A0A060WI26_ONCMY Loading...

Gap junction protein

One gap junction consists of a cluster of closely packed pairs of transmembrane channels, the connexons, through which materials of low MW diffuse from one cell to a neighboring cell.

AlphaFold DB , UniProt , Accession A0A060WI26, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110537274, Length 254 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43.4	Very low	40.7	Very low	238 Å²	238	155.2 Å²	155.2	100%	1.172	85%	0.85	S	S	*	*				0	97	0	-165.2	162.4	-169.2	0	0	107.3
2	P	37.3	Very low	40.9	Very low	123 Å²	123	155.8 Å²	155.8	80%	0.799	84%	0.843	S	S	*	*			trans	-89.9	128.5	176.9	15.8	1.3	0	0	0	109.7
3	L	44.8	Very low	41.2	Very low	178 Å²	178	151.7 Å²	151.7	93%	0.932	83%	0.833	S	S	*	*			trans	-78	115.4	169.4	-74.7	156.6	0	0	0	108.4
4	T	44.5	Very low	41.5	Very low	128 Å²	128	154.3 Å²	154.3	79%	0.785	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-82.3	142.1	165.6	44.4	0	0	0	0	109.8
5	P	43.7	Very low	41.9	Very low	110 Å²	110	152.4 Å²	152.4	71%	0.714	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-72.9	160.9	-178.1	31.5	-34.4	0	0	0	112
6	P	41.5	Very low	42.9	Very low	123 Å²	123	149.5 Å²	149.5	80%	0.799	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-71	135.7	-179.6	28.8	-32.1	0	0	0	111.2	E8	P6-E8 PolarHBondContact O-N 3.47Å; P6-E8 VanDerWaalsContact O-N 3.17Å
7	D	37.1	Very low	43.6	Very low	163 Å²	163	149.2 Å²	149.2	87%	0.872	79%	0.787	S	S	*	*			trans	-54.5	115.2	173.4	-72.1	-52.5	0	0	0	110.6	L9	D7-L9 PolarHBondContact O-N 3.42Å
8	E	37.4	Very low	44.1	Very low	191 Å²	191	145.1 Å²	145.1	89%	0.893	78%	0.778	S	S	*	*			trans	-60.7	120.2	166.6	-120.2	173.4	146.2	0	0	108.2	P6 D10	P6-E8 PolarHBondContact O-N 3.47Å; P6-E8 VanDerWaalsContact O-N 3.17Å; E8-D10 PolarHBondContact O-N 3.13Å
9	L	37.9	Very low	44.6	Very low	152 Å²	152	140.9 Å²	140.9	80%	0.796	76%	0.761	S	S	*	*			trans	-65.9	97.3	179.9	-149.8	106.8	0	0	0	108.3	D7 L11	D7-L9 PolarHBondContact O-N 3.42Å; L9-L11 HydrophobicContact CD2-CD1 4.38Å; L9-L11 PolarHBondContact O-N 3.01Å
10	D	41.1	Very low	45.1	Very low	151 Å²	151	138.1 Å²	138.1	81%	0.807	74%	0.742	S	S	*	*			trans	-60.3	80.3	169.3	-110.9	-17.5	0	0	0	109.5	E8 E12	E8-D10 PolarHBondContact O-N 3.13Å; D10-E12 PolarHBondContact O-N 3.46Å
11	L	39.1	Very low	45.5	Very low	150 Å²	150	138.6 Å²	138.6	79%	0.785	73%	0.734	S	S	*	*			trans	-87.4	39.6	166.7	-158.9	89.6	0	0	0	109.6	L9 S13	L9-L11 HydrophobicContact CD2-CD1 4.38Å; L9-L11 PolarHBondContact O-N 3.01Å; L11-S13 PolarHBondContact O-N 3.37Å; L11-S13 VanDerWaalsContact O-N 3.16Å
12	E	43	Very low	46.1	Very low	163 Å²	163	130 Å²	130	76%	0.762	70%	0.701	S	S	*	*			trans	-72.5	107.7	163.3	-157.5	-177.5	117	0	0	106.9	D10 K14	D10-E12 PolarHBondContact O-N 3.46Å; E12-K14 PolarHBondContact O-N 3.03Å
13	S	45.4	Very low	47	Very low	102 Å²	102	127.2 Å²	127.2	71%	0.713	68%	0.682	S	S	*	*			trans	-50.5	105.1	179	61.6	0	0	0	0	110	L11 M15	L11-S13 PolarHBondContact O-N 3.37Å; L11-S13 VanDerWaalsContact O-N 3.16Å; S13-M15 PolarHBondContact O-N 3.48Å
14	K	44.8	Very low	47.6	Very low	188 Å²	188	121.3 Å²	121.3	82%	0.817	65%	0.651	S	S	*	*			trans	-64	78.4	162.6	-73.4	179.7	-179.5	170	0	108.3	E12 N16	E12-K14 PolarHBondContact O-N 3.03Å; K14-N16 VanDerWaalsContact C-N 3.3Å; K14-N16 PolarHBondContact O-N 2.98Å
15	M	47	Very low	48	Very low	126 Å²	126	118.5 Å²	118.5	62%	0.621	64%	0.636	S	S	*	*			trans	-56.4	106.9	151.7	-127.2	175.3	64.4	0	0	104.3	S13 W17	S13-M15 PolarHBondContact O-N 3.48Å; M15-W17 HydrophobicContact CE-CZ2 4.47Å; M15-W17 PolarHBondContact O-N 3.13Å
16	N	58.4	Low	48.2	Very low	106 Å²	106	115.2 Å²	115.2	57%	0.567	62%	0.622	S	S	*	*			trans	-63.8	84.6	-178.3	-85.2	-37	0	0	0	108.6	K14 A18 S19 F20	K14-N16 VanDerWaalsContact C-N 3.3Å; K14-N16 PolarHBondContact O-N 2.98Å; N16-A18 PolarHBondContact O-N 3.28Å; N16-A18 VanDerWaalsContact O-N 3.15Å; N16-S19 WeakPolarHBondContact O-CA 3.39Å; N16-S19 WeakPolarHBondContact O-CB 3.38Å; N16-S19 PolarHBondContact O-N 3.49Å; N16-F20 PolarHBondContact O-N 3.01Å; N16-F20 VanDerWaalsContact O-N 3.11Å
17	W	54.2	Low	48.7	Very low	144 Å²	144	111.4 Å²	111.4	55%	0.545	60%	0.596	S	S	.	*	H	α-helix	trans	-53.7	-34.5	176.7	-87	99.2	0	0	0	110.3	M15 S19 F20 Y21	M15-W17 HydrophobicContact CE-CZ2 4.47Å; M15-W17 PolarHBondContact O-N 3.13Å; W17-S19 VanDerWaalsContact C-N 3.32Å; W17-S19 PolarHBondContact O-N 2.97Å; W17-F20 AromaticContact CE3-CD1 3.81Å; W17-F20 HydrophobicContact CE3-CD1 3.81Å; W17-F20 HydrophobicContact CE3-CE1 4.39Å; W17-F20 AromaticContact CZ3-CD1 3.71Å; W17-F20 HydrophobicContact CZ3-CD1 3.71Å; W17-F20 AromaticContact CZ3-CE1 3.82Å; W17-F20 HydrophobicContact CZ3-CE1 3.82Å; W17-F20 PolarHBondContact O-N 2.92Å; W17-Y21 HydrophobicContact CB-CD2 4.28Å; W17-Y21 HydrophobicContact CB-CE2 4.41Å; W17-Y21 HydrophobicContact CE3-CD2 4.17Å; W17-Y21 AromaticContact CE3-CE2 3.68Å; W17-Y21 HydrophobicContact CE3-CE2 3.68Å; W17-Y21 HydrophobicContact CZ3-CE2 4.37Å; W17-Y21 WeakPolarHBondContact O-CB 3.49Å; W17-Y21 WeakPolarHBondContact O-CD2 3.23Å; W17-Y21 PolarHBondContact O-N 2.69Å
18	A	53	Low	49.1	Very low	75 Å²	75	107.8 Å²	107.8	62%	0.62	58%	0.577	S	S	*	*	H	α-helix	trans	-58.3	-39.4	172.2	0	0	0	0	0	113.5	N16 A22	N16-A18 PolarHBondContact O-N 3.28Å; N16-A18 VanDerWaalsContact O-N 3.15Å; A18-A22 VanDerWaalsContact O-CB 3.23Å; A18-A22 WeakPolarHBondContact O-CB 3.46Å; A18-A22 PolarHBondContact O-N 3.49Å
19	S	54.1	Low	49.5	Very low	67 Å²	67	106.6 Å²	106.6	47%	0.469	56%	0.564	S	S	.	*	H	α-helix	trans	-70.8	-40	175.2	-59	0	0	0	0	111.5	N16 W17 A22 V23	N16-S19 WeakPolarHBondContact O-CA 3.39Å; N16-S19 WeakPolarHBondContact O-CB 3.38Å; N16-S19 PolarHBondContact O-N 3.49Å; W17-S19 VanDerWaalsContact C-N 3.32Å; W17-S19 PolarHBondContact O-N 2.97Å; S19-A22 PolarHBondContact O-N 2.96Å; S19-V23 VanDerWaalsContact O-CG2 3.25Å; S19-V23 WeakPolarHBondContact O-CG2 3.36Å; S19-V23 PolarHBondContact O-N 2.94Å
20	F	54.3	Low	50	Low	84 Å²	84	101.1 Å²	101.1	37%	0.368	53%	0.534	S	S	.	.	H	α-helix	trans	-63.8	-46.4	174.4	-177	-110.3	0	0	0	111.9	N16 W17 A22 V23 I24	N16-F20 PolarHBondContact O-N 3.01Å; N16-F20 VanDerWaalsContact O-N 3.11Å; W17-F20 AromaticContact CE3-CD1 3.81Å; W17-F20 HydrophobicContact CE3-CD1 3.81Å; W17-F20 HydrophobicContact CE3-CE1 4.39Å; W17-F20 AromaticContact CZ3-CD1 3.71Å; W17-F20 HydrophobicContact CZ3-CD1 3.71Å; W17-F20 AromaticContact CZ3-CE1 3.82Å; W17-F20 HydrophobicContact CZ3-CE1 3.82Å; W17-F20 PolarHBondContact O-N 2.92Å; F20-A22 VanDerWaalsContact C-N 3.33Å; F20-A22 PolarHBondContact O-N 3.39Å; F20-V23 PolarHBondContact O-N 2.95Å; F20-I24 HydrophobicContact CD1-CD1 3.68Å; F20-I24 HydrophobicContact CD2-CD1 4.32Å; F20-I24 HydrophobicContact CE1-CD1 3.21Å; F20-I24 HydrophobicContact CE1-CG1 4.4Å; F20-I24 HydrophobicContact CE2-CD1 3.91Å; F20-I24 HydrophobicContact CE2-CG1 4.47Å; F20-I24 HydrophobicContact CG-CD1 4.23Å; F20-I24 HydrophobicContact CZ-CD1 3.36Å; F20-I24 HydrophobicContact CZ-CG1 4.36Å; F20-I24 WeakPolarHBondContact O-CB 3.43Å; F20-I24 WeakPolarHBondContact O-CG1 3.42Å; F20-I24 PolarHBondContact O-N 3.1Å
21	Y	52.6	Low	49.9	Very low	149 Å²	149	96.3 Å²	96.3	58%	0.584	51%	0.513	S	S	*	.	H	α-helix	trans	-61.6	-37.6	172.7	-85.3	-70.6	0	0	0	112.3	W17 S25	W17-Y21 HydrophobicContact CB-CD2 4.28Å; W17-Y21 HydrophobicContact CB-CE2 4.41Å; W17-Y21 HydrophobicContact CE3-CD2 4.17Å; W17-Y21 AromaticContact CE3-CE2 3.68Å; W17-Y21 HydrophobicContact CE3-CE2 3.68Å; W17-Y21 HydrophobicContact CZ3-CE2 4.37Å; W17-Y21 WeakPolarHBondContact O-CB 3.49Å; W17-Y21 WeakPolarHBondContact O-CD2 3.23Å; W17-Y21 PolarHBondContact O-N 2.69Å; Y21-S25 WeakPolarHBondContact O-CB 3.46Å; Y21-S25 PolarHBondContact O-N 3.23Å; Y21-S25 PolarHBondContact O-OG 3.45Å; Y21-S25 VanDerWaalsContact O-OG 3.1Å
22	A	56.7	Low	50.2	Low	58 Å²	58	93.5 Å²	93.5	48%	0.479	50%	0.502	S	S	.	.	H	α-helix	trans	-66.5	-39.9	174.9	0	0	0	0	0	112	A18 S19 F20 S25 G26	A18-A22 VanDerWaalsContact O-CB 3.23Å; A18-A22 WeakPolarHBondContact O-CB 3.46Å; A18-A22 PolarHBondContact O-N 3.49Å; S19-A22 PolarHBondContact O-N 2.96Å; F20-A22 VanDerWaalsContact C-N 3.33Å; F20-A22 PolarHBondContact O-N 3.39Å; A22-S25 PolarHBondContact O-OG 3.47Å; A22-G26 PolarHBondContact O-N 2.95Å
23	V	56.8	Low	50.8	Low	64 Å²	64	87.9 Å²	87.9	39%	0.388	49%	0.488	S	S	.	.	H	α-helix	trans	-66.7	-47.8	175.5	170.9	0	0	0	0	110.7	S19 F20 G26 V27 L103	S19-V23 VanDerWaalsContact O-CG2 3.25Å; S19-V23 WeakPolarHBondContact O-CG2 3.36Å; S19-V23 PolarHBondContact O-N 2.94Å; F20-V23 PolarHBondContact O-N 2.95Å; V23-G26 PolarHBondContact O-N 3.31Å; V23-V27 WeakPolarHBondContact O-CG2 3.41Å; V23-V27 PolarHBondContact O-N 2.69Å; V23-V27 VanDerWaalsContact O-N 3.13Å; V23-L103 HydrophobicContact CG1-CD2 3.47Å; V23-L103 VanDerWaalsContact CG1-CD2 3.47Å
24	I	56.9	Low	51.2	Low	54 Å²	54	89 Å²	89	28%	0.277	49%	0.485	S	S	.	.	H	α-helix	trans	-63.2	-45.3	177.8	-70.4	179.9	0	0	0	111.5	F20 G26 V27 N28	F20-I24 HydrophobicContact CD1-CD1 3.68Å; F20-I24 HydrophobicContact CD2-CD1 4.32Å; F20-I24 HydrophobicContact CE1-CD1 3.21Å; F20-I24 HydrophobicContact CE1-CG1 4.4Å; F20-I24 HydrophobicContact CE2-CD1 3.91Å; F20-I24 HydrophobicContact CE2-CG1 4.47Å; F20-I24 HydrophobicContact CG-CD1 4.23Å; F20-I24 HydrophobicContact CZ-CD1 3.36Å; F20-I24 HydrophobicContact CZ-CG1 4.36Å; F20-I24 WeakPolarHBondContact O-CB 3.43Å; F20-I24 WeakPolarHBondContact O-CG1 3.42Å; F20-I24 PolarHBondContact O-N 3.1Å; I24-G26 VanDerWaalsContact C-N 3.3Å; I24-G26 PolarHBondContact O-N 2.82Å; I24-V27 PolarHBondContact O-N 3.07Å; I24-N28 PolarHBondContact O-N 3.47Å
25	S	52.3	Low	51.7	Low	68 Å²	68	81 Å²	81	48%	0.476	46%	0.455	S	S	.	.	H	α-helix	trans	-68.6	-30.6	178.4	76	0	0	0	0	112.5	Y21 A22 V27 N28 R29	Y21-S25 WeakPolarHBondContact O-CB 3.46Å; Y21-S25 PolarHBondContact O-N 3.23Å; Y21-S25 PolarHBondContact O-OG 3.45Å; Y21-S25 VanDerWaalsContact O-OG 3.1Å; A22-S25 PolarHBondContact O-OG 3.47Å; S25-V27 VanDerWaalsContact C-N 3.35Å; S25-N28 PolarHBondContact O-N 3.26Å; S25-R29 PolarHBondContact O-N 3Å
26	G	48.6	Very low	52.5	Low	41 Å²	41	76.6 Å²	76.6	42%	0.423	43%	0.432	S	S	.	.	H	α-helix	trans	-64.4	-36.9	174	0	0	0	0	0	112.8	A22 V23 I24 N28	A22-G26 PolarHBondContact O-N 2.95Å; V23-G26 PolarHBondContact O-N 3.31Å; I24-G26 VanDerWaalsContact C-N 3.3Å; I24-G26 PolarHBondContact O-N 2.82Å; G26-N28 VanDerWaalsContact C-N 3.33Å
27	V	52.6	Low	52.9	Low	43 Å²	43	75.5 Å²	75.5	26%	0.261	43%	0.425	S	S	.	.	H	α-helix	trans	-67.2	-35.2	174.5	174.7	0	0	0	0	111.3	V23 I24 S25 R36 A106	V23-V27 WeakPolarHBondContact O-CG2 3.41Å; V23-V27 PolarHBondContact O-N 2.69Å; V23-V27 VanDerWaalsContact O-N 3.13Å; I24-V27 PolarHBondContact O-N 3.07Å; S25-V27 VanDerWaalsContact C-N 3.35Å; V27-R36 WeakPolarHBondContact O-CD 3.05Å; V27-A106 HydrophobicContact CG2-CB 3.9Å
28	N	45.8	Very low	53.6	Low	87 Å²	87	75.7 Å²	75.7	47%	0.465	43%	0.426	S	S	.	.	H	α-helix	trans	-81.4	-19	-171	-153.6	16.3	0	0	0	115	I24 S25 G26	I24-N28 PolarHBondContact O-N 3.47Å; S25-N28 PolarHBondContact O-N 3.26Å; G26-N28 VanDerWaalsContact C-N 3.33Å
29	R	44.1	Very low	54.4	Low	167 Å²	167	72.4 Å²	72.4	63%	0.63	40%	0.398	S	S	*	.	S	Bend	trans	-89.4	-6.2	-162.1	-163	156.7	163.2	153.3	-5.5	117	S25	S25-R29 PolarHBondContact O-N 3Å
30	H	48.7	Very low	55.5	Low	36 Å²	36	70.4 Å²	70.4	17%	0.167	38%	0.384	C	S	.	.	S	Bend	trans	-148.5	64.1	-166.7	-60.9	-66.9	0	0	0	117.4	R36 R113	H30-R36 PolarHBondContact O-NH1 3.41Å; H30-R113 PolarHBondContact CD2-NH2 2.49Å; H30-R113 PolarHBondContact CE1-NH2 3.13Å; H30-R113 VanDerWaalsContact CE1-NH2 3.29Å; H30-R113 PolarHBondContact NE2-NH1 2.96Å; H30-R113 VanDerWaalsContact NE2-NH1 3.17Å; H30-R113 PolarHBondContact NE2-NH2 3.01Å
31	S	39.5	Very low	56.7	Low	50 Å²	50	70.1 Å²	70.1	35%	0.35	39%	0.389	S	S	.	.	S	Bend	trans	177.6	152	138.4	-148.6	0	0	0	0	110.9	G33 I141	S31-G33 PolarHBondContact O-N 3.39Å; S31-I141 WeakPolarHBondContact OG-CD1 3.28Å
32	T	45.2	Very low	58.1	Low	92 Å²	92	63.9 Å²	63.9	56%	0.564	37%	0.365	S	S	*	.			trans	-31.9	118.6	171	49.3	0	0	0	0	112.4
33	G	56.1	Low	59.4	Low	44 Å²	44	64 Å²	64	45%	0.454	36%	0.355	S	S	.	.	S	Bend	cis	170.5	-29.1	2.7	0	0	0	0	0	108.7	S31 I37	S31-G33 PolarHBondContact O-N 3.39Å; G33-I37 VanDerWaalsContact O-CD1 3.32Å; G33-I37 WeakPolarHBondContact O-CD1 3.43Å
34	I	53	Low	60.8	Low	127 Å²	127	64.4 Å²	64.4	65%	0.651	35%	0.354	S	S	*	.	S	Bend	trans	-116.3	-56.2	178	-74.1	160.2	0	0	0	111	R36 I37 W38	I34-R36 VanDerWaalsContact C-N 3.33Å; I34-R36 PolarHBondContact O-N 3.06Å; I34-I37 PolarHBondContact O-N 3.04Å; I34-W38 PolarHBondContact O-N 3.22Å; I34-W38 VanDerWaalsContact O-N 3.09Å
35	G	56.9	Low	62.2	Low	20 Å²	20	65.5 Å²	65.5	21%	0.206	36%	0.357	C	S	.	.	H	α-helix	trans	-57	-38.4	-176.8	0	0	0	0	0	115.1	L39	G35-L39 WeakPolarHBondContact O-CB 3.43Å; G35-L39 WeakPolarHBondContact O-CD1 3.42Å; G35-L39 WeakPolarHBondContact O-CG 3.45Å; G35-L39 PolarHBondContact O-N 3.43Å
36	R	61.8	Low	64	Low	32 Å²	32	62.4 Å²	62.4	12%	0.121	34%	0.335	C	S	.	.	H	α-helix	trans	-75.6	-36.7	-176.9	-159.7	-179.1	-64.8	-161.1	-3.1	114.6	V27 H30 I34 S40 Y149	V27-R36 WeakPolarHBondContact O-CD 3.05Å; H30-R36 PolarHBondContact O-NH1 3.41Å; I34-R36 VanDerWaalsContact C-N 3.33Å; I34-R36 PolarHBondContact O-N 3.06Å; R36-S40 WeakPolarHBondContact O-CB 3.47Å; R36-S40 PolarHBondContact O-N 3.45Å; R36-S40 VanDerWaalsContact O-N 3.08Å; R36-S40 PolarHBondContact O-OG 3.08Å; R36-Y149 PolarHBondContact NH2-OH 2.9Å; R36-Y149 VanDerWaalsContact NH2-OH 3.13Å
37	I	67.5	Low	66	Low	84 Å²	84	63.1 Å²	63.1	43%	0.431	33%	0.329	S	S	.	.	H	α-helix	trans	-68.7	-48.1	175.5	-62.1	178.7	0	0	0	108.4	G33 I34 L39 S40 V41	G33-I37 VanDerWaalsContact O-CD1 3.32Å; G33-I37 WeakPolarHBondContact O-CD1 3.43Å; I34-I37 PolarHBondContact O-N 3.04Å; I37-L39 PolarHBondContact O-N 3.22Å; I37-S40 PolarHBondContact O-N 3.16Å; I37-V41 HydrophobicContact CG2-CG2 4.33Å; I37-V41 WeakPolarHBondContact O-CB 3.46Å; I37-V41 VanDerWaalsContact O-CG2 3.28Å; I37-V41 WeakPolarHBondContact O-CG2 3.46Å; I37-V41 PolarHBondContact O-N 3.19Å
38	W	68.4	Low	67.8	Low	147 Å²	147	65.9 Å²	65.9	56%	0.557	34%	0.342	S	S	*	.	H	α-helix	trans	-62.8	-43.5	177.7	-79.1	92.4	0	0	0	112.3	I34 S40 V41 L42 L218	I34-W38 PolarHBondContact O-N 3.22Å; I34-W38 VanDerWaalsContact O-N 3.09Å; W38-S40 VanDerWaalsContact C-N 3.31Å; W38-S40 PolarHBondContact O-N 3.07Å; W38-V41 PolarHBondContact O-N 3.07Å; W38-L42 VanDerWaalsContact O-CB 3.32Å; W38-L42 WeakPolarHBondContact O-CB 3.28Å; W38-L42 WeakPolarHBondContact O-CG 3.26Å; W38-L42 PolarHBondContact O-N 3.48Å; W38-L218 HydrophobicContact CB-CD1 4.06Å
39	L	70.6	Confident	69.8	Low	7 Å²	7	62.6 Å²	62.6	4%	0.037	32%	0.324	C	S	.	.	H	α-helix	trans	-61.5	-38.1	175.2	-77	170.7	0	0	0	112.5	G35 I37 F43 C215 L218	G35-L39 WeakPolarHBondContact O-CB 3.43Å; G35-L39 WeakPolarHBondContact O-CD1 3.42Å; G35-L39 WeakPolarHBondContact O-CG 3.45Å; G35-L39 PolarHBondContact O-N 3.43Å; I37-L39 PolarHBondContact O-N 3.22Å; L39-F43 WeakPolarHBondContact O-CB 3.4Å; L39-F43 PolarHBondContact O-N 2.65Å; L39-C215 HydrophobicContact CD2-CB 4.23Å; L39-L218 HydrophobicContact CD2-CB 3.93Å; L39-L218 HydrophobicContact CD2-CD1 4.22Å; L39-L218 HydrophobicContact CG-CB 4.17Å; L39-L218 HydrophobicContact CG-CD1 4.36Å
40	S	76.5	Confident	72.1	Confident	24 Å²	24	55.9 Å²	55.9	17%	0.168	30%	0.301	C	S	.	.	H	α-helix	trans	-71.6	-42	177.9	-55.4	0	0	0	0	111.6	R36 I37 W38 F43 I44	R36-S40 WeakPolarHBondContact O-CB 3.47Å; R36-S40 PolarHBondContact O-N 3.45Å; R36-S40 VanDerWaalsContact O-N 3.08Å; R36-S40 PolarHBondContact O-OG 3.08Å; I37-S40 PolarHBondContact O-N 3.16Å; W38-S40 VanDerWaalsContact C-N 3.31Å; W38-S40 PolarHBondContact O-N 3.07Å; S40-F43 PolarHBondContact O-N 3.38Å; S40-I44 VanDerWaalsContact O-CG1 3.31Å; S40-I44 WeakPolarHBondContact O-CG1 3.47Å; S40-I44 PolarHBondContact O-N 3.38Å
41	V	79.6	Confident	74.1	Confident	78 Å²	78	58.1 Å²	58.1	47%	0.473	32%	0.317	S	S	.	.	H	α-helix	trans	-62.1	-49.8	175.8	169.6	0	0	0	0	110.5	I37 W38 F43 I44 F45	I37-V41 HydrophobicContact CG2-CG2 4.33Å; I37-V41 WeakPolarHBondContact O-CB 3.46Å; I37-V41 VanDerWaalsContact O-CG2 3.28Å; I37-V41 WeakPolarHBondContact O-CG2 3.46Å; I37-V41 PolarHBondContact O-N 3.19Å; W38-V41 PolarHBondContact O-N 3.07Å; V41-F43 VanDerWaalsContact C-N 3.27Å; V41-F43 PolarHBondContact O-N 2.9Å; V41-I44 PolarHBondContact O-N 2.99Å; V41-F45 WeakPolarHBondContact O-CB 3.45Å; V41-F45 PolarHBondContact O-N 3.02Å
42	L	83.1	Confident	76.5	Confident	19 Å²	19	59.7 Å²	59.7	10%	0.099	32%	0.324	C	S	.	.	H	α-helix	trans	-62	-37	177.9	-67.7	176.7	0	0	0	111.5	W38 R46 V211 I214 L218	W38-L42 VanDerWaalsContact O-CB 3.32Å; W38-L42 WeakPolarHBondContact O-CB 3.28Å; W38-L42 WeakPolarHBondContact O-CG 3.26Å; W38-L42 PolarHBondContact O-N 3.48Å; L42-R46 WeakPolarHBondContact O-CG 3.35Å; L42-R46 PolarHBondContact O-N 3.42Å; L42-V211 HydrophobicContact CB-CG1 4.12Å; L42-V211 HydrophobicContact CD2-CG1 4.11Å; L42-I214 HydrophobicContact CD1-CB 4.48Å; L42-I214 HydrophobicContact CD1-CG2 3.65Å; L42-L218 HydrophobicContact CD1-CD1 3.68Å
43	F	83.3	Confident	78.6	Confident	60 Å²	60	55.4 Å²	55.4	26%	0.263	30%	0.298	S	S	.	.	H	α-helix	trans	-66.2	-49.3	176.7	-178.4	-100.2	0	0	0	112.7	L39 S40 V41 F45 R46 I47 L95 S99	L39-F43 WeakPolarHBondContact O-CB 3.4Å; L39-F43 PolarHBondContact O-N 2.65Å; S40-F43 PolarHBondContact O-N 3.38Å; V41-F43 VanDerWaalsContact C-N 3.27Å; V41-F43 PolarHBondContact O-N 2.9Å; F43-F45 VanDerWaalsContact C-N 3.26Å; F43-F45 PolarHBondContact O-N 2.95Å; F43-R46 PolarHBondContact O-N 2.93Å; F43-I47 HydrophobicContact CD1-CD1 4.01Å; F43-I47 HydrophobicContact CE1-CD1 3.34Å; F43-I47 HydrophobicContact CE1-CG1 4.25Å; F43-I47 HydrophobicContact CZ-CD1 3.66Å; F43-I47 HydrophobicContact CZ-CG1 4.21Å; F43-I47 PolarHBondContact O-N 3.14Å; F43-I47 VanDerWaalsContact O-N 3.1Å; F43-L95 HydrophobicContact CD2-CD2 4.12Å; F43-L95 HydrophobicContact CE2-CD2 3.81Å; F43-S99 WeakPolarHBondContact CE2-OG 3.36Å; F43-S99 WeakPolarHBondContact CZ-OG 3.38Å
44	I	86	Confident	80.2	Confident	72 Å²	72	55 Å²	55	37%	0.369	29%	0.29	S	S	.	.	H	α-helix	trans	-57.7	-46.7	175.4	-70.3	165.6	0	0	0	109.8	S40 V41 R46 I47 L48	S40-I44 VanDerWaalsContact O-CG1 3.31Å; S40-I44 WeakPolarHBondContact O-CG1 3.47Å; S40-I44 PolarHBondContact O-N 3.38Å; V41-I44 PolarHBondContact O-N 2.99Å; I44-R46 VanDerWaalsContact C-N 3.32Å; I44-R46 PolarHBondContact O-N 3.09Å; I44-I47 WeakPolarHBondContact O-CB 3.42Å; I44-I47 PolarHBondContact O-N 2.96Å; I44-I47 VanDerWaalsContact O-N 3.08Å; I44-L48 HydrophobicContact CG2-CD1 4.18Å; I44-L48 HydrophobicContact CG2-CG 4.45Å; I44-L48 WeakPolarHBondContact O-CG 3.29Å; I44-L48 PolarHBondContact O-N 2.86Å
