3.42Å; I215-V217 VanDerWaalsContact C-N 3.31Å; I215-V217 PolarHBondContact O-N 2.7Å; I215-M218 PolarHBondContact O-N 3.34Å; I215-L219 HydrophobicContact CG2-CD1 4.1Å; I215-L219 HydrophobicContact CG2-CG 4.41Å; I215-L219 WeakPolarHBondContact O-CG 3.46Å; I215-L219 PolarHBondContact O-N 3.49Å
216	I	88.9	Confident	82.9	Confident	110 Å²	110	63.9 Å²	63.9	56%	0.564	33%	0.331	S	S	*	.	H	α-helix	trans	-60.5	-43	176.5	-67.4	165.7	0	0	0	110.7	Y212 F213 L219 S220	Y212-I216 WeakPolarHBondContact O-CG1 3.42Å; Y212-I216 PolarHBondContact O-N 3.28Å; F213-I216 PolarHBondContact O-N 2.94Å; I216-L219 PolarHBondContact O-N 2.9Å; I216-S220 PolarHBondContact O-N 3.44Å
217	V	88.7	Confident	84.3	Confident	21 Å²	21	65.9 Å²	65.9	13%	0.127	34%	0.335	C	S	.	.	H	α-helix	trans	-58.7	-49.6	175.2	170.6	0	0	0	0	110.1	Y112 I183 F213 L214 I215 L219 S220 Y221	Y112-V217 HydrophobicContact CE1-CG1 4.34Å; I183-V217 HydrophobicContact CD1-CG1 4.11Å; F213-V217 HydrophobicContact CD1-CG2 4.15Å; F213-V217 HydrophobicContact CE1-CG2 3.7Å; F213-V217 HydrophobicContact CE2-CG2 4.27Å; F213-V217 HydrophobicContact CZ-CG2 3.77Å; F213-V217 WeakPolarHBondContact O-CG2 3.37Å; F213-V217 PolarHBondContact O-N 3.04Å; L214-V217 PolarHBondContact O-N 3.43Å; I215-V217 VanDerWaalsContact C-N 3.31Å; I215-V217 PolarHBondContact O-N 2.7Å; V217-L219 VanDerWaalsContact C-N 3.32Å; V217-L219 PolarHBondContact O-N 3.33Å; V217-S220 WeakPolarHBondContact O-CB 3.34Å; V217-S220 PolarHBondContact O-N 2.97Å; V217-S220 VanDerWaalsContact O-N 3.11Å; V217-S220 PolarHBondContact O-OG 3.34Å; V217-Y221 HydrophobicContact CG1-CE2 4.06Å; V217-Y221 VanDerWaalsContact O-CD2 3.26Å; V217-Y221 WeakPolarHBondContact O-CD2 3.46Å
218	M	91.3	Very high	85.3	Confident	43 Å²	43	64.1 Å²	64.1	21%	0.212	32%	0.319	C	S	.	.	H	α-helix	trans	-58.2	-43.4	177.1	-69.1	178.3	72.5	0	0	112.3	L180 I183 Y184 L187 L214 I215 S220 Y221	L180-M218 HydrophobicContact CD2-CB 3.98Å; L180-M218 HydrophobicContact CD2-CE 4.4Å; L180-M218 HydrophobicContact CD2-CG 3.93Å; I183-M218 HydrophobicContact CB-CG 4.19Å; I183-M218 HydrophobicContact CB-SD 4.37Å; I183-M218 HydrophobicContact CD1-CG 4.5Å; I183-M218 HydrophobicContact CG2-CG 3.62Å; I183-M218 HydrophobicContact CG2-SD 3.75Å; Y184-M218 HydrophobicContact CD2-CE 4.36Å; L187-M218 HydrophobicContact CD1-SD 4.14Å; L214-M218 WeakPolarHBondContact O-CG 3.29Å; L214-M218 PolarHBondContact O-N 3.47Å; I215-M218 PolarHBondContact O-N 3.34Å; M218-S220 VanDerWaalsContact C-N 3.29Å; M218-S220 PolarHBondContact O-N 2.92Å; M218-Y221 PolarHBondContact O-N 3.39Å
