A0A5K4FDL5_SCHMA Loading...

Pecanex-like protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4FDL5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 541 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	46.4	Very low	50	Low	194 Å²	194	125.4 Å²	125.4	96%	0.956	65%	0.651	S	S	*	*				0	-47.3	0	-76	-128.4	-81.5	0	0	112.3	E3 I4	M1-E3 VanDerWaalsContact C-N 3.26Å; M1-E3 PolarHBondContact O-N 3.36Å; M1-I4 PolarHBondContact O-N 3.36Å; M1-I4 VanDerWaalsContact O-N 3.14Å
2	N	42.1	Very low	50.5	Low	151 Å²	151	118.3 Å²	118.3	81%	0.807	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-62	-25.4	-179.8	-79.1	6.8	0	0	0	115.5	I4	N2-I4 VanDerWaalsContact C-N 3.27Å; N2-I4 PolarHBondContact O-N 3.08Å
3	E	43.3	Very low	51.1	Low	170 Å²	170	117.1 Å²	117.1	79%	0.794	61%	0.607	S	S	*	*	G	3₁₀ helix	trans	-73.2	-15.5	176.8	-74.2	176.9	163.1	0	0	114	M1 F5	M1-E3 VanDerWaalsContact C-N 3.26Å; M1-E3 PolarHBondContact O-N 3.36Å; E3-F5 VanDerWaalsContact C-N 3.29Å; E3-F5 PolarHBondContact O-N 3.18Å
4	I	49	Very low	51.7	Low	88 Å²	88	115.1 Å²	115.1	45%	0.451	60%	0.603	S	S	.	*	G	3₁₀ helix	trans	-73.2	-24.6	-177.8	-58.9	174.7	0	0	0	111.2	M1 N2 T6 T12	M1-I4 PolarHBondContact O-N 3.36Å; M1-I4 VanDerWaalsContact O-N 3.14Å; N2-I4 VanDerWaalsContact C-N 3.27Å; N2-I4 PolarHBondContact O-N 3.08Å; I4-T6 VanDerWaalsContact C-N 3.32Å; I4-T6 PolarHBondContact O-N 3.31Å; I4-T12 HydrophobicContact CG2-CG2 4.29Å
5	F	47.6	Very low	52	Low	191 Å²	191	112.6 Å²	112.6	84%	0.838	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-78	-11.4	-176.4	-81.9	-75.3	0	0	0	114.8	E3	E3-F5 VanDerWaalsContact C-N 3.29Å; E3-F5 PolarHBondContact O-N 3.18Å
6	T	49.9	Very low	52.2	Low	128 Å²	128	113.1 Å²	113.1	79%	0.785	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-113.7	-3.5	-179	48.9	0	0	0	0	114	I4	I4-T6 VanDerWaalsContact C-N 3.32Å; I4-T6 PolarHBondContact O-N 3.31Å
7	A	46.7	Very low	52.8	Low	26 Å²	26	114.5 Å²	114.5	22%	0.215	59%	0.588	C	S	.	*	S	Bend	trans	-80.7	144.3	-178.7	0	0	0	0	0	111.4	E11 T12	A7-E11 HydrophobicContact CB-CB 3.98Å; A7-E11 WeakPolarHBondContact CB-OE2 3.49Å; A7-T12 HydrophobicContact CB-CG2 4.13Å
8	S	56.1	Low	53	Low	72 Å²	72	111.8 Å²	111.8	50%	0.503	58%	0.581	S	S	.	*			trans	-58.6	153.4	173.6	-179.3	0	0	0	0	110.7	D10 E11 T12	S8-D10 PolarHBondContact O-N 3.34Å; S8-D10 VanDerWaalsContact O-N 3.1Å; S8-E11 PolarHBondContact O-N 3.41Å; S8-T12 PolarHBondContact O-N 3.37Å; S8-T12 VanDerWaalsContact O-N 3.08Å
9	I	60.3	Low	53.2	Low	129 Å²	129	110.8 Å²	110.8	66%	0.662	58%	0.575	S	S	*	*	H	α-helix	trans	-52.2	-36	178.1	-65.5	169.7	0	0	0	111.1	T12 Q13	I9-T12 PolarHBondContact O-N 3.05Å; I9-T12 PolarHBondContact O-OG1 3.41Å; I9-Q13 PolarHBondContact O-N 3.28Å; I9-Q13 VanDerWaalsContact O-N 3.1Å
10	D	56.1	Low	53.2	Low	115 Å²	115	109.5 Å²	109.5	62%	0.615	57%	0.569	S	S	*	*	H	α-helix	trans	-68.2	-37	178.1	-69.5	-27	0	0	0	113.4	S8 T14	S8-D10 PolarHBondContact O-N 3.34Å; S8-D10 VanDerWaalsContact O-N 3.1Å; D10-T14 PolarHBondContact O-N 2.82Å; D10-T14 VanDerWaalsContact O-N 3.15Å; D10-T14 PolarHBondContact O-OG1 3Å
11	E	53.1	Low	53.2	Low	115 Å²	115	109.5 Å²	109.5	54%	0.537	57%	0.57	S	S	.	*	H	α-helix	trans	-69.5	-41	175.9	-82	-178.2	149.4	0	0	110.9	A7 S8 Q13 T14 I15	A7-E11 HydrophobicContact CB-CB 3.98Å; A7-E11 WeakPolarHBondContact CB-OE2 3.49Å; S8-E11 PolarHBondContact O-N 3.41Å; E11-Q13 PolarHBondContact O-N 3.26Å; E11-T14 PolarHBondContact O-N 3.19Å; E11-T14 VanDerWaalsContact O-N 3.17Å; E11-I15 VanDerWaalsContact O-CG1 3.32Å; E11-I15 WeakPolarHBondContact O-CG1 3.36Å; E11-I15 PolarHBondContact O-N 3.39Å