45	F	86.4	Confident	81.8	Confident	77 Å²	77	56.6 Å²	56.6	34%	0.338	30%	0.295	S	S	.	.	H	α-helix	trans	-65.2	-34.8	-178.2	173.7	-103.1	0	0	0	112.5	V41 F43 L48 V49 F207 V211	V41-F45 WeakPolarHBondContact O-CB 3.45Å; V41-F45 PolarHBondContact O-N 3.02Å; F43-F45 VanDerWaalsContact C-N 3.26Å; F43-F45 PolarHBondContact O-N 2.95Å; F45-L48 PolarHBondContact O-N 3.33Å; F45-V49 HydrophobicContact CD2-CG2 4.48Å; F45-V49 HydrophobicContact CE1-CG2 4.18Å; F45-V49 HydrophobicContact CE2-CG2 3.97Å; F45-V49 HydrophobicContact CZ-CG2 3.78Å; F45-V49 WeakPolarHBondContact O-CG2 3.43Å; F45-V49 PolarHBondContact O-N 3.22Å; F45-F207 HydrophobicContact CD1-CE1 4.24Å; F45-F207 HydrophobicContact CD1-CZ 4.35Å; F45-F207 HydrophobicContact CE1-CD1 4.46Å; F45-F207 AromaticContact CE1-CE1 3.09Å; F45-F207 HydrophobicContact CE1-CE1 3.09Å; F45-F207 HydrophobicContact CE1-CE2 4.37Å; F45-F207 AromaticContact CE1-CZ 3.04Å; F45-F207 HydrophobicContact CE1-CZ 3.04Å; F45-F207 AromaticContact CZ-CE1 3.33Å; F45-F207 HydrophobicContact CZ-CE1 3.33Å; F45-F207 HydrophobicContact CZ-CE2 4.32Å; F45-F207 AromaticContact CZ-CZ 3.13Å; F45-F207 HydrophobicContact CZ-CZ 3.13Å; F45-V211 HydrophobicContact CE1-CG2 4.41Å
46	R	90.4	Very high	83.3	Confident	4 Å²	4	58.3 Å²	58.3	2%	0.015	30%	0.304	C	S	.	.	H	α-helix	trans	-62.8	-40.2	168.9	-78.9	-168.9	-170	164.3	18.9	113.1	L42 F43 I44 L48 V49 L50 L95 E160 M208 V211 C215	L42-R46 WeakPolarHBondContact O-CG 3.35Å; L42-R46 PolarHBondContact O-N 3.42Å; F43-R46 PolarHBondContact O-N 2.93Å; I44-R46 VanDerWaalsContact C-N 3.32Å; I44-R46 PolarHBondContact O-N 3.09Å; R46-L48 VanDerWaalsContact C-N 3.34Å; R46-V49 PolarHBondContact O-N 3.28Å; R46-L50 VanDerWaalsContact O-CB 3.29Å; R46-L50 WeakPolarHBondContact O-CB 3.4Å; R46-L50 PolarHBondContact O-N 3.14Å; R46-L95 HydrophobicContact CB-CD1 4.29Å; R46-L95 HydrophobicContact CB-CD2 3.88Å; R46-L95 HydrophobicContact CG-CD2 4.47Å; R46-E160 IonicContact CZ-OE1 2.74Å; R46-E160 VanDerWaalsContact CZ-OE1 3.31Å; R46-E160 IonicContact NH1-OE1 3.78Å; R46-E160 PolarHBondContact NH1-OE1 3.11Å; R46-E160 IonicContact NH1-OE2 2.91Å; R46-E160 PolarHBondContact NH1-OE2 2.83Å; R46-E160 IonicContact NH2-OE1 3.14Å; R46-E160 PolarHBondContact NH2-OE1 3.38Å; R46-E160 IonicContact NH2-OE2 3.31Å; R46-M208 HydrophobicContact CB-CE 4.46Å; R46-M208 HydrophobicContact CG-CE 4.34Å; R46-M208 HydrophobicContact CG-SD 4.29Å; R46-V211 HydrophobicContact CG-CB 4.45Å; R46-V211 HydrophobicContact CG-CG1 3.78Å; R46-V211 VanDerWaalsContact NH2-C 3.35Å; R46-V211 PolarHBondContact NH2-O 3.06Å; R46-C215 PolarHBondContact NH2-SG 3.24Å
47	I	90.4	Very high	84.7	Confident	56 Å²	56	56.8 Å²	56.8	29%	0.287	30%	0.298	S	S	.	.	H	α-helix	trans	-61	-47.6	175.4	-67.8	169.2	0	0	0	109.7	F43 I44 V49 L50 V51 L95	F43-I47 HydrophobicContact CD1-CD1 4.01Å; F43-I47 HydrophobicContact CE1-CD1 3.34Å; F43-I47 HydrophobicContact CE1-CG1 4.25Å; F43-I47 HydrophobicContact CZ-CD1 3.66Å; F43-I47 HydrophobicContact CZ-CG1 4.21Å; F43-I47 PolarHBondContact O-N 3.14Å; F43-I47 VanDerWaalsContact O-N 3.1Å; I44-I47 WeakPolarHBondContact O-CB 3.42Å; I44-I47 PolarHBondContact O-N 2.96Å; I44-I47 VanDerWaalsContact O-N 3.08Å; I47-V49 PolarHBondContact O-N 3.35Å; I47-L50 PolarHBondContact O-N 2.9Å; I47-V51 HydrophobicContact CG2-CG2 4.28Å; I47-V51 WeakPolarHBondContact O-CG2 3.48Å; I47-V51 PolarHBondContact O-N 2.8Å; I47-L95 HydrophobicContact CG1-CD1 4.24Å
48	L	89.6	Confident	85.9	Confident	101 Å²	101	53.1 Å²	53.1	53%	0.529	28%	0.279	S	S	.	.	H	α-helix	trans	-58.1	-48.1	179.1	-67.1	173.8	0	0	0	111.5	I44 F45 R46 L50 V51 V52	I44-L48 HydrophobicContact CG2-CD1 4.18Å; I44-L48 HydrophobicContact CG2-CG 4.45Å; I44-L48 WeakPolarHBondContact O-CG 3.29Å; I44-L48 PolarHBondContact O-N 2.86Å; F45-L48 PolarHBondContact O-N 3.33Å; R46-L48 VanDerWaalsContact C-N 3.34Å; L48-L50 VanDerWaalsContact C-N 3.34Å; L48-L50 PolarHBondContact O-N 3.11Å; L48-V51 PolarHBondContact O-N 3.4Å; L48-V52 WeakPolarHBondContact O-CG2 3.23Å; L48-V52 PolarHBondContact O-N 3.42Å
49	V	89.6	Confident	86.9	Confident	17 Å²	17	48.7 Å²	48.7	10%	0.103	28%	0.279	C	S	.	.	H	α-helix	trans	-62.1	-42.2	177.3	170.7	0	0	0	0	111.3	F45 R46 I47 V52 A53 F204 F207 M208	F45-V49 HydrophobicContact CD2-CG2 4.48Å; F45-V49 HydrophobicContact CE1-CG2 4.18Å; F45-V49 HydrophobicContact CE2-CG2 3.97Å; F45-V49 HydrophobicContact CZ-CG2 3.78Å; F45-V49 WeakPolarHBondContact O-CG2 3.43Å; F45-V49 PolarHBondContact O-N 3.22Å; R46-V49 PolarHBondContact O-N 3.28Å; I47-V49 PolarHBondContact O-N 3.35Å; V49-V52 PolarHBondContact O-N 2.95Å; V49-A53 WeakPolarHBondContact O-CB 2.98Å; V49-A53 PolarHBondContact O-N 3.17Å; V49-F204 HydrophobicContact CG1-CD1 3.77Å; V49-F204 HydrophobicContact CG1-CE1 4.05Å; V49-F207 HydrophobicContact CG1-CD1 4.27Å; V49-F207 HydrophobicContact CG2-CD1 4.38Å; V49-F207 HydrophobicContact CG2-CE1 3.95Å; V49-M208 HydrophobicContact CB-SD 4.41Å; V49-M208 HydrophobicContact CG1-CG 4.41Å; V49-M208 HydrophobicContact CG1-SD 3.92Å
50	L	90.8	Very high	87.8	Confident	27 Å²	27	50.3 Å²	50.3	14%	0.141	29%	0.287	C	S	.	.	H	α-helix	trans	-62.7	-45.1	178.5	-168.9	150.7	0	0	0	111.4	R46 I47 L48 A53 A54 I88 W91 A92 L95	R46-L50 VanDerWaalsContact O-CB 3.29Å; R46-L50 WeakPolarHBondContact O-CB 3.4Å; R46-L50 PolarHBondContact O-N 3.14Å; I47-L50 PolarHBondContact O-N 2.9Å; L48-L50 VanDerWaalsContact C-N 3.34Å; L48-L50 PolarHBondContact O-N 3.11Å; L50-A53 PolarHBondContact O-N 3.44Å; L50-A54 WeakPolarHBondContact O-CB 3.47Å; L50-A54 PolarHBondContact O-N 3.2Å; L50-I88 HydrophobicContact CD2-CD1 4.23Å; L50-I88 HydrophobicContact CD2-CG1 4.4Å; L50-I88 HydrophobicContact CG-CD1 3.76Å; L50-I88 HydrophobicContact CG-CG1 4.35Å; L50-W91 HydrophobicContact CD1-CB 3.92Å; L50-A92 HydrophobicContact CD1-CB 4.08Å; L50-L95 HydrophobicContact CB-CD1 4.37Å; L50-L95 HydrophobicContact CD1-CD1 3.66Å
51	V	90.7	Very high	88.5	Confident	82 Å²	82	50.5 Å²	50.5	50%	0.497	29%	0.285	S	S	.	.	H	α-helix	trans	-61.4	-49.2	178.3	170.6	0	0	0	0	110.9	I47 L48 A54	I47-V51 HydrophobicContact CG2-CG2 4.28Å; I47-V51 WeakPolarHBondContact O-CG2 3.48Å; I47-V51 PolarHBondContact O-N 2.8Å; L48-V51 PolarHBondContact O-N 3.4Å; V51-A54 PolarHBondContact O-N 3.02Å
52	V	90.8	Very high	89	Confident	84 Å²	84	52.3 Å²	52.3	51%	0.509	29%	0.287	S	S	.	.	H	α-helix	trans	-60.7	-50.2	178.6	171.4	0	0	0	0	110.7	L48 V49 A54 E55 S56	L48-V52 WeakPolarHBondContact O-CG2 3.23Å; L48-V52 PolarHBondContact O-N 3.42Å; V49-V52 PolarHBondContact O-N 2.95Å; V52-A54 VanDerWaalsContact C-N 3.34Å; V52-A54 PolarHBondContact O-N 3.37Å; V52-E55 PolarHBondContact O-N 3.42Å; V52-S56 PolarHBondContact O-N 3.48Å; V52-S56 PolarHBondContact O-OG 2.95Å
53	A	90	Very high	89.5	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.008	32%	0.315	C	S	.	.	H	α-helix	trans	-63.2	-38.7	-177.4	0	0	0	0	0	112.7	V49 L50 E55 V57 W58 I88 F204	V49-A53 WeakPolarHBondContact O-CB 2.98Å; V49-A53 PolarHBondContact O-N 3.17Å; L50-A53 PolarHBondContact O-N 3.44Å; A53-E55 VanDerWaalsContact C-N 3.3Å; A53-E55 PolarHBondContact O-N 3.36Å; A53-V57 WeakPolarHBondContact O-CB 3.44Å; A53-V57 PolarHBondContact O-N 3.2Å; A53-W58 HydrophobicContact CB-CE3 3.83Å; A53-W58 HydrophobicContact CB-CZ3 3.76Å; A53-W58 PolarHBondContact O-N 2.91Å; A53-I88 HydrophobicContact CB-CD1 4.11Å; A53-F204 HydrophobicContact CB-CD1 3.94Å; A53-F204 HydrophobicContact CB-CE1 4.11Å; A53-F204 HydrophobicContact CB-CG 4.36Å
54	A	88.8	Confident	89.9	Confident	35 Å²	35	54.5 Å²	54.5	29%	0.289	32%	0.315	S	S	.	.	H	α-helix	trans	-57.5	-44	-178.4	0	0	0	0	0	111.9	L50 V51 V52 W58 G59 I88	L50-A54 WeakPolarHBondContact O-CB 3.47Å; L50-A54 PolarHBondContact O-N 3.2Å; V51-A54 PolarHBondContact O-N 3.02Å; V52-A54 VanDerWaalsContact C-N 3.34Å; V52-A54 PolarHBondContact O-N 3.37Å; A54-W58 CarbonylContact O-C 3.56Å; A54-G59 PolarHBondContact O-N 3.33Å; A54-I88 HydrophobicContact CB-CD1 4.06Å; A54-I88 HydrophobicContact CB-CG1 3.81Å
55	E	86.6	Confident	90.4	Very high	162 Å²	162	51.3 Å²	51.3	76%	0.757	30%	0.299	S	S	*	.	H	α-helix	trans	-84.8	-46.9	-178.5	-64.5	-173.8	170.2	0	0	112.3	V52 A53	V52-E55 PolarHBondContact O-N 3.42Å; A53-E55 VanDerWaalsContact C-N 3.3Å; A53-E55 PolarHBondContact O-N 3.36Å
56	S	88.3	Confident	90.8	Very high	55 Å²	55	51.2 Å²	51.2	39%	0.385	31%	0.305	S	S	.	.	H	α-helix	trans	-83.9	-27.2	-168.9	67.4	0	0	0	0	114.8	V52	V52-S56 PolarHBondContact O-N 3.48Å; V52-S56 PolarHBondContact O-OG 2.95Å
57	V	91.1	Very high	91.1	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.2	-36	-170.2	-174.5	0	0	0	0	112.8	A53 E200 K201 F204	A53-V57 WeakPolarHBondContact O-CB 3.44Å; A53-V57 PolarHBondContact O-N 3.2Å; V57-E200 HydrophobicContact CB-CG 4.46Å; V57-E200 HydrophobicContact CG1-CB 4.22Å; V57-E200 HydrophobicContact CG1-CG 3.86Å; V57-E200 VanDerWaalsContact CG2-CD 3.5Å; V57-E200 HydrophobicContact CG2-CG 3.76Å; V57-E200 VanDerWaalsContact CG2-OE1 3.25Å; V57-E200 WeakPolarHBondContact CG2-OE1 3.24Å; V57-K201 HydrophobicContact CG1-CB 4.47Å; V57-K201 HydrophobicContact CG1-CG 3.53Å; V57-K201 WeakPolarHBondContact O-CE 2.98Å; V57-F204 HydrophobicContact CG1-CD2 4.38Å; V57-F204 HydrophobicContact CG2-CD2 3.86Å; V57-F204 HydrophobicContact CG2-CE2 3.51Å; V57-F204 HydrophobicContact CG2-CZ 4.19Å
58	W	92.3	Very high	91.4	Very high	8 Å²	8	54.5 Å²	54.5	3%	0.03	32%	0.324	C	S	.	.	S	Bend	trans	-104.4	-6	178.7	-80.5	-92.2	0	0	0	113.4	A53 A54 D60 E61 H87 I88 W91 K201 F204	A53-W58 HydrophobicContact CB-CE3 3.83Å; A53-W58 HydrophobicContact CB-CZ3 3.76Å; A53-W58 PolarHBondContact O-N 2.91Å; A54-W58 CarbonylContact O-C 3.56Å; W58-D60 VanDerWaalsContact C-N 3.28Å; W58-D60 PolarHBondContact O-N 3.1Å; W58-E61 VanDerWaalsContact CD1-OE2 3.27Å; W58-E61 VanDerWaalsContact O-CB 3.28Å; W58-E61 WeakPolarHBondContact O-CB 3.41Å; W58-E61 VanDerWaalsContact O-CG 3.24Å; W58-E61 WeakPolarHBondContact O-CG 2.91Å; W58-E61 PolarHBondContact O-N 2.94Å; W58-E61 VanDerWaalsContact O-N 3.12Å; W58-H87 HydrophobicContact CZ2-CB 3.95Å; W58-I88 HydrophobicContact CB-CB 4.35Å; W58-I88 HydrophobicContact CB-CG2 4.23Å; W58-I88 HydrophobicContact CG-CB 4.19Å; W58-I88 HydrophobicContact CG-CG2 4.38Å; W58-W91 AromaticContact CH2-CH2 3.57Å; W58-W91 HydrophobicContact CH2-CH2 3.57Å; W58-W91 AromaticContact CH2-CZ3 3.53Å; W58-W91 HydrophobicContact CH2-CZ3 3.53Å; W58-W91 AromaticContact CZ2-CH2 3.65Å; W58-W91 HydrophobicContact CZ2-CH2 3.65Å; W58-W91 AromaticContact CZ2-CZ3 3.73Å; W58-W91 HydrophobicContact CZ2-CZ3 3.73Å; W58-W91 HydrophobicContact CZ3-CH2 4.43Å; W58-W91 AromaticContact CZ3-CZ3 3.98Å; W58-W91 HydrophobicContact CZ3-CZ3 3.98Å; W58-K201 HydrophobicContact CD2-CG 4.35Å; W58-K201 HydrophobicContact CH2-CB 4.03Å; W58-K201 HydrophobicContact CH2-CG 4Å; W58-K201 HydrophobicContact CZ2-CB 3.76Å; W58-K201 HydrophobicContact CZ2-CD 4.35Å; W58-K201 HydrophobicContact CZ2-CG 3.65Å; W58-K201 HydrophobicContact CZ3-CG 4.48Å; W58-F204 HydrophobicContact CH2-CB 3.61Å; W58-F204 HydrophobicContact CH2-CG 4.45Å; W58-F204 HydrophobicContact CZ3-CB 3.68Å; W58-F204 HydrophobicContact CZ3-CD2 4.31Å; W58-F204 HydrophobicContact CZ3-CG 4.06Å
59	G	89.6	Confident	91.7	Very high	54 Å²	54	51.5 Å²	51.5	56%	0.557	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-32.6	-179.8	0	0	0	0	0	113.7	A54	A54-G59 PolarHBondContact O-N 3.33Å
60	D	90.2	Very high	92	Very high	41 Å²	41	60.2 Å²	60.2	22%	0.219	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	19.9	176.3	67.5	-9.3	0	0	0	112.6	W58 K62 S63 G64 S196 R197	W58-D60 VanDerWaalsContact C-N 3.28Å; W58-D60 PolarHBondContact O-N 3.1Å; D60-K62 VanDerWaalsContact C-N 3.33Å; D60-K62 PolarHBondContact O-N 3.5Å; D60-S63 WeakPolarHBondContact CA-OG 3.29Å; D60-S63 PolarHBondContact O-N 3.45Å; D60-S63 PolarHBondContact O-OG 3.4Å; D60-G64 WeakPolarHBondContact O-CA 3.4Å; D60-G64 PolarHBondContact O-N 2.9Å; D60-S196 PolarHBondContact OD2-OG 3.48Å; D60-R197 IonicContact OD1-NE 3.43Å; D60-R197 IonicContact OD2-CZ 3.89Å; D60-R197 IonicContact OD2-NE 3.86Å; D60-R197 PolarHBondContact OD2-NE 3.34Å; D60-R197 VanDerWaalsContact OD2-NE 3.14Å; D60-R197 IonicContact OD2-NH2 3.72Å
61	E	91.1	Very high	92.2	Very high	27 Å²	27	62.9 Å²	62.9	13%	0.126	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-41.7	-172.2	68.3	174.6	168.9	0	0	113.4	W58 Y79 S86	W58-E61 VanDerWaalsContact CD1-OE2 3.27Å; W58-E61 VanDerWaalsContact O-CB 3.28Å; W58-E61 WeakPolarHBondContact O-CB 3.41Å; W58-E61 VanDerWaalsContact O-CG 3.24Å; W58-E61 WeakPolarHBondContact O-CG 2.91Å; W58-E61 PolarHBondContact O-N 2.94Å; W58-E61 VanDerWaalsContact O-N 3.12Å; E61-Y79 HydrophobicContact CG-CE2 4.44Å; E61-Y79 VanDerWaalsContact CG-OH 3.24Å; E61-Y79 WeakPolarHBondContact CG-OH 3.43Å; E61-Y79 WeakPolarHBondContact O-CE2 3.38Å; E61-Y79 PolarHBondContact OE1-OH 3.01Å; E61-Y79 PolarHBondContact OE2-OH 2.86Å; E61-S86 VanDerWaalsContact CD-CB 3.49Å; E61-S86 WeakPolarHBondContact OE1-CB 3.48Å; E61-S86 PolarHBondContact OE1-OG 2.89Å; E61-S86 WeakPolarHBondContact OE2-CB 3.37Å
62	K	91.2	Very high	92.4	Very high	117 Å²	117	63.8 Å²	63.8	51%	0.509	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-40.9	-178.9	-172.7	-175.2	178.3	78.9	0	111.5	D60 F65 Y79	D60-K62 VanDerWaalsContact C-N 3.33Å; D60-K62 PolarHBondContact O-N 3.5Å; K62-F65 PolarHBondContact O-N 3.01Å; K62-Y79 HydrophobicContact CB-CE1 4.38Å; K62-Y79 HydrophobicContact CB-CE2 4.24Å; K62-Y79 HydrophobicContact CG-CD1 4.23Å; K62-Y79 HydrophobicContact CG-CE1 4.31Å; K62-Y79 HydrophobicContact CG-CG 4.37Å
63	S	92.6	Very high	92.6	Very high	98 Å²	98	61.8 Å²	61.8	69%	0.685	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-30.3	-178	51	0	0	0	0	113	D60	D60-S63 WeakPolarHBondContact CA-OG 3.29Å; D60-S63 PolarHBondContact O-N 3.45Å; D60-S63 PolarHBondContact O-OG 3.4Å
64	G	91.8	Very high	92.9	Very high	26 Å²	26	61.8 Å²	61.8	27%	0.268	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	2.5	175.1	0	0	0	0	0	114.4	D60 S196	D60-G64 WeakPolarHBondContact O-CA 3.4Å; D60-G64 PolarHBondContact O-N 2.9Å; G64-S196 WeakPolarHBondContact O-CB 3.4Å
65	F	95.5	Very high	93.3	Very high	5 Å²	5	62.9 Å²	62.9	2%	0.022	37%	0.366	C	S	.	.			trans	-88.1	115	171.8	-177.3	-92.4	0	0	0	110	K62 C78 Y79 F83 V180 C193 V195	K62-F65 PolarHBondContact O-N 3.01Å; F65-C78 HydrophobicContact CE1-CB 3.87Å; F65-C78 HydrophobicContact CZ-CB 4.13Å; F65-Y79 HydrophobicContact CB-CD2 3.86Å; F65-Y79 HydrophobicContact CD1-CD2 4.24Å; F65-Y79 HydrophobicContact CD2-CD2 4.29Å; F65-Y79 AromaticContact CG-CD2 3.88Å; F65-Y79 HydrophobicContact CG-CD2 3.88Å; F65-F83 HydrophobicContact CD2-CE2 4.17Å; F65-F83 AromaticContact CE2-CE2 3.96Å; F65-F83 HydrophobicContact CE2-CE2 3.96Å; F65-V180 HydrophobicContact CE2-CG2 3.96Å; F65-V180 HydrophobicContact CZ-CG2 3.92Å; F65-C193 HydrophobicContact CE1-CB 3.79Å; F65-C193 HydrophobicContact CE2-CB 3.9Å; F65-C193 HydrophobicContact CZ-CB 3.32Å; F65-V195 HydrophobicContact CD2-CG2 4.24Å; F65-V195 HydrophobicContact CE2-CG2 4.16Å
66	T	96.1	Very high	93.7	Very high	75 Å²	75	58.1 Å²	58.1	46%	0.46	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	124.7	-171.1	-58.3	0	0	0	0	110.7	C193 F194	T66-C193 CarbonylContact O-C 3.56Å; T66-C193 WeakPolarHBondContact O-CA 3.35Å; T66-F194 PolarHBondContact N-O 3.33Å; T66-F194 PolarHBondContact O-N 3.47Å
67	C	96.9	Very high	94	Very high	7 Å²	7	57.9 Å²	57.9	5%	0.047	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	146.8	169.2	-52	0	0	0	0	111.7	T69 N75 V191 D192 C193	C67-T69 HydrophobicContact CB-CG2 4.02Å; C67-T69 PolarHBondContact O-N 2.88Å; C67-N75 WeakPolarHBondContact CA-OD1 3.5Å; C67-N75 WeakPolarHBondContact CB-OD1 3.5Å; C67-N75 PolarHBondContact N-OD1 3.44Å; C67-N75 PolarHBondContact SG-OD1 3.41Å; C67-V191 HydrophobicContact CB-CG2 4.12Å; C67-D192 CarbonylContact C-O 3.56Å; C67-D192 WeakPolarHBondContact CA-O 3.47Å; C67-C193 HydrophobicContact CB-CB 3.9Å; C67-C193 WeakPolarHBondContact CB-SG 3.44Å; C67-C193 WeakPolarHBondContact SG-CB 3.26Å; C67-C193 CovalentContact SG-SG 2.04Å; C67-C193 PolarHBondContact SG-SG 3.08Å
68	N	96.6	Very high	94.3	Very high	122 Å²	122	57.9 Å²	57.9	65%	0.652	35%	0.347	S	S	*	.	S	Bend	trans	-77.3	69.2	174.8	-171.8	13.7	0	0	0	110.8	D192	N68-D192 PolarHBondContact N-O 3.19Å
69	T	95.9	Very high	94.4	Very high	38 Å²	38	58.5 Å²	58.5	23%	0.233	35%	0.349	C	S	.	.			trans	-156.7	152.4	177.3	-175.3	0	0	0	0	111.2	C67 Q71 C74 V191	C67-T69 HydrophobicContact CB-CG2 4.02Å; C67-T69 PolarHBondContact O-N 2.88Å; T69-Q71 HydrophobicContact CG2-CB 4.39Å; T69-Q71 WeakPolarHBondContact OG1-CB 3.34Å; T69-Q71 PolarHBondContact OG1-N 2.94Å; T69-C74 HydrophobicContact CG2-CB 3.78Å; T69-C74 VanDerWaalsContact CG2-SG 3.59Å; T69-V191 HydrophobicContact CG2-CG1 4.38Å
70	Q	95	Very high	94.7	Very high	200 Å²	200	61.1 Å²	61.1	94%	0.935	35%	0.35	S	S	*	.			trans	-94.3	0.3	172.2	-62.2	-175.4	6.9	0	0	112.4	P72	Q70-P72 WeakPolarHBondContact O-CD 3.35Å
71	Q	95.4	Very high	94.8	Very high	83 Å²	83	64.4 Å²	64.4	39%	0.388	36%	0.364	S	S	.	.			trans	-70.2	121.3	-177.7	-177.7	64.6	26.5	0	0	111.3	T69 C74 P186 P188	T69-Q71 HydrophobicContact CG2-CB 4.39Å; T69-Q71 WeakPolarHBondContact OG1-CB 3.34Å; T69-Q71 PolarHBondContact OG1-N 2.94Å; Q71-C74 HydrophobicContact CB-CB 4.24Å; Q71-C74 HydrophobicContact CG-CB 4.4Å; Q71-C74 PolarHBondContact O-N 3.22Å; Q71-P186 VanDerWaalsContact CG-O 3.26Å; Q71-P186 WeakPolarHBondContact CG-O 3.32Å; Q71-P188 HydrophobicContact CB-CG 4.25Å
72	P	95.8	Very high	94.9	Very high	101 Å²	101	66 Å²	66	66%	0.656	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	140.9	177.7	26.4	-34.6	0	0	0	111.2	Q70 C74	Q70-P72 WeakPolarHBondContact O-CD 3.35Å; P72-C74 VanDerWaalsContact C-N 3.26Å; P72-C74 PolarHBondContact O-N 3.33Å
73	G	95	Very high	95	Very high	43 Å²	43	61.1 Å²	61.1	44%	0.443	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.4	-21.1	178.9	0	0	0	0	0	115.3	N75 S76 V77	G73-N75 PolarHBondContact O-N 3.5Å; G73-S76 PolarHBondContact O-N 3.03Å; G73-S76 VanDerWaalsContact O-N 3.08Å; G73-V77 PolarHBondContact O-N 3.2Å
74	C	96.3	Very high	95	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-57.8	-46.3	-177.8	178.5	0	0	0	0	112.9	T69 Q71 P72 S76 V77 C78 C187	T69-C74 HydrophobicContact CG2-CB 3.78Å; T69-C74 VanDerWaalsContact CG2-SG 3.59Å; Q71-C74 HydrophobicContact CB-CB 4.24Å; Q71-C74 HydrophobicContact CG-CB 4.4Å; Q71-C74 PolarHBondContact O-N 3.22Å; P72-C74 VanDerWaalsContact C-N 3.26Å; P72-C74 PolarHBondContact O-N 3.33Å; C74-S76 VanDerWaalsContact C-N 3.26Å; C74-S76 PolarHBondContact O-N 3.1Å; C74-V77 WeakPolarHBondContact O-CG2 3.49Å; C74-V77 PolarHBondContact O-N 2.94Å; C74-C78 WeakPolarHBondContact O-CB 3.45Å; C74-C78 PolarHBondContact O-N 2.98Å; C74-C78 PolarHBondContact O-SG 3.34Å; C74-C187 WeakPolarHBondContact CA-SG 3.46Å; C74-C187 HydrophobicContact CB-CB 4.09Å; C74-C187 WeakPolarHBondContact CB-SG 3.4Å; C74-C187 WeakPolarHBondContact SG-CB 3.46Å; C74-C187 CovalentContact SG-SG 2.03Å; C74-C187 PolarHBondContact SG-SG 3.37Å