219	L	90.1	Very high	86	Confident	101 Å²	101	62.2 Å²	62.2	53%	0.529	31%	0.31	S	S	.	.	H	α-helix	trans	-64.4	-32.9	177.4	-70.3	174.9	0	0	0	112.4	I215 I216 V217 Y221 I222 P223	I215-L219 HydrophobicContact CG2-CD1 4.1Å; I215-L219 HydrophobicContact CG2-CG 4.41Å; I215-L219 WeakPolarHBondContact O-CG 3.46Å; I215-L219 PolarHBondContact O-N 3.49Å; I216-L219 PolarHBondContact O-N 2.9Å; V217-L219 VanDerWaalsContact C-N 3.32Å; V217-L219 PolarHBondContact O-N 3.33Å; L219-Y221 PolarHBondContact O-N 2.92Å; L219-I222 HydrophobicContact CD2-CD1 3.97Å; L219-I222 WeakPolarHBondContact O-CB 3.49Å; L219-I222 PolarHBondContact O-N 3.39Å; L219-I222 VanDerWaalsContact O-N 3.11Å; L219-P223 VanDerWaalsContact O-CD 3.28Å; L219-P223 WeakPolarHBondContact O-CD 3.48Å
220	S	88.8	Confident	86.4	Confident	42 Å²	42	64.1 Å²	64.1	29%	0.294	32%	0.32	S	S	.	.	H	α-helix	trans	-64.4	-22.8	177.9	79.2	0	0	0	0	113.5	I216 V217 M218 I222 P223 L224	I216-S220 PolarHBondContact O-N 3.44Å; V217-S220 WeakPolarHBondContact O-CB 3.34Å; V217-S220 PolarHBondContact O-N 2.97Å; V217-S220 VanDerWaalsContact O-N 3.11Å; V217-S220 PolarHBondContact O-OG 3.34Å; M218-S220 VanDerWaalsContact C-N 3.29Å; M218-S220 PolarHBondContact O-N 2.92Å; S220-I222 PolarHBondContact O-N 2.94Å; S220-P223 VanDerWaalsContact O-CD 3.23Å; S220-P223 WeakPolarHBondContact O-CD 3.4Å; S220-P223 WeakPolarHBondContact O-CG 3.38Å; S220-L224 VanDerWaalsContact O-CB 3.3Å; S220-L224 WeakPolarHBondContact O-CB 3.42Å; S220-L224 WeakPolarHBondContact O-CD1 3.42Å; S220-L224 VanDerWaalsContact O-CG 3.24Å; S220-L224 WeakPolarHBondContact O-CG 3.25Å; S220-L224 PolarHBondContact O-N 3.48Å
221	Y	85.9	Confident	86.6	Confident	25 Å²	25	67.6 Å²	67.6	10%	0.098	34%	0.336	C	S	.	.	H	α-helix	trans	-65.7	-28.5	174.6	-80.2	-104.8	0	0	0	111.9	S109 V176 E179 L180 V217 M218 L219 L224 F225	S109-Y221 PolarHBondContact OG-OH 2.98Å; S109-Y221 VanDerWaalsContact OG-OH 3.09Å; V176-Y221 HydrophobicContact CB-CD1 4.35Å; V176-Y221 HydrophobicContact CG1-CD1 3.56Å; V176-Y221 HydrophobicContact CG1-CE1 4.18Å; V176-Y221 HydrophobicContact CG1-CG 4.45Å; V176-Y221 HydrophobicContact CG2-CD1 4.06Å; V176-Y221 HydrophobicContact CG2-CE1 4.14Å; E179-Y221 WeakPolarHBondContact OE2-CE1 3.29Å; E179-Y221 PolarHBondContact OE2-OH 3.05Å; L180-Y221 HydrophobicContact CD2-CD2 3.93Å; L180-Y221 HydrophobicContact CD2-CE2 4.48Å; L180-Y221 HydrophobicContact CD2-CG 3.99Å; L180-Y221 HydrophobicContact CG-CG 4.41Å; V217-Y221 HydrophobicContact CG1-CE2 4.06Å; V217-Y221 VanDerWaalsContact O-CD2 3.26Å; V217-Y221 WeakPolarHBondContact O-CD2 3.46Å; M218-Y221 PolarHBondContact O-N 3.39Å; L219-Y221 PolarHBondContact O-N 2.92Å; Y221-L224 PolarHBondContact O-N 3.39Å; Y221-F225 WeakPolarHBondContact O-CB 3.48Å; Y221-F225 PolarHBondContact O-N 2.88Å