12	T	55	Low	53.4	Low	41 Å²	41	104.7 Å²	104.7	25%	0.252	55%	0.552	S	S	.	*	H	α-helix	trans	-63.6	-39.1	177.2	59.7	0	0	0	0	112.3	I4 A7 S8 I9 T14 I15 Q16	I4-T12 HydrophobicContact CG2-CG2 4.29Å; A7-T12 HydrophobicContact CB-CG2 4.13Å; S8-T12 PolarHBondContact O-N 3.37Å; S8-T12 VanDerWaalsContact O-N 3.08Å; I9-T12 PolarHBondContact O-N 3.05Å; I9-T12 PolarHBondContact O-OG1 3.41Å; T12-T14 VanDerWaalsContact C-N 3.35Å; T12-T14 PolarHBondContact O-N 2.66Å; T12-I15 PolarHBondContact O-N 3.42Å; T12-Q16 VanDerWaalsContact O-CB 3.27Å; T12-Q16 WeakPolarHBondContact O-CB 3.46Å; T12-Q16 PolarHBondContact O-N 3.4Å
13	Q	58.8	Low	53.8	Low	102 Å²	102	100.9 Å²	100.9	48%	0.477	53%	0.534	S	S	.	.	H	α-helix	trans	-63.3	-39.3	172.8	-79.2	-168.8	18.4	0	0	112.6	I9 E11 Q16 K17	I9-Q13 PolarHBondContact O-N 3.28Å; I9-Q13 VanDerWaalsContact O-N 3.1Å; E11-Q13 PolarHBondContact O-N 3.26Å; Q13-Q16 PolarHBondContact O-N 3.19Å; Q13-K17 WeakPolarHBondContact O-CB 3.49Å; Q13-K17 WeakPolarHBondContact O-CG 2.77Å; Q13-K17 PolarHBondContact O-N 3.29Å
14	T	59.9	Low	54	Low	89 Å²	89	97.2 Å²	97.2	55%	0.546	52%	0.519	S	S	.	.	H	α-helix	trans	-67.3	-42.4	179.2	-55.7	0	0	0	0	111.1	D10 E11 T12 S18	D10-T14 PolarHBondContact O-N 2.82Å; D10-T14 VanDerWaalsContact O-N 3.15Å; D10-T14 PolarHBondContact O-OG1 3Å; E11-T14 PolarHBondContact O-N 3.19Å; E11-T14 VanDerWaalsContact O-N 3.17Å; T12-T14 VanDerWaalsContact C-N 3.35Å; T12-T14 PolarHBondContact O-N 2.66Å; T14-S18 WeakPolarHBondContact O-CB 3.46Å; T14-S18 PolarHBondContact O-N 3Å; T14-S18 PolarHBondContact O-OG 3.08Å
15	I	55.4	Low	54	Low	78 Å²	78	97.1 Å²	97.1	40%	0.4	52%	0.523	S	S	.	.	H	α-helix	trans	-64.5	-44.4	174.6	-65.9	166.4	0	0	0	110.2	E11 T12 S18 I19	E11-I15 VanDerWaalsContact O-CG1 3.32Å; E11-I15 WeakPolarHBondContact O-CG1 3.36Å; E11-I15 PolarHBondContact O-N 3.39Å; T12-I15 PolarHBondContact O-N 3.42Å; I15-S18 WeakPolarHBondContact O-CB 2.87Å; I15-S18 PolarHBondContact O-N 2.96Å; I15-S18 VanDerWaalsContact O-N 3.13Å; I15-I19 HydrophobicContact CG2-CD1 3.85Å; I15-I19 HydrophobicContact CG2-CG1 4.41Å; I15-I19 WeakPolarHBondContact O-CG1 3.33Å; I15-I19 PolarHBondContact O-N 3.06Å
16	Q	56.3	Low	53.5	Low	120 Å²	120	96.5 Å²	96.5	56%	0.561	52%	0.515	S	S	*	.	H	α-helix	trans	-65.9	-40.1	179.8	-165.7	172.6	5.5	0	0	112.3	T12 Q13 S18 I19 N20	T12-Q16 VanDerWaalsContact O-CB 3.27Å; T12-Q16 WeakPolarHBondContact O-CB 3.46Å; T12-Q16 PolarHBondContact O-N 3.4Å; Q13-Q16 PolarHBondContact O-N 3.19Å; Q16-S18 VanDerWaalsContact C-N 3.3Å; Q16-S18 PolarHBondContact O-N 2.86Å; Q16-I19 PolarHBondContact O-N 2.78Å; Q16-N20 WeakPolarHBondContact O-CB 3.48Å; Q16-N20 VanDerWaalsContact O-CG 3.31Å; Q16-N20 PolarHBondContact O-N 3.37Å
17	K	61.2	Low	53	Low	138 Å²	138	95 Å²	95	60%	0.6	50%	0.502	S	S	*	.	H	α-helix	trans	-60.3	-40.6	170.2	-81	179.6	179.2	173.3	0	111.7	Q13 N20 N21	Q13-K17 WeakPolarHBondContact O-CB 3.49Å; Q13-K17 WeakPolarHBondContact O-CG 2.77Å; Q13-K17 PolarHBondContact O-N 3.29Å; K17-N20 PolarHBondContact O-N 3.38Å; K17-N21 PolarHBondContact O-N 3.07Å
18	S	56.3	Low	52.9	Low	65 Å²	65	100.6 Å²	100.6	46%	0.455	52%	0.524	S	S	.	.	H	α-helix	trans	-65.5	-43.2	177.8	-57.3	0	0	0	0	111.8	T14 I15 Q16 N21 V22	T14-S18 WeakPolarHBondContact O-CB 3.46Å; T14-S18 PolarHBondContact O-N 3Å; T14-S18 PolarHBondContact O-OG 3.08Å; I15-S18 WeakPolarHBondContact O-CB 2.87Å; I15-S18 PolarHBondContact O-N 2.96Å; I15-S18 VanDerWaalsContact O-N 3.13Å; Q16-S18 VanDerWaalsContact C-N 3.3Å; Q16-S18 PolarHBondContact O-N 2.86Å; S18-N21 PolarHBondContact O-N 3.25Å; S18-V22 WeakPolarHBondContact O-CG2 3.49Å; S18-V22 PolarHBondContact O-N 2.7Å