75	N	95.2	Very high	95	Very high	59 Å²	59	62 Å²	62	32%	0.316	34%	0.344	S	S	.	.	H	α-helix	trans	-55.8	-40.8	176.1	-74.5	1.1	0	0	0	112.7	C67 G73 Y79	C67-N75 WeakPolarHBondContact CA-OD1 3.5Å; C67-N75 WeakPolarHBondContact CB-OD1 3.5Å; C67-N75 PolarHBondContact N-OD1 3.44Å; C67-N75 PolarHBondContact SG-OD1 3.41Å; G73-N75 PolarHBondContact O-N 3.5Å; N75-Y79 VanDerWaalsContact O-CB 3.23Å; N75-Y79 WeakPolarHBondContact O-CB 3.28Å; N75-Y79 PolarHBondContact O-N 3.46Å
76	S	95.1	Very high	94.9	Very high	62 Å²	62	61.9 Å²	61.9	43%	0.434	34%	0.344	S	S	.	.	H	α-helix	trans	-71.1	-42.1	-175.2	-72	0	0	0	0	112.3	G73 C74 D80	G73-S76 PolarHBondContact O-N 3.03Å; G73-S76 VanDerWaalsContact O-N 3.08Å; C74-S76 VanDerWaalsContact C-N 3.26Å; C74-S76 PolarHBondContact O-N 3.1Å; S76-D80 PolarHBondContact O-N 3.47Å; S76-D80 VanDerWaalsContact O-N 3.15Å
77	V	96.3	Very high	94.7	Very high	49 Å²	49	58.6 Å²	58.6	30%	0.297	32%	0.323	S	S	.	.	H	α-helix	trans	-72.1	-37.8	179	-61.2	0	0	0	0	111.8	G73 C74 D80 H81 Y185	G73-V77 PolarHBondContact O-N 3.2Å; C74-V77 WeakPolarHBondContact O-CG2 3.49Å; C74-V77 PolarHBondContact O-N 2.94Å; V77-D80 PolarHBondContact O-N 3.05Å; V77-H81 WeakPolarHBondContact O-CB 3.49Å; V77-H81 PolarHBondContact O-N 3.25Å; V77-Y185 WeakPolarHBondContact CG2-O 3.44Å
78	C	96.2	Very high	94.4	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-67.6	-41.3	176.8	-68.2	0	0	0	0	111.2	F65 C74 D80 H81 F82 C182 C187	F65-C78 HydrophobicContact CE1-CB 3.87Å; F65-C78 HydrophobicContact CZ-CB 4.13Å; C74-C78 WeakPolarHBondContact O-CB 3.45Å; C74-C78 PolarHBondContact O-N 2.98Å; C74-C78 PolarHBondContact O-SG 3.34Å; C78-D80 VanDerWaalsContact C-N 3.35Å; C78-D80 PolarHBondContact O-N 2.96Å; C78-H81 PolarHBondContact O-N 3.39Å; C78-F82 VanDerWaalsContact O-CD2 3.29Å; C78-F82 WeakPolarHBondContact O-CD2 3.45Å; C78-F82 PolarHBondContact O-N 3.48Å; C78-C182 WeakPolarHBondContact CA-SG 3.02Å; C78-C182 HydrophobicContact CB-CB 3.76Å; C78-C182 WeakPolarHBondContact CB-SG 3.48Å; C78-C182 WeakPolarHBondContact SG-CB 3.41Å; C78-C182 CovalentContact SG-SG 2.02Å; C78-C182 PolarHBondContact SG-SG 2.83Å; C78-C187 PolarHBondContact SG-SG 2.94Å
79	Y	94.9	Very high	94.3	Very high	22 Å²	22	60.7 Å²	60.7	9%	0.086	32%	0.322	C	S	.	.	H	α-helix	trans	-57.3	-49.4	173.8	176.5	-90.2	0	0	0	111.3	E61 K62 F65 N75 H81 F82 F83	E61-Y79 HydrophobicContact CG-CE2 4.44Å; E61-Y79 VanDerWaalsContact CG-OH 3.24Å; E61-Y79 WeakPolarHBondContact CG-OH 3.43Å; E61-Y79 WeakPolarHBondContact O-CE2 3.38Å; E61-Y79 PolarHBondContact OE1-OH 3.01Å; E61-Y79 PolarHBondContact OE2-OH 2.86Å; K62-Y79 HydrophobicContact CB-CE1 4.38Å; K62-Y79 HydrophobicContact CB-CE2 4.24Å; K62-Y79 HydrophobicContact CG-CD1 4.23Å; K62-Y79 HydrophobicContact CG-CE1 4.31Å; K62-Y79 HydrophobicContact CG-CG 4.37Å; F65-Y79 HydrophobicContact CB-CD2 3.86Å; F65-Y79 HydrophobicContact CD1-CD2 4.24Å; F65-Y79 HydrophobicContact CD2-CD2 4.29Å; F65-Y79 AromaticContact CG-CD2 3.88Å; F65-Y79 HydrophobicContact CG-CD2 3.88Å; N75-Y79 VanDerWaalsContact O-CB 3.23Å; N75-Y79 WeakPolarHBondContact O-CB 3.28Å; N75-Y79 PolarHBondContact O-N 3.46Å; Y79-H81 VanDerWaalsContact C-N 3.34Å; Y79-H81 PolarHBondContact O-N 2.99Å; Y79-F82 PolarHBondContact O-N 3.34Å; Y79-F83 HydrophobicContact CD2-CD2 4.06Å; Y79-F83 HydrophobicContact CE2-CB 4.27Å; Y79-F83 HydrophobicContact CE2-CD2 4.12Å; Y79-F83 HydrophobicContact CE2-CG 4.46Å; Y79-F83 WeakPolarHBondContact O-CA 3.36Å; Y79-F83 WeakPolarHBondContact O-CB 3.22Å; Y79-F83 PolarHBondContact O-N 3.31Å
80	D	95.1	Very high	94.2	Very high	108 Å²	108	59.4 Å²	59.4	58%	0.578	31%	0.314	S	S	*	.	H	α-helix	trans	-63.9	-38.6	-179.3	-168.2	71.7	0	0	0	112.3	S76 V77 C78 F83 P84	S76-D80 PolarHBondContact O-N 3.47Å; S76-D80 VanDerWaalsContact O-N 3.15Å; V77-D80 PolarHBondContact O-N 3.05Å; C78-D80 VanDerWaalsContact C-N 3.35Å; C78-D80 PolarHBondContact O-N 2.96Å; D80-F83 CarbonylContact O-C 3.52Å; D80-P84 VanDerWaalsContact O-CA 3.29Å; D80-P84 WeakPolarHBondContact O-CA 3.41Å
81	H	93.8	Very high	94.1	Very high	111 Å²	111	50 Å²	50	51%	0.514	27%	0.27	S	S	.	.	H	α-helix	trans	-64.3	-45.6	178	-175.3	74.7	0	0	0	113.1	V77 C78 Y79	V77-H81 WeakPolarHBondContact O-CB 3.49Å; V77-H81 PolarHBondContact O-N 3.25Å; C78-H81 PolarHBondContact O-N 3.39Å; Y79-H81 VanDerWaalsContact C-N 3.34Å; Y79-H81 PolarHBondContact O-N 2.99Å
82	F	92.1	Very high	94.1	Very high	59 Å²	59	47.6 Å²	47.6	26%	0.259	26%	0.264	S	S	.	.	H	α-helix	trans	-85.9	-24.1	-178.2	-74.6	-73.7	0	0	0	113.7	C78 Y79 P84 V180 K181 C182	C78-F82 VanDerWaalsContact O-CD2 3.29Å; C78-F82 WeakPolarHBondContact O-CD2 3.45Å; C78-F82 PolarHBondContact O-N 3.48Å; Y79-F82 PolarHBondContact O-N 3.34Å; F82-P84 VanDerWaalsContact C-CD 3.46Å; F82-V180 HydrophobicContact CD1-CB 4.04Å; F82-V180 HydrophobicContact CD1-CG1 3.74Å; F82-V180 HydrophobicContact CD2-CB 3.94Å; F82-V180 HydrophobicContact CD2-CG1 4.33Å; F82-V180 HydrophobicContact CD2-CG2 3.68Å; F82-V180 HydrophobicContact CE1-CB 3.94Å; F82-V180 HydrophobicContact CE1-CG1 4.01Å; F82-V180 HydrophobicContact CE2-CB 3.87Å; F82-V180 HydrophobicContact CE2-CG2 3.88Å; F82-V180 HydrophobicContact CG-CB 4.05Å; F82-V180 HydrophobicContact CG-CG1 3.93Å; F82-V180 HydrophobicContact CG-CG2 4.07Å; F82-V180 HydrophobicContact CZ-CB 3.88Å; F82-V180 HydrophobicContact CZ-CG1 4.45Å; F82-V180 HydrophobicContact CZ-CG2 4.41Å; F82-K181 VanDerWaalsContact CZ-O 3.28Å; F82-K181 WeakPolarHBondContact CZ-O 3.28Å; F82-C182 HydrophobicContact CE2-CB 3.75Å
83	F	93.1	Very high	94.1	Very high	16 Å²	16	46.9 Å²	46.9	7%	0.07	25%	0.254	C	S	.	.			trans	-129.4	64.2	-179.2	-56.8	-70.2	0	0	0	111.1	F65 Y79 D80 I85 Y171 M176 V195	F65-F83 HydrophobicContact CD2-CE2 4.17Å; F65-F83 AromaticContact CE2-CE2 3.96Å; F65-F83 HydrophobicContact CE2-CE2 3.96Å; Y79-F83 HydrophobicContact CD2-CD2 4.06Å; Y79-F83 HydrophobicContact CE2-CB 4.27Å; Y79-F83 HydrophobicContact CE2-CD2 4.12Å; Y79-F83 HydrophobicContact CE2-CG 4.46Å; Y79-F83 WeakPolarHBondContact O-CA 3.36Å; Y79-F83 WeakPolarHBondContact O-CB 3.22Å; Y79-F83 PolarHBondContact O-N 3.31Å; D80-F83 CarbonylContact O-C 3.52Å; F83-I85 PolarHBondContact O-N 3.42Å; F83-Y171 HydrophobicContact CD1-CE1 4.34Å; F83-M176 HydrophobicContact CD1-CE 3.98Å; F83-M176 HydrophobicContact CE1-CE 3.1Å; F83-M176 HydrophobicContact CE1-SD 4.25Å; F83-M176 HydrophobicContact CZ-CE 3.48Å; F83-M176 VanDerWaalsContact CZ-CE 3.48Å; F83-V195 HydrophobicContact CE2-CG2 3.97Å; F83-V195 HydrophobicContact CZ-CG1 4.24Å; F83-V195 HydrophobicContact CZ-CG2 3.83Å
84	P	92.2	Very high	94.1	Very high	78 Å²	78	45.3 Å²	45.3	51%	0.506	24%	0.235	S	C	.	.	S	Bend	trans	-61.4	-33.4	-175.5	24.5	-35.1	0	0	0	112.4	D80 F82	D80-P84 VanDerWaalsContact O-CA 3.29Å; D80-P84 WeakPolarHBondContact O-CA 3.41Å; F82-P84 VanDerWaalsContact C-CD 3.46Å
85	I	93.1	Very high	93.9	Very high	65 Å²	65	45.9 Å²	45.9	33%	0.333	24%	0.238	S	C	.	.	S	Bend	trans	-127.2	147	165.1	-55.4	177.8	0	0	0	105.8	F83 R89 L90 Y171	F83-I85 PolarHBondContact O-N 3.42Å; I85-R89 HydrophobicContact CG2-CB 3.91Å; I85-L90 HydrophobicContact CB-CD1 4.48Å; I85-L90 HydrophobicContact CB-CG 4.36Å; I85-L90 HydrophobicContact CD1-CD2 4.37Å; I85-L90 HydrophobicContact CG2-CD1 4.35Å; I85-L90 HydrophobicContact CG2-CD2 4.22Å; I85-L90 HydrophobicContact CG2-CG 3.76Å; I85-Y171 PolarHBondContact O-OH 2.96Å
86	S	92.1	Very high	93.8	Very high	2 Å²	2	47.9 Å²	47.9	1%	0.014	25%	0.248	C	C	.	.			trans	-84.2	151.5	172	58	0	0	0	0	111.8	E61 I88 R89 L90	E61-S86 VanDerWaalsContact CD-CB 3.49Å; E61-S86 WeakPolarHBondContact OE1-CB 3.48Å; E61-S86 PolarHBondContact OE1-OG 2.89Å; E61-S86 WeakPolarHBondContact OE2-CB 3.37Å; S86-I88 PolarHBondContact O-N 3.39Å; S86-R89 PolarHBondContact O-N 3.03Å; S86-R89 VanDerWaalsContact O-N 3.08Å; S86-R89 VanDerWaalsContact OG-CD 3.29Å; S86-R89 WeakPolarHBondContact OG-CD 3.47Å; S86-R89 VanDerWaalsContact OG-CG 3.27Å; S86-R89 WeakPolarHBondContact OG-CG 3.36Å; S86-R89 PolarHBondContact OG-NE 3.1Å; S86-L90 PolarHBondContact O-N 3Å
87	H	91.7	Very high	93.8	Very high	6 Å²	6	48.1 Å²	48.1	3%	0.028	24%	0.244	C	C	.	.	H	α-helix	trans	-55.9	-43.7	-177.2	-67.5	58.3	0	0	0	111.3	W58 R89 L90 W91 F167 Y171 M176	W58-H87 HydrophobicContact CZ2-CB 3.95Å; H87-R89 VanDerWaalsContact C-N 3.29Å; H87-R89 PolarHBondContact O-N 3.25Å; H87-L90 PolarHBondContact O-N 3.49Å; H87-W91 HydrophobicContact CB-CE3 4.38Å; H87-W91 HydrophobicContact CB-CH2 3.74Å; H87-W91 HydrophobicContact CB-CZ2 3.94Å; H87-W91 HydrophobicContact CB-CZ3 3.98Å; H87-W91 PolarHBondContact O-N 3.17Å; H87-F167 HydrophobicContact CB-CE2 4.38Å; H87-F167 AromaticContact CD2-CE2 3.46Å; H87-F167 VanDerWaalsContact CD2-CE2 3.46Å; H87-F167 WeakPolarHBondContact CD2-CE2 3.38Å; H87-F167 AromaticContact CD2-CZ 3.37Å; H87-F167 WeakPolarHBondContact CD2-CZ 3.12Å; H87-F167 AromaticContact NE2-CZ 3.81Å; H87-Y171 AromaticContact CE1-CD1 3.46Å; H87-Y171 VanDerWaalsContact CE1-CD1 3.46Å; H87-Y171 WeakPolarHBondContact CE1-CD1 3.32Å; H87-Y171 AromaticContact CE1-CE1 3.32Å; H87-Y171 WeakPolarHBondContact CE1-CE1 3.37Å; H87-Y171 AromaticContact CE1-CE2 3.9Å; H87-Y171 AromaticContact CE1-CG 3.81Å; H87-Y171 AromaticContact CE1-CZ 3.54Å; H87-Y171 PolarHBondContact N-OH 3.37Å; H87-Y171 AromaticContact ND1-CE1 3.68Å; H87-Y171 AromaticContact ND1-CE2 3.97Å; H87-Y171 AromaticContact ND1-CZ 3.5Å; H87-Y171 AromaticContact NE2-CD1 3.87Å; H87-Y171 AromaticContact NE2-CD2 3.85Å; H87-Y171 AromaticContact NE2-CG 3.74Å; H87-M176 VanDerWaalsContact CE1-SD 3.6Å
88	I	91.7	Very high	93.6	Very high	19 Å²	19	46.1 Å²	46.1	10%	0.097	23%	0.232	C	C	.	.	H	α-helix	trans	-61.7	-36.2	-179.3	-159.8	71	0	0	0	112.5	L50 A53 A54 W58 S86 W91 A92	L50-I88 HydrophobicContact CD2-CD1 4.23Å; L50-I88 HydrophobicContact CD2-CG1 4.4Å; L50-I88 HydrophobicContact CG-CD1 3.76Å; L50-I88 HydrophobicContact CG-CG1 4.35Å; A53-I88 HydrophobicContact CB-CD1 4.11Å; A54-I88 HydrophobicContact CB-CD1 4.06Å; A54-I88 HydrophobicContact CB-CG1 3.81Å; W58-I88 HydrophobicContact CB-CB 4.35Å; W58-I88 HydrophobicContact CB-CG2 4.23Å; W58-I88 HydrophobicContact CG-CB 4.19Å; W58-I88 HydrophobicContact CG-CG2 4.38Å; S86-I88 PolarHBondContact O-N 3.39Å; I88-W91 HydrophobicContact CD1-CE3 4.01Å; I88-W91 HydrophobicContact CD1-CZ3 4.4Å; I88-W91 PolarHBondContact O-N 2.99Å; I88-A92 WeakPolarHBondContact O-CB 3.3Å; I88-A92 PolarHBondContact O-N 2.94Å
89	R	93.8	Very high	93.2	Very high	153 Å²	153	47 Å²	47	58%	0.577	24%	0.238	S	C	*	.	H	α-helix	trans	-70.1	-41.2	177.5	-69	175.5	-171.5	177.8	3.7	111.3	I85 S86 H87 A92 L93	I85-R89 HydrophobicContact CG2-CB 3.91Å; S86-R89 PolarHBondContact O-N 3.03Å; S86-R89 VanDerWaalsContact O-N 3.08Å; S86-R89 VanDerWaalsContact OG-CD 3.29Å; S86-R89 WeakPolarHBondContact OG-CD 3.47Å; S86-R89 VanDerWaalsContact OG-CG 3.27Å; S86-R89 WeakPolarHBondContact OG-CG 3.36Å; S86-R89 PolarHBondContact OG-NE 3.1Å; H87-R89 VanDerWaalsContact C-N 3.29Å; H87-R89 PolarHBondContact O-N 3.25Å; R89-A92 PolarHBondContact O-N 3.47Å; R89-L93 WeakPolarHBondContact O-CG 3.31Å; R89-L93 PolarHBondContact O-N 3.44Å
90	L	93.7	Very high	93	Very high	12 Å²	12	48.8 Å²	48.8	6%	0.063	25%	0.252	C	S	.	.	H	α-helix	trans	-62.9	-43.6	174.3	-76.7	169.2	0	0	0	111.6	I85 S86 H87 A92 L93 Q94 I170 Y171	I85-L90 HydrophobicContact CB-CD1 4.48Å; I85-L90 HydrophobicContact CB-CG 4.36Å; I85-L90 HydrophobicContact CD1-CD2 4.37Å; I85-L90 HydrophobicContact CG2-CD1 4.35Å; I85-L90 HydrophobicContact CG2-CD2 4.22Å; I85-L90 HydrophobicContact CG2-CG 3.76Å; S86-L90 PolarHBondContact O-N 3Å; H87-L90 PolarHBondContact O-N 3.49Å; L90-A92 VanDerWaalsContact C-N 3.34Å; L90-A92 PolarHBondContact O-N 2.84Å; L90-L93 PolarHBondContact O-N 3.41Å; L90-Q94 WeakPolarHBondContact O-CB 3.46Å; L90-Q94 PolarHBondContact O-N 2.92Å; L90-I170 HydrophobicContact CD1-CD1 4.07Å; L90-Y171 HydrophobicContact CD1-CE2 3.64Å
91	W	94.6	Very high	92.8	Very high	3 Å²	3	44.2 Å²	44.2	1%	0.011	23%	0.228	C	C	.	.	H	α-helix	trans	-65.5	-35.9	175.8	-62.5	-33.1	0	0	0	112.8	L50 W58 H87 I88 Q94 L95 F167 T205 M208	L50-W91 HydrophobicContact CD1-CB 3.92Å; W58-W91 AromaticContact CH2-CH2 3.57Å; W58-W91 HydrophobicContact CH2-CH2 3.57Å; W58-W91 AromaticContact CH2-CZ3 3.53Å; W58-W91 HydrophobicContact CH2-CZ3 3.53Å; W58-W91 AromaticContact CZ2-CH2 3.65Å; W58-W91 HydrophobicContact CZ2-CH2 3.65Å; W58-W91 AromaticContact CZ2-CZ3 3.73Å; W58-W91 HydrophobicContact CZ2-CZ3 3.73Å; W58-W91 HydrophobicContact CZ3-CH2 4.43Å; W58-W91 AromaticContact CZ3-CZ3 3.98Å; W58-W91 HydrophobicContact CZ3-CZ3 3.98Å; H87-W91 HydrophobicContact CB-CE3 4.38Å; H87-W91 HydrophobicContact CB-CH2 3.74Å; H87-W91 HydrophobicContact CB-CZ2 3.94Å; H87-W91 HydrophobicContact CB-CZ3 3.98Å; H87-W91 PolarHBondContact O-N 3.17Å; I88-W91 HydrophobicContact CD1-CE3 4.01Å; I88-W91 HydrophobicContact CD1-CZ3 4.4Å; I88-W91 PolarHBondContact O-N 2.99Å; W91-Q94 WeakPolarHBondContact O-CB 3.49Å; W91-Q94 PolarHBondContact O-N 3.4Å; W91-L95 WeakPolarHBondContact O-CG 3.29Å; W91-L95 PolarHBondContact O-N 2.8Å; W91-F167 AromaticContact CE2-CE2 3.96Å; W91-F167 AromaticContact CZ2-CE2 3.87Å; W91-F167 HydrophobicContact CZ2-CE2 3.87Å; W91-F167 HydrophobicContact CZ2-CZ 4.15Å; W91-F167 AromaticContact NE1-CD2 3.87Å; W91-F167 AromaticContact NE1-CE2 3.67Å; W91-T205 WeakPolarHBondContact CH2-OG1 3.47Å; W91-T205 HydrophobicContact CZ2-CG2 4.19Å; W91-M208 HydrophobicContact CB-CE 3.99Å; W91-M208 HydrophobicContact CD2-CB 4.32Å; W91-M208 HydrophobicContact CD2-CE 4.3Å; W91-M208 HydrophobicContact CD2-CG 4.18Å; W91-M208 HydrophobicContact CE3-CG 4.27Å; W91-M208 HydrophobicContact CG-CE 4Å; W91-M208 HydrophobicContact CZ2-CB 4.2Å; W91-M208 HydrophobicContact CZ2-CG 4.47Å; W91-M208 HydrophobicContact CZ3-CG 4.46Å
92	A	94.3	Very high	92.4	Very high	32 Å²	32	40.3 Å²	40.3	26%	0.264	21%	0.214	S	C	.	.	H	α-helix	trans	-63.9	-47.4	175.1	0	0	0	0	0	111.1	L50 I88 R89 L90 Q94 L95 I96	L50-A92 HydrophobicContact CD1-CB 4.08Å; I88-A92 WeakPolarHBondContact O-CB 3.3Å; I88-A92 PolarHBondContact O-N 2.94Å; R89-A92 PolarHBondContact O-N 3.47Å; L90-A92 VanDerWaalsContact C-N 3.34Å; L90-A92 PolarHBondContact O-N 2.84Å; A92-Q94 VanDerWaalsContact C-N 3.34Å; A92-Q94 PolarHBondContact O-N 3.25Å; A92-L95 PolarHBondContact O-N 2.89Å; A92-I96 VanDerWaalsContact O-CG1 3.28Å; A92-I96 WeakPolarHBondContact O-CG1 3.48Å; A92-I96 PolarHBondContact O-N 3.21Å
93	L	95.4	Very high	92	Very high	86 Å²	86	41.6 Å²	41.6	45%	0.45	22%	0.223	S	C	.	.	H	α-helix	trans	-61.2	-42.1	175.5	-70.5	172.1	0	0	0	111.9	R89 L90 I96 L97 F163	R89-L93 WeakPolarHBondContact O-CG 3.31Å; R89-L93 PolarHBondContact O-N 3.44Å; L90-L93 PolarHBondContact O-N 3.41Å; L93-I96 PolarHBondContact O-N 3.09Å; L93-L97 PolarHBondContact O-N 3.1Å; L93-F163 HydrophobicContact CB-CE1 3.83Å; L93-F163 HydrophobicContact CB-CZ 3.89Å
94	Q	95.3	Very high	91.7	Very high	9 Å²	9	45.8 Å²	45.8	4%	0.042	25%	0.246	C	C	.	.	H	α-helix	trans	-57.7	-50.1	174	-178.5	-174.5	-1.4	0	0	111.1	L90 W91 A92 I96 L97 V98 E160 F163 S212	L90-Q94 WeakPolarHBondContact O-CB 3.46Å; L90-Q94 PolarHBondContact O-N 2.92Å; W91-Q94 WeakPolarHBondContact O-CB 3.49Å; W91-Q94 PolarHBondContact O-N 3.4Å; A92-Q94 VanDerWaalsContact C-N 3.34Å; A92-Q94 PolarHBondContact O-N 3.25Å; Q94-I96 PolarHBondContact O-N 3.42Å; Q94-L97 PolarHBondContact O-N 3.43Å; Q94-V98 HydrophobicContact CG-CG2 4.36Å; Q94-V98 VanDerWaalsContact O-CB 3.28Å; Q94-V98 WeakPolarHBondContact O-CB 3.3Å; Q94-V98 WeakPolarHBondContact O-CG2 3.23Å; Q94-V98 PolarHBondContact O-N 3.44Å; Q94-E160 PolarHBondContact NE2-OE2 3.21Å; Q94-F163 HydrophobicContact CB-CB 3.94Å; Q94-F163 HydrophobicContact CB-CD1 3.74Å; Q94-F163 HydrophobicContact CB-CD2 3.93Å; Q94-F163 HydrophobicContact CB-CE1 4.22Å; Q94-F163 HydrophobicContact CB-CE2 4.41Å; Q94-F163 HydrophobicContact CB-CG 3.58Å; Q94-F163 HydrophobicContact CG-CB 3.65Å; Q94-F163 HydrophobicContact CG-CD1 4.4Å; Q94-F163 HydrophobicContact CG-CD2 4.04Å; Q94-F163 HydrophobicContact CG-CG 3.78Å; Q94-S212 PolarHBondContact NE2-OG 3.36Å; Q94-S212 VanDerWaalsContact NE2-OG 3.1Å
95	L	92.4	Very high	91.3	Very high	13 Å²	13	43 Å²	43	7%	0.068	23%	0.228	C	C	.	.	H	α-helix	trans	-62.2	-42.6	179.7	-77.1	-176.8	0	0	0	112.4	F43 R46 I47 L50 W91 A92 S99	F43-L95 HydrophobicContact CD2-CD2 4.12Å; F43-L95 HydrophobicContact CE2-CD2 3.81Å; R46-L95 HydrophobicContact CB-CD1 4.29Å; R46-L95 HydrophobicContact CB-CD2 3.88Å; R46-L95 HydrophobicContact CG-CD2 4.47Å; I47-L95 HydrophobicContact CG1-CD1 4.24Å; L50-L95 HydrophobicContact CB-CD1 4.37Å; L50-L95 HydrophobicContact CD1-CD1 3.66Å; W91-L95 WeakPolarHBondContact O-CG 3.29Å; W91-L95 PolarHBondContact O-N 2.8Å; A92-L95 PolarHBondContact O-N 2.89Å; L95-S99 WeakPolarHBondContact O-CB 3.36Å; L95-S99 PolarHBondContact O-N 3.12Å; L95-S99 PolarHBondContact O-OG 3.23Å
96	I	92.9	Very high	90.8	Very high	101 Å²	101	41 Å²	41	52%	0.518	22%	0.221	S	C	.	.	H	α-helix	trans	-60	-54.8	177.6	-69.3	164.7	0	0	0	109.7	A92 L93 Q94 V98 S99 T100	A92-I96 VanDerWaalsContact O-CG1 3.28Å; A92-I96 WeakPolarHBondContact O-CG1 3.48Å; A92-I96 PolarHBondContact O-N 3.21Å; L93-I96 PolarHBondContact O-N 3.09Å; Q94-I96 PolarHBondContact O-N 3.42Å; I96-V98 PolarHBondContact O-N 2.97Å; I96-S99 WeakPolarHBondContact O-CB 3.32Å; I96-S99 PolarHBondContact O-N 3.3Å; I96-S99 VanDerWaalsContact O-N 3.12Å; I96-T100 PolarHBondContact O-N 3.2Å; I96-T100 PolarHBondContact O-OG1 2.7Å
97	L	95.3	Very high	90.4	Very high	67 Å²	67	47.2 Å²	47.2	35%	0.351	25%	0.251	S	S	.	.	H	α-helix	trans	-67.5	-35.1	-176	-72.1	177.8	0	0	0	113	L93 Q94 S99 P101 F159 F163	L93-L97 PolarHBondContact O-N 3.1Å; Q94-L97 PolarHBondContact O-N 3.43Å; L97-S99 VanDerWaalsContact C-N 3.28Å; L97-S99 PolarHBondContact O-N 2.8Å; L97-P101 WeakPolarHBondContact O-CD 3.42Å; L97-F159 HydrophobicContact CB-CD2 4.21Å; L97-F159 HydrophobicContact CB-CG 4.23Å; L97-F159 WeakPolarHBondContact O-CD2 3.33Å; L97-F159 WeakPolarHBondContact O-CE2 3.12Å; L97-F163 HydrophobicContact CB-CE2 4.2Å; L97-F163 HydrophobicContact CD1-CE2 3.57Å; L97-F163 HydrophobicContact CD1-CZ 3.71Å; L97-F163 HydrophobicContact CG-CE2 4.43Å
98	V	91.9	Very high	89.9	Confident	6 Å²	6	49.3 Å²	49.3	4%	0.036	26%	0.261	C	S	.	.	H	α-helix	trans	-70.4	-27.7	174.8	172	0	0	0	0	111.8	Q94 I96 F159 E160	Q94-V98 HydrophobicContact CG-CG2 4.36Å; Q94-V98 VanDerWaalsContact O-CB 3.28Å; Q94-V98 WeakPolarHBondContact O-CB 3.3Å; Q94-V98 WeakPolarHBondContact O-CG2 3.23Å; Q94-V98 PolarHBondContact O-N 3.44Å; I96-V98 PolarHBondContact O-N 2.97Å; V98-F159 HydrophobicContact CG2-CB 3.84Å; V98-E160 HydrophobicContact CG1-CG 4.22Å; V98-E160 HydrophobicContact CG2-CG 3.75Å