222	I	86.9	Confident	86.6	Confident	118 Å²	118	67.2 Å²	67.2	61%	0.605	34%	0.336	S	S	*	.	H	α-helix	trans	-60	-51.6	-178.5	-59.2	171.3	0	0	0	111.9	L219 S220 P226	L219-I222 HydrophobicContact CD2-CD1 3.97Å; L219-I222 WeakPolarHBondContact O-CB 3.49Å; L219-I222 PolarHBondContact O-N 3.39Å; L219-I222 VanDerWaalsContact O-N 3.11Å; S220-I222 PolarHBondContact O-N 2.94Å; I222-P226 WeakPolarHBondContact O-CD 3.5Å; I222-P226 WeakPolarHBondContact O-CG 3.37Å
223	P	87.6	Confident	86.7	Confident	75 Å²	75	62.2 Å²	62.2	49%	0.487	32%	0.32	S	S	.	.	H	α-helix	trans	-78.2	-34.5	175.5	28.8	-35.9	0	0	0	113.6	L219 S220 Q227	L219-P223 VanDerWaalsContact O-CD 3.28Å; L219-P223 WeakPolarHBondContact O-CD 3.48Å; S220-P223 VanDerWaalsContact O-CD 3.23Å; S220-P223 WeakPolarHBondContact O-CD 3.4Å; S220-P223 WeakPolarHBondContact O-CG 3.38Å; P223-Q227 WeakPolarHBondContact O-CG 3.42Å
224	L	84.1	Confident	86.6	Confident	69 Å²	69	64.9 Å²	64.9	36%	0.361	33%	0.328	S	S	.	.	H	α-helix	trans	-74	-38.6	-173.6	-71.9	171.5	0	0	0	112.9	S220 Y221 Q227 L228	S220-L224 VanDerWaalsContact O-CB 3.3Å; S220-L224 WeakPolarHBondContact O-CB 3.42Å; S220-L224 WeakPolarHBondContact O-CD1 3.42Å; S220-L224 VanDerWaalsContact O-CG 3.24Å; S220-L224 WeakPolarHBondContact O-CG 3.25Å; S220-L224 PolarHBondContact O-N 3.48Å; Y221-L224 PolarHBondContact O-N 3.39Å; L224-Q227 PolarHBondContact O-N 3.21Å; L224-L228 WeakPolarHBondContact O-CG 3.35Å; L224-L228 PolarHBondContact O-N 3.46Å; L224-L228 VanDerWaalsContact O-N 3.14Å
225	F	84.9	Confident	86.4	Confident	57 Å²	57	67.5 Å²	67.5	25%	0.25	34%	0.34	C	S	.	.	H	α-helix	trans	-61.6	-52.7	-176.2	167.8	-97.2	0	0	0	112.8	Y172 P173 V176 Y221 Q227 L228 Y229	Y172-F225 AromaticContact CD1-CD2 3.77Å; Y172-F225 HydrophobicContact CD1-CD2 3.77Å; Y172-F225 AromaticContact CD1-CE2 3.43Å; Y172-F225 HydrophobicContact CD1-CE2 3.43Å; Y172-F225 VanDerWaalsContact CD1-CE2 3.43Å; Y172-F225 HydrophobicContact CD1-CZ 4.43Å; Y172-F225 AromaticContact CE1-CD2 3.4Å; Y172-F225 HydrophobicContact CE1-CD2 3.4Å; Y172-F225 VanDerWaalsContact CE1-CD2 3.4Å; Y172-F225 AromaticContact CE1-CE2 3.61Å; Y172-F225 HydrophobicContact CE1-CE2 3.61Å; Y172-F225 HydrophobicContact CE1-CG 4.42Å; P173-F225 HydrophobicContact CB-CE2 4.45Å; P173-F225 HydrophobicContact CB-CZ 4.25Å; P173-F225 HydrophobicContact CG-CE2 4.42Å; P173-F225 HydrophobicContact CG-CZ 4.12Å; V176-F225 HydrophobicContact CB-CD2 4.25Å; V176-F225 HydrophobicContact CB-CE2 4.44Å; V176-F225 HydrophobicContact CG1-CD2 4.32Å; V176-F225 HydrophobicContact CG2-CD2 3.78Å; V176-F225 HydrophobicContact CG2-CE2 4.22Å; Y221-F225 WeakPolarHBondContact O-CB 3.48Å; Y221-F225 PolarHBondContact O-N 2.88Å; F225-Q227 VanDerWaalsContact C-N 3.31Å; F225-Q227 PolarHBondContact O-N 2.86Å; F225-L228 PolarHBondContact O-N 2.91Å; F225-Y229 WeakPolarHBondContact O-CB 3.36Å; F225-Y229 PolarHBondContact O-N 2.87Å