19	I	57.8	Low	52.3	Low	93 Å²	93	103.7 Å²	103.7	48%	0.477	53%	0.53	S	S	.	.	H	α-helix	trans	-63.2	-45.1	175.4	-66.9	167.2	0	0	0	110.5	I15 Q16 N21 V22 V23	I15-I19 HydrophobicContact CG2-CD1 3.85Å; I15-I19 HydrophobicContact CG2-CG1 4.41Å; I15-I19 WeakPolarHBondContact O-CG1 3.33Å; I15-I19 PolarHBondContact O-N 3.06Å; Q16-I19 PolarHBondContact O-N 2.78Å; I19-N21 VanDerWaalsContact C-N 3.31Å; I19-N21 PolarHBondContact O-N 3.1Å; I19-V22 PolarHBondContact O-N 2.82Å; I19-V22 VanDerWaalsContact O-N 3.13Å; I19-V23 HydrophobicContact CG2-CG2 4.34Å; I19-V23 WeakPolarHBondContact O-CG2 3.17Å; I19-V23 PolarHBondContact O-N 3.31Å
20	N	53.4	Low	51.4	Low	84 Å²	84	105.1 Å²	105.1	45%	0.449	53%	0.534	S	S	.	.	H	α-helix	trans	-62.6	-37.9	177.8	-74	-12.3	0	0	0	112	Q16 K17 V23 N24	Q16-N20 WeakPolarHBondContact O-CB 3.48Å; Q16-N20 VanDerWaalsContact O-CG 3.31Å; Q16-N20 PolarHBondContact O-N 3.37Å; K17-N20 PolarHBondContact O-N 3.38Å; N20-V23 PolarHBondContact O-N 3.07Å; N20-N24 WeakPolarHBondContact O-CB 3.35Å; N20-N24 VanDerWaalsContact O-CG 3.27Å; N20-N24 PolarHBondContact O-N 3.32Å; N20-N24 PolarHBondContact O-ND2 3.46Å
21	N	52.5	Low	50.3	Low	110 Å²	110	107.1 Å²	107.1	59%	0.588	54%	0.539	S	S	*	.	H	α-helix	trans	-62.9	-42	172.8	-85.5	-8.3	0	0	0	111.9	K17 S18 I19 N24 T25	K17-N21 PolarHBondContact O-N 3.07Å; S18-N21 PolarHBondContact O-N 3.25Å; I19-N21 VanDerWaalsContact C-N 3.31Å; I19-N21 PolarHBondContact O-N 3.1Å; N21-N24 PolarHBondContact O-N 2.99Å; N21-T25 PolarHBondContact O-N 2.91Å; N21-T25 PolarHBondContact O-OG1 3.31Å
22	V	51.8	Low	49.6	Very low	94 Å²	94	107.5 Å²	107.5	57%	0.57	54%	0.544	S	S	*	.	H	α-helix	trans	-65.2	-43.1	176.7	175.5	0	0	0	0	111.3	S18 I19 N24 T25 R26	S18-V22 WeakPolarHBondContact O-CG2 3.49Å; S18-V22 PolarHBondContact O-N 2.7Å; I19-V22 PolarHBondContact O-N 2.82Å; I19-V22 VanDerWaalsContact O-N 3.13Å; V22-N24 VanDerWaalsContact C-N 3.34Å; V22-N24 PolarHBondContact O-N 3.06Å; V22-T25 WeakPolarHBondContact CA-OG1 2.99Å; V22-T25 PolarHBondContact O-N 3Å; V22-T25 PolarHBondContact O-OG1 2.79Å; V22-R26 PolarHBondContact O-N 3.44Å
23	V	49.9	Very low	48.6	Very low	71 Å²	71	110.8 Å²	110.8	43%	0.43	56%	0.564	S	S	.	*	H	α-helix	trans	-64.4	-40.5	177	175.3	0	0	0	0	111	I19 N20 R26 N27	I19-V23 HydrophobicContact CG2-CG2 4.34Å; I19-V23 WeakPolarHBondContact O-CG2 3.17Å; I19-V23 PolarHBondContact O-N 3.31Å; N20-V23 PolarHBondContact O-N 3.07Å; V23-R26 PolarHBondContact O-N 3.1Å; V23-R26 VanDerWaalsContact O-N 3.17Å; V23-N27 PolarHBondContact O-N 3.37Å
24	N	46.5	Very low	47.6	Very low	93 Å²	93	114.4 Å²	114.4	50%	0.497	58%	0.583	S	S	.	*	H	α-helix	trans	-64	-41.1	175	-76.3	-18.2	0	0	0	112	N20 N21 V22 R26 N27 Q28	N20-N24 WeakPolarHBondContact O-CB 3.35Å; N20-N24 VanDerWaalsContact O-CG 3.27Å; N20-N24 PolarHBondContact O-N 3.32Å; N20-N24 PolarHBondContact O-ND2 3.46Å; N21-N24 PolarHBondContact O-N 2.99Å; V22-N24 VanDerWaalsContact C-N 3.34Å; V22-N24 PolarHBondContact O-N 3.06Å; N24-R26 VanDerWaalsContact C-N 3.27Å; N24-R26 PolarHBondContact O-N 3.4Å; N24-N27 PolarHBondContact O-N 2.79Å; N24-Q28 WeakPolarHBondContact O-CG 3.1Å; N24-Q28 PolarHBondContact O-N 2.85Å
25	T	48.8	Very low	46.4	Very low	86 Å²	86	115.2 Å²	115.2	53%	0.528	58%	0.583	S	S	.	*	H	α-helix	trans	-63.5	-34	173.5	49.5	0	0	0	0	112.5	N21 V22 Q29	N21-T25 PolarHBondContact O-N 2.91Å; N21-T25 PolarHBondContact O-OG1 3.31Å; V22-T25 WeakPolarHBondContact CA-OG1 2.99Å; V22-T25 PolarHBondContact O-N 3Å; V22-T25 PolarHBondContact O-OG1 2.79Å; T25-Q29 PolarHBondContact O-N 3.32Å