99	S	88.6	Confident	89.5	Confident	19 Å²	19	49.9 Å²	49.9	13%	0.133	27%	0.265	C	S	.	.	H	α-helix	trans	-77.8	-34.9	177.1	-62	0	0	0	0	113.1	F43 L95 I96 L97 A102 L103	F43-S99 WeakPolarHBondContact CE2-OG 3.36Å; F43-S99 WeakPolarHBondContact CZ-OG 3.38Å; L95-S99 WeakPolarHBondContact O-CB 3.36Å; L95-S99 PolarHBondContact O-N 3.12Å; L95-S99 PolarHBondContact O-OG 3.23Å; I96-S99 WeakPolarHBondContact O-CB 3.32Å; I96-S99 PolarHBondContact O-N 3.3Å; I96-S99 VanDerWaalsContact O-N 3.12Å; L97-S99 VanDerWaalsContact C-N 3.28Å; L97-S99 PolarHBondContact O-N 2.8Å; S99-A102 WeakPolarHBondContact O-CB 3.21Å; S99-A102 PolarHBondContact O-N 3.43Å; S99-L103 WeakPolarHBondContact O-CG 3.41Å; S99-L103 PolarHBondContact O-N 2.85Å
100	T	90	Very high	88.8	Confident	60 Å²	60	45.4 Å²	45.4	37%	0.368	26%	0.261	S	S	.	.	H	α-helix	trans	-53.7	-49.8	-174.9	-56.5	0	0	0	0	112.7	I96 A102 L103 L104	I96-T100 PolarHBondContact O-N 3.2Å; I96-T100 PolarHBondContact O-OG1 2.7Å; T100-A102 VanDerWaalsContact C-N 3.31Å; T100-A102 PolarHBondContact O-N 3.19Å; T100-L103 PolarHBondContact O-N 2.97Å; T100-L104 HydrophobicContact CG2-CD1 4.04Å; T100-L104 HydrophobicContact CG2-CG 4.31Å; T100-L104 WeakPolarHBondContact O-CB 3.29Å; T100-L104 VanDerWaalsContact O-CG 3.28Å; T100-L104 WeakPolarHBondContact O-CG 3.21Å; T100-L104 PolarHBondContact O-N 3.37Å
101	P	89.9	Confident	88.3	Confident	12 Å²	12	50.2 Å²	50.2	8%	0.078	28%	0.283	C	S	.	.	H	α-helix	trans	-61.7	-35.9	177.3	-22.2	32.1	0	0	0	113.6	L97 V105 F155 R156 F159	L97-P101 WeakPolarHBondContact O-CD 3.42Å; P101-V105 WeakPolarHBondContact O-CG2 3.01Å; P101-V105 PolarHBondContact O-N 3.4Å; P101-V105 VanDerWaalsContact O-N 3.1Å; P101-F155 HydrophobicContact CB-CB 4.39Å; P101-F155 HydrophobicContact CG-CB 3.9Å; P101-R156 HydrophobicContact CB-CG 4Å; P101-R156 HydrophobicContact CG-CG 4.11Å; P101-F159 HydrophobicContact CG-CD2 4.22Å; P101-F159 HydrophobicContact CG-CE2 3.92Å
102	A	85.4	Confident	87.8	Confident	28 Å²	28	55.8 Å²	55.8	23%	0.231	30%	0.304	C	S	.	.	H	α-helix	trans	-68	-43	178.3	0	0	0	0	0	111.4	S99 T100 V105 A106	S99-A102 WeakPolarHBondContact O-CB 3.21Å; S99-A102 PolarHBondContact O-N 3.43Å; T100-A102 VanDerWaalsContact C-N 3.31Å; T100-A102 PolarHBondContact O-N 3.19Å; A102-V105 PolarHBondContact O-N 2.91Å; A102-A106 PolarHBondContact O-N 3.42Å
103	L	84.8	Confident	87	Confident	86 Å²	86	57.3 Å²	57.3	45%	0.45	30%	0.303	S	S	.	.	H	α-helix	trans	-65.8	-39.9	176	-67.5	177	0	0	0	111.9	V23 S99 T100 V105 A106 M107	V23-L103 HydrophobicContact CG1-CD2 3.47Å; V23-L103 VanDerWaalsContact CG1-CD2 3.47Å; S99-L103 WeakPolarHBondContact O-CG 3.41Å; S99-L103 PolarHBondContact O-N 2.85Å; T100-L103 PolarHBondContact O-N 2.97Å; L103-V105 VanDerWaalsContact C-N 3.34Å; L103-V105 PolarHBondContact O-N 2.98Å; L103-A106 PolarHBondContact O-N 3.44Å; L103-M107 VanDerWaalsContact O-CB 3.31Å; L103-M107 WeakPolarHBondContact O-CB 3.16Å; L103-M107 PolarHBondContact O-N 3.13Å
104	L	86.9	Confident	86.4	Confident	105 Å²	105	59 Å²	59	55%	0.55	31%	0.308	S	S	.	.	H	α-helix	trans	-62	-41.3	175.8	-72.9	175.4	0	0	0	111.9	T100 M107 H108	T100-L104 HydrophobicContact CG2-CD1 4.04Å; T100-L104 HydrophobicContact CG2-CG 4.31Å; T100-L104 WeakPolarHBondContact O-CB 3.29Å; T100-L104 VanDerWaalsContact O-CG 3.28Å; T100-L104 WeakPolarHBondContact O-CG 3.21Å; T100-L104 PolarHBondContact O-N 3.37Å; L104-M107 PolarHBondContact O-N 2.89Å; L104-H108 WeakPolarHBondContact O-CB 3.3Å; L104-H108 PolarHBondContact O-N 3.29Å
105	V	84.6	Confident	85.9	Confident	19 Å²	19	61.7 Å²	61.7	12%	0.115	32%	0.322	C	S	.	.	H	α-helix	trans	-64.8	-44.9	173.8	168.1	0	0	0	0	111.4	P101 A102 L103 M107 H108 V109 Y149 S152	P101-V105 WeakPolarHBondContact O-CG2 3.01Å; P101-V105 PolarHBondContact O-N 3.4Å; P101-V105 VanDerWaalsContact O-N 3.1Å; A102-V105 PolarHBondContact O-N 2.91Å; L103-V105 VanDerWaalsContact C-N 3.34Å; L103-V105 PolarHBondContact O-N 2.98Å; V105-M107 VanDerWaalsContact C-N 3.3Å; V105-M107 PolarHBondContact O-N 3.03Å; V105-H108 PolarHBondContact O-N 2.83Å; V105-V109 WeakPolarHBondContact O-CB 3.49Å; V105-V109 WeakPolarHBondContact O-CG2 3.5Å; V105-V109 PolarHBondContact O-N 2.91Å; V105-Y149 HydrophobicContact CG1-CD2 4.03Å; V105-S152 VanDerWaalsContact CG2-CB 3.45Å; V105-S152 WeakPolarHBondContact CG2-OG 3.39Å
106	A	81.1	Confident	85.4	Confident	23 Å²	23	64.5 Å²	64.5	19%	0.19	34%	0.337	C	S	.	.	H	α-helix	trans	-60.3	-42.6	177.5	0	0	0	0	0	111.4	V27 A102 L103 V109 A110	V27-A106 HydrophobicContact CG2-CB 3.9Å; A102-A106 PolarHBondContact O-N 3.42Å; L103-A106 PolarHBondContact O-N 3.44Å; A106-V109 PolarHBondContact O-N 3.39Å; A106-A110 WeakPolarHBondContact O-CB 3.46Å; A106-A110 PolarHBondContact O-N 3.34Å
107	M	83.4	Confident	84.9	Confident	133 Å²	133	64 Å²	64	66%	0.655	33%	0.332	S	S	*	.	H	α-helix	trans	-63.2	-46.1	174.4	-179.9	179.9	-94.7	0	0	111.5	L103 L104 V105 V109 A110 H111	L103-M107 VanDerWaalsContact O-CB 3.31Å; L103-M107 WeakPolarHBondContact O-CB 3.16Å; L103-M107 PolarHBondContact O-N 3.13Å; L104-M107 PolarHBondContact O-N 2.89Å; V105-M107 VanDerWaalsContact C-N 3.3Å; V105-M107 PolarHBondContact O-N 3.03Å; M107-V109 VanDerWaalsContact C-N 3.31Å; M107-V109 PolarHBondContact O-N 3.45Å; M107-A110 PolarHBondContact O-N 2.99Å; M107-H111 VanDerWaalsContact O-CB 3.29Å; M107-H111 WeakPolarHBondContact O-CB 3.36Å; M107-H111 PolarHBondContact O-N 2.69Å
108	H	82.4	Confident	84.5	Confident	50 Å²	50	67 Å²	67	23%	0.231	34%	0.342	C	S	.	.	H	α-helix	trans	-59.8	-42.1	177.1	176.7	-117.4	0	0	0	111.7	L104 V105 H111 R112	L104-H108 WeakPolarHBondContact O-CB 3.3Å; L104-H108 PolarHBondContact O-N 3.29Å; V105-H108 PolarHBondContact O-N 2.83Å; H108-H111 PolarHBondContact O-N 3.29Å; H108-R112 PolarHBondContact NE2-NE 3.32Å; H108-R112 WeakPolarHBondContact O-CB 3.42Å; H108-R112 VanDerWaalsContact O-CG 3.28Å; H108-R112 WeakPolarHBondContact O-CG 3.31Å; H108-R112 PolarHBondContact O-N 3.44Å
109	V	81.9	Confident	84.1	Confident	30 Å²	30	71.9 Å²	71.9	18%	0.182	37%	0.367	C	S	.	.	H	α-helix	trans	-62.5	-47	174.2	163.9	0	0	0	0	111.6	V105 A106 M107 H111 R113 M139 L145	V105-V109 WeakPolarHBondContact O-CB 3.49Å; V105-V109 WeakPolarHBondContact O-CG2 3.5Å; V105-V109 PolarHBondContact O-N 2.91Å; A106-V109 PolarHBondContact O-N 3.39Å; M107-V109 VanDerWaalsContact C-N 3.31Å; M107-V109 PolarHBondContact O-N 3.45Å; V109-H111 VanDerWaalsContact C-N 3.35Å; V109-R113 WeakPolarHBondContact O-CG 3.38Å; V109-R113 PolarHBondContact O-N 3.49Å; V109-R113 VanDerWaalsContact O-N 3.09Å; V109-M139 HydrophobicContact CB-CE 4.29Å; V109-M139 HydrophobicContact CG1-CE 3.68Å; V109-M139 HydrophobicContact CG2-CE 4.29Å; V109-L145 HydrophobicContact CG2-CD1 3.52Å; V109-L145 HydrophobicContact CG2-CD2 4.4Å
110	A	81	Confident	83.7	Confident	59 Å²	59	72.9 Å²	72.9	49%	0.488	37%	0.368	S	S	.	.	H	α-helix	trans	-63.2	-42.6	178.7	0	0	0	0	0	111.5	A106 M107 R113 H114	A106-A110 WeakPolarHBondContact O-CB 3.46Å; A106-A110 PolarHBondContact O-N 3.34Å; M107-A110 PolarHBondContact O-N 2.99Å; A110-R113 PolarHBondContact O-N 2.89Å; A110-H114 WeakPolarHBondContact O-CB 3.49Å; A110-H114 PolarHBondContact O-N 3.47Å
111	H	83.3	Confident	83.3	Confident	114 Å²	114	76.1 Å²	76.1	53%	0.528	38%	0.377	S	S	.	.	H	α-helix	trans	-63	-49.3	177.5	-178.8	-92.8	0	0	0	111.7	M107 H108 V109 R113 H114 I115	M107-H111 VanDerWaalsContact O-CB 3.29Å; M107-H111 WeakPolarHBondContact O-CB 3.36Å; M107-H111 PolarHBondContact O-N 2.69Å; H108-H111 PolarHBondContact O-N 3.29Å; V109-H111 VanDerWaalsContact C-N 3.35Å; H111-R113 VanDerWaalsContact C-N 3.33Å; H111-R113 PolarHBondContact O-N 2.98Å; H111-H114 WeakPolarHBondContact O-CB 3.31Å; H111-H114 PolarHBondContact O-N 3Å; H111-H114 VanDerWaalsContact O-N 3.1Å; H111-I115 WeakPolarHBondContact O-CG1 3.43Å; H111-I115 PolarHBondContact O-N 3.39Å
112	R	82.3	Confident	83	Confident	120 Å²	120	82 Å²	82	45%	0.453	41%	0.407	S	S	.	.	H	α-helix	trans	-53.7	-49.2	175.1	-78.3	-90.9	-178	172.3	-4.9	111.6	H108 H114 I115 D116	H108-R112 PolarHBondContact NE2-NE 3.32Å; H108-R112 WeakPolarHBondContact O-CB 3.42Å; H108-R112 VanDerWaalsContact O-CG 3.28Å; H108-R112 WeakPolarHBondContact O-CG 3.31Å; H108-R112 PolarHBondContact O-N 3.44Å; R112-H114 VanDerWaalsContact C-N 3.31Å; R112-H114 PolarHBondContact O-N 3.27Å; R112-I115 PolarHBondContact O-N 3Å; R112-D116 VanDerWaalsContact O-CG 3.29Å; R112-D116 PolarHBondContact O-N 3.49Å
113	R	78.9	Confident	82.8	Confident	63 Å²	63	84 Å²	84	24%	0.238	42%	0.419	C	S	.	.	H	α-helix	trans	-60.1	-39.7	177.1	-76.1	178.2	170.4	-176.1	-6.5	113.1	H30 V109 A110 H111 I115 K117 M139	H30-R113 PolarHBondContact CD2-NH2 2.49Å; H30-R113 PolarHBondContact CE1-NH2 3.13Å; H30-R113 VanDerWaalsContact CE1-NH2 3.29Å; H30-R113 PolarHBondContact NE2-NH1 2.96Å; H30-R113 VanDerWaalsContact NE2-NH1 3.17Å; H30-R113 PolarHBondContact NE2-NH2 3.01Å; V109-R113 WeakPolarHBondContact O-CG 3.38Å; V109-R113 PolarHBondContact O-N 3.49Å; V109-R113 VanDerWaalsContact O-N 3.09Å; A110-R113 PolarHBondContact O-N 2.89Å; H111-R113 VanDerWaalsContact C-N 3.33Å; H111-R113 PolarHBondContact O-N 2.98Å; R113-I115 VanDerWaalsContact C-N 3.35Å; R113-K117 VanDerWaalsContact O-CB 3.23Å; R113-K117 WeakPolarHBondContact O-CB 3.29Å; R113-K117 PolarHBondContact O-N 3.17Å; R113-M139 HydrophobicContact CG-CE 4.01Å; R113-M139 HydrophobicContact CG-SD 4.03Å
114	H	82.9	Confident	82.2	Confident	121 Å²	121	83 Å²	83	56%	0.56	43%	0.43	S	S	*	.	H	α-helix	trans	-63.8	-42.9	178.2	-177.6	-97.1	0	0	0	111.4	A110 H111 R112 K117 K118	A110-H114 WeakPolarHBondContact O-CB 3.49Å; A110-H114 PolarHBondContact O-N 3.47Å; H111-H114 WeakPolarHBondContact O-CB 3.31Å; H111-H114 PolarHBondContact O-N 3Å; H111-H114 VanDerWaalsContact O-N 3.1Å; R112-H114 VanDerWaalsContact C-N 3.31Å; R112-H114 PolarHBondContact O-N 3.27Å; H114-K117 PolarHBondContact O-N 2.9Å; H114-K118 PolarHBondContact O-N 3.25Å
115	I	85.1	Confident	81.2	Confident	67 Å²	67	86.2 Å²	86.2	34%	0.344	44%	0.435	S	S	.	.	H	α-helix	trans	-64.9	-48.2	175.6	-62.8	-62.4	0	0	0	111.3	H111 R112 R113 K117 K118 L119	H111-I115 WeakPolarHBondContact O-CG1 3.43Å; H111-I115 PolarHBondContact O-N 3.39Å; R112-I115 PolarHBondContact O-N 3Å; R113-I115 VanDerWaalsContact C-N 3.35Å; I115-K117 VanDerWaalsContact C-N 3.28Å; I115-K117 PolarHBondContact O-N 3.28Å; I115-K118 WeakPolarHBondContact O-CA 3.41Å; I115-K118 WeakPolarHBondContact O-CB 3.22Å; I115-K118 PolarHBondContact O-N 3.05Å; I115-L119 HydrophobicContact CG2-CD1 3.98Å; I115-L119 HydrophobicContact CG2-CG 4.33Å; I115-L119 WeakPolarHBondContact O-CG 3.38Å; I115-L119 PolarHBondContact O-N 3.32Å
116	D	81.9	Confident	80.3	Confident	72 Å²	72	89.4 Å²	89.4	39%	0.385	46%	0.463	S	S	.	.	H	α-helix	trans	-59.3	-41.3	178.8	-66.5	-19.2	0	0	0	111.2	R112 K118 L119 Y120	R112-D116 VanDerWaalsContact O-CG 3.29Å; R112-D116 PolarHBondContact O-N 3.49Å; D116-K118 VanDerWaalsContact C-N 3.33Å; D116-K118 PolarHBondContact O-N 3.1Å; D116-L119 PolarHBondContact O-N 2.92Å; D116-Y120 WeakPolarHBondContact O-CB 3.28Å; D116-Y120 PolarHBondContact O-N 2.7Å
117	K	82.1	Confident	79.9	Confident	91 Å²	91	92.4 Å²	92.4	40%	0.396	48%	0.476	S	S	.	.	H	α-helix	trans	-62.6	-38.7	174.7	-170	-178.3	-177.8	-179.3	0	112.1	R113 H114 I115 K121 L131	R113-K117 VanDerWaalsContact O-CB 3.23Å; R113-K117 WeakPolarHBondContact O-CB 3.29Å; R113-K117 PolarHBondContact O-N 3.17Å; H114-K117 PolarHBondContact O-N 2.9Å; I115-K117 VanDerWaalsContact C-N 3.28Å; I115-K117 PolarHBondContact O-N 3.28Å; K117-K121 WeakPolarHBondContact O-CG 3.23Å; K117-K121 PolarHBondContact O-N 3.14Å; K117-L131 HydrophobicContact CD-CD1 4.46Å; K117-L131 HydrophobicContact CG-CD1 3.78Å
118	K	85.4	Confident	79.2	Confident	129 Å²	129	90.7 Å²	90.7	56%	0.561	47%	0.474	S	S	*	.	H	α-helix	trans	-66.9	-49	176.7	-171.2	178.7	179.7	-177.4	0	110.5	H114 I115 D116 Y120 K121 L122	H114-K118 PolarHBondContact O-N 3.25Å; I115-K118 WeakPolarHBondContact O-CA 3.41Å; I115-K118 WeakPolarHBondContact O-CB 3.22Å; I115-K118 PolarHBondContact O-N 3.05Å; D116-K118 VanDerWaalsContact C-N 3.33Å; D116-K118 PolarHBondContact O-N 3.1Å; K118-Y120 VanDerWaalsContact C-N 3.33Å; K118-Y120 PolarHBondContact O-N 2.87Å; K118-K121 PolarHBondContact O-N 3.29Å; K118-L122 HydrophobicContact CG-CD1 3.88Å; K118-L122 WeakPolarHBondContact O-CD1 3.24Å; K118-L122 PolarHBondContact O-N 3.14Å; K118-L122 VanDerWaalsContact O-N 3.08Å
119	L	84.2	Confident	78.4	Confident	108 Å²	108	95.7 Å²	95.7	57%	0.565	50%	0.496	S	S	*	.	H	α-helix	trans	-59.6	-42.1	177.5	-68.6	172.9	0	0	0	112.1	I115 D116 K121 L122 S123	I115-L119 HydrophobicContact CG2-CD1 3.98Å; I115-L119 HydrophobicContact CG2-CG 4.33Å; I115-L119 WeakPolarHBondContact O-CG 3.38Å; I115-L119 PolarHBondContact O-N 3.32Å; D116-L119 PolarHBondContact O-N 2.92Å; L119-K121 PolarHBondContact O-N 3.17Å; L119-L122 PolarHBondContact O-N 3.39Å; L119-S123 PolarHBondContact O-N 3.41Å
120	Y	80.3	Confident	77.7	Confident	40 Å²	40	96.9 Å²	96.9	16%	0.157	50%	0.501	C	S	.	.	H	α-helix	trans	-58.9	-45.9	176	-170.5	-103.7	0	0	0	112.2	D116 K118 L122 S123 R125 D130 L131 I134	D116-Y120 WeakPolarHBondContact O-CB 3.28Å; D116-Y120 PolarHBondContact O-N 2.7Å; K118-Y120 VanDerWaalsContact C-N 3.33Å; K118-Y120 PolarHBondContact O-N 2.87Å; Y120-L122 VanDerWaalsContact C-N 3.34Å; Y120-L122 PolarHBondContact O-N 2.92Å; Y120-S123 PolarHBondContact O-N 2.9Å; Y120-S123 PolarHBondContact O-OG 3Å; Y120-R125 HydrophobicContact CE1-CB 4.25Å; Y120-R125 WeakPolarHBondContact CE1-O 3.28Å; Y120-R125 HydrophobicContact CE2-CB 4Å; Y120-R125 WeakPolarHBondContact OH-CB 3.42Å; Y120-D130 HydrophobicContact CE1-CB 3.99Å; Y120-D130 WeakPolarHBondContact OH-CB 3.49Å; Y120-D130 VanDerWaalsContact OH-CG 3.32Å; Y120-D130 PolarHBondContact OH-OD2 2.68Å; Y120-L131 HydrophobicContact CD1-CD1 4.11Å; Y120-I134 HydrophobicContact CD1-CD1 3.8Å; Y120-I134 HydrophobicContact CD2-CD1 3.58Å; Y120-I134 HydrophobicContact CE1-CD1 4.11Å; Y120-I134 HydrophobicContact CE2-CD1 3.93Å; Y120-I134 HydrophobicContact CG-CD1 3.53Å
121	K	82.3	Confident	76.9	Confident	128 Å²	128	96.4 Å²	96.4	56%	0.557	49%	0.49	S	S	*	.	H	α-helix	trans	-62.4	-38.2	176.1	-73.6	-179.8	174.4	-166.6	0	113	K117 K118 L119 S123	K117-K121 WeakPolarHBondContact O-CG 3.23Å; K117-K121 PolarHBondContact O-N 3.14Å; K118-K121 PolarHBondContact O-N 3.29Å; L119-K121 PolarHBondContact O-N 3.17Å; K121-S123 VanDerWaalsContact C-N 3.29Å; K121-S123 PolarHBondContact O-N 3.4Å
122	L	83.2	Confident	76	Confident	135 Å²	135	97.4 Å²	97.4	71%	0.707	50%	0.495	S	S	*	.	H	α-helix	trans	-68.9	-26.7	176.9	-88.8	85	0	0	0	112.8	K118 L119 Y120 G124	K118-L122 HydrophobicContact CG-CD1 3.88Å; K118-L122 WeakPolarHBondContact O-CD1 3.24Å; K118-L122 PolarHBondContact O-N 3.14Å; K118-L122 VanDerWaalsContact O-N 3.08Å; L119-L122 PolarHBondContact O-N 3.39Å; Y120-L122 VanDerWaalsContact C-N 3.34Å; Y120-L122 PolarHBondContact O-N 2.92Å; L122-G124 PolarHBondContact O-N 2.86Å; L122-G124 VanDerWaalsContact O-N 3.07Å
123	S	81.1	Confident	75.2	Confident	70 Å²	70	97.6 Å²	97.6	49%	0.49	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	4.9	179.5	74.7	0	0	0	0	114.9	L119 Y120 K121 R125	L119-S123 PolarHBondContact O-N 3.41Å; Y120-S123 PolarHBondContact O-N 2.9Å; Y120-S123 PolarHBondContact O-OG 3Å; K121-S123 VanDerWaalsContact C-N 3.29Å; K121-S123 PolarHBondContact O-N 3.4Å; S123-R125 PolarHBondContact O-N 3.3Å; S123-R125 VanDerWaalsContact O-N 3.16Å
124	G	72.3	Confident	74.4	Confident	65 Å²	65	97 Å²	97	67%	0.67	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.2	-4.1	-179.9	0	0	0	0	0	114.7	L122 A126	L122-G124 PolarHBondContact O-N 2.86Å; L122-G124 VanDerWaalsContact O-N 3.07Å; G124-A126 PolarHBondContact O-N 3.01Å; G124-A126 VanDerWaalsContact O-N 3.1Å
125	R	66.3	Low	73.3	Confident	174 Å²	174	98.6 Å²	98.6	66%	0.657	51%	0.507	S	S	*	.			trans	-83.7	77.2	175.9	-65.2	-175.7	176.2	174.4	-0.5	110.5	Y120 S123 N127	Y120-R125 HydrophobicContact CE1-CB 4.25Å; Y120-R125 WeakPolarHBondContact CE1-O 3.28Å; Y120-R125 HydrophobicContact CE2-CB 4Å; Y120-R125 WeakPolarHBondContact OH-CB 3.42Å; S123-R125 PolarHBondContact O-N 3.3Å; S123-R125 VanDerWaalsContact O-N 3.16Å; R125-N127 VanDerWaalsContact C-N 3.3Å; R125-N127 PolarHBondContact O-N 3.26Å
126	A	64.3	Low	71.9	Confident	86 Å²	86	99.3 Å²	99.3	71%	0.711	52%	0.515	S	S	*	.			trans	-90	28.9	-176.8	0	0	0	0	0	114.1	G124 P128	G124-A126 PolarHBondContact O-N 3.01Å; G124-A126 VanDerWaalsContact O-N 3.1Å; A126-P128 VanDerWaalsContact O-CD 3.29Å; A126-P128 WeakPolarHBondContact O-CD 3.5Å
127	N	73.9	Confident	70.7	Confident	86 Å²	86	101.8 Å²	101.8	46%	0.46	52%	0.524	S	S	.	.			trans	-76	119.7	179.8	-150.4	-6.1	0	0	0	109.8	R125 K129 D130 L131	R125-N127 VanDerWaalsContact C-N 3.3Å; R125-N127 PolarHBondContact O-N 3.26Å; N127-K129 PolarHBondContact O-N 3.47Å; N127-D130 WeakPolarHBondContact CB-OD2 3.34Å; N127-D130 PolarHBondContact O-N 2.91Å; N127-L131 PolarHBondContact O-N 3.48Å
128	P	68.1	Low	69.3	Low	96 Å²	96	105.3 Å²	105.3	62%	0.623	54%	0.539	S	S	*	.	H	α-helix	trans	-60.5	-28.3	-176.3	18.8	-31.2	0	0	0	113.6	A126 L131 E132	A126-P128 VanDerWaalsContact O-CD 3.29Å; A126-P128 WeakPolarHBondContact O-CD 3.5Å; P128-L131 PolarHBondContact O-N 2.93Å; P128-E132 PolarHBondContact O-N 3.15Å; P128-E132 VanDerWaalsContact O-N 3.14Å
129	K	66.1	Low	67.8	Low	156 Å²	156	101.7 Å²	101.7	68%	0.678	53%	0.525	S	S	*	.	H	α-helix	trans	-64.9	-40.4	177.7	-65.9	-175.5	178.1	-179.3	0	112.7	N127 E132 Q133	N127-K129 PolarHBondContact O-N 3.47Å; K129-E132 PolarHBondContact O-N 3.35Å; K129-Q133 WeakPolarHBondContact O-CB 3.19Å; K129-Q133 PolarHBondContact O-N 2.86Å
130	D	66.1	Low	66.3	Low	55 Å²	55	105.4 Å²	105.4	29%	0.294	54%	0.537	S	S	.	.	H	α-helix	trans	-72.4	-32.3	178.9	-61.2	-33.6	0	0	0	111.8	Y120 N127 E132 Q133 I134	Y120-D130 HydrophobicContact CE1-CB 3.99Å; Y120-D130 WeakPolarHBondContact OH-CB 3.49Å; Y120-D130 VanDerWaalsContact OH-CG 3.32Å; Y120-D130 PolarHBondContact OH-OD2 2.68Å; N127-D130 WeakPolarHBondContact CB-OD2 3.34Å; N127-D130 PolarHBondContact O-N 2.91Å; D130-E132 VanDerWaalsContact C-N 3.33Å; D130-Q133 WeakPolarHBondContact O-CB 3.28Å; D130-Q133 PolarHBondContact O-N 3.3Å; D130-I134 VanDerWaalsContact O-CG1 3.31Å; D130-I134 WeakPolarHBondContact O-CG1 3.46Å; D130-I134 PolarHBondContact O-N 3.3Å
131	L	64.9	Low	65.3	Low	49 Å²	49	105.4 Å²	105.4	26%	0.257	54%	0.539	S	S	.	.	H	α-helix	trans	-65.5	-39	174.8	-161	78.4	0	0	0	111.5	K117 Y120 N127 P128 Q133 K135	K117-L131 HydrophobicContact CD-CD1 4.46Å; K117-L131 HydrophobicContact CG-CD1 3.78Å; Y120-L131 HydrophobicContact CD1-CD1 4.11Å; N127-L131 PolarHBondContact O-N 3.48Å; P128-L131 PolarHBondContact O-N 2.93Å; L131-Q133 VanDerWaalsContact C-N 3.34Å; L131-K135 PolarHBondContact O-N 3.41Å; L131-K135 VanDerWaalsContact O-N 3.12Å