226	P	86.9	Confident	86.2	Confident	56 Å²	56	67.4 Å²	67.4	36%	0.364	34%	0.336	S	S	.	.	H	α-helix	trans	-61.9	-39.5	-179.8	-22.9	34.4	0	0	0	112.3	I222 Y229 L230	I222-P226 WeakPolarHBondContact O-CD 3.5Å; I222-P226 WeakPolarHBondContact O-CG 3.37Å; P226-Y229 PolarHBondContact O-N 3.23Å; P226-L230 VanDerWaalsContact O-CB 3.22Å; P226-L230 WeakPolarHBondContact O-CB 3.25Å; P226-L230 WeakPolarHBondContact O-CD1 3.39Å; P226-L230 WeakPolarHBondContact O-CG 3.34Å; P226-L230 PolarHBondContact O-N 3.42Å
227	Q	85.4	Confident	85.9	Confident	130 Å²	130	67.9 Å²	67.9	61%	0.607	33%	0.331	S	S	*	.	H	α-helix	trans	-61.3	-49.9	-179.7	-72.4	-175.5	-15.3	0	0	111.8	P223 L224 F225 H231	P223-Q227 WeakPolarHBondContact O-CG 3.42Å; L224-Q227 PolarHBondContact O-N 3.21Å; F225-Q227 VanDerWaalsContact C-N 3.31Å; F225-Q227 PolarHBondContact O-N 2.86Å; Q227-H231 WeakPolarHBondContact O-CB 3.43Å; Q227-H231 PolarHBondContact O-N 3.34Å; Q227-H231 VanDerWaalsContact O-N 3.07Å
228	L	84.3	Confident	85.5	Confident	34 Å²	34	73.4 Å²	73.4	18%	0.178	35%	0.349	C	S	.	.	H	α-helix	trans	-69.2	-39.2	179.8	-68.9	173	0	0	0	111.9	V102 Y172 L224 F225 H231 M232	V102-L228 HydrophobicContact CG1-CD2 3.9Å; Y172-L228 WeakPolarHBondContact OH-CB 3.27Å; Y172-L228 VanDerWaalsContact OH-CD1 3.29Å; Y172-L228 WeakPolarHBondContact OH-CD1 3.45Å; L224-L228 WeakPolarHBondContact O-CG 3.35Å; L224-L228 PolarHBondContact O-N 3.46Å; L224-L228 VanDerWaalsContact O-N 3.14Å; F225-L228 PolarHBondContact O-N 2.91Å; L228-H231 WeakPolarHBondContact O-CB 3.22Å; L228-H231 PolarHBondContact O-N 2.94Å; L228-M232 WeakPolarHBondContact O-CG 3.35Å; L228-M232 PolarHBondContact O-N 3.48Å; L228-M232 VanDerWaalsContact O-N 3.09Å
229	Y	85.9	Confident	84.9	Confident	48 Å²	48	74.3 Å²	74.3	19%	0.188	36%	0.357	C	S	.	.	H	α-helix	trans	-65.5	-46.8	178.5	-173.8	-105.5	0	0	0	112.2	F168 Y172 P173 F225 P226 H231 M232 L233	F168-Y229 HydrophobicContact CD2-CD2 4.41Å; F168-Y229 HydrophobicContact CD2-CE2 4.15Å; F168-Y229 HydrophobicContact CE2-CD2 4.41Å; F168-Y229 HydrophobicContact CE2-CE2 4.09Å; Y172-Y229 AromaticContact CD1-CD2 3.68Å; Y172-Y229 HydrophobicContact CD1-CD2 3.68Å; Y172-Y229 HydrophobicContact CD1-CG 4.4Å; Y172-Y229 HydrophobicContact CE1-CD2 4.4Å; Y172-Y229 HydrophobicContact CG-CD2 4.28Å; P173-Y229 HydrophobicContact CG-CE2 4.34Å; F225-Y229 WeakPolarHBondContact O-CB 3.36Å; F225-Y229 PolarHBondContact O-N 2.87Å; P226-Y229 PolarHBondContact O-N 3.23Å; Y229-H231 VanDerWaalsContact C-N 3.28Å; Y229-H231 PolarHBondContact O-N 3.22Å; Y229-M232 PolarHBondContact O-N 2.89Å; Y229-M232 VanDerWaalsContact O-N 3.16Å; Y229-L233 HydrophobicContact CD1-CD1 3.79Å; Y229-L233 HydrophobicContact CD1-CG 4.46Å; Y229-L233 HydrophobicContact CE1-CD1 3.51Å; Y229-L233 HydrophobicContact CE1-CG 4.19Å; Y229-L233 PolarHBondContact O-N 3.47Å