26	R	37.2	Very low	45.5	Very low	178 Å²	178	117.1 Å²	117.1	67%	0.672	59%	0.594	S	S	*	*	H	α-helix	trans	-71.3	-38.8	177.3	-155.1	-179.6	-154.8	155.9	5.6	112.3	V22 V23 N24 Q29	V22-R26 PolarHBondContact O-N 3.44Å; V23-R26 PolarHBondContact O-N 3.1Å; V23-R26 VanDerWaalsContact O-N 3.17Å; N24-R26 VanDerWaalsContact C-N 3.27Å; N24-R26 PolarHBondContact O-N 3.4Å; R26-Q29 VanDerWaalsContact O-CB 3.3Å; R26-Q29 WeakPolarHBondContact O-CB 3.18Å; R26-Q29 PolarHBondContact O-N 3.02Å
27	N	40.8	Very low	44.6	Very low	95 Å²	95	118.4 Å²	118.4	51%	0.508	60%	0.6	S	S	.	*	H	α-helix	trans	-70.4	-34.2	175.7	-80	-18.7	0	0	0	112.4	V23 N24 Q29 H30	V23-N27 PolarHBondContact O-N 3.37Å; N24-N27 PolarHBondContact O-N 2.79Å; N27-Q29 PolarHBondContact O-N 2.74Å; N27-H30 PolarHBondContact O-N 3Å; N27-H30 VanDerWaalsContact O-N 3.14Å
28	Q	43.1	Very low	43.5	Very low	145 Å²	145	119.2 Å²	119.2	68%	0.678	61%	0.606	S	S	*	*	H	α-helix	trans	-64.4	-28.8	171.3	-73.5	-171.6	7.2	0	0	112.4	N24 H30 Q31	N24-Q28 WeakPolarHBondContact O-CG 3.1Å; N24-Q28 PolarHBondContact O-N 2.85Å; Q28-H30 PolarHBondContact O-N 3.28Å; Q28-Q31 PolarHBondContact O-N 2.96Å; Q28-Q31 VanDerWaalsContact O-N 3.16Å
29	Q	43.8	Very low	42.5	Very low	137 Å²	137	118.4 Å²	118.4	64%	0.64	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	-20.9	175.1	-130.6	169.9	4.6	0	0	113.5	T25 R26 N27 I32	T25-Q29 PolarHBondContact O-N 3.32Å; R26-Q29 VanDerWaalsContact O-CB 3.3Å; R26-Q29 WeakPolarHBondContact O-CB 3.18Å; R26-Q29 PolarHBondContact O-N 3.02Å; N27-Q29 PolarHBondContact O-N 2.74Å; Q29-I32 HydrophobicContact CG-CD1 4.3Å
30	H	42	Very low	41.3	Very low	159 Å²	159	118 Å²	118	74%	0.736	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	-5.7	174.6	-73.6	-40.8	0	0	0	114.5	N27 Q28	N27-H30 PolarHBondContact O-N 3Å; N27-H30 VanDerWaalsContact O-N 3.14Å; Q28-H30 PolarHBondContact O-N 3.28Å
31	Q	33.2	Very low	40.5	Very low	156 Å²	156	121.1 Å²	121.1	73%	0.729	62%	0.616	S	S	*	*			trans	-106.7	22.9	173.2	-75.1	-172.9	33.4	0	0	113.3	Q28 T33	Q28-Q31 PolarHBondContact O-N 2.96Å; Q28-Q31 VanDerWaalsContact O-N 3.16Å; Q31-T33 PolarHBondContact O-N 3.29Å
32	I	38	Very low	39.6	Very low	124 Å²	124	120.3 Å²	120.3	64%	0.636	62%	0.619	S	S	*	*			trans	-77.1	66.2	168.4	-48.4	175.7	0	0	0	108.3	Q29	Q29-I32 HydrophobicContact CG-CD1 4.3Å
33	T	34.4	Very low	38.6	Very low	110 Å²	110	120.5 Å²	120.5	68%	0.675	62%	0.616	S	S	*	*	S	Bend	trans	-121.3	108.6	169.8	-54.8	0	0	0	0	105.5	Q31	Q31-T33 PolarHBondContact O-N 3.29Å
34	M	37.3	Very low	38.1	Very low	178 Å²	178	122.3 Å²	122.3	88%	0.877	63%	0.629	S	S	*	*			trans	66	44.5	167.6	-50.4	-62.6	-72.3	0	0	116.5	D36	M34-D36 PolarHBondContact O-N 3.1Å
35	I	34.7	Very low	37.9	Very low	105 Å²	105	123.5 Å²	123.5	54%	0.538	63%	0.634	S	S	.	*			trans	-85.9	113	164.3	-57.5	179.8	0	0	0	108.1	E37 S39	I35-E37 PolarHBondContact O-N 3.03Å; I35-S39 WeakPolarHBondContact CG2-OG 3.19Å
36	D	37.5	Very low	37.6	Very low	118 Å²	118	123.1 Å²	123.1	63%	0.631	65%	0.647	S	S	*	*			trans	-40.7	128.7	173.7	-163.8	-1.6	0	0	0	111.5	M34 Q38 S39	M34-D36 PolarHBondContact O-N 3.1Å; D36-Q38 PolarHBondContact O-N 2.73Å; D36-S39 PolarHBondContact O-N 3.41Å; D36-S39 VanDerWaalsContact O-N 3.09Å; D36-S39 PolarHBondContact O-OG 3.35Å
37	E	37.4	Very low	38.1	Very low	148 Å²	148	120.4 Å²	120.4	69%	0.692	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.9	-16.4	-171.7	-75.2	-89.4	139.3	0	0	113.4	I35 S39 L40	I35-E37 PolarHBondContact O-N 3.03Å; E37-S39 PolarHBondContact O-N 2.81Å; E37-L40 PolarHBondContact O-N 2.77Å
38	Q	37.7	Very low	39.2	Very low	154 Å²	154	120 Å²	120	72%	0.72	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	-31.6	178.1	-60.3	-163.1	13	0	0	113.9	D36	D36-Q38 PolarHBondContact O-N 2.73Å