132	E	65.2	Low	64.1	Low	135 Å²	135	102.3 Å²	102.3	63%	0.631	54%	0.537	S	S	*	.	H	α-helix	trans	-67.4	-38.1	173	-136.1	-172.3	176.6	0	0	111.2	P128 K129 D130 K135 T136	P128-E132 PolarHBondContact O-N 3.15Å; P128-E132 VanDerWaalsContact O-N 3.14Å; K129-E132 PolarHBondContact O-N 3.35Å; D130-E132 VanDerWaalsContact C-N 3.33Å; E132-K135 WeakPolarHBondContact O-CB 3.11Å; E132-K135 PolarHBondContact O-N 2.95Å; E132-T136 WeakPolarHBondContact O-CB 3.2Å; E132-T136 PolarHBondContact O-N 2.91Å; E132-T136 PolarHBondContact O-OG1 3.41Å
133	Q	64	Low	63.5	Low	123 Å²	123	98.5 Å²	98.5	58%	0.575	53%	0.531	S	S	*	.	H	α-helix	trans	-65	-43	175.5	-156	168.4	-4.5	0	0	111.6	K129 D130 L131 K135 T136 Q137	K129-Q133 WeakPolarHBondContact O-CB 3.19Å; K129-Q133 PolarHBondContact O-N 2.86Å; D130-Q133 WeakPolarHBondContact O-CB 3.28Å; D130-Q133 PolarHBondContact O-N 3.3Å; L131-Q133 VanDerWaalsContact C-N 3.34Å; Q133-K135 VanDerWaalsContact C-N 3.33Å; Q133-K135 PolarHBondContact O-N 3.44Å; Q133-T136 CarbonylContact O-C 3.48Å; Q133-T136 PolarHBondContact O-N 2.83Å; Q133-T136 VanDerWaalsContact O-N 3.1Å; Q133-Q137 WeakPolarHBondContact O-CA 3.41Å; Q133-Q137 VanDerWaalsContact O-CB 3.3Å; Q133-Q137 WeakPolarHBondContact O-CB 3.36Å; Q133-Q137 PolarHBondContact O-N 3.47Å
134	I	63.5	Low	63	Low	50 Å²	50	97.7 Å²	97.7	26%	0.256	53%	0.528	S	S	.	.	H	α-helix	trans	-62.1	-38.5	174	-68.5	164.2	0	0	0	111.6	Y120 D130 T136	Y120-I134 HydrophobicContact CD1-CD1 3.8Å; Y120-I134 HydrophobicContact CD2-CD1 3.58Å; Y120-I134 HydrophobicContact CE1-CD1 4.11Å; Y120-I134 HydrophobicContact CE2-CD1 3.93Å; Y120-I134 HydrophobicContact CG-CD1 3.53Å; D130-I134 VanDerWaalsContact O-CG1 3.31Å; D130-I134 WeakPolarHBondContact O-CG1 3.46Å; D130-I134 PolarHBondContact O-N 3.3Å; I134-T136 VanDerWaalsContact C-N 3.26Å; I134-T136 PolarHBondContact O-N 2.85Å
135	K	59.3	Low	63.1	Low	155 Å²	155	95.9 Å²	95.9	67%	0.674	50%	0.503	S	S	*	.	H	α-helix	trans	-65.5	-31.9	175.3	-170.9	-179.1	178.4	-172.1	0	112	L131 E132 Q133	L131-K135 PolarHBondContact O-N 3.41Å; L131-K135 VanDerWaalsContact O-N 3.12Å; E132-K135 WeakPolarHBondContact O-CB 3.11Å; E132-K135 PolarHBondContact O-N 2.95Å; Q133-K135 VanDerWaalsContact C-N 3.33Å; Q133-K135 PolarHBondContact O-N 3.44Å
136	T	55.3	Low	63.6	Low	83 Å²	83	90.5 Å²	90.5	51%	0.509	48%	0.483	S	S	.	.	H	α-helix	trans	-95.8	-18.8	-175.6	-44.2	0	0	0	0	112.4	E132 Q133 I134 K138	E132-T136 WeakPolarHBondContact O-CB 3.2Å; E132-T136 PolarHBondContact O-N 2.91Å; E132-T136 PolarHBondContact O-OG1 3.41Å; Q133-T136 CarbonylContact O-C 3.48Å; Q133-T136 PolarHBondContact O-N 2.83Å; Q133-T136 VanDerWaalsContact O-N 3.1Å; I134-T136 VanDerWaalsContact C-N 3.26Å; I134-T136 PolarHBondContact O-N 2.85Å; T136-K138 PolarHBondContact O-N 2.99Å
137	Q	56.9	Low	64.4	Low	123 Å²	123	94 Å²	94	58%	0.575	48%	0.478	S	S	*	.	S	Bend	trans	-63	119.9	-179.1	-143.3	175.4	-30	0	0	108.9	Q133 M139	Q133-Q137 WeakPolarHBondContact O-CA 3.41Å; Q133-Q137 VanDerWaalsContact O-CB 3.3Å; Q133-Q137 WeakPolarHBondContact O-CB 3.36Å; Q133-Q137 PolarHBondContact O-N 3.47Å; Q137-M139 PolarHBondContact O-N 3.48Å
138	K	52.3	Low	64.9	Low	165 Å²	165	92 Å²	92	72%	0.717	47%	0.469	S	S	*	.			trans	-61.9	105.8	170	-72.2	-178.8	179.1	175.9	0	106.8	T136 K140	T136-K138 PolarHBondContact O-N 2.99Å; K138-K140 PolarHBondContact O-N 2.75Å
139	M	53.9	Low	65.6	Low	54 Å²	54	88.6 Å²	88.6	27%	0.266	44%	0.443	S	S	.	.			trans	-56.6	115.5	171.2	-74.4	-154.4	-58.2	0	0	106.8	V109 R113 Q137 I141 L145	V109-M139 HydrophobicContact CB-CE 4.29Å; V109-M139 HydrophobicContact CG1-CE 3.68Å; V109-M139 HydrophobicContact CG2-CE 4.29Å; R113-M139 HydrophobicContact CG-CE 4.01Å; R113-M139 HydrophobicContact CG-SD 4.03Å; Q137-M139 PolarHBondContact O-N 3.48Å; M139-I141 PolarHBondContact O-N 2.92Å; M139-I141 VanDerWaalsContact O-N 3.17Å; M139-L145 HydrophobicContact CE-CD2 4.14Å
140	K	53.2	Low	66.6	Low	186 Å²	186	82.5 Å²	82.5	81%	0.809	42%	0.418	S	S	*	.			trans	-61	122.4	173.9	-72	179.2	178.2	176.4	0	105.9	K138 A142	K138-K140 PolarHBondContact O-N 2.75Å; K140-A142 HydrophobicContact CB-CB 4.46Å; K140-A142 PolarHBondContact O-N 3.43Å
141	I	58.2	Low	67.7	Low	39 Å²	39	83.9 Å²	83.9	20%	0.2	43%	0.425	C	S	.	.			trans	-64.3	92.2	170.4	-59.1	170.8	0	0	0	106.1	S31 M139 W146	S31-I141 WeakPolarHBondContact OG-CD1 3.28Å; M139-I141 PolarHBondContact O-N 2.92Å; M139-I141 VanDerWaalsContact O-N 3.17Å; I141-W146 HydrophobicContact CG2-CB 3.77Å; I141-W146 HydrophobicContact CG2-CG 4.12Å
142	A	57.4	Low	68.8	Low	64 Å²	64	82 Å²	82	53%	0.529	42%	0.415	S	S	.	.			trans	-144.7	144.3	-176.1	0	0	0	0	0	109.3	K140	K140-A142 HydrophobicContact CB-CB 4.46Å; K140-A142 PolarHBondContact O-N 3.43Å
143	G	70.8	Confident	70	Confident	55 Å²	55	75.6 Å²	75.6	57%	0.567	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.4	-134.1	-179.5	0	0	0	0	0	113.6	L145 W146	G143-L145 VanDerWaalsContact C-N 3.26Å; G143-L145 PolarHBondContact O-N 2.71Å; G143-W146 WeakPolarHBondContact O-CB 2.9Å; G143-W146 PolarHBondContact O-N 3.14Å; G143-W146 VanDerWaalsContact O-N 3.11Å
144	A	70.1	Confident	71.3	Confident	52 Å²	52	75.6 Å²	75.6	43%	0.43	38%	0.384	S	S	.	.	H	α-helix	trans	-58.6	-31.6	-173.8	0	0	0	0	0	114.3	W146 W147 T148	A144-W146 VanDerWaalsContact C-N 3.31Å; A144-W146 PolarHBondContact O-N 3.29Å; A144-W147 PolarHBondContact O-N 3.43Å; A144-T148 PolarHBondContact O-N 2.97Å; A144-T148 VanDerWaalsContact O-N 3.09Å; A144-T148 PolarHBondContact O-OG1 3.27Å
145	L	75	Confident	72.8	Confident	27 Å²	27	77.5 Å²	77.5	14%	0.141	39%	0.39	C	S	.	.	H	α-helix	trans	-66.8	-34	179.4	-175.6	63.8	0	0	0	112.1	V109 M139 G143 T148 Y149	V109-L145 HydrophobicContact CG2-CD1 3.52Å; V109-L145 HydrophobicContact CG2-CD2 4.4Å; M139-L145 HydrophobicContact CE-CD2 4.14Å; G143-L145 VanDerWaalsContact C-N 3.26Å; G143-L145 PolarHBondContact O-N 2.71Å; L145-T148 WeakPolarHBondContact CA-OG1 3.21Å; L145-T148 PolarHBondContact O-OG1 2.91Å; L145-Y149 WeakPolarHBondContact O-CB 2.84Å; L145-Y149 PolarHBondContact O-N 2.74Å; L145-Y149 VanDerWaalsContact O-N 3.14Å
146	W	77.4	Confident	74.4	Confident	62 Å²	62	71.7 Å²	71.7	24%	0.235	36%	0.364	C	S	.	.	H	α-helix	trans	-65.5	-45.4	175.9	-175.1	82.8	0	0	0	111	I141 G143 A144 Y149 I150 A230	I141-W146 HydrophobicContact CG2-CB 3.77Å; I141-W146 HydrophobicContact CG2-CG 4.12Å; G143-W146 WeakPolarHBondContact O-CB 2.9Å; G143-W146 PolarHBondContact O-N 3.14Å; G143-W146 VanDerWaalsContact O-N 3.11Å; A144-W146 VanDerWaalsContact C-N 3.31Å; A144-W146 PolarHBondContact O-N 3.29Å; W146-Y149 WeakPolarHBondContact O-CB 3.4Å; W146-Y149 PolarHBondContact O-N 3.37Å; W146-Y149 VanDerWaalsContact O-N 3.17Å; W146-I150 HydrophobicContact CD2-CG1 4.04Å; W146-I150 HydrophobicContact CE3-CG1 4.28Å; W146-I150 HydrophobicContact CH2-CG1 4.13Å; W146-I150 HydrophobicContact CZ2-CD1 4.13Å; W146-I150 HydrophobicContact CZ2-CG1 3.87Å; W146-I150 HydrophobicContact CZ3-CG1 4.32Å; W146-I150 WeakPolarHBondContact O-CG1 3.25Å; W146-I150 PolarHBondContact O-N 2.99Å; W146-A230 HydrophobicContact CZ2-CB 4.11Å
147	W	81.8	Confident	76.2	Confident	159 Å²	159	69.2 Å²	69.2	60%	0.602	35%	0.348	S	S	*	.	H	α-helix	trans	-60.8	-47	176.5	-78.6	107.2	0	0	0	112.7	A144 Y149 I150 I151	A144-W147 PolarHBondContact O-N 3.43Å; W147-Y149 PolarHBondContact O-N 2.99Å; W147-I150 PolarHBondContact O-N 3.46Å; W147-I151 WeakPolarHBondContact O-CB 3.33Å; W147-I151 VanDerWaalsContact O-CG1 3.26Å; W147-I151 WeakPolarHBondContact O-CG1 3.42Å; W147-I151 PolarHBondContact O-N 3.4Å
148	T	83.9	Confident	78.1	Confident	45 Å²	45	66.3 Å²	66.3	28%	0.276	34%	0.335	S	S	.	.	H	α-helix	trans	-60.6	-32.3	176.7	55.3	0	0	0	0	112.6	A144 L145 S152	A144-T148 PolarHBondContact O-N 2.97Å; A144-T148 VanDerWaalsContact O-N 3.09Å; A144-T148 PolarHBondContact O-OG1 3.27Å; L145-T148 WeakPolarHBondContact CA-OG1 3.21Å; L145-T148 PolarHBondContact O-OG1 2.91Å; T148-S152 WeakPolarHBondContact O-CB 3.23Å; T148-S152 PolarHBondContact O-N 2.88Å; T148-S152 VanDerWaalsContact O-N 3.1Å
149	Y	83.2	Confident	80.2	Confident	23 Å²	23	60.8 Å²	60.8	9%	0.09	31%	0.312	C	S	.	.	H	α-helix	trans	-72.7	-46.1	177.3	-166.1	-102	0	0	0	112.4	R36 V105 L145 W146 W147 I151 S152 L153 E222 L226	R36-Y149 PolarHBondContact NH2-OH 2.9Å; R36-Y149 VanDerWaalsContact NH2-OH 3.13Å; V105-Y149 HydrophobicContact CG1-CD2 4.03Å; L145-Y149 WeakPolarHBondContact O-CB 2.84Å; L145-Y149 PolarHBondContact O-N 2.74Å; L145-Y149 VanDerWaalsContact O-N 3.14Å; W146-Y149 WeakPolarHBondContact O-CB 3.4Å; W146-Y149 PolarHBondContact O-N 3.37Å; W146-Y149 VanDerWaalsContact O-N 3.17Å; W147-Y149 PolarHBondContact O-N 2.99Å; Y149-I151 VanDerWaalsContact C-N 3.34Å; Y149-I151 PolarHBondContact O-N 3.42Å; Y149-S152 PolarHBondContact O-N 2.61Å; Y149-S152 PolarHBondContact O-OG 3.12Å; Y149-L153 HydrophobicContact CD1-CD1 3.81Å; Y149-L153 HydrophobicContact CD1-CG 4.22Å; Y149-L153 HydrophobicContact CE1-CD1 3.54Å; Y149-L153 HydrophobicContact CE1-CD2 4.37Å; Y149-L153 HydrophobicContact CE1-CG 4.02Å; Y149-L153 WeakPolarHBondContact O-CG 3.39Å; Y149-L153 PolarHBondContact O-N 3.01Å; Y149-E222 HydrophobicContact CE1-CG 4.42Å; Y149-E222 WeakPolarHBondContact CE1-OE1 3.15Å; Y149-E222 VanDerWaalsContact OH-CD 3.26Å; Y149-E222 PolarHBondContact OH-OE1 3.31Å; Y149-L226 HydrophobicContact CD1-CD1 3.58Å; Y149-L226 HydrophobicContact CE1-CD1 3.57Å
150	I	85.3	Confident	82.2	Confident	29 Å²	29	58.3 Å²	58.3	15%	0.149	30%	0.299	C	S	.	.	H	α-helix	trans	-62.6	-43.9	177.9	-68.1	-65.4	0	0	0	110.8	W146 W147 S152 L153 F154 L226	W146-I150 HydrophobicContact CD2-CG1 4.04Å; W146-I150 HydrophobicContact CE3-CG1 4.28Å; W146-I150 HydrophobicContact CH2-CG1 4.13Å; W146-I150 HydrophobicContact CZ2-CD1 4.13Å; W146-I150 HydrophobicContact CZ2-CG1 3.87Å; W146-I150 HydrophobicContact CZ3-CG1 4.32Å; W146-I150 WeakPolarHBondContact O-CG1 3.25Å; W146-I150 PolarHBondContact O-N 2.99Å; W147-I150 PolarHBondContact O-N 3.46Å; I150-S152 VanDerWaalsContact C-N 3.31Å; I150-S152 PolarHBondContact O-N 2.9Å; I150-L153 PolarHBondContact O-N 3.46Å; I150-F154 WeakPolarHBondContact O-CB 3.29Å; I150-F154 PolarHBondContact O-N 2.99Å; I150-L226 HydrophobicContact CD1-CB 4Å; I150-L226 HydrophobicContact CD1-CD1 3.8Å
151	I	89.1	Confident	84.3	Confident	84 Å²	84	52.4 Å²	52.4	43%	0.431	28%	0.278	S	S	.	.	H	α-helix	trans	-60.6	-42.1	176.4	-68.5	168.4	0	0	0	110.6	W147 Y149 F154 F155	W147-I151 WeakPolarHBondContact O-CB 3.33Å; W147-I151 VanDerWaalsContact O-CG1 3.26Å; W147-I151 WeakPolarHBondContact O-CG1 3.42Å; W147-I151 PolarHBondContact O-N 3.4Å; Y149-I151 VanDerWaalsContact C-N 3.34Å; Y149-I151 PolarHBondContact O-N 3.42Å; I151-F154 WeakPolarHBondContact O-CB 3.5Å; I151-F154 PolarHBondContact O-N 3.41Å; I151-F155 HydrophobicContact CG2-CD2 3.65Å; I151-F155 HydrophobicContact CG2-CE2 3.5Å; I151-F155 VanDerWaalsContact CG2-CE2 3.5Å; I151-F155 VanDerWaalsContact O-CD2 3.22Å; I151-F155 WeakPolarHBondContact O-CD2 3.39Å; I151-F155 PolarHBondContact O-N 3.13Å
152	S	89.6	Confident	86.1	Confident	9 Å²	9	53.5 Å²	53.5	6%	0.063	29%	0.287	C	S	.	.	H	α-helix	trans	-66.3	-41	179	80.2	0	0	0	0	112.6	V105 T148 Y149 I150 F154 F155 R156	V105-S152 VanDerWaalsContact CG2-CB 3.45Å; V105-S152 WeakPolarHBondContact CG2-OG 3.39Å; T148-S152 WeakPolarHBondContact O-CB 3.23Å; T148-S152 PolarHBondContact O-N 2.88Å; T148-S152 VanDerWaalsContact O-N 3.1Å; Y149-S152 PolarHBondContact O-N 2.61Å; Y149-S152 PolarHBondContact O-OG 3.12Å; I150-S152 VanDerWaalsContact C-N 3.31Å; I150-S152 PolarHBondContact O-N 2.9Å; S152-F154 VanDerWaalsContact C-N 3.32Å; S152-F154 PolarHBondContact O-N 3.26Å; S152-F155 PolarHBondContact O-N 3.29Å; S152-R156 WeakPolarHBondContact O-CG 3.48Å; S152-R156 PolarHBondContact O-N 2.94Å
153	L	89.4	Confident	87.9	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61.5	-42.1	175	-69.6	179.4	0	0	0	111.6	Y149 I150 R156 I157 E222 V223 L226	Y149-L153 HydrophobicContact CD1-CD1 3.81Å; Y149-L153 HydrophobicContact CD1-CG 4.22Å; Y149-L153 HydrophobicContact CE1-CD1 3.54Å; Y149-L153 HydrophobicContact CE1-CD2 4.37Å; Y149-L153 HydrophobicContact CE1-CG 4.02Å; Y149-L153 WeakPolarHBondContact O-CG 3.39Å; Y149-L153 PolarHBondContact O-N 3.01Å; I150-L153 PolarHBondContact O-N 3.46Å; L153-R156 PolarHBondContact O-N 3.43Å; L153-I157 WeakPolarHBondContact O-CG1 3.5Å; L153-I157 PolarHBondContact O-N 2.85Å; L153-E222 HydrophobicContact CD1-CB 4.4Å; L153-E222 HydrophobicContact CD1-CG 3.93Å; L153-V223 HydrophobicContact CB-CG2 3.76Å; L153-V223 HydrophobicContact CD1-CG2 3.8Å; L153-V223 HydrophobicContact CG-CG2 4.43Å; L153-L226 HydrophobicContact CD1-CD1 3.93Å
154	F	91.8	Very high	89	Confident	123 Å²	123	52.2 Å²	52.2	54%	0.539	26%	0.256	S	S	.	.	H	α-helix	trans	-59.7	-49.3	176.3	177.1	-106.7	0	0	0	112	I150 I151 S152 R156 I157 I158	I150-F154 WeakPolarHBondContact O-CB 3.29Å; I150-F154 PolarHBondContact O-N 2.99Å; I151-F154 WeakPolarHBondContact O-CB 3.5Å; I151-F154 PolarHBondContact O-N 3.41Å; S152-F154 VanDerWaalsContact C-N 3.32Å; S152-F154 PolarHBondContact O-N 3.26Å; F154-R156 VanDerWaalsContact C-N 3.32Å; F154-R156 PolarHBondContact O-N 3.3Å; F154-I157 PolarHBondContact O-N 3.29Å; F154-I158 HydrophobicContact CD1-CD1 3.71Å; F154-I158 HydrophobicContact CD2-CD1 4.38Å; F154-I158 HydrophobicContact CE1-CD1 3.19Å; F154-I158 HydrophobicContact CE1-CG1 4.39Å; F154-I158 HydrophobicContact CE2-CD1 3.93Å; F154-I158 HydrophobicContact CE2-CG1 4.46Å; F154-I158 HydrophobicContact CG-CD1 4.3Å; F154-I158 HydrophobicContact CZ-CD1 3.34Å; F154-I158 HydrophobicContact CZ-CG1 4.3Å; F154-I158 WeakPolarHBondContact O-CG1 3.31Å; F154-I158 PolarHBondContact O-N 3.43Å
155	F	94.4	Very high	90.2	Very high	90 Å²	90	56.2 Å²	56.2	40%	0.395	26%	0.261	S	S	.	.	H	α-helix	trans	-61.7	-38.3	175.7	-81.2	-65.7	0	0	0	112.8	P101 I151 S152 I157 I158 F159	P101-F155 HydrophobicContact CB-CB 4.39Å; P101-F155 HydrophobicContact CG-CB 3.9Å; I151-F155 HydrophobicContact CG2-CD2 3.65Å; I151-F155 HydrophobicContact CG2-CE2 3.5Å; I151-F155 VanDerWaalsContact CG2-CE2 3.5Å; I151-F155 VanDerWaalsContact O-CD2 3.22Å; I151-F155 WeakPolarHBondContact O-CD2 3.39Å; I151-F155 PolarHBondContact O-N 3.13Å; S152-F155 PolarHBondContact O-N 3.29Å; F155-I157 PolarHBondContact O-N 2.92Å; F155-I158 PolarHBondContact O-N 2.89Å; F155-F159 HydrophobicContact CB-CD2 4.46Å; F155-F159 HydrophobicContact CB-CE2 4.09Å; F155-F159 HydrophobicContact CD1-CE2 4.46Å; F155-F159 HydrophobicContact CD1-CZ 4.22Å; F155-F159 WeakPolarHBondContact O-CD2 3.32Å; F155-F159 VanDerWaalsContact O-CG 3.29Å; F155-F159 WeakPolarHBondContact O-CG 3.48Å; F155-F159 PolarHBondContact O-N 3.1Å
156	R	92.6	Very high	91.1	Very high	33 Å²	33	58.3 Å²	58.3	13%	0.125	27%	0.272	C	S	.	.	H	α-helix	trans	-61.6	-43.8	176.1	-71.6	170	75.6	-157	-0.4	111.8	P101 S152 L153 F154 F159 E160 N219	P101-R156 HydrophobicContact CB-CG 4Å; P101-R156 HydrophobicContact CG-CG 4.11Å; S152-R156 WeakPolarHBondContact O-CG 3.48Å; S152-R156 PolarHBondContact O-N 2.94Å; L153-R156 PolarHBondContact O-N 3.43Å; F154-R156 VanDerWaalsContact C-N 3.32Å; F154-R156 PolarHBondContact O-N 3.3Å; R156-F159 PolarHBondContact O-N 3.2Å; R156-E160 WeakPolarHBondContact O-CB 3.17Å; R156-E160 VanDerWaalsContact O-CG 3.3Å; R156-E160 WeakPolarHBondContact O-CG 3.33Å; R156-E160 PolarHBondContact O-N 2.83Å; R156-N219 VanDerWaalsContact CZ-OD1 3.25Å; R156-N219 PolarHBondContact NH1-OD1 3.08Å; R156-N219 VanDerWaalsContact NH1-OD1 3.14Å
157	I	94.1	Very high	91.8	Very high	32 Å²	32	55.9 Å²	55.9	16%	0.164	26%	0.263	C	S	.	.	H	α-helix	trans	-63.3	-46.6	176	-66.2	164.7	0	0	0	110.2	L153 F154 F155 F159 E160 V161 N219 I220 V223	L153-I157 WeakPolarHBondContact O-CG1 3.5Å; L153-I157 PolarHBondContact O-N 2.85Å; F154-I157 PolarHBondContact O-N 3.29Å; F155-I157 PolarHBondContact O-N 2.92Å; I157-F159 PolarHBondContact O-N 3.22Å; I157-E160 PolarHBondContact O-N 3.32Å; I157-V161 HydrophobicContact CG2-CG2 4.21Å; I157-V161 WeakPolarHBondContact O-CB 3.47Å; I157-V161 VanDerWaalsContact O-CG2 3.29Å; I157-V161 WeakPolarHBondContact O-CG2 3.28Å; I157-V161 PolarHBondContact O-N 3.44Å; I157-N219 HydrophobicContact CD1-CB 4.03Å; I157-N219 HydrophobicContact CG1-CB 3.6Å; I157-I220 HydrophobicContact CD1-CG1 3.93Å; I157-I220 HydrophobicContact CG1-CG1 4.44Å; I157-V223 HydrophobicContact CD1-CG2 4.06Å
158	I	96.9	Very high	92.2	Very high	61 Å²	61	54.5 Å²	54.5	31%	0.313	26%	0.259	S	S	.	.	H	α-helix	trans	-57.7	-49.5	177.8	-74.2	173	0	0	0	111.1	F154 F155 V161 T162	F154-I158 HydrophobicContact CD1-CD1 3.71Å; F154-I158 HydrophobicContact CD2-CD1 4.38Å; F154-I158 HydrophobicContact CE1-CD1 3.19Å; F154-I158 HydrophobicContact CE1-CG1 4.39Å; F154-I158 HydrophobicContact CE2-CD1 3.93Å; F154-I158 HydrophobicContact CE2-CG1 4.46Å; F154-I158 HydrophobicContact CG-CD1 4.3Å; F154-I158 HydrophobicContact CZ-CD1 3.34Å; F154-I158 HydrophobicContact CZ-CG1 4.3Å; F154-I158 WeakPolarHBondContact O-CG1 3.31Å; F154-I158 PolarHBondContact O-N 3.43Å; F155-I158 PolarHBondContact O-N 2.89Å; I158-V161 PolarHBondContact O-N 3.28Å; I158-T162 VanDerWaalsContact O-CB 3.23Å; I158-T162 WeakPolarHBondContact O-CB 3.43Å; I158-T162 PolarHBondContact O-N 2.97Å; I158-T162 PolarHBondContact O-OG1 3.49Å
159	F	96.8	Very high	92.5	Very high	50 Å²	50	57.9 Å²	57.9	22%	0.219	27%	0.272	C	S	.	.	H	α-helix	trans	-63.6	-47.4	-179.2	-65.5	-38.8	0	0	0	111.2	L97 V98 P101 F155 R156 I157 V161 T162 F163	L97-F159 HydrophobicContact CB-CD2 4.21Å; L97-F159 HydrophobicContact CB-CG 4.23Å; L97-F159 WeakPolarHBondContact O-CD2 3.33Å; L97-F159 WeakPolarHBondContact O-CE2 3.12Å; V98-F159 HydrophobicContact CG2-CB 3.84Å; P101-F159 HydrophobicContact CG-CD2 4.22Å; P101-F159 HydrophobicContact CG-CE2 3.92Å; F155-F159 HydrophobicContact CB-CD2 4.46Å; F155-F159 HydrophobicContact CB-CE2 4.09Å; F155-F159 HydrophobicContact CD1-CE2 4.46Å; F155-F159 HydrophobicContact CD1-CZ 4.22Å; F155-F159 WeakPolarHBondContact O-CD2 3.32Å; F155-F159 VanDerWaalsContact O-CG 3.29Å; F155-F159 WeakPolarHBondContact O-CG 3.48Å; F155-F159 PolarHBondContact O-N 3.1Å; R156-F159 PolarHBondContact O-N 3.2Å; I157-F159 PolarHBondContact O-N 3.22Å; F159-V161 PolarHBondContact O-N 3.42Å; F159-T162 PolarHBondContact O-N 3.48Å; F159-F163 VanDerWaalsContact O-CD2 3.28Å; F159-F163 WeakPolarHBondContact O-CD2 3.29Å; F159-F163 PolarHBondContact O-N 3.1Å