230	L	85.2	Confident	84.3	Confident	83 Å²	83	71.7 Å²	71.7	44%	0.435	34%	0.343	S	S	.	.	H	α-helix	trans	-63.5	-35.9	176.2	-70.6	170.8	0	0	0	111.7	P226 L233 R234	P226-L230 VanDerWaalsContact O-CB 3.22Å; P226-L230 WeakPolarHBondContact O-CB 3.25Å; P226-L230 WeakPolarHBondContact O-CD1 3.39Å; P226-L230 WeakPolarHBondContact O-CG 3.34Å; P226-L230 PolarHBondContact O-N 3.42Å; L230-L233 HydrophobicContact CD2-CD1 4.22Å; L230-L233 PolarHBondContact O-N 2.89Å; L230-R234 WeakPolarHBondContact O-CG 3.36Å; L230-R234 PolarHBondContact O-N 3.28Å
231	H	84.2	Confident	83.5	Confident	82 Å²	82	75 Å²	75	38%	0.38	35%	0.354	S	S	.	.	H	α-helix	trans	-60.5	-44.6	173.4	-179.8	-105.9	0	0	0	111.7	Q227 L228 Y229 L233 R234 Q235	Q227-H231 WeakPolarHBondContact O-CB 3.43Å; Q227-H231 PolarHBondContact O-N 3.34Å; Q227-H231 VanDerWaalsContact O-N 3.07Å; L228-H231 WeakPolarHBondContact O-CB 3.22Å; L228-H231 PolarHBondContact O-N 2.94Å; Y229-H231 VanDerWaalsContact C-N 3.28Å; Y229-H231 PolarHBondContact O-N 3.22Å; H231-L233 PolarHBondContact O-N 2.88Å; H231-R234 WeakPolarHBondContact O-CB 3.3Å; H231-R234 PolarHBondContact O-N 3.38Å; H231-Q235 PolarHBondContact CE1-NE2 3.03Å; H231-Q235 WeakPolarHBondContact O-CG 3.38Å; H231-Q235 PolarHBondContact O-N 3.07Å
232	M	84.6	Confident	82.3	Confident	41 Å²	41	76.3 Å²	76.3	20%	0.202	38%	0.375	C	S	.	.	H	α-helix	trans	-64.3	-37.9	175.5	-69.9	-65.4	-68.6	0	0	112.7	F168 L228 Y229 R234 Q235 R236	F168-M232 HydrophobicContact CB-CE 4.32Å; F168-M232 HydrophobicContact CD1-CE 4.41Å; F168-M232 HydrophobicContact CD2-CB 3.74Å; F168-M232 HydrophobicContact CD2-CG 4.48Å; F168-M232 HydrophobicContact CE2-CB 3.55Å; F168-M232 HydrophobicContact CG-CB 4.37Å; F168-M232 HydrophobicContact CG-CE 4.21Å; F168-M232 HydrophobicContact CZ-CB 4.02Å; L228-M232 WeakPolarHBondContact O-CG 3.35Å; L228-M232 PolarHBondContact O-N 3.48Å; L228-M232 VanDerWaalsContact O-N 3.09Å; Y229-M232 PolarHBondContact O-N 2.89Å; Y229-M232 VanDerWaalsContact O-N 3.16Å; M232-R234 PolarHBondContact O-N 3.05Å; M232-Q235 PolarHBondContact O-N 3.29Å; M232-Q235 PolarHBondContact SD-OE1 3.42Å; M232-R236 WeakPolarHBondContact O-CB 3.08Å; M232-R236 PolarHBondContact O-N 2.88Å