39	S	35.2	Very low	40.2	Very low	49 Å²	49	114.7 Å²	114.7	34%	0.343	62%	0.617	S	S	.	*	G	3₁₀ helix	trans	-82.6	-15.9	180	67.6	0	0	0	0	113.5	I35 D36 E37 N41 S42	I35-S39 WeakPolarHBondContact CG2-OG 3.19Å; D36-S39 PolarHBondContact O-N 3.41Å; D36-S39 VanDerWaalsContact O-N 3.09Å; D36-S39 PolarHBondContact O-OG 3.35Å; E37-S39 PolarHBondContact O-N 2.81Å; S39-N41 PolarHBondContact O-N 2.62Å; S39-S42 PolarHBondContact O-N 2.87Å; S39-S42 PolarHBondContact O-OG 3.32Å
40	L	32.4	Very low	41.3	Very low	83 Å²	83	110 Å²	110	44%	0.435	60%	0.6	S	S	.	*	G	3₁₀ helix	trans	-65.2	-20.1	173.7	-73	175.7	0	0	0	112.5	E37 S42	E37-L40 PolarHBondContact O-N 2.77Å; L40-S42 PolarHBondContact O-N 3.17Å
41	N	37.1	Very low	42.9	Very low	151 Å²	151	107.9 Å²	107.9	81%	0.807	59%	0.59	S	S	*	*	G	3₁₀ helix	trans	-72	-10.4	170.8	-70.5	-33.4	0	0	0	113.7	S39	S39-N41 PolarHBondContact O-N 2.62Å
42	S	32.6	Very low	44.9	Very low	93 Å²	93	103.3 Å²	103.3	65%	0.65	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.1	-12.1	178.6	73.7	0	0	0	0	113.9	S39 L40	S39-S42 PolarHBondContact O-N 2.87Å; S39-S42 PolarHBondContact O-OG 3.32Å; L40-S42 PolarHBondContact O-N 3.17Å
43	L	32.1	Very low	46.7	Very low	98 Å²	98	97.7 Å²	97.7	51%	0.513	54%	0.54	S	S	.	.	S	Bend	trans	-68.9	129.7	166.3	-112.8	83	0	0	0	107.7	I45	L43-I45 HydrophobicContact CB-CD1 3.72Å; L43-I45 HydrophobicContact CB-CG1 3.93Å; L43-I45 HydrophobicContact CD2-CD1 3.38Å; L43-I45 HydrophobicContact CD2-CG1 3.87Å; L43-I45 HydrophobicContact CG-CD1 4.16Å; L43-I45 HydrophobicContact CG-CG1 4.46Å; L43-I45 PolarHBondContact O-N 2.88Å
44	P	38.3	Very low	48.8	Very low	109 Å²	109	93.7 Å²	93.7	71%	0.708	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	56.5	172.5	32.9	-33.4	0	0	0	109.2	M47	P44-M47 WeakPolarHBondContact O-CG 3.19Å
45	I	43	Very low	50.9	Low	118 Å²	118	90.7 Å²	90.7	61%	0.605	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-12.6	168.9	-72.1	162.9	0	0	0	110	L43 M47	L43-I45 HydrophobicContact CB-CD1 3.72Å; L43-I45 HydrophobicContact CB-CG1 3.93Å; L43-I45 HydrophobicContact CD2-CD1 3.38Å; L43-I45 HydrophobicContact CD2-CG1 3.87Å; L43-I45 HydrophobicContact CG-CD1 4.16Å; L43-I45 HydrophobicContact CG-CG1 4.46Å; L43-I45 PolarHBondContact O-N 2.88Å; I45-M47 PolarHBondContact O-N 3.37Å
46	G	41.1	Very low	52.9	Low	77 Å²	77	88.2 Å²	88.2	79%	0.794	48%	0.484	S	S	*	.			trans	-71.7	28.7	167.6	0	0	0	0	0	114.1	N48	G46-N48 PolarHBondContact O-N 3.16Å
47	M	49.5	Very low	54.9	Low	122 Å²	122	82.6 Å²	82.6	60%	0.601	45%	0.454	S	S	*	.			trans	-62.3	110.2	174.7	-55.9	-172.1	73.8	0	0	107.6	P44 I45 L49 E52	P44-M47 WeakPolarHBondContact O-CG 3.19Å; I45-M47 PolarHBondContact O-N 3.37Å; M47-L49 PolarHBondContact O-N 3.44Å; M47-E52 HydrophobicContact CE-CG 4.06Å
48	N	64	Low	56.7	Low	87 Å²	87	79.1 Å²	79.1	47%	0.465	44%	0.438	S	S	.	.			trans	-66.4	103.5	178.6	-167	-35	0	0	0	107.7	G46 S50 Q51 E52	G46-N48 PolarHBondContact O-N 3.16Å; N48-S50 PolarHBondContact O-N 2.92Å; N48-S50 PolarHBondContact OD1-N 3.08Å; N48-S50 PolarHBondContact OD1-OG 2.93Å; N48-Q51 HydrophobicContact CB-CB 4.41Å; N48-Q51 HydrophobicContact CB-CG 4.05Å; N48-Q51 WeakPolarHBondContact O-CA 3.15Å; N48-Q51 WeakPolarHBondContact O-CB 3.37Å; N48-Q51 PolarHBondContact O-N 2.76Å; N48-E52 PolarHBondContact O-N 3.13Å