160	E	95.8	Very high	92.9	Very high	2 Å²	2	59.7 Å²	59.7	1%	0.009	28%	0.283	C	S	.	.	H	α-helix	trans	-57	-48	176.7	-74.8	-78.4	-158.1	0	0	112.1	R46 Q94 V98 R156 I157 M164 I216	R46-E160 IonicContact CZ-OE1 2.74Å; R46-E160 VanDerWaalsContact CZ-OE1 3.31Å; R46-E160 IonicContact NH1-OE1 3.78Å; R46-E160 PolarHBondContact NH1-OE1 3.11Å; R46-E160 IonicContact NH1-OE2 2.91Å; R46-E160 PolarHBondContact NH1-OE2 2.83Å; R46-E160 IonicContact NH2-OE1 3.14Å; R46-E160 PolarHBondContact NH2-OE1 3.38Å; R46-E160 IonicContact NH2-OE2 3.31Å; Q94-E160 PolarHBondContact NE2-OE2 3.21Å; V98-E160 HydrophobicContact CG1-CG 4.22Å; V98-E160 HydrophobicContact CG2-CG 3.75Å; R156-E160 WeakPolarHBondContact O-CB 3.17Å; R156-E160 VanDerWaalsContact O-CG 3.3Å; R156-E160 WeakPolarHBondContact O-CG 3.33Å; R156-E160 PolarHBondContact O-N 2.83Å; I157-E160 PolarHBondContact O-N 3.32Å; E160-M164 VanDerWaalsContact O-CB 3.24Å; E160-M164 WeakPolarHBondContact O-CB 3.37Å; E160-M164 PolarHBondContact O-N 3.44Å; E160-I216 HydrophobicContact CB-CD1 3.98Å; E160-I216 HydrophobicContact CB-CG1 3.53Å; E160-I216 HydrophobicContact CG-CG1 4.26Å
161	V	96.8	Very high	93	Very high	61 Å²	61	59.2 Å²	59.2	37%	0.37	28%	0.28	S	S	.	.	H	α-helix	trans	-65.6	-42	179.5	171.7	0	0	0	0	111.3	I157 I158 F159 M164 Y165 I216	I157-V161 HydrophobicContact CG2-CG2 4.21Å; I157-V161 WeakPolarHBondContact O-CB 3.47Å; I157-V161 VanDerWaalsContact O-CG2 3.29Å; I157-V161 WeakPolarHBondContact O-CG2 3.28Å; I157-V161 PolarHBondContact O-N 3.44Å; I158-V161 PolarHBondContact O-N 3.28Å; F159-V161 PolarHBondContact O-N 3.42Å; V161-M164 PolarHBondContact O-N 2.95Å; V161-Y165 VanDerWaalsContact O-CB 3.28Å; V161-Y165 WeakPolarHBondContact O-CB 3.41Å; V161-Y165 PolarHBondContact O-N 3.26Å; V161-I216 HydrophobicContact CG2-CD1 4.04Å; V161-I216 HydrophobicContact CG2-CG1 4.45Å; V161-I216 HydrophobicContact CG2-CG2 4.4Å
162	T	96.6	Very high	92.4	Very high	62 Å²	62	60.9 Å²	60.9	38%	0.38	30%	0.296	S	S	.	.	H	α-helix	trans	-64.2	-47.1	-180	-58	0	0	0	0	110.9	I158 F159 Y165 L166	I158-T162 VanDerWaalsContact O-CB 3.23Å; I158-T162 WeakPolarHBondContact O-CB 3.43Å; I158-T162 PolarHBondContact O-N 2.97Å; I158-T162 PolarHBondContact O-OG1 3.49Å; F159-T162 PolarHBondContact O-N 3.48Å; T162-Y165 PolarHBondContact O-N 2.88Å; T162-L166 HydrophobicContact CG2-CD1 4.07Å; T162-L166 HydrophobicContact CG2-CG 4.37Å; T162-L166 WeakPolarHBondContact O-CB 3.31Å; T162-L166 VanDerWaalsContact O-CG 3.29Å; T162-L166 WeakPolarHBondContact O-CG 3.22Å; T162-L166 PolarHBondContact O-N 2.92Å
163	F	95.8	Very high	91.8	Very high	22 Å²	22	62.1 Å²	62.1	10%	0.096	31%	0.31	C	S	.	.	H	α-helix	trans	-66.2	-39.5	177.3	-86.1	-79.6	0	0	0	112.2	L93 Q94 L97 F159 Y165 L166 F167	L93-F163 HydrophobicContact CB-CE1 3.83Å; L93-F163 HydrophobicContact CB-CZ 3.89Å; Q94-F163 HydrophobicContact CB-CB 3.94Å; Q94-F163 HydrophobicContact CB-CD1 3.74Å; Q94-F163 HydrophobicContact CB-CD2 3.93Å; Q94-F163 HydrophobicContact CB-CE1 4.22Å; Q94-F163 HydrophobicContact CB-CE2 4.41Å; Q94-F163 HydrophobicContact CB-CG 3.58Å; Q94-F163 HydrophobicContact CG-CB 3.65Å; Q94-F163 HydrophobicContact CG-CD1 4.4Å; Q94-F163 HydrophobicContact CG-CD2 4.04Å; Q94-F163 HydrophobicContact CG-CG 3.78Å; L97-F163 HydrophobicContact CB-CE2 4.2Å; L97-F163 HydrophobicContact CD1-CE2 3.57Å; L97-F163 HydrophobicContact CD1-CZ 3.71Å; L97-F163 HydrophobicContact CG-CE2 4.43Å; F159-F163 VanDerWaalsContact O-CD2 3.28Å; F159-F163 WeakPolarHBondContact O-CD2 3.29Å; F159-F163 PolarHBondContact O-N 3.1Å; F163-Y165 VanDerWaalsContact C-N 3.31Å; F163-Y165 PolarHBondContact O-N 3.25Å; F163-L166 PolarHBondContact O-N 2.92Å; F163-F167 VanDerWaalsContact O-CB 3.23Å; F163-F167 WeakPolarHBondContact O-CB 3.32Å; F163-F167 PolarHBondContact O-N 3.09Å
164	M	93.6	Very high	91.2	Very high	70 Å²	70	69 Å²	69	35%	0.345	34%	0.337	S	S	.	.	H	α-helix	trans	-61.6	-41.4	174.2	-174.1	175.5	69.9	0	0	111.6	E160 V161 Y168 I216	E160-M164 VanDerWaalsContact O-CB 3.24Å; E160-M164 WeakPolarHBondContact O-CB 3.37Å; E160-M164 PolarHBondContact O-N 3.44Å; V161-M164 PolarHBondContact O-N 2.95Å; M164-Y168 PolarHBondContact O-N 3.44Å; M164-Y168 VanDerWaalsContact O-N 3.1Å; M164-I216 HydrophobicContact CE-CD1 3.8Å; M164-I216 HydrophobicContact SD-CD1 3.92Å
165	Y	93.8	Very high	90.9	Very high	137 Å²	137	71 Å²	71	54%	0.537	35%	0.346	S	S	.	.	H	α-helix	trans	-65.9	-49.2	175.7	176.9	-101.3	0	0	0	112.1	V161 T162 F163 F167 Y168 M169	V161-Y165 VanDerWaalsContact O-CB 3.28Å; V161-Y165 WeakPolarHBondContact O-CB 3.41Å; V161-Y165 PolarHBondContact O-N 3.26Å; T162-Y165 PolarHBondContact O-N 2.88Å; F163-Y165 VanDerWaalsContact C-N 3.31Å; F163-Y165 PolarHBondContact O-N 3.25Å; Y165-F167 VanDerWaalsContact C-N 3.27Å; Y165-F167 PolarHBondContact O-N 3.18Å; Y165-Y168 PolarHBondContact O-N 3.41Å; Y165-Y168 VanDerWaalsContact O-N 3.15Å; Y165-M169 HydrophobicContact CD1-CG 4.16Å; Y165-M169 HydrophobicContact CD2-CG 4.37Å; Y165-M169 HydrophobicContact CE1-CG 3.72Å; Y165-M169 HydrophobicContact CE2-CG 3.95Å; Y165-M169 HydrophobicContact CE2-SD 4.16Å; Y165-M169 HydrophobicContact CG-CG 4.47Å; Y165-M169 WeakPolarHBondContact O-CG 3.28Å; Y165-M169 PolarHBondContact O-N 3.2Å
166	L	93.8	Very high	90.5	Very high	70 Å²	70	68 Å²	68	37%	0.366	33%	0.333	S	S	.	.	H	α-helix	trans	-58	-41.4	176.2	-73	174.4	0	0	0	111.3	T162 F163 Y168 M169 I170	T162-L166 HydrophobicContact CG2-CD1 4.07Å; T162-L166 HydrophobicContact CG2-CG 4.37Å; T162-L166 WeakPolarHBondContact O-CB 3.31Å; T162-L166 VanDerWaalsContact O-CG 3.29Å; T162-L166 WeakPolarHBondContact O-CG 3.22Å; T162-L166 PolarHBondContact O-N 2.92Å; F163-L166 PolarHBondContact O-N 2.92Å; L166-Y168 PolarHBondContact O-N 3.37Å; L166-M169 PolarHBondContact O-N 2.99Å; L166-I170 WeakPolarHBondContact O-CB 3.38Å; L166-I170 VanDerWaalsContact O-CG1 3.22Å; L166-I170 WeakPolarHBondContact O-CG1 3.49Å; L166-I170 PolarHBondContact O-N 3.34Å
167	F	92.8	Very high	90.2	Very high	11 Å²	11	70.8 Å²	70.8	5%	0.048	35%	0.35	C	S	.	.	H	α-helix	trans	-60.4	-45.7	176.6	-171.3	-83.9	0	0	0	111.7	H87 W91 F163 Y165 M169 I170 Y171 T205 L209	H87-F167 HydrophobicContact CB-CE2 4.38Å; H87-F167 AromaticContact CD2-CE2 3.46Å; H87-F167 VanDerWaalsContact CD2-CE2 3.46Å; H87-F167 WeakPolarHBondContact CD2-CE2 3.38Å; H87-F167 AromaticContact CD2-CZ 3.37Å; H87-F167 WeakPolarHBondContact CD2-CZ 3.12Å; H87-F167 AromaticContact NE2-CZ 3.81Å; W91-F167 AromaticContact CE2-CE2 3.96Å; W91-F167 AromaticContact CZ2-CE2 3.87Å; W91-F167 HydrophobicContact CZ2-CE2 3.87Å; W91-F167 HydrophobicContact CZ2-CZ 4.15Å; W91-F167 AromaticContact NE1-CD2 3.87Å; W91-F167 AromaticContact NE1-CE2 3.67Å; F163-F167 VanDerWaalsContact O-CB 3.23Å; F163-F167 WeakPolarHBondContact O-CB 3.32Å; F163-F167 PolarHBondContact O-N 3.09Å; Y165-F167 VanDerWaalsContact C-N 3.27Å; Y165-F167 PolarHBondContact O-N 3.18Å; F167-M169 VanDerWaalsContact C-N 3.34Å; F167-M169 PolarHBondContact O-N 2.53Å; F167-I170 PolarHBondContact O-N 3.1Å; F167-Y171 HydrophobicContact CD1-CD2 4.34Å; F167-Y171 AromaticContact CD2-CD2 3.81Å; F167-Y171 HydrophobicContact CD2-CD2 3.81Å; F167-Y171 AromaticContact CD2-CE2 3.91Å; F167-Y171 HydrophobicContact CD2-CE2 3.91Å; F167-Y171 HydrophobicContact CE1-CD2 4.15Å; F167-Y171 AromaticContact CE2-CD2 3.61Å; F167-Y171 HydrophobicContact CE2-CD2 3.61Å; F167-Y171 AromaticContact CE2-CE2 3.74Å; F167-Y171 HydrophobicContact CE2-CE2 3.74Å; F167-Y171 HydrophobicContact CG-CD2 4.15Å; F167-Y171 AromaticContact CZ-CD2 3.77Å; F167-Y171 HydrophobicContact CZ-CD2 3.77Å; F167-Y171 HydrophobicContact CZ-CE2 4.32Å; F167-Y171 WeakPolarHBondContact O-CD2 3.35Å; F167-Y171 PolarHBondContact O-N 3.06Å; F167-T205 HydrophobicContact CE1-CG2 3.63Å; F167-T205 HydrophobicContact CE2-CG2 4.47Å; F167-T205 HydrophobicContact CZ-CG2 3.35Å; F167-L209 HydrophobicContact CD1-CD1 4.14Å; F167-L209 HydrophobicContact CD1-CD2 3.83Å; F167-L209 HydrophobicContact CD1-CG 4.42Å; F167-L209 HydrophobicContact CE1-CD1 3.88Å; F167-L209 HydrophobicContact CE1-CD2 4.24Å; F167-L209 HydrophobicContact CE1-CG 4.36Å; F167-L209 HydrophobicContact CG-CD2 4.28Å
168	Y	90.3	Very high	90	Very high	131 Å²	131	77.6 Å²	77.6	51%	0.514	37%	0.373	S	S	.	.	H	α-helix	trans	-66.3	-34.9	177.9	-174	-98.2	0	0	0	113	M164 Y165 L166	M164-Y168 PolarHBondContact O-N 3.44Å; M164-Y168 VanDerWaalsContact O-N 3.1Å; Y165-Y168 PolarHBondContact O-N 3.41Å; Y165-Y168 VanDerWaalsContact O-N 3.15Å; L166-Y168 PolarHBondContact O-N 3.37Å
169	M	91.1	Very high	89.8	Confident	115 Å²	115	78 Å²	78	57%	0.567	38%	0.375	S	S	*	.	H	α-helix	trans	-72.6	-38.7	177.6	-72.1	-64.5	-65.5	0	0	112.7	Y165 L166 F167	Y165-M169 HydrophobicContact CD1-CG 4.16Å; Y165-M169 HydrophobicContact CD2-CG 4.37Å; Y165-M169 HydrophobicContact CE1-CG 3.72Å; Y165-M169 HydrophobicContact CE2-CG 3.95Å; Y165-M169 HydrophobicContact CE2-SD 4.16Å; Y165-M169 HydrophobicContact CG-CG 4.47Å; Y165-M169 WeakPolarHBondContact O-CG 3.28Å; Y165-M169 PolarHBondContact O-N 3.2Å; L166-M169 PolarHBondContact O-N 2.99Å; F167-M169 VanDerWaalsContact C-N 3.34Å; F167-M169 PolarHBondContact O-N 2.53Å
170	I	90.7	Very high	89.7	Confident	61 Å²	61	75.8 Å²	75.8	31%	0.313	37%	0.366	S	S	.	.	H	α-helix	trans	-79.1	-40.1	-177.8	-65.4	167.2	0	0	0	111.1	L90 L166 F167 P172	L90-I170 HydrophobicContact CD1-CD1 4.07Å; L166-I170 WeakPolarHBondContact O-CB 3.38Å; L166-I170 VanDerWaalsContact O-CG1 3.22Å; L166-I170 WeakPolarHBondContact O-CG1 3.49Å; L166-I170 PolarHBondContact O-N 3.34Å; F167-I170 PolarHBondContact O-N 3.1Å; I170-P172 VanDerWaalsContact O-CD 3.29Å; I170-P172 WeakPolarHBondContact O-CD 3.48Å
171	Y	88.4	Confident	89.7	Confident	20 Å²	20	82.4 Å²	82.4	8%	0.078	40%	0.395	C	S	.	.	S	Bend	trans	-115.2	91.1	-178.7	-49.2	-70.2	0	0	0	110	F83 I85 H87 L90 F167 G173	F83-Y171 HydrophobicContact CD1-CE1 4.34Å; I85-Y171 PolarHBondContact O-OH 2.96Å; H87-Y171 AromaticContact CE1-CD1 3.46Å; H87-Y171 VanDerWaalsContact CE1-CD1 3.46Å; H87-Y171 WeakPolarHBondContact CE1-CD1 3.32Å; H87-Y171 AromaticContact CE1-CE1 3.32Å; H87-Y171 WeakPolarHBondContact CE1-CE1 3.37Å; H87-Y171 AromaticContact CE1-CE2 3.9Å; H87-Y171 AromaticContact CE1-CG 3.81Å; H87-Y171 AromaticContact CE1-CZ 3.54Å; H87-Y171 PolarHBondContact N-OH 3.37Å; H87-Y171 AromaticContact ND1-CE1 3.68Å; H87-Y171 AromaticContact ND1-CE2 3.97Å; H87-Y171 AromaticContact ND1-CZ 3.5Å; H87-Y171 AromaticContact NE2-CD1 3.87Å; H87-Y171 AromaticContact NE2-CD2 3.85Å; H87-Y171 AromaticContact NE2-CG 3.74Å; L90-Y171 HydrophobicContact CD1-CE2 3.64Å; F167-Y171 HydrophobicContact CD1-CD2 4.34Å; F167-Y171 AromaticContact CD2-CD2 3.81Å; F167-Y171 HydrophobicContact CD2-CD2 3.81Å; F167-Y171 AromaticContact CD2-CE2 3.91Å; F167-Y171 HydrophobicContact CD2-CE2 3.91Å; F167-Y171 HydrophobicContact CE1-CD2 4.15Å; F167-Y171 AromaticContact CE2-CD2 3.61Å; F167-Y171 HydrophobicContact CE2-CD2 3.61Å; F167-Y171 AromaticContact CE2-CE2 3.74Å; F167-Y171 HydrophobicContact CE2-CE2 3.74Å; F167-Y171 HydrophobicContact CG-CD2 4.15Å; F167-Y171 AromaticContact CZ-CD2 3.77Å; F167-Y171 HydrophobicContact CZ-CD2 3.77Å; F167-Y171 HydrophobicContact CZ-CE2 4.32Å; F167-Y171 WeakPolarHBondContact O-CD2 3.35Å; F167-Y171 PolarHBondContact O-N 3.06Å; Y171-G173 PolarHBondContact O-N 3.22Å
172	P	75.3	Confident	89.7	Confident	118 Å²	118	79.5 Å²	79.5	77%	0.766	38%	0.377	S	S	*	.			trans	-66.2	104.6	-180	24.8	-32.2	0	0	0	110.3	I170	I170-P172 VanDerWaalsContact O-CD 3.29Å; I170-P172 WeakPolarHBondContact O-CD 3.48Å
173	G	76.8	Confident	89.7	Confident	36 Å²	36	82 Å²	82	37%	0.371	39%	0.388	S	S	.	.	S	Bend	trans	110.7	148.5	177.8	0	0	0	0	0	113.8	Y171 K175	Y171-G173 PolarHBondContact O-N 3.22Å; G173-K175 PolarHBondContact O-N 3.08Å
174	Y	77.2	Confident	89.7	Confident	143 Å²	143	82 Å²	82	56%	0.561	39%	0.392	S	S	*	.	S	Bend	trans	-75.6	-7.7	178.8	-60.1	-75.7	0	0	0	113.8	L209	Y174-L209 HydrophobicContact CD1-CD1 3.69Å; Y174-L209 HydrophobicContact CE1-CD1 4.03Å
175	K	85.3	Confident	89.7	Confident	167 Å²	167	88.8 Å²	88.8	73%	0.726	42%	0.415	S	S	*	.	S	Bend	trans	-111.6	130.5	-176.7	-64.2	-175.3	179.2	176.3	0	109.8	G173 I177 T202	G173-K175 PolarHBondContact O-N 3.08Å; K175-I177 PolarHBondContact O-N 3.5Å; K175-T202 HydrophobicContact CB-CG2 4.26Å; K175-T202 HydrophobicContact CG-CG2 4.06Å
176	M	85.9	Confident	89.9	Confident	25 Å²	25	83.7 Å²	83.7	12%	0.123	40%	0.398	C	S	.	.			trans	-65.4	125.2	170.5	-159	80.4	172.2	0	0	109.1	F83 H87 V195 P198 K201 T202	F83-M176 HydrophobicContact CD1-CE 3.98Å; F83-M176 HydrophobicContact CE1-CE 3.1Å; F83-M176 HydrophobicContact CE1-SD 4.25Å; F83-M176 HydrophobicContact CZ-CE 3.48Å; F83-M176 VanDerWaalsContact CZ-CE 3.48Å; H87-M176 VanDerWaalsContact CE1-SD 3.6Å; M176-V195 HydrophobicContact CE-CG1 3.78Å; M176-V195 HydrophobicContact CG-CG1 4.26Å; M176-P198 HydrophobicContact CB-CB 4.11Å; M176-P198 WeakPolarHBondContact CB-O 3.37Å; M176-P198 HydrophobicContact CG-CB 4.18Å; M176-K201 HydrophobicContact CB-CB 4.43Å; M176-K201 HydrophobicContact CE-CD 4.05Å; M176-K201 HydrophobicContact CG-CB 4.3Å; M176-K201 HydrophobicContact SD-CB 4.47Å; M176-T202 WeakPolarHBondContact CB-OG1 3.1Å; M176-T202 PolarHBondContact N-OG1 2.76Å
177	I	86.9	Confident	90	Very high	92 Å²	92	81 Å²	81	47%	0.472	39%	0.386	S	S	.	.			trans	-67.4	141	173.6	56.4	-169	0	0	0	110.4	K175 V180	K175-I177 PolarHBondContact O-N 3.5Å; I177-V180 HydrophobicContact CD1-CG1 3.2Å; I177-V180 HydrophobicContact CG1-CG1 3.78Å
178	R	89.9	Confident	90	Very high	176 Å²	176	83.4 Å²	83.4	66%	0.664	40%	0.402	S	S	*	.	S	Bend	trans	-83.4	-32.3	-179.1	-53.2	-170.9	-172.1	-177.7	2.4	112.1	F194 V195 P198	R178-F194 WeakPolarHBondContact O-CA 3.12Å; R178-V195 PolarHBondContact O-N 2.92Å; R178-V195 VanDerWaalsContact O-N 3.07Å; R178-P198 HydrophobicContact CB-CG 4.17Å; R178-P198 HydrophobicContact CG-CB 4.11Å; R178-P198 HydrophobicContact CG-CG 3.73Å
179	L	93.3	Very high	90.2	Very high	68 Å²	68	84 Å²	84	36%	0.356	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	134.5	-177	179.4	150.7	0	0	0	109	K181 D192 C193 F194	L179-K181 HydrophobicContact CD2-CG 3.97Å; L179-D192 HydrophobicContact CD1-CB 3.94Å; L179-D192 HydrophobicContact CG-CB 4.33Å; L179-C193 CarbonylContact C-O 3.57Å; L179-C193 VanDerWaalsContact CA-O 3.27Å; L179-C193 WeakPolarHBondContact CA-O 3.34Å; L179-F194 HydrophobicContact CD1-CD1 4.33Å; L179-F194 HydrophobicContact CD1-CE1 3.7Å; L179-F194 HydrophobicContact CD1-CZ 4Å
180	V	93.6	Very high	90.4	Very high	5 Å²	5	82.6 Å²	82.6	3%	0.03	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	146.9	169.5	-67.8	0	0	0	0	109.3	F65 F82 I177 C193	F65-V180 HydrophobicContact CE2-CG2 3.96Å; F65-V180 HydrophobicContact CZ-CG2 3.92Å; F82-V180 HydrophobicContact CD1-CB 4.04Å; F82-V180 HydrophobicContact CD1-CG1 3.74Å; F82-V180 HydrophobicContact CD2-CB 3.94Å; F82-V180 HydrophobicContact CD2-CG1 4.33Å; F82-V180 HydrophobicContact CD2-CG2 3.68Å; F82-V180 HydrophobicContact CE1-CB 3.94Å; F82-V180 HydrophobicContact CE1-CG1 4.01Å; F82-V180 HydrophobicContact CE2-CB 3.87Å; F82-V180 HydrophobicContact CE2-CG2 3.88Å; F82-V180 HydrophobicContact CG-CB 4.05Å; F82-V180 HydrophobicContact CG-CG1 3.93Å; F82-V180 HydrophobicContact CG-CG2 4.07Å; F82-V180 HydrophobicContact CZ-CB 3.88Å; F82-V180 HydrophobicContact CZ-CG1 4.45Å; F82-V180 HydrophobicContact CZ-CG2 4.41Å; I177-V180 HydrophobicContact CD1-CG1 3.2Å; I177-V180 HydrophobicContact CG1-CG1 3.78Å; V180-C193 HydrophobicContact CG2-CB 3.68Å; V180-C193 PolarHBondContact N-O 2.85Å; V180-C193 PolarHBondContact O-N 3.33Å
181	K	96.1	Very high	90.8	Very high	140 Å²	140	80.2 Å²	80.2	61%	0.609	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.9	114.4	173.8	-69.3	-165.5	172.5	-175.2	0	108.4	F82 L179 T190	F82-K181 VanDerWaalsContact CZ-O 3.28Å; F82-K181 WeakPolarHBondContact CZ-O 3.28Å; L179-K181 HydrophobicContact CD2-CG 3.97Å; K181-T190 HydrophobicContact CB-CG2 3.76Å
182	C	96.9	Very high	91.2	Very high	0 Å²	0	82 Å²	82	0%	0	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	131	-173.5	-174.5	0	0	0	0	111.2	C78 F82 T190 V191	C78-C182 WeakPolarHBondContact CA-SG 3.02Å; C78-C182 HydrophobicContact CB-CB 3.76Å; C78-C182 WeakPolarHBondContact CB-SG 3.48Å; C78-C182 WeakPolarHBondContact SG-CB 3.41Å; C78-C182 CovalentContact SG-SG 2.02Å; C78-C182 PolarHBondContact SG-SG 2.83Å; F82-C182 HydrophobicContact CE2-CB 3.75Å; C182-T190 CarbonylContact O-C 3.48Å; C182-T190 VanDerWaalsContact O-CA 3.32Å; C182-T190 WeakPolarHBondContact O-CA 3.31Å; C182-V191 HydrophobicContact CB-CG2 4.13Å; C182-V191 PolarHBondContact N-O 3.26Å; C182-V191 PolarHBondContact O-N 3.22Å
183	D	96.6	Very high	92.2	Very high	115 Å²	115	76.3 Å²	76.3	62%	0.615	38%	0.375	S	S	*	.			trans	-120.3	12.8	175.3	64	-28.2	0	0	0	112.9
184	S	95.8	Very high	93.1	Very high	23 Å²	23	79.5 Å²	79.5	16%	0.161	38%	0.378	C	S	.	.			trans	-65.3	139.7	179.3	-60.5	0	0	0	0	112.9	C187	S184-C187 WeakPolarHBondContact O-CB 3.29Å; S184-C187 PolarHBondContact O-N 2.79Å; S184-C187 PolarHBondContact O-SG 2.88Å
185	Y	94.4	Very high	93.9	Very high	211 Å²	211	73.3 Å²	73.3	83%	0.827	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	133	172	-178.7	-93.4	0	0	0	111.1	V77	V77-Y185 WeakPolarHBondContact CG2-O 3.44Å
186	P	95.9	Very high	94.3	Very high	30 Å²	30	66.2 Å²	66.2	20%	0.195	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	cis	-98.5	22.6	16.6	38.8	-37.5	0	0	0	115.8	Q71	Q71-P186 VanDerWaalsContact CG-O 3.26Å; Q71-P186 WeakPolarHBondContact CG-O 3.32Å
187	C	96	Very high	94.6	Very high	15 Å²	15	70.3 Å²	70.3	10%	0.101	34%	0.341	C	S	.	.	S	Bend	trans	-65.6	140.1	-175.1	-56.9	0	0	0	0	113.1	C74 C78 S184 N189 V191	C74-C187 WeakPolarHBondContact CA-SG 3.46Å; C74-C187 HydrophobicContact CB-CB 4.09Å; C74-C187 WeakPolarHBondContact CB-SG 3.4Å; C74-C187 WeakPolarHBondContact SG-CB 3.46Å; C74-C187 CovalentContact SG-SG 2.03Å; C74-C187 PolarHBondContact SG-SG 3.37Å; C78-C187 PolarHBondContact SG-SG 2.94Å; S184-C187 WeakPolarHBondContact O-CB 3.29Å; S184-C187 PolarHBondContact O-N 2.79Å; S184-C187 PolarHBondContact O-SG 2.88Å; C187-N189 PolarHBondContact O-N 3.45Å; C187-V191 HydrophobicContact CB-CG1 4.46Å; C187-V191 HydrophobicContact CB-CG2 4.25Å
188	P	93.6	Very high	94.9	Very high	60 Å²	60	66.9 Å²	66.9	39%	0.39	32%	0.324	S	S	.	.	S	Bend	trans	-78.7	108.4	175.3	30.9	-32	0	0	0	109.8	Q71 V191	Q71-P188 HydrophobicContact CB-CG 4.25Å; P188-V191 HydrophobicContact CG-CG1 4.45Å
189	N	94.7	Very high	95	Very high	143 Å²	143	62.6 Å²	62.6	77%	0.765	32%	0.318	S	S	*	.	S	Bend	trans	55.4	-156.5	-174.4	-49.5	-69.2	0	0	0	111.8	C187	C187-N189 PolarHBondContact O-N 3.45Å
190	T	96.3	Very high	94.9	Very high	86 Å²	86	62.2 Å²	62.2	53%	0.528	31%	0.314	S	S	.	.	S	Bend	trans	-82.5	121.1	174.3	-47	0	0	0	0	110.6	K181 C182	K181-T190 HydrophobicContact CB-CG2 3.76Å; C182-T190 CarbonylContact O-C 3.48Å; C182-T190 VanDerWaalsContact O-CA 3.32Å; C182-T190 WeakPolarHBondContact O-CA 3.31Å
191	V	97.1	Very high	94.9	Very high	11 Å²	11	62.2 Å²	62.2	7%	0.067	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	149.2	176.6	-58.8	0	0	0	0	111	C67 T69 C182 C187 P188	C67-V191 HydrophobicContact CB-CG2 4.12Å; T69-V191 HydrophobicContact CG2-CG1 4.38Å; C182-V191 HydrophobicContact CB-CG2 4.13Å; C182-V191 PolarHBondContact N-O 3.26Å; C182-V191 PolarHBondContact O-N 3.22Å; C187-V191 HydrophobicContact CB-CG1 4.46Å; C187-V191 HydrophobicContact CB-CG2 4.25Å; P188-V191 HydrophobicContact CG-CG1 4.45Å