233	L	86.3	Confident	80.5	Confident	47 Å²	47	76.5 Å²	76.5	25%	0.246	37%	0.373	C	S	.	.	H	α-helix	trans	-63.1	-39.6	173.5	-74.2	169.7	0	0	0	112.4	F168 Y229 L230 H231 R236 R237	F168-L233 HydrophobicContact CE2-CD2 4.11Å; F168-L233 HydrophobicContact CE2-CG 4.13Å; F168-L233 HydrophobicContact CZ-CD2 3.83Å; F168-L233 HydrophobicContact CZ-CG 4.18Å; Y229-L233 HydrophobicContact CD1-CD1 3.79Å; Y229-L233 HydrophobicContact CD1-CG 4.46Å; Y229-L233 HydrophobicContact CE1-CD1 3.51Å; Y229-L233 HydrophobicContact CE1-CG 4.19Å; Y229-L233 PolarHBondContact O-N 3.47Å; L230-L233 HydrophobicContact CD2-CD1 4.22Å; L230-L233 PolarHBondContact O-N 2.89Å; H231-L233 PolarHBondContact O-N 2.88Å; L233-R236 WeakPolarHBondContact O-CB 3.36Å; L233-R236 PolarHBondContact O-N 2.86Å; L233-R237 PolarHBondContact O-N 2.79Å; L233-R237 VanDerWaalsContact O-N 3.07Å
234	R	83.8	Confident	78.4	Confident	125 Å²	125	78.9 Å²	78.9	47%	0.472	39%	0.386	S	S	.	.	H	α-helix	trans	-63.5	-43.5	172.8	-69	175.4	-166.5	137.9	1.3	111.2	L230 H231 M232 R236 R237 R238	L230-R234 WeakPolarHBondContact O-CG 3.36Å; L230-R234 PolarHBondContact O-N 3.28Å; H231-R234 WeakPolarHBondContact O-CB 3.3Å; H231-R234 PolarHBondContact O-N 3.38Å; M232-R234 PolarHBondContact O-N 3.05Å; R234-R236 VanDerWaalsContact C-N 3.33Å; R234-R236 PolarHBondContact O-N 3.42Å; R234-R237 PolarHBondContact O-N 3.5Å; R234-R238 WeakPolarHBondContact O-CG 3.23Å; R234-R238 PolarHBondContact O-N 3.42Å; R234-R238 VanDerWaalsContact O-N 3.08Å
235	Q	82.3	Confident	76.6	Confident	55 Å²	55	80.3 Å²	80.3	26%	0.257	39%	0.393	S	S	.	.	H	α-helix	trans	-61.8	-40.8	176	-70.3	-172.9	-13.4	0	0	112.2	Y165 H231 M232 R238 V239	Y165-Q235 HydrophobicContact CE1-CB 4.09Å; H231-Q235 PolarHBondContact CE1-NE2 3.03Å; H231-Q235 WeakPolarHBondContact O-CG 3.38Å; H231-Q235 PolarHBondContact O-N 3.07Å; M232-Q235 PolarHBondContact O-N 3.29Å; M232-Q235 PolarHBondContact SD-OE1 3.42Å; Q235-R238 PolarHBondContact O-N 3.08Å; Q235-V239 WeakPolarHBondContact O-CG2 3.32Å; Q235-V239 PolarHBondContact O-N 2.65Å
236	R	84.2	Confident	74.4	Confident	54 Å²	54	83.4 Å²	83.4	20%	0.204	42%	0.417	C	S	.	.	H	α-helix	trans	-57.5	-49.8	174.3	178.9	-176.5	-175.2	-84.1	0.6	111.5	Y165 N166 F168 M232 L233 R234 R238 V239 L240 H241	Y165-R236 HydrophobicContact CD1-CB 4.07Å; Y165-R236 WeakPolarHBondContact O-CD 3.43Å; Y165-R236 PolarHBondContact O-NE 3.3Å; N166-R236 PolarHBondContact OD1-NH2 2.85Å; F168-R236 HydrophobicContact CE1-CB 4.1Å; F168-R236 HydrophobicContact CE1-CG 4.44Å; F168-R236 HydrophobicContact CZ-CB 4.25Å; M232-R236 WeakPolarHBondContact O-CB 3.08Å; M232-R236 PolarHBondContact O-N 2.88Å; L233-R236 WeakPolarHBondContact O-CB 3.36Å; L233-R236 PolarHBondContact O-N 2.86Å; R234-R236 VanDerWaalsContact C-N 3.33Å; R234-R236 PolarHBondContact O-N 3.42Å; R236-R238 PolarHBondContact O-N 2.86Å; R236-V239 PolarHBondContact O-N 3.49Å; R236-L240 HydrophobicContact CG-CD1 3.98Å; R236-L240 HydrophobicContact CG-CG 4.49Å; R236-L240 WeakPolarHBondContact O-CB 3.37Å; R236-L240 PolarHBondContact O-N 3.22Å; R236-H241 PolarHBondContact NH1-CE1 3.49Å; R236-H241 VanDerWaalsContact NH1-CE1 3.3Å