49	L	63.2	Low	58.5	Low	33 Å²	33	74.9 Å²	74.9	17%	0.173	43%	0.426	C	S	.	.	H	α-helix	trans	-47.7	-36.9	-176.9	178.9	67.6	0	0	0	111.8	M47 Q51 E52 I53 I511	M47-L49 PolarHBondContact O-N 3.44Å; L49-Q51 VanDerWaalsContact C-N 3.28Å; L49-Q51 PolarHBondContact O-N 2.91Å; L49-E52 PolarHBondContact O-N 2.49Å; L49-I53 HydrophobicContact CD1-CD1 4.04Å; L49-I53 HydrophobicContact CD1-CG1 4.27Å; L49-I53 HydrophobicContact CD2-CD1 4.2Å; L49-I53 HydrophobicContact CG-CD1 3.66Å; L49-I53 HydrophobicContact CG-CG1 4.29Å; L49-I53 VanDerWaalsContact O-CG1 3.26Å; L49-I53 WeakPolarHBondContact O-CG1 3.46Å; L49-I53 PolarHBondContact O-N 2.71Å; L49-I511 HydrophobicContact CD1-CB 3.84Å; L49-I511 HydrophobicContact CD1-CD1 3.56Å; L49-I511 HydrophobicContact CD1-CG1 4.29Å; L49-I511 HydrophobicContact CD1-CG2 3.63Å
50	S	67.6	Low	60.2	Low	38 Å²	38	72.8 Å²	72.8	27%	0.266	41%	0.411	S	S	.	.	H	α-helix	trans	-65	-30.4	178.5	71.7	0	0	0	0	113.2	N48 L54	N48-S50 PolarHBondContact O-N 2.92Å; N48-S50 PolarHBondContact OD1-N 3.08Å; N48-S50 PolarHBondContact OD1-OG 2.93Å; S50-L54 WeakPolarHBondContact O-CB 3.36Å; S50-L54 PolarHBondContact O-N 3.34Å
51	Q	73.9	Confident	62	Low	114 Å²	114	70.4 Å²	70.4	53%	0.533	40%	0.397	S	S	.	.	H	α-helix	trans	-72.3	-39.7	175.9	-69.8	-174.2	-8.4	0	0	112	N48 L49 L54 K55	N48-Q51 HydrophobicContact CB-CB 4.41Å; N48-Q51 HydrophobicContact CB-CG 4.05Å; N48-Q51 WeakPolarHBondContact O-CA 3.15Å; N48-Q51 WeakPolarHBondContact O-CB 3.37Å; N48-Q51 PolarHBondContact O-N 2.76Å; L49-Q51 VanDerWaalsContact C-N 3.28Å; L49-Q51 PolarHBondContact O-N 2.91Å; Q51-L54 WeakPolarHBondContact O-CB 3.24Å; Q51-L54 PolarHBondContact O-N 3.15Å; Q51-K55 WeakPolarHBondContact O-CG 3.39Å; Q51-K55 PolarHBondContact O-N 2.84Å
52	E	76.2	Confident	63.6	Low	60 Å²	60	66.4 Å²	66.4	28%	0.28	38%	0.384	S	S	.	.	H	α-helix	trans	-69.2	-42.4	175.7	-68.7	-55.3	140.5	0	0	111.4	M47 N48 L49 L54 K55 L56	M47-E52 HydrophobicContact CE-CG 4.06Å; N48-E52 PolarHBondContact O-N 3.13Å; L49-E52 PolarHBondContact O-N 2.49Å; E52-L54 VanDerWaalsContact C-N 3.28Å; E52-L54 PolarHBondContact O-N 2.84Å; E52-K55 PolarHBondContact O-N 2.82Å; E52-K55 IonicContact OE1-NZ 2.76Å; E52-K55 PolarHBondContact OE1-NZ 3.12Å; E52-K55 IonicContact OE2-NZ 3.81Å; E52-L56 PolarHBondContact O-N 3.36Å
53	I	75.5	Confident	64.9	Low	7 Å²	7	66.4 Å²	66.4	4%	0.036	38%	0.377	C	S	.	.	H	α-helix	trans	-61.2	-41.5	172.7	-62.6	169.1	0	0	0	109.7	L49 L56 V57 L249 V252 L255	L49-I53 HydrophobicContact CD1-CD1 4.04Å; L49-I53 HydrophobicContact CD1-CG1 4.27Å; L49-I53 HydrophobicContact CD2-CD1 4.2Å; L49-I53 HydrophobicContact CG-CD1 3.66Å; L49-I53 HydrophobicContact CG-CG1 4.29Å; L49-I53 VanDerWaalsContact O-CG1 3.26Å; L49-I53 WeakPolarHBondContact O-CG1 3.46Å; L49-I53 PolarHBondContact O-N 2.71Å; I53-L56 PolarHBondContact O-N 3.23Å; I53-V57 HydrophobicContact CG2-CG2 4.11Å; I53-V57 WeakPolarHBondContact O-CB 3.41Å; I53-V57 WeakPolarHBondContact O-CG2 3.48Å; I53-V57 PolarHBondContact O-N 2.76Å; I53-L249 HydrophobicContact CB-CD2 4.29Å; I53-L249 HydrophobicContact CG2-CD2 3.53Å; I53-V252 HydrophobicContact CD1-CB 3.95Å; I53-V252 HydrophobicContact CD1-CG1 3.87Å; I53-V252 VanDerWaalsContact CD1-O 3.31Å; I53-V252 WeakPolarHBondContact CD1-O 3.38Å; I53-V252 HydrophobicContact CG2-CB 4.28Å; I53-V252 HydrophobicContact CG2-CG1 3.99Å; I53-L255 HydrophobicContact CG2-CD1 4.22Å