192	D	97.2	Very high	94.8	Very high	57 Å²	57	56.7 Å²	56.7	31%	0.305	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	125.1	173.6	-69.7	-29.9	0	0	0	109.8	C67 N68 L179	C67-D192 CarbonylContact C-O 3.56Å; C67-D192 WeakPolarHBondContact CA-O 3.47Å; N68-D192 PolarHBondContact N-O 3.19Å; L179-D192 HydrophobicContact CD1-CB 3.94Å; L179-D192 HydrophobicContact CG-CB 4.33Å
193	C	96.8	Very high	94.6	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	138.6	174.2	-45.8	0	0	0	0	112	F65 T66 C67 L179 V180	F65-C193 HydrophobicContact CE1-CB 3.79Å; F65-C193 HydrophobicContact CE2-CB 3.9Å; F65-C193 HydrophobicContact CZ-CB 3.32Å; T66-C193 CarbonylContact O-C 3.56Å; T66-C193 WeakPolarHBondContact O-CA 3.35Å; C67-C193 HydrophobicContact CB-CB 3.9Å; C67-C193 WeakPolarHBondContact CB-SG 3.44Å; C67-C193 WeakPolarHBondContact SG-CB 3.26Å; C67-C193 CovalentContact SG-SG 2.04Å; C67-C193 PolarHBondContact SG-SG 3.08Å; L179-C193 CarbonylContact C-O 3.57Å; L179-C193 VanDerWaalsContact CA-O 3.27Å; L179-C193 WeakPolarHBondContact CA-O 3.34Å; V180-C193 HydrophobicContact CG2-CB 3.68Å; V180-C193 PolarHBondContact N-O 2.85Å; V180-C193 PolarHBondContact O-N 3.33Å
194	F	95.9	Very high	94.4	Very high	102 Å²	102	58 Å²	58	45%	0.447	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	133	-176	-58.8	-88	0	0	0	110.5	T66 R178 L179	T66-F194 PolarHBondContact N-O 3.33Å; T66-F194 PolarHBondContact O-N 3.47Å; R178-F194 WeakPolarHBondContact O-CA 3.12Å; L179-F194 HydrophobicContact CD1-CD1 4.33Å; L179-F194 HydrophobicContact CD1-CE1 3.7Å; L179-F194 HydrophobicContact CD1-CZ 4Å
195	V	93.9	Very high	94.2	Very high	13 Å²	13	57.1 Å²	57.1	8%	0.079	29%	0.294	C	S	.	.			trans	-91.7	132.1	179.5	-178.5	0	0	0	0	109.7	F65 F83 M176 R178 P198	F65-V195 HydrophobicContact CD2-CG2 4.24Å; F65-V195 HydrophobicContact CE2-CG2 4.16Å; F83-V195 HydrophobicContact CE2-CG2 3.97Å; F83-V195 HydrophobicContact CZ-CG1 4.24Å; F83-V195 HydrophobicContact CZ-CG2 3.83Å; M176-V195 HydrophobicContact CE-CG1 3.78Å; M176-V195 HydrophobicContact CG-CG1 4.26Å; R178-V195 PolarHBondContact O-N 2.92Å; R178-V195 VanDerWaalsContact O-N 3.07Å; V195-P198 WeakPolarHBondContact O-CD 3.19Å
196	S	93	Very high	94.1	Very high	18 Å²	18	50.5 Å²	50.5	13%	0.126	28%	0.276	C	S	.	.	S	Bend	trans	-65.2	135.8	173.8	177.5	0	0	0	0	111.9	D60 G64 K201	D60-S196 PolarHBondContact OD2-OG 3.48Å; G64-S196 WeakPolarHBondContact O-CB 3.4Å; S196-K201 WeakPolarHBondContact O-CD 3.27Å; S196-K201 WeakPolarHBondContact O-CE 3.2Å; S196-K201 PolarHBondContact O-NZ 3.39Å
197	R	92.7	Very high	93.9	Very high	112 Å²	112	52.8 Å²	52.8	42%	0.423	28%	0.283	S	S	.	.	S	Bend	trans	47.5	51.9	171.5	-58.4	163.2	-172.2	-101.4	3.2	114.8	D60 T199 E200 K201	D60-R197 IonicContact OD1-NE 3.43Å; D60-R197 IonicContact OD2-CZ 3.89Å; D60-R197 IonicContact OD2-NE 3.86Å; D60-R197 PolarHBondContact OD2-NE 3.34Å; D60-R197 VanDerWaalsContact OD2-NE 3.14Å; D60-R197 IonicContact OD2-NH2 3.72Å; R197-T199 VanDerWaalsContact C-N 3.31Å; R197-T199 PolarHBondContact O-N 2.93Å; R197-E200 HydrophobicContact CB-CB 4.13Å; R197-E200 IonicContact NH1-OE2 3.35Å; R197-E200 PolarHBondContact NH1-OE2 3.36Å; R197-E200 PolarHBondContact O-N 2.97Å; R197-K201 WeakPolarHBondContact O-CB 3.48Å; R197-K201 WeakPolarHBondContact O-CG 3.29Å; R197-K201 PolarHBondContact O-N 3.21Å
198	P	92.6	Very high	93.7	Very high	19 Å²	19	52.2 Å²	52.2	12%	0.123	28%	0.278	C	S	.	.	H	α-helix	trans	-66.5	-33.2	-172.7	27.4	-33.3	0	0	0	112.4	M176 R178 V195 T202	M176-P198 HydrophobicContact CB-CB 4.11Å; M176-P198 WeakPolarHBondContact CB-O 3.37Å; M176-P198 HydrophobicContact CG-CB 4.18Å; R178-P198 HydrophobicContact CB-CG 4.17Å; R178-P198 HydrophobicContact CG-CB 4.11Å; R178-P198 HydrophobicContact CG-CG 3.73Å; V195-P198 WeakPolarHBondContact O-CD 3.19Å; P198-T202 WeakPolarHBondContact O-CB 3.29Å; P198-T202 PolarHBondContact O-N 3.1Å; P198-T202 PolarHBondContact O-OG1 2.67Å
199	T	92.6	Very high	93.6	Very high	86 Å²	86	50.5 Å²	50.5	53%	0.528	27%	0.266	S	S	.	.	H	α-helix	trans	-67.9	-45.6	177.1	46.3	0	0	0	0	112	R197 T202 V203	R197-T199 VanDerWaalsContact C-N 3.31Å; R197-T199 PolarHBondContact O-N 2.93Å; T199-T202 WeakPolarHBondContact O-CB 3.37Å; T199-T202 PolarHBondContact O-N 3.23Å; T199-V203 WeakPolarHBondContact O-CG2 3.41Å; T199-V203 PolarHBondContact O-N 3.15Å
200	E	92.3	Very high	93.5	Very high	61 Å²	61	46.1 Å²	46.1	29%	0.285	25%	0.25	S	C	.	.	H	α-helix	trans	-63.2	-49.1	177.3	-167.4	172.6	-169.7	0	0	110.7	V57 R197 T202 V203 F204	V57-E200 HydrophobicContact CB-CG 4.46Å; V57-E200 HydrophobicContact CG1-CB 4.22Å; V57-E200 HydrophobicContact CG1-CG 3.86Å; V57-E200 VanDerWaalsContact CG2-CD 3.5Å; V57-E200 HydrophobicContact CG2-CG 3.76Å; V57-E200 VanDerWaalsContact CG2-OE1 3.25Å; V57-E200 WeakPolarHBondContact CG2-OE1 3.24Å; R197-E200 HydrophobicContact CB-CB 4.13Å; R197-E200 IonicContact NH1-OE2 3.35Å; R197-E200 PolarHBondContact NH1-OE2 3.36Å; R197-E200 PolarHBondContact O-N 2.97Å; E200-T202 PolarHBondContact O-N 3.35Å; E200-V203 PolarHBondContact O-N 2.72Å; E200-F204 HydrophobicContact CG-CD2 4.03Å; E200-F204 HydrophobicContact CG-CE2 3.86Å; E200-F204 WeakPolarHBondContact O-CD2 3.23Å; E200-F204 PolarHBondContact O-N 2.95Å; E200-F204 VanDerWaalsContact O-N 3.09Å
201	K	93.1	Very high	93.3	Very high	4 Å²	4	42.4 Å²	42.4	2%	0.017	23%	0.227	C	C	.	.	H	α-helix	trans	-55.7	-39.3	174.5	-72.4	177.7	178.9	155.9	0	112.5	V57 W58 M176 S196 R197 T205	V57-K201 HydrophobicContact CG1-CB 4.47Å; V57-K201 HydrophobicContact CG1-CG 3.53Å; V57-K201 WeakPolarHBondContact O-CE 2.98Å; W58-K201 HydrophobicContact CD2-CG 4.35Å; W58-K201 HydrophobicContact CH2-CB 4.03Å; W58-K201 HydrophobicContact CH2-CG 4Å; W58-K201 HydrophobicContact CZ2-CB 3.76Å; W58-K201 HydrophobicContact CZ2-CD 4.35Å; W58-K201 HydrophobicContact CZ2-CG 3.65Å; W58-K201 HydrophobicContact CZ3-CG 4.48Å; M176-K201 HydrophobicContact CB-CB 4.43Å; M176-K201 HydrophobicContact CE-CD 4.05Å; M176-K201 HydrophobicContact CG-CB 4.3Å; M176-K201 HydrophobicContact SD-CB 4.47Å; S196-K201 WeakPolarHBondContact O-CD 3.27Å; S196-K201 WeakPolarHBondContact O-CE 3.2Å; S196-K201 PolarHBondContact O-NZ 3.39Å; R197-K201 WeakPolarHBondContact O-CB 3.48Å; R197-K201 WeakPolarHBondContact O-CG 3.29Å; R197-K201 PolarHBondContact O-N 3.21Å; K201-T205 VanDerWaalsContact O-CB 3.23Å; K201-T205 WeakPolarHBondContact O-CB 3.19Å; K201-T205 PolarHBondContact O-N 3.16Å; K201-T205 PolarHBondContact O-OG1 2.9Å
202	T	92.9	Very high	93.1	Very high	24 Å²	24	41.9 Å²	41.9	15%	0.147	22%	0.224	C	C	.	.	H	α-helix	trans	-63.7	-45.7	175.8	-62.1	0	0	0	0	111.8	K175 M176 P198 T199 E200 T205 V206	K175-T202 HydrophobicContact CB-CG2 4.26Å; K175-T202 HydrophobicContact CG-CG2 4.06Å; M176-T202 WeakPolarHBondContact CB-OG1 3.1Å; M176-T202 PolarHBondContact N-OG1 2.76Å; P198-T202 WeakPolarHBondContact O-CB 3.29Å; P198-T202 PolarHBondContact O-N 3.1Å; P198-T202 PolarHBondContact O-OG1 2.67Å; T199-T202 WeakPolarHBondContact O-CB 3.37Å; T199-T202 PolarHBondContact O-N 3.23Å; E200-T202 PolarHBondContact O-N 3.35Å; T202-T205 PolarHBondContact O-N 3.36Å; T202-V206 HydrophobicContact CG2-CG2 4.31Å; T202-V206 WeakPolarHBondContact O-CG2 3.32Å; T202-V206 PolarHBondContact O-N 3.24Å
203	V	93	Very high	92.9	Very high	100 Å²	100	40.4 Å²	40.4	61%	0.606	22%	0.222	S	C	*	.	H	α-helix	trans	-60.1	-50.4	179.7	171	0	0	0	0	110.5	T199 E200 T205 V206 F207	T199-V203 WeakPolarHBondContact O-CG2 3.41Å; T199-V203 PolarHBondContact O-N 3.15Å; E200-V203 PolarHBondContact O-N 2.72Å; V203-T205 VanDerWaalsContact C-N 3.3Å; V203-T205 PolarHBondContact O-N 2.85Å; V203-V206 PolarHBondContact O-N 3.45Å; V203-F207 VanDerWaalsContact O-CB 3.23Å; V203-F207 WeakPolarHBondContact O-CB 3.44Å; V203-F207 PolarHBondContact O-N 2.95Å
204	F	92.3	Very high	92.7	Very high	42 Å²	42	44.2 Å²	44.2	18%	0.184	24%	0.241	C	C	.	.	H	α-helix	trans	-62	-37.4	176.9	-80.8	-78.8	0	0	0	112.5	V49 A53 V57 W58 E200 F207 M208	V49-F204 HydrophobicContact CG1-CD1 3.77Å; V49-F204 HydrophobicContact CG1-CE1 4.05Å; A53-F204 HydrophobicContact CB-CD1 3.94Å; A53-F204 HydrophobicContact CB-CE1 4.11Å; A53-F204 HydrophobicContact CB-CG 4.36Å; V57-F204 HydrophobicContact CG1-CD2 4.38Å; V57-F204 HydrophobicContact CG2-CD2 3.86Å; V57-F204 HydrophobicContact CG2-CE2 3.51Å; V57-F204 HydrophobicContact CG2-CZ 4.19Å; W58-F204 HydrophobicContact CH2-CB 3.61Å; W58-F204 HydrophobicContact CH2-CG 4.45Å; W58-F204 HydrophobicContact CZ3-CB 3.68Å; W58-F204 HydrophobicContact CZ3-CD2 4.31Å; W58-F204 HydrophobicContact CZ3-CG 4.06Å; E200-F204 HydrophobicContact CG-CD2 4.03Å; E200-F204 HydrophobicContact CG-CE2 3.86Å; E200-F204 WeakPolarHBondContact O-CD2 3.23Å; E200-F204 PolarHBondContact O-N 2.95Å; E200-F204 VanDerWaalsContact O-N 3.09Å; F204-F207 WeakPolarHBondContact O-CB 3.34Å; F204-F207 PolarHBondContact O-N 3.41Å; F204-M208 WeakPolarHBondContact O-CB 3.37Å; F204-M208 VanDerWaalsContact O-CG 3.31Å; F204-M208 WeakPolarHBondContact O-CG 3.23Å; F204-M208 PolarHBondContact O-N 2.73Å
205	T	92.1	Very high	92.5	Very high	5 Å²	5	39.7 Å²	39.7	3%	0.031	22%	0.222	C	C	.	.	H	α-helix	trans	-63.7	-52.4	176.5	-64.7	0	0	0	0	112.2	W91 F167 K201 T202 V203 F207 M208 L209	W91-T205 WeakPolarHBondContact CH2-OG1 3.47Å; W91-T205 HydrophobicContact CZ2-CG2 4.19Å; F167-T205 HydrophobicContact CE1-CG2 3.63Å; F167-T205 HydrophobicContact CE2-CG2 4.47Å; F167-T205 HydrophobicContact CZ-CG2 3.35Å; K201-T205 VanDerWaalsContact O-CB 3.23Å; K201-T205 WeakPolarHBondContact O-CB 3.19Å; K201-T205 PolarHBondContact O-N 3.16Å; K201-T205 PolarHBondContact O-OG1 2.9Å; T202-T205 PolarHBondContact O-N 3.36Å; V203-T205 VanDerWaalsContact C-N 3.3Å; V203-T205 PolarHBondContact O-N 2.85Å; T205-F207 PolarHBondContact O-N 3.32Å; T205-M208 PolarHBondContact O-N 2.95Å; T205-L209 HydrophobicContact CG2-CD1 3.97Å; T205-L209 HydrophobicContact CG2-CG 4.45Å; T205-L209 WeakPolarHBondContact O-CB 3.23Å; T205-L209 WeakPolarHBondContact O-CG 3.04Å; T205-L209 PolarHBondContact O-N 3.25Å
206	V	92	Very high	92.4	Very high	73 Å²	73	39.8 Å²	39.8	44%	0.442	22%	0.222	S	C	.	.	H	α-helix	trans	-57.7	-41.1	177.7	169.8	0	0	0	0	110.3	T202 V203 L209 A210	T202-V206 HydrophobicContact CG2-CG2 4.31Å; T202-V206 WeakPolarHBondContact O-CG2 3.32Å; T202-V206 PolarHBondContact O-N 3.24Å; V203-V206 PolarHBondContact O-N 3.45Å; V206-L209 PolarHBondContact O-N 3.02Å; V206-A210 WeakPolarHBondContact O-CB 3.34Å; V206-A210 PolarHBondContact O-N 2.02Å
207	F	91.6	Very high	92.3	Very high	78 Å²	78	44.7 Å²	44.7	34%	0.342	25%	0.246	S	C	.	.	H	α-helix	trans	-61.1	-51.6	177.9	-169.7	-96	0	0	0	112.8	F45 V49 V203 F204 T205 L209 A210 V211	F45-F207 HydrophobicContact CD1-CE1 4.24Å; F45-F207 HydrophobicContact CD1-CZ 4.35Å; F45-F207 HydrophobicContact CE1-CD1 4.46Å; F45-F207 AromaticContact CE1-CE1 3.09Å; F45-F207 HydrophobicContact CE1-CE1 3.09Å; F45-F207 HydrophobicContact CE1-CE2 4.37Å; F45-F207 AromaticContact CE1-CZ 3.04Å; F45-F207 HydrophobicContact CE1-CZ 3.04Å; F45-F207 AromaticContact CZ-CE1 3.33Å; F45-F207 HydrophobicContact CZ-CE1 3.33Å; F45-F207 HydrophobicContact CZ-CE2 4.32Å; F45-F207 AromaticContact CZ-CZ 3.13Å; F45-F207 HydrophobicContact CZ-CZ 3.13Å; V49-F207 HydrophobicContact CG1-CD1 4.27Å; V49-F207 HydrophobicContact CG2-CD1 4.38Å; V49-F207 HydrophobicContact CG2-CE1 3.95Å; V203-F207 VanDerWaalsContact O-CB 3.23Å; V203-F207 WeakPolarHBondContact O-CB 3.44Å; V203-F207 PolarHBondContact O-N 2.95Å; F204-F207 WeakPolarHBondContact O-CB 3.34Å; F204-F207 PolarHBondContact O-N 3.41Å; T205-F207 PolarHBondContact O-N 3.32Å; F207-L209 VanDerWaalsContact C-N 3.32Å; F207-L209 PolarHBondContact O-N 3.29Å; F207-A210 PolarHBondContact O-N 2.84Å; F207-V211 HydrophobicContact CD1-CG2 4.35Å; F207-V211 HydrophobicContact CE1-CG2 3.86Å; F207-V211 HydrophobicContact CZ-CG2 4.01Å; F207-V211 WeakPolarHBondContact O-CG2 3.35Å; F207-V211 PolarHBondContact O-N 3.46Å
208	M	91.4	Very high	92.2	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.01	24%	0.236	C	C	.	.	H	α-helix	trans	-62.7	-38	178.4	-72.9	-64	-75.7	0	0	112.2	R46 V49 W91 F204 T205 S212	R46-M208 HydrophobicContact CB-CE 4.46Å; R46-M208 HydrophobicContact CG-CE 4.34Å; R46-M208 HydrophobicContact CG-SD 4.29Å; V49-M208 HydrophobicContact CB-SD 4.41Å; V49-M208 HydrophobicContact CG1-CG 4.41Å; V49-M208 HydrophobicContact CG1-SD 3.92Å; W91-M208 HydrophobicContact CB-CE 3.99Å; W91-M208 HydrophobicContact CD2-CB 4.32Å; W91-M208 HydrophobicContact CD2-CE 4.3Å; W91-M208 HydrophobicContact CD2-CG 4.18Å; W91-M208 HydrophobicContact CE3-CG 4.27Å; W91-M208 HydrophobicContact CG-CE 4Å; W91-M208 HydrophobicContact CZ2-CB 4.2Å; W91-M208 HydrophobicContact CZ2-CG 4.47Å; W91-M208 HydrophobicContact CZ3-CG 4.46Å; F204-M208 WeakPolarHBondContact O-CB 3.37Å; F204-M208 VanDerWaalsContact O-CG 3.31Å; F204-M208 WeakPolarHBondContact O-CG 3.23Å; F204-M208 PolarHBondContact O-N 2.73Å; T205-M208 PolarHBondContact O-N 2.95Å; M208-S212 WeakPolarHBondContact O-CB 3.48Å; M208-S212 PolarHBondContact O-N 2.88Å; M208-S212 PolarHBondContact O-OG 3.3Å
209	L	92.1	Very high	92	Very high	24 Å²	24	40.3 Å²	40.3	13%	0.126	23%	0.23	C	C	.	.	H	α-helix	trans	-66	-42.3	174.6	-70.4	175.4	0	0	0	112.2	F167 Y174 T205 V206 F207 S212 G213	F167-L209 HydrophobicContact CD1-CD1 4.14Å; F167-L209 HydrophobicContact CD1-CD2 3.83Å; F167-L209 HydrophobicContact CD1-CG 4.42Å; F167-L209 HydrophobicContact CE1-CD1 3.88Å; F167-L209 HydrophobicContact CE1-CD2 4.24Å; F167-L209 HydrophobicContact CE1-CG 4.36Å; F167-L209 HydrophobicContact CG-CD2 4.28Å; Y174-L209 HydrophobicContact CD1-CD1 3.69Å; Y174-L209 HydrophobicContact CE1-CD1 4.03Å; T205-L209 HydrophobicContact CG2-CD1 3.97Å; T205-L209 HydrophobicContact CG2-CG 4.45Å; T205-L209 WeakPolarHBondContact O-CB 3.23Å; T205-L209 WeakPolarHBondContact O-CG 3.04Å; T205-L209 PolarHBondContact O-N 3.25Å; V206-L209 PolarHBondContact O-N 3.02Å; F207-L209 VanDerWaalsContact C-N 3.32Å; F207-L209 PolarHBondContact O-N 3.29Å; L209-S212 WeakPolarHBondContact O-CA 2.95Å; L209-S212 WeakPolarHBondContact O-CB 3.39Å; L209-S212 PolarHBondContact O-N 3.12Å; L209-G213 PolarHBondContact O-N 3.18Å
210	A	92.9	Very high	91.9	Very high	52 Å²	52	39.7 Å²	39.7	43%	0.43	22%	0.223	S	C	.	.	H	α-helix	trans	-62.2	-46.3	176.8	0	0	0	0	0	111.6	V206 F207 S212 G213 I214	V206-A210 WeakPolarHBondContact O-CB 3.34Å; V206-A210 PolarHBondContact O-N 2.02Å; F207-A210 PolarHBondContact O-N 2.84Å; A210-S212 VanDerWaalsContact C-N 3.28Å; A210-S212 PolarHBondContact O-N 3Å; A210-G213 PolarHBondContact O-N 3.48Å; A210-I214 WeakPolarHBondContact O-CG1 3.05Å; A210-I214 PolarHBondContact O-N 3.26Å
211	V	92.1	Very high	91.7	Very high	7 Å²	7	39.4 Å²	39.4	4%	0.042	23%	0.231	C	C	.	.	H	α-helix	trans	-65.8	-32.7	175.7	-175.6	0	0	0	0	111.2	L42 F45 R46 F207 C215	L42-V211 HydrophobicContact CB-CG1 4.12Å; L42-V211 HydrophobicContact CD2-CG1 4.11Å; F45-V211 HydrophobicContact CE1-CG2 4.41Å; R46-V211 HydrophobicContact CG-CB 4.45Å; R46-V211 HydrophobicContact CG-CG1 3.78Å; R46-V211 VanDerWaalsContact NH2-C 3.35Å; R46-V211 PolarHBondContact NH2-O 3.06Å; F207-V211 HydrophobicContact CD1-CG2 4.35Å; F207-V211 HydrophobicContact CE1-CG2 3.86Å; F207-V211 HydrophobicContact CZ-CG2 4.01Å; F207-V211 WeakPolarHBondContact O-CG2 3.35Å; F207-V211 PolarHBondContact O-N 3.46Å; V211-C215 WeakPolarHBondContact O-CB 3.43Å; V211-C215 PolarHBondContact O-N 2.92Å; V211-C215 PolarHBondContact O-SG 2.87Å; V211-C215 VanDerWaalsContact O-SG 3.37Å
212	S	92.9	Very high	91.4	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.007	24%	0.235	C	C	.	.	H	α-helix	trans	-60.3	-50.4	170.6	-58.9	0	0	0	0	112.1	Q94 M208 L209 A210 I214 C215 I216	Q94-S212 PolarHBondContact NE2-OG 3.36Å; Q94-S212 VanDerWaalsContact NE2-OG 3.1Å; M208-S212 WeakPolarHBondContact O-CB 3.48Å; M208-S212 PolarHBondContact O-N 2.88Å; M208-S212 PolarHBondContact O-OG 3.3Å; L209-S212 WeakPolarHBondContact O-CA 2.95Å; L209-S212 WeakPolarHBondContact O-CB 3.39Å; L209-S212 PolarHBondContact O-N 3.12Å; A210-S212 VanDerWaalsContact C-N 3.28Å; A210-S212 PolarHBondContact O-N 3Å; S212-I214 PolarHBondContact O-N 3.23Å; S212-C215 PolarHBondContact O-N 3.39Å; S212-I216 WeakPolarHBondContact O-CG1 3.44Å; S212-I216 PolarHBondContact O-N 3.17Å
213	G	93.4	Very high	91	Very high	25 Å²	25	41 Å²	41	26%	0.258	24%	0.239	S	C	.	.	H	α-helix	trans	-57.8	-46.7	174.4	0	0	0	0	0	113	L209 A210 C215 I216 L217	L209-G213 PolarHBondContact O-N 3.18Å; A210-G213 PolarHBondContact O-N 3.48Å; G213-C215 VanDerWaalsContact C-N 3.35Å; G213-C215 PolarHBondContact O-N 3.15Å; G213-I216 PolarHBondContact O-N 2.99Å; G213-L217 WeakPolarHBondContact O-CG 3.5Å; G213-L217 PolarHBondContact O-N 3.2Å
214	I	92.4	Very high	90.8	Very high	81 Å²	81	40.7 Å²	40.7	42%	0.415	24%	0.237	S	C	.	.	H	α-helix	trans	-60.9	-43.5	178	-66.1	166.5	0	0	0	111	L42 A210 S212 I216 L217 L218	L42-I214 HydrophobicContact CD1-CB 4.48Å; L42-I214 HydrophobicContact CD1-CG2 3.65Å; A210-I214 WeakPolarHBondContact O-CG1 3.05Å; A210-I214 PolarHBondContact O-N 3.26Å; S212-I214 PolarHBondContact O-N 3.23Å; I214-I216 PolarHBondContact O-N 3.44Å; I214-L217 PolarHBondContact O-N 2.88Å; I214-L218 HydrophobicContact CG2-CD1 3.91Å; I214-L218 HydrophobicContact CG2-CG 4.25Å; I214-L218 WeakPolarHBondContact O-CB 3.5Å; I214-L218 VanDerWaalsContact O-CG 3.31Å; I214-L218 WeakPolarHBondContact O-CG 3.07Å; I214-L218 PolarHBondContact O-N 3.46Å
215	C	90.8	Very high	90.4	Very high	6 Å²	6	44 Å²	44	4%	0.041	25%	0.252	C	S	.	.	H	α-helix	trans	-64.2	-39	176.9	-75.7	0	0	0	0	112.5	L39 R46 V211 S212 G213 L218 N219	L39-C215 HydrophobicContact CD2-CB 4.23Å; R46-C215 PolarHBondContact NH2-SG 3.24Å; V211-C215 WeakPolarHBondContact O-CB 3.43Å; V211-C215 PolarHBondContact O-N 2.92Å; V211-C215 PolarHBondContact O-SG 2.87Å; V211-C215 VanDerWaalsContact O-SG 3.37Å; S212-C215 PolarHBondContact O-N 3.39Å; G213-C215 VanDerWaalsContact C-N 3.35Å; G213-C215 PolarHBondContact O-N 3.15Å; C215-L218 PolarHBondContact O-N 3.41Å; C215-N219 WeakPolarHBondContact O-CB 3.38Å; C215-N219 PolarHBondContact O-N 3.35Å; C215-N219 PolarHBondContact O-ND2 2.98Å