237	R	82.1	Confident	72.2	Confident	119 Å²	119	88.2 Å²	88.2	45%	0.449	43%	0.434	S	S	.	.	H	α-helix	trans	-58.4	-46.5	178.1	-77.9	-169	-75.2	-124.3	0.1	111.8	L233 R234 V239 H241 G242	L233-R237 PolarHBondContact O-N 2.79Å; L233-R237 VanDerWaalsContact O-N 3.07Å; R234-R237 PolarHBondContact O-N 3.5Å; R237-V239 PolarHBondContact O-N 3.24Å; R237-H241 CarbonylContact O-C 3.56Å; R237-H241 WeakPolarHBondContact O-CA 3.42Å; R237-H241 WeakPolarHBondContact O-CB 3.38Å; R237-H241 PolarHBondContact O-N 3.46Å; R237-G242 PolarHBondContact O-N 3.24Å
238	R	80.6	Confident	70.1	Confident	137 Å²	137	90.2 Å²	90.2	52%	0.517	44%	0.441	S	S	.	.	H	α-helix	trans	-60.2	-46.1	178.5	-70.5	178.7	-175	178.9	-2	112.9	R234 Q235 R236 G242 I245	R234-R238 WeakPolarHBondContact O-CG 3.23Å; R234-R238 PolarHBondContact O-N 3.42Å; R234-R238 VanDerWaalsContact O-N 3.08Å; Q235-R238 PolarHBondContact O-N 3.08Å; R236-R238 PolarHBondContact O-N 2.86Å; R238-G242 PolarHBondContact O-N 3.11Å; R238-I245 VanDerWaalsContact NE-CD1 3.3Å
239	V	79	Confident	68.1	Low	62 Å²	62	95.7 Å²	95.7	38%	0.376	47%	0.471	S	S	.	.	H	α-helix	trans	-86.9	-35.2	-171	178.3	0	0	0	0	113.4	K161 Y165 Q235 R236 R237	K161-V239 HydrophobicContact CD-CG1 4.33Å; Y165-V239 HydrophobicContact CD2-CG1 4.23Å; Y165-V239 HydrophobicContact CE1-CB 4.44Å; Y165-V239 HydrophobicContact CE1-CG2 4.5Å; Y165-V239 HydrophobicContact CE2-CB 3.97Å; Y165-V239 HydrophobicContact CE2-CG1 3.58Å; Y165-V239 HydrophobicContact CE2-CG2 4.39Å; Q235-V239 WeakPolarHBondContact O-CG2 3.32Å; Q235-V239 PolarHBondContact O-N 2.65Å; R236-V239 PolarHBondContact O-N 3.49Å; R237-V239 PolarHBondContact O-N 3.24Å
240	L	77.1	Confident	65.7	Low	46 Å²	46	103.3 Å²	103.3	24%	0.241	51%	0.514	C	S	.	.	H	α-helix	trans	-95.5	-32.1	-178.1	-67.1	-173	0	0	0	113.8	K161 Y165 R236	K161-L240 HydrophobicContact CD-CD2 4.21Å; K161-L240 HydrophobicContact CG-CD2 4.14Å; Y165-L240 HydrophobicContact CD2-CD2 4.44Å; Y165-L240 HydrophobicContact CD2-CG 4.43Å; Y165-L240 HydrophobicContact CG-CD1 4.47Å; Y165-L240 HydrophobicContact CG-CG 4.36Å; R236-L240 HydrophobicContact CG-CD1 3.98Å; R236-L240 HydrophobicContact CG-CG 4.49Å; R236-L240 WeakPolarHBondContact O-CB 3.37Å; R236-L240 PolarHBondContact O-N 3.22Å
241	H	72.9	Confident	64.7	Low	112 Å²	112	104.3 Å²	104.3	52%	0.519	52%	0.518	S	S	.	.	S	Bend	trans	-104.8	-4.7	-177.4	-55	160.8	0	0	0	113.2	R236 R237 E243	R236-H241 PolarHBondContact NH1-CE1 3.49Å; R236-H241 VanDerWaalsContact NH1-CE1 3.3Å; R237-H241 CarbonylContact O-C 3.56Å; R237-H241 WeakPolarHBondContact O-CA 3.42Å; R237-H241 WeakPolarHBondContact O-CB 3.38Å; R237-H241 PolarHBondContact O-N 3.46Å; H241-E243 PolarHBondContact O-N 3.29Å