54	L	79.7	Confident	66	Low	25 Å²	25	65.3 Å²	65.3	13%	0.131	37%	0.368	C	S	.	.	H	α-helix	trans	-60.1	-48.3	175.5	177.4	63.6	0	0	0	112	S50 Q51 E52 L56 V57 M58 I148 Q152 L249	S50-L54 WeakPolarHBondContact O-CB 3.36Å; S50-L54 PolarHBondContact O-N 3.34Å; Q51-L54 WeakPolarHBondContact O-CB 3.24Å; Q51-L54 PolarHBondContact O-N 3.15Å; E52-L54 VanDerWaalsContact C-N 3.28Å; E52-L54 PolarHBondContact O-N 2.84Å; L54-L56 VanDerWaalsContact C-N 3.25Å; L54-L56 PolarHBondContact O-N 2.92Å; L54-V57 PolarHBondContact O-N 3.44Å; L54-M58 HydrophobicContact CD1-CG 4.02Å; L54-M58 HydrophobicContact CG-CG 4.29Å; L54-M58 WeakPolarHBondContact O-CB 3.42Å; L54-M58 VanDerWaalsContact O-CG 3.23Å; L54-M58 WeakPolarHBondContact O-CG 3.34Å; L54-M58 PolarHBondContact O-N 2.77Å; L54-I148 HydrophobicContact CD1-CG2 4.23Å; L54-Q152 HydrophobicContact CD1-CB 3.89Å; L54-Q152 HydrophobicContact CD2-CB 3.74Å; L54-Q152 HydrophobicContact CG-CB 4.47Å; L54-L249 HydrophobicContact CB-CD1 3.95Å; L54-L249 HydrophobicContact CD1-CD1 3.81Å; L54-L249 HydrophobicContact CG-CD1 4.39Å
55	K	80.2	Confident	66.5	Low	115 Å²	115	62.5 Å²	62.5	50%	0.5	35%	0.346	S	S	.	.	H	α-helix	trans	-56.4	-42.9	176.2	-73.9	173.6	-172.2	168.8	0	111.1	Q51 E52 S59	Q51-K55 WeakPolarHBondContact O-CG 3.39Å; Q51-K55 PolarHBondContact O-N 2.84Å; E52-K55 PolarHBondContact O-N 2.82Å; E52-K55 IonicContact OE1-NZ 2.76Å; E52-K55 PolarHBondContact OE1-NZ 3.12Å; E52-K55 IonicContact OE2-NZ 3.81Å; K55-S59 WeakPolarHBondContact O-CB 3.23Å; K55-S59 PolarHBondContact O-N 3.21Å; K55-S59 PolarHBondContact O-OG 3.33Å
56	L	77.7	Confident	66.2	Low	53 Å²	53	61.1 Å²	61.1	28%	0.277	35%	0.345	S	S	.	.	H	α-helix	trans	-64	-50.8	177.4	-175.6	61	0	0	0	110.6	E52 I53 L54 M58 S59 L60 L255	E52-L56 PolarHBondContact O-N 3.36Å; I53-L56 PolarHBondContact O-N 3.23Å; L54-L56 VanDerWaalsContact C-N 3.25Å; L54-L56 PolarHBondContact O-N 2.92Å; L56-M58 VanDerWaalsContact C-N 3.32Å; L56-M58 PolarHBondContact O-N 3.36Å; L56-S59 WeakPolarHBondContact O-CB 2.94Å; L56-S59 PolarHBondContact O-N 2.99Å; L56-S59 VanDerWaalsContact O-N 3.09Å; L56-L60 HydrophobicContact CD1-CG 4.4Å; L56-L60 HydrophobicContact CG-CD1 4.43Å; L56-L60 HydrophobicContact CG-CG 4.45Å; L56-L60 VanDerWaalsContact O-CG 3.28Å; L56-L60 WeakPolarHBondContact O-CG 3.28Å; L56-L60 PolarHBondContact O-N 2.62Å; L56-L255 HydrophobicContact CD2-CB 4.21Å; L56-L255 HydrophobicContact CD2-CD2 3.54Å; L56-L255 HydrophobicContact CD2-CG 4.47Å; L56-L255 HydrophobicContact CG-CD2 3.84Å
57	V	78.2	Confident	65.8	Low	1 Å²	1	61.4 Å²	61.4	1%	0.006	33%	0.328	C	S	.	.	H	α-helix	trans	-58.5	-43.2	178.4	176.3	0	0	0	0	111.2	I53 L54 L60 Y61 L145 I148 F155 L249 L255	I53-V57 HydrophobicContact CG2-CG2 4.11Å; I53-V57 WeakPolarHBondContact O-CB 3.41Å; I53-V57 WeakPolarHBondContact O-CG2 3.48Å; I53-V57 PolarHBondContact O-N 2.76Å; L54-V57 PolarHBondContact O-N 3.44Å; V57-L60 PolarHBondContact O-N 3.5Å; V57-Y61 VanDerWaalsContact O-CB 3.28Å; V57-Y61 WeakPolarHBondContact O-CB 3.35Å; V57-Y61 PolarHBondContact O-N 3.11Å; V57-L145 HydrophobicContact CG1-CD1 4.15Å; V57-L145 HydrophobicContact CG1-CD2 4.07Å; V57-I148 HydrophobicContact CG1-CD1 3.66Å; V57-I148 HydrophobicContact CG1-CG1 3.71Å; V57-F155 HydrophobicContact CG1-CB 4.11Å; V57-F155 HydrophobicContact CG1-CD1 4.25Å; V57-F155 HydrophobicContact CG1-CG 4.15Å; V57-F155 HydrophobicContact CG2-CD1 4.2Å; V57-F155 HydrophobicContact CG2-CE1 4.23Å; V57-L249 HydrophobicContact CG2-CD2 4.2Å; V57-L255 HydrophobicContact CG2-CD1 3.41Å; V57-L255 VanDerWaalsContact CG2-CD1 3.41Å
58	M	76	Confident	64.9	Low	74 Å²	74	63.1 Å²	63.1	37%	0.365	33%	0.334	S	S	.	.	H	α-helix	trans	-61	-44.8	174.7	-71.5	-68.4	-65	0	0	111.5	L54 L56 Y61 A62 I148	L54-M58 HydrophobicContact CD1-CG 4.02Å; L54-M58 HydrophobicContact CG-CG 4.29Å; L54-M58 WeakPolarHBondContact O-CB 3.42Å; L54-M58 VanDerWaalsContact O-CG 3.23Å; L54-M58 WeakPolarHBondContact O-CG 3.34Å; L54-M58 PolarHBondContact O-N 2.77Å; L56-M58 VanDerWaalsContact C-N 3.32Å; L56-M58 PolarHBondContact O-N 3.36Å; M58-Y61 PolarHBondContact O-N 2.92Å; M58-A62 WeakPolarHBondContact O-CB 3.43Å; M58-A62 PolarHBondContact O-N 3.38Å; M58-I148 HydrophobicContact CB-CD1 4.42Å; M58-I148 HydrophobicContact CG-CD1 3.95Å; M58-I148 HydrophobicContact SD-CD1 3.24Å; M58-I148 WeakPolarHBondContact SD-CD1 3.47Å; M58-I148 HydrophobicContact SD-CG1 4.45Å; M58-I148 HydrophobicContact SD-CG2 4.29Å