216	I	92.3	Very high	89.9	Confident	16 Å²	16	44.7 Å²	44.7	8%	0.082	26%	0.255	C	S	.	.	H	α-helix	trans	-58.9	-50.2	174.2	-68.5	165.5	0	0	0	109.7	E160 V161 M164 S212 G213 I214 L218 N219 I220	E160-I216 HydrophobicContact CB-CD1 3.98Å; E160-I216 HydrophobicContact CB-CG1 3.53Å; E160-I216 HydrophobicContact CG-CG1 4.26Å; V161-I216 HydrophobicContact CG2-CD1 4.04Å; V161-I216 HydrophobicContact CG2-CG1 4.45Å; V161-I216 HydrophobicContact CG2-CG2 4.4Å; M164-I216 HydrophobicContact CE-CD1 3.8Å; M164-I216 HydrophobicContact SD-CD1 3.92Å; S212-I216 WeakPolarHBondContact O-CG1 3.44Å; S212-I216 PolarHBondContact O-N 3.17Å; G213-I216 PolarHBondContact O-N 2.99Å; I214-I216 PolarHBondContact O-N 3.44Å; I216-L218 VanDerWaalsContact C-N 3.35Å; I216-L218 PolarHBondContact O-N 2.97Å; I216-N219 PolarHBondContact O-N 3.46Å; I216-I220 HydrophobicContact CG2-CD1 3.69Å; I216-I220 HydrophobicContact CG2-CG1 4.42Å; I216-I220 WeakPolarHBondContact O-CG1 3.02Å; I216-I220 PolarHBondContact O-N 3.36Å
217	L	91.9	Very high	89.5	Confident	120 Å²	120	44.3 Å²	44.3	63%	0.628	25%	0.253	S	S	*	.	H	α-helix	trans	-59.6	-43.6	179	-67.3	175	0	0	0	112.2	G213 I214 I220 A221	G213-L217 WeakPolarHBondContact O-CG 3.5Å; G213-L217 PolarHBondContact O-N 3.2Å; I214-L217 PolarHBondContact O-N 2.88Å; L217-I220 PolarHBondContact O-N 2.9Å; L217-A221 VanDerWaalsContact O-CB 3.31Å; L217-A221 WeakPolarHBondContact O-CB 3.08Å; L217-A221 PolarHBondContact O-N 3.08Å
218	L	88.9	Confident	89.1	Confident	39 Å²	39	42.6 Å²	42.6	20%	0.204	26%	0.257	C	S	.	.	H	α-helix	trans	-65.1	-41.7	177.7	-71.9	175	0	0	0	112.4	W38 L39 L42 I214 C215 I216 A221 E222	W38-L218 HydrophobicContact CB-CD1 4.06Å; L39-L218 HydrophobicContact CD2-CB 3.93Å; L39-L218 HydrophobicContact CD2-CD1 4.22Å; L39-L218 HydrophobicContact CG-CB 4.17Å; L39-L218 HydrophobicContact CG-CD1 4.36Å; L42-L218 HydrophobicContact CD1-CD1 3.68Å; I214-L218 HydrophobicContact CG2-CD1 3.91Å; I214-L218 HydrophobicContact CG2-CG 4.25Å; I214-L218 WeakPolarHBondContact O-CB 3.5Å; I214-L218 VanDerWaalsContact O-CG 3.31Å; I214-L218 WeakPolarHBondContact O-CG 3.07Å; I214-L218 PolarHBondContact O-N 3.46Å; C215-L218 PolarHBondContact O-N 3.41Å; I216-L218 VanDerWaalsContact C-N 3.35Å; I216-L218 PolarHBondContact O-N 2.97Å; L218-A221 PolarHBondContact O-N 2.88Å; L218-E222 WeakPolarHBondContact O-CB 3.39Å; L218-E222 PolarHBondContact O-N 3.33Å
219	N	89.2	Confident	88.6	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-65.9	-40.7	176.1	-76.7	-75.7	0	0	0	111.3	R156 I157 C215 I216 E222 V223	R156-N219 VanDerWaalsContact CZ-OD1 3.25Å; R156-N219 PolarHBondContact NH1-OD1 3.08Å; R156-N219 VanDerWaalsContact NH1-OD1 3.14Å; I157-N219 HydrophobicContact CD1-CB 4.03Å; I157-N219 HydrophobicContact CG1-CB 3.6Å; C215-N219 WeakPolarHBondContact O-CB 3.38Å; C215-N219 PolarHBondContact O-N 3.35Å; C215-N219 PolarHBondContact O-ND2 2.98Å; I216-N219 PolarHBondContact O-N 3.46Å; N219-E222 PolarHBondContact O-N 2.73Å; N219-V223 WeakPolarHBondContact O-CG2 3.28Å; N219-V223 PolarHBondContact O-N 2.89Å
220	I	90.1	Very high	88.1	Confident	74 Å²	74	47 Å²	47	38%	0.379	28%	0.281	S	S	.	.	H	α-helix	trans	-63.2	-48	175.2	-68.4	169	0	0	0	110.5	I157 I216 L217 E222 V223 V224	I157-I220 HydrophobicContact CD1-CG1 3.93Å; I157-I220 HydrophobicContact CG1-CG1 4.44Å; I216-I220 HydrophobicContact CG2-CD1 3.69Å; I216-I220 HydrophobicContact CG2-CG1 4.42Å; I216-I220 WeakPolarHBondContact O-CG1 3.02Å; I216-I220 PolarHBondContact O-N 3.36Å; L217-I220 PolarHBondContact O-N 2.9Å; I220-E222 PolarHBondContact O-N 2.93Å; I220-V223 PolarHBondContact O-N 3.47Å; I220-V223 VanDerWaalsContact O-N 3.13Å; I220-V224 HydrophobicContact CG2-CG2 4.29Å; I220-V224 WeakPolarHBondContact O-CG2 3.09Å; I220-V224 PolarHBondContact O-N 2.89Å
221	A	88.4	Confident	87.6	Confident	55 Å²	55	48.2 Å²	48.2	46%	0.455	29%	0.285	S	S	.	.	H	α-helix	trans	-58.2	-38	177.7	0	0	0	0	0	111.7	L217 L218 F225	L217-A221 VanDerWaalsContact O-CB 3.31Å; L217-A221 WeakPolarHBondContact O-CB 3.08Å; L217-A221 PolarHBondContact O-N 3.08Å; L218-A221 PolarHBondContact O-N 2.88Å; A221-F225 VanDerWaalsContact O-CB 3.3Å; A221-F225 WeakPolarHBondContact O-CB 3.43Å; A221-F225 PolarHBondContact O-N 2.9Å
222	E	86.1	Confident	87	Confident	22 Å²	22	51.7 Å²	51.7	10%	0.103	31%	0.31	C	S	.	.	H	α-helix	trans	-67.2	-42.6	175.5	-172.6	162.3	-162.6	0	0	112.6	Y149 L153 L218 N219 I220 F225 L226	Y149-E222 HydrophobicContact CE1-CG 4.42Å; Y149-E222 WeakPolarHBondContact CE1-OE1 3.15Å; Y149-E222 VanDerWaalsContact OH-CD 3.26Å; Y149-E222 PolarHBondContact OH-OE1 3.31Å; L153-E222 HydrophobicContact CD1-CB 4.4Å; L153-E222 HydrophobicContact CD1-CG 3.93Å; L218-E222 WeakPolarHBondContact O-CB 3.39Å; L218-E222 PolarHBondContact O-N 3.33Å; N219-E222 PolarHBondContact O-N 2.73Å; I220-E222 PolarHBondContact O-N 2.93Å; E222-F225 PolarHBondContact O-N 3.42Å; E222-L226 HydrophobicContact CG-CD1 4.22Å; E222-L226 VanDerWaalsContact O-CG 3.28Å; E222-L226 WeakPolarHBondContact O-CG 3.44Å; E222-L226 PolarHBondContact O-N 3.24Å
223	V	86.3	Confident	86.2	Confident	38 Å²	38	58.5 Å²	58.5	23%	0.23	34%	0.335	C	S	.	.	H	α-helix	trans	-59.6	-49.6	173.4	172	0	0	0	0	110.6	L153 I157 N219 I220 F225 L226 V227	L153-V223 HydrophobicContact CB-CG2 3.76Å; L153-V223 HydrophobicContact CD1-CG2 3.8Å; L153-V223 HydrophobicContact CG-CG2 4.43Å; I157-V223 HydrophobicContact CD1-CG2 4.06Å; N219-V223 WeakPolarHBondContact O-CG2 3.28Å; N219-V223 PolarHBondContact O-N 2.89Å; I220-V223 PolarHBondContact O-N 3.47Å; I220-V223 VanDerWaalsContact O-N 3.13Å; V223-F225 VanDerWaalsContact C-N 3.34Å; V223-F225 PolarHBondContact O-N 2.85Å; V223-L226 PolarHBondContact O-N 2.88Å; V223-V227 HydrophobicContact CG1-CG2 4.29Å; V223-V227 WeakPolarHBondContact O-CG2 3.24Å; V223-V227 PolarHBondContact O-N 3.36Å
224	V	87	Confident	85.2	Confident	95 Å²	95	64.3 Å²	64.3	58%	0.576	36%	0.355	S	S	*	.	H	α-helix	trans	-59.5	-44.4	179.4	172	0	0	0	0	111.2	I220 L226 V227 G228	I220-V224 HydrophobicContact CG2-CG2 4.29Å; I220-V224 WeakPolarHBondContact O-CG2 3.09Å; I220-V224 PolarHBondContact O-N 2.89Å; V224-L226 PolarHBondContact O-N 2.69Å; V224-V227 PolarHBondContact O-N 2.99Å; V224-G228 PolarHBondContact O-N 3.42Å
225	F	84.4	Confident	84.3	Confident	112 Å²	112	66.8 Å²	66.8	49%	0.491	37%	0.369	S	S	.	.	H	α-helix	trans	-60.5	-43.4	177.2	176.2	-100.7	0	0	0	112.3	A221 E222 V223 K229	A221-F225 VanDerWaalsContact O-CB 3.3Å; A221-F225 WeakPolarHBondContact O-CB 3.43Å; A221-F225 PolarHBondContact O-N 2.9Å; E222-F225 PolarHBondContact O-N 3.42Å; V223-F225 VanDerWaalsContact C-N 3.34Å; V223-F225 PolarHBondContact O-N 2.85Å; F225-K229 WeakPolarHBondContact O-CB 3.27Å; F225-K229 PolarHBondContact O-N 2.04Å
226	L	81.4	Confident	83.3	Confident	18 Å²	18	69.7 Å²	69.7	9%	0.094	39%	0.389	C	S	.	.	H	α-helix	trans	-69.8	-42	-179.7	-70.1	170.9	0	0	0	112.7	Y149 I150 L153 E222 V223 V224 K229 A230	Y149-L226 HydrophobicContact CD1-CD1 3.58Å; Y149-L226 HydrophobicContact CE1-CD1 3.57Å; I150-L226 HydrophobicContact CD1-CB 4Å; I150-L226 HydrophobicContact CD1-CD1 3.8Å; L153-L226 HydrophobicContact CD1-CD1 3.93Å; E222-L226 HydrophobicContact CG-CD1 4.22Å; E222-L226 VanDerWaalsContact O-CG 3.28Å; E222-L226 WeakPolarHBondContact O-CG 3.44Å; E222-L226 PolarHBondContact O-N 3.24Å; V223-L226 PolarHBondContact O-N 2.88Å; V224-L226 PolarHBondContact O-N 2.69Å; L226-K229 PolarHBondContact O-N 2.91Å; L226-A230 WeakPolarHBondContact O-CB 3.44Å; L226-A230 PolarHBondContact O-N 2.93Å
227	V	83.5	Confident	81.8	Confident	66 Å²	66	74 Å²	74	40%	0.4	41%	0.412	S	S	.	.	H	α-helix	trans	-64.6	-47.1	176	173.4	0	0	0	0	110	V223 V224 K229 A230 C231	V223-V227 HydrophobicContact CG1-CG2 4.29Å; V223-V227 WeakPolarHBondContact O-CG2 3.24Å; V223-V227 PolarHBondContact O-N 3.36Å; V224-V227 PolarHBondContact O-N 2.99Å; V227-K229 VanDerWaalsContact C-N 3.31Å; V227-K229 PolarHBondContact O-N 2.71Å; V227-A230 WeakPolarHBondContact O-CB 3.4Å; V227-A230 PolarHBondContact O-N 3.09Å; V227-C231 PolarHBondContact O-N 3.24Å; V227-C231 PolarHBondContact O-SG 2.03Å; V227-C231 VanDerWaalsContact O-SG 3.42Å
228	G	83.9	Confident	80.2	Confident	42 Å²	42	70.5 Å²	70.5	43%	0.433	40%	0.401	S	S	.	.	H	α-helix	trans	-58.3	-42	176.8	0	0	0	0	0	112.7	V224 A230 C231 S232	V224-G228 PolarHBondContact O-N 3.42Å; G228-A230 PolarHBondContact O-N 3.4Å; G228-C231 PolarHBondContact O-N 2.85Å; G228-S232 WeakPolarHBondContact O-CB 3.36Å; G228-S232 PolarHBondContact O-N 3.31Å
229	K	81.6	Confident	78.7	Confident	91 Å²	91	70.4 Å²	70.4	40%	0.396	41%	0.409	S	S	.	.	H	α-helix	trans	-65.5	-36.6	174.5	-173.6	173.4	-176.6	167.2	0	112.9	F225 L226 V227 R233	F225-K229 WeakPolarHBondContact O-CB 3.27Å; F225-K229 PolarHBondContact O-N 2.04Å; L226-K229 PolarHBondContact O-N 2.91Å; V227-K229 VanDerWaalsContact C-N 3.31Å; V227-K229 PolarHBondContact O-N 2.71Å; K229-R233 WeakPolarHBondContact O-CG 3.33Å; K229-R233 PolarHBondContact O-N 3.31Å
230	A	80.1	Confident	77.2	Confident	28 Å²	28	75.6 Å²	75.6	23%	0.231	44%	0.437	C	S	.	.	H	α-helix	trans	-68.2	-44.5	175.9	0	0	0	0	0	111.5	W146 L226 V227 G228 R233 H234	W146-A230 HydrophobicContact CZ2-CB 4.11Å; L226-A230 WeakPolarHBondContact O-CB 3.44Å; L226-A230 PolarHBondContact O-N 2.93Å; V227-A230 WeakPolarHBondContact O-CB 3.4Å; V227-A230 PolarHBondContact O-N 3.09Å; G228-A230 PolarHBondContact O-N 3.4Å; A230-R233 PolarHBondContact O-N 2.92Å; A230-H234 PolarHBondContact O-N 3.38Å
231	C	82.4	Confident	75.6	Confident	77 Å²	77	75.8 Å²	75.8	52%	0.52	45%	0.445	S	S	.	.	H	α-helix	trans	-61.7	-45	175.6	-69.7	0	0	0	0	112.1	V227 G228 R233 H234 L235	V227-C231 PolarHBondContact O-N 3.24Å; V227-C231 PolarHBondContact O-SG 2.03Å; V227-C231 VanDerWaalsContact O-SG 3.42Å; G228-C231 PolarHBondContact O-N 2.85Å; C231-R233 VanDerWaalsContact C-N 3.31Å; C231-R233 PolarHBondContact O-N 3.28Å; C231-H234 PolarHBondContact O-N 2.99Å; C231-H234 VanDerWaalsContact O-N 3.14Å; C231-L235 PolarHBondContact O-N 2.87Å
232	S	80.5	Confident	74	Confident	80 Å²	80	78 Å²	78	56%	0.559	45%	0.452	S	S	*	.	H	α-helix	trans	-61	-38.4	177.7	175.1	0	0	0	0	112.4	G228 L235 S236	G228-S232 WeakPolarHBondContact O-CB 3.36Å; G228-S232 PolarHBondContact O-N 3.31Å; S232-L235 PolarHBondContact O-N 3.47Å; S232-S236 PolarHBondContact O-N 3.27Å
233	R	75.7	Confident	72.6	Confident	143 Å²	143	82.1 Å²	82.1	54%	0.54	47%	0.473	S	S	.	.	H	α-helix	trans	-67.3	-38.3	173.3	-78	176.2	167.9	177.4	-5.5	113.2	K229 A230 C231 L235 S236 N237	K229-R233 WeakPolarHBondContact O-CG 3.33Å; K229-R233 PolarHBondContact O-N 3.31Å; A230-R233 PolarHBondContact O-N 2.92Å; C231-R233 VanDerWaalsContact C-N 3.31Å; C231-R233 PolarHBondContact O-N 3.28Å; R233-L235 VanDerWaalsContact C-N 3.33Å; R233-S236 PolarHBondContact O-OG 3.29Å; R233-N237 WeakPolarHBondContact O-CB 3.37Å; R233-N237 PolarHBondContact O-N 3.44Å
234	H	73.4	Confident	71.1	Confident	148 Å²	148	81.8 Å²	81.8	69%	0.685	48%	0.478	S	S	*	.	H	α-helix	trans	-64.4	-40.2	174	-99.1	-78.4	0	0	0	111.4	A230 C231 N237 A238	A230-H234 PolarHBondContact O-N 3.38Å; C231-H234 PolarHBondContact O-N 2.99Å; C231-H234 VanDerWaalsContact O-N 3.14Å; H234-N237 PolarHBondContact O-N 3.23Å; H234-A238 WeakPolarHBondContact O-CB 3.38Å; H234-A238 PolarHBondContact O-N 2.81Å
235	L	73.4	Confident	69.5	Low	133 Å²	133	80.1 Å²	80.1	70%	0.696	47%	0.474	S	S	*	.	H	α-helix	trans	-68.8	-39.7	178.3	-167.7	65.8	0	0	0	112.3	C231 S232 R233 A238 G239	C231-L235 PolarHBondContact O-N 2.87Å; S232-L235 PolarHBondContact O-N 3.47Å; R233-L235 VanDerWaalsContact C-N 3.33Å; L235-A238 PolarHBondContact O-N 3.47Å; L235-G239 PolarHBondContact O-N 3.33Å
236	S	69.5	Low	68.1	Low	66 Å²	66	82.2 Å²	82.2	46%	0.462	48%	0.478	S	S	.	.	H	α-helix	trans	-65.3	-40.8	174.6	67.9	0	0	0	0	112.2	S232 R233 G239 D240	S232-S236 PolarHBondContact O-N 3.27Å; R233-S236 PolarHBondContact O-OG 3.29Å; S236-G239 PolarHBondContact O-N 3.02Å; S236-D240 PolarHBondContact O-N 3.44Å
237	N	60.1	Low	66.9	Low	107 Å²	107	85.2 Å²	85.2	57%	0.572	49%	0.494	S	S	*	.	H	α-helix	trans	-68.3	-33.8	176.8	-78.8	3.8	0	0	0	112.5	R233 H234 S241	R233-N237 WeakPolarHBondContact O-CB 3.37Å; R233-N237 PolarHBondContact O-N 3.44Å; H234-N237 PolarHBondContact O-N 3.23Å; N237-S241 PolarHBondContact O-N 3.45Å; N237-S241 VanDerWaalsContact O-N 3.1Å; N237-S241 PolarHBondContact O-OG 3.41Å
238	A	59.4	Low	65.6	Low	47 Å²	47	86.2 Å²	86.2	39%	0.388	50%	0.5	S	S	.	.	H	α-helix	trans	-64.3	-43.5	171.3	0	0	0	0	0	110.8	H234 L235 D240 S241 T242	H234-A238 WeakPolarHBondContact O-CB 3.38Å; H234-A238 PolarHBondContact O-N 2.81Å; L235-A238 PolarHBondContact O-N 3.47Å; A238-D240 PolarHBondContact O-N 3.28Å; A238-S241 WeakPolarHBondContact CA-OG 3.49Å; A238-S241 PolarHBondContact O-N 3.12Å; A238-S241 PolarHBondContact O-OG 3.02Å; A238-S241 VanDerWaalsContact O-OG 3.07Å; A238-T242 PolarHBondContact O-N 3.44Å; A238-T242 PolarHBondContact O-OG1 2.87Å
239	G	57.3	Low	64.2	Low	37 Å²	37	91.4 Å²	91.4	38%	0.381	51%	0.513	S	S	.	.	H	α-helix	trans	-57.2	-45.7	174.1	0	0	0	0	0	113.5	L235 S236 S241 T242 M243	L235-G239 PolarHBondContact O-N 3.33Å; S236-G239 PolarHBondContact O-N 3.02Å; G239-S241 PolarHBondContact O-N 3.37Å; G239-T242 PolarHBondContact O-N 3.06Å; G239-T242 PolarHBondContact O-OG1 3.05Å; G239-M243 WeakPolarHBondContact O-CB 3.41Å; G239-M243 PolarHBondContact O-N 3.02Å
240	D	57.3	Low	62.7	Low	109 Å²	109	93.1 Å²	93.1	58%	0.583	52%	0.52	S	S	*	.	H	α-helix	trans	-66.9	-32.2	176.9	-98.1	-11.1	0	0	0	113.3	S236 A238 G244	S236-D240 PolarHBondContact O-N 3.44Å; A238-D240 PolarHBondContact O-N 3.28Å; D240-G244 PolarHBondContact O-N 3.17Å
241	S	56.1	Low	61.2	Low	77 Å²	77	98 Å²	98	54%	0.538	54%	0.542	S	S	.	.	H	α-helix	trans	-75.9	-34.5	175.8	31.8	0	0	0	0	112.5	N237 A238 G239 A245	N237-S241 PolarHBondContact O-N 3.45Å; N237-S241 VanDerWaalsContact O-N 3.1Å; N237-S241 PolarHBondContact O-OG 3.41Å; A238-S241 WeakPolarHBondContact CA-OG 3.49Å; A238-S241 PolarHBondContact O-N 3.12Å; A238-S241 PolarHBondContact O-OG 3.02Å; A238-S241 VanDerWaalsContact O-OG 3.07Å; G239-S241 PolarHBondContact O-N 3.37Å; S241-A245 WeakPolarHBondContact O-CB 3.35Å; S241-A245 PolarHBondContact O-N 3.04Å
242	T	55.7	Low	59.4	Low	101 Å²	101	99.8 Å²	99.8	62%	0.62	55%	0.554	S	S	*	*	H	α-helix	trans	-66.3	-41.2	169.4	-6.1	0	0	0	0	112.2	A238 G239 A245 W246	A238-T242 PolarHBondContact O-N 3.44Å; A238-T242 PolarHBondContact O-OG1 2.87Å; G239-T242 PolarHBondContact O-N 3.06Å; G239-T242 PolarHBondContact O-OG1 3.05Å; T242-A245 PolarHBondContact O-N 2.82Å; T242-W246 WeakPolarHBondContact O-CB 3.47Å; T242-W246 PolarHBondContact O-N 2.8Å
243	M	55.5	Low	57.6	Low	109 Å²	109	100.5 Å²	100.5	54%	0.537	56%	0.559	S	S	.	*	H	α-helix	trans	-71.8	-36.3	177.8	-166.4	141.1	67.4	0	0	112	G239 W246 I247	G239-M243 WeakPolarHBondContact O-CB 3.41Å; G239-M243 PolarHBondContact O-N 3.02Å; M243-W246 PolarHBondContact O-N 3.31Å; M243-I247 HydrophobicContact CG-CD1 4.07Å; M243-I247 WeakPolarHBondContact O-CB 3.25Å; M243-I247 VanDerWaalsContact O-CG1 3.23Å; M243-I247 WeakPolarHBondContact O-CG1 3.4Å; M243-I247 PolarHBondContact O-N 3.33Å
244	G	54.4	Low	55.9	Low	32 Å²	32	106.8 Å²	106.8	33%	0.33	59%	0.585	S	S	.	*	H	α-helix	trans	-60.4	-47.1	170.4	0	0	0	0	0	112.4	D240 W246 I247 T248	D240-G244 PolarHBondContact O-N 3.17Å; G244-W246 PolarHBondContact O-N 3Å; G244-I247 PolarHBondContact O-N 3.17Å; G244-T248 PolarHBondContact O-N 3.2Å; G244-T248 PolarHBondContact O-OG1 3.06Å
245	A	54.6	Low	55	Low	59 Å²	59	104.7 Å²	104.7	49%	0.488	58%	0.58	S	S	.	*	H	α-helix	trans	-62.2	-40	175.6	0	0	0	0	0	112.6	S241 T242 Q249	S241-A245 WeakPolarHBondContact O-CB 3.35Å; S241-A245 PolarHBondContact O-N 3.04Å; T242-A245 PolarHBondContact O-N 2.82Å; A245-Q249 WeakPolarHBondContact O-CB 3.4Å; A245-Q249 PolarHBondContact O-N 3.07Å
246	W	55.2	Low	54	Low	156 Å²	156	103.2 Å²	103.2	59%	0.591	57%	0.573	S	S	*	*	H	α-helix	trans	-65.8	-39.5	176.3	-170.7	82	0	0	0	112.7	T242 M243 G244 K250	T242-W246 WeakPolarHBondContact O-CB 3.47Å; T242-W246 PolarHBondContact O-N 2.8Å; M243-W246 PolarHBondContact O-N 3.31Å; G244-W246 PolarHBondContact O-N 3Å; W246-K250 HydrophobicContact CH2-CD 3.96Å; W246-K250 HydrophobicContact CZ2-CD 4.15Å; W246-K250 HydrophobicContact CZ3-CD 4.24Å; W246-K250 PolarHBondContact O-N 2.8Å; W246-K250 VanDerWaalsContact O-N 3.13Å
247	I	56.2	Low	53.2	Low	82 Å²	82	105.3 Å²	105.3	42%	0.421	58%	0.58	S	S	.	*	H	α-helix	trans	-69.3	-42.1	177.2	-69.8	167.2	0	0	0	111.2	M243 G244 Q249 K250 L251	M243-I247 HydrophobicContact CG-CD1 4.07Å; M243-I247 WeakPolarHBondContact O-CB 3.25Å; M243-I247 VanDerWaalsContact O-CG1 3.23Å; M243-I247 WeakPolarHBondContact O-CG1 3.4Å; M243-I247 PolarHBondContact O-N 3.33Å; G244-I247 PolarHBondContact O-N 3.17Å; I247-Q249 VanDerWaalsContact C-N 3.35Å; I247-Q249 PolarHBondContact O-N 3.35Å; I247-K250 PolarHBondContact O-N 3.47Å; I247-L251 HydrophobicContact CG2-CD1 3.69Å; I247-L251 WeakPolarHBondContact O-CB 3.49Å; I247-L251 PolarHBondContact O-N 2.92Å
248	T	55.4	Low	52.8	Low	87 Å²	87	105.2 Å²	105.2	53%	0.534	58%	0.58	S	S	.	*	H	α-helix	trans	-64	-39.4	176.2	-48.9	0	0	0	0	111.9	G244 K250 L251 C252	G244-T248 PolarHBondContact O-N 3.2Å; G244-T248 PolarHBondContact O-OG1 3.06Å; T248-K250 VanDerWaalsContact C-N 3.33Å; T248-K250 PolarHBondContact O-N 3.46Å; T248-L251 PolarHBondContact O-N 3.4Å; T248-C252 PolarHBondContact O-N 3.14Å; T248-C252 VanDerWaalsContact O-N 3.13Å
249	Q	54.3	Low	52.4	Low	151 Å²	151	108.8 Å²	108.8	71%	0.706	59%	0.592	S	S	*	*	H	α-helix	trans	-66.6	-33.6	176.6	-168.6	173.5	-11.3	0	0	112.5	A245 I247	A245-Q249 WeakPolarHBondContact O-CB 3.4Å; A245-Q249 PolarHBondContact O-N 3.07Å; I247-Q249 VanDerWaalsContact C-N 3.35Å; I247-Q249 PolarHBondContact O-N 3.35Å
250	K	49.7	Very low	52	Low	126 Å²	126	113.6 Å²	113.6	55%	0.548	61%	0.606	S	S	.	*	H	α-helix	trans	-77.5	-30.3	177.1	-127.4	-177.9	-178.7	-172.2	0	113.6	W246 I247 T248	W246-K250 HydrophobicContact CH2-CD 3.96Å; W246-K250 HydrophobicContact CZ2-CD 4.15Å; W246-K250 HydrophobicContact CZ3-CD 4.24Å; W246-K250 PolarHBondContact O-N 2.8Å; W246-K250 VanDerWaalsContact O-N 3.13Å; I247-K250 PolarHBondContact O-N 3.47Å; T248-K250 VanDerWaalsContact C-N 3.33Å; T248-K250 PolarHBondContact O-N 3.46Å
251	L	48.4	Very low	51.7	Low	132 Å²	132	113.9 Å²	113.9	69%	0.691	61%	0.608	S	S	*	*	H	α-helix	trans	-80.3	-22.5	177.4	-83.3	159.1	0	0	0	113.7	I247 T248 S253	I247-L251 HydrophobicContact CG2-CD1 3.69Å; I247-L251 WeakPolarHBondContact O-CB 3.49Å; I247-L251 PolarHBondContact O-N 2.92Å; T248-L251 PolarHBondContact O-N 3.4Å; L251-S253 VanDerWaalsContact C-N 3.31Å
252	C	46	Very low	51.3	Low	113 Å²	113	116.8 Å²	116.8	76%	0.764	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	3.4	172.2	-77.5	0	0	0	0	114.1	T248	T248-C252 PolarHBondContact O-N 3.14Å; T248-C252 VanDerWaalsContact O-N 3.13Å
253	S	42	Very low	50.9	Low	95 Å²	95	118.1 Å²	118.1	66%	0.664	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.7	10.1	-177.8	-173.5	0	0	0	0	113.7	L251	L251-S253 VanDerWaalsContact C-N 3.31Å
254	Y	39.8	Very low	50.5	Low	275 Å²	275	118.9 Å²	118.9	100%	1.078	62%	0.619	S	S	*	*			trans	-124.9	0	173.8	-91.3	-79.8	0	0	0	110.8

Retrieved 254 of 254 residues in 48.9 ms (Link to these results)

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