242	G	59.8	Low	63.7	Low	53 Å²	53	105.5 Å²	105.5	55%	0.546	53%	0.526	S	S	.	.			trans	65.2	23.1	171.7	0	0	0	0	0	114.7	R237 R238 V244	R237-G242 PolarHBondContact O-N 3.24Å; R238-G242 PolarHBondContact O-N 3.11Å; G242-V244 VanDerWaalsContact C-N 3.33Å; G242-V244 PolarHBondContact O-N 3.4Å
243	E	49	Very low	62.5	Low	121 Å²	121	109.1 Å²	109.1	57%	0.565	54%	0.544	S	S	*	.			trans	-62.5	97.2	171.8	-81.3	-178.7	163.8	0	0	109.2	H241 I245	H241-E243 PolarHBondContact O-N 3.29Å; E243-I245 PolarHBondContact O-N 3.15Å; E243-I245 VanDerWaalsContact O-N 3.13Å
244	V	44.5	Very low	61.1	Low	125 Å²	125	112.7 Å²	112.7	76%	0.758	56%	0.561	S	S	*	*			trans	-58.9	109.5	156.9	-179.3	0	0	0	0	104.8	G242 V246	G242-V244 VanDerWaalsContact C-N 3.33Å; G242-V244 PolarHBondContact O-N 3.4Å; V244-V246 VanDerWaalsContact C-N 3.29Å; V244-V246 PolarHBondContact O-N 3.34Å
245	I	45	Very low	59.7	Low	99 Å²	99	111.9 Å²	111.9	51%	0.508	57%	0.567	S	S	.	*			trans	-63.3	104.6	166.9	-62.3	173.7	0	0	0	104.2	R238 E243 E247	R238-I245 VanDerWaalsContact NE-CD1 3.3Å; E243-I245 PolarHBondContact O-N 3.15Å; E243-I245 VanDerWaalsContact O-N 3.13Å; I245-E247 PolarHBondContact O-N 3.05Å
246	V	40.5	Very low	58.2	Low	122 Å²	122	115.7 Å²	115.7	74%	0.739	59%	0.587	S	S	*	*			trans	-58.9	101.7	155.4	178.7	0	0	0	0	103.5	V244 K248	V244-V246 VanDerWaalsContact C-N 3.29Å; V244-V246 PolarHBondContact O-N 3.34Å; V246-K248 PolarHBondContact O-N 3.02Å
247	E	38.8	Very low	56.3	Low	157 Å²	157	120.1 Å²	120.1	73%	0.734	62%	0.615	S	S	*	*			trans	-51.9	111.5	161.3	-100.9	173.1	153.8	0	0	105	I245 D249	I245-E247 PolarHBondContact O-N 3.05Å; E247-D249 PolarHBondContact O-N 3.39Å
248	K	41.9	Very low	54.4	Low	173 Å²	173	120.2 Å²	120.2	75%	0.752	63%	0.628	S	S	*	*			trans	-68.1	96.9	159.4	-103.8	-173.7	162.2	-155.4	0	104.6	V246 D250	V246-K248 PolarHBondContact O-N 3.02Å; K248-D250 VanDerWaalsContact C-N 3.28Å; K248-D250 IonicContact NZ-OD2 3.88Å; K248-D250 PolarHBondContact O-N 3.03Å; K248-D250 VanDerWaalsContact O-N 3.11Å
249	D	41.6	Very low	52.2	Low	149 Å²	149	118.8 Å²	118.8	80%	0.797	64%	0.637	S	S	*	*			trans	-61.2	98.7	153.1	-71.7	-36	0	0	0	106.2	E247	E247-D249 PolarHBondContact O-N 3.39Å
250	D	36.1	Very low	49.7	Very low	207 Å²	207	124 Å²	124	100%	1.107	66%	0.66	S	S	*	*			trans	-120.3	0	160	-75.8	-41	0	0	0	107.5	K248	K248-D250 VanDerWaalsContact C-N 3.28Å; K248-D250 IonicContact NZ-OD2 3.88Å; K248-D250 PolarHBondContact O-N 3.03Å; K248-D250 VanDerWaalsContact O-N 3.11Å

Retrieved 250 of 250 residues in 122.1 ms (Link to these results)

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