59	S	74.4	Confident	63.1	Low	66 Å²	66	62.4 Å²	62.4	46%	0.462	34%	0.336	S	S	.	.	H	α-helix	trans	-62.2	-45.3	176.6	-57.1	0	0	0	0	111.3	K55 L56 Y61 A62 L63	K55-S59 WeakPolarHBondContact O-CB 3.23Å; K55-S59 PolarHBondContact O-N 3.21Å; K55-S59 PolarHBondContact O-OG 3.33Å; L56-S59 WeakPolarHBondContact O-CB 2.94Å; L56-S59 PolarHBondContact O-N 2.99Å; L56-S59 VanDerWaalsContact O-N 3.09Å; S59-Y61 VanDerWaalsContact C-N 3.33Å; S59-Y61 PolarHBondContact O-N 3.04Å; S59-A62 WeakPolarHBondContact O-CB 3.37Å; S59-A62 PolarHBondContact O-N 3.18Å; S59-L63 WeakPolarHBondContact O-CG 3.41Å; S59-L63 PolarHBondContact O-N 2.97Å
60	L	72.3	Confident	61.3	Low	5 Å²	5	68.3 Å²	68.3	3%	0.026	37%	0.366	C	S	.	.	H	α-helix	trans	-62.7	-41.5	176.6	-65.8	-171.4	0	0	0	112.1	L56 V57 A62 L63 P127 I129 L145 L255 I257	L56-L60 HydrophobicContact CD1-CG 4.4Å; L56-L60 HydrophobicContact CG-CD1 4.43Å; L56-L60 HydrophobicContact CG-CG 4.45Å; L56-L60 VanDerWaalsContact O-CG 3.28Å; L56-L60 WeakPolarHBondContact O-CG 3.28Å; L56-L60 PolarHBondContact O-N 2.62Å; V57-L60 PolarHBondContact O-N 3.5Å; L60-A62 VanDerWaalsContact C-N 3.27Å; L60-A62 PolarHBondContact O-N 2.97Å; L60-L63 HydrophobicContact CD2-CD1 3.91Å; L60-L63 WeakPolarHBondContact O-CB 3.26Å; L60-L63 PolarHBondContact O-N 3.08Å; L60-P127 HydrophobicContact CB-CG 4.01Å; L60-P127 WeakPolarHBondContact O-CD 3.11Å; L60-P127 VanDerWaalsContact O-CG 3.28Å; L60-P127 WeakPolarHBondContact O-CG 3.46Å; L60-I129 HydrophobicContact CD1-CG2 3.66Å; L60-L145 HydrophobicContact CB-CD2 4.15Å; L60-L255 HydrophobicContact CD1-CD2 3.38Å; L60-I257 HydrophobicContact CD1-CG1 4.02Å; L60-I257 HydrophobicContact CD2-CD1 3.22Å; L60-I257 HydrophobicContact CD2-CG1 3.33Å; L60-I257 HydrophobicContact CG-CG1 4.33Å
61	Y	70	Confident	59.3	Low	33 Å²	33	73.9 Å²	73.9	13%	0.129	39%	0.387	C	S	.	.	H	α-helix	trans	-66.8	-33	177.9	-164.6	-127.2	0	0	0	112	V57 M58 S59 I101 L145 I146 I148	V57-Y61 VanDerWaalsContact O-CB 3.28Å; V57-Y61 WeakPolarHBondContact O-CB 3.35Å; V57-Y61 PolarHBondContact O-N 3.11Å; M58-Y61 PolarHBondContact O-N 2.92Å; S59-Y61 VanDerWaalsContact C-N 3.33Å; S59-Y61 PolarHBondContact O-N 3.04Å; Y61-I101 HydrophobicContact CD1-CD1 3.18Å; Y61-I101 HydrophobicContact CD1-CG1 4.12Å; Y61-I101 HydrophobicContact CE1-CD1 3.18Å; Y61-I101 HydrophobicContact CE1-CG1 3.65Å; Y61-I101 HydrophobicContact CG-CD1 4.23Å; Y61-L145 HydrophobicContact CD2-CD2 4.24Å; Y61-L145 HydrophobicContact CD2-CG 4.22Å; Y61-I146 VanDerWaalsContact CE2-C 3.48Å; Y61-I146 WeakPolarHBondContact CE2-O 3.45Å; Y61-I146 PolarHBondContact OH-O 3.02Å; Y61-I148 HydrophobicContact CD1-CD1 3.97Å; Y61-I148 HydrophobicContact CD1-CG1 4.3Å; Y61-I148 HydrophobicContact CG-CD1 4.1Å; Y61-I148 HydrophobicContact CG-CG1 4.42Å
62	A	69.9	Low	57	Low	67 Å²	67	76.5 Å²	76.5	55%	0.554	40%	0.397	S	S	*	.	H	α-helix	trans	-71.6	-30.3	172.6	0	0	0	0	0	113.3	M58 S59 L60 K64	M58-A62 WeakPolarHBondContact O-CB 3.43Å; M58-A62 PolarHBondContact O-N 3.38Å; S59-A62 WeakPolarHBondContact O-CB 3.37Å; S59-A62 PolarHBondContact O-N 3.18Å; L60-A62 VanDerWaalsContact C-N 3.27Å; L60-A62 PolarHBondContact O-N 2.97Å; A62-K64 PolarHBondContact O-N 3.32Å
63	L	60.1	Low	54.6	Low	93 Å²	93	80 Å²	80	49%	0.487	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-9.8	-177	-79.9	174.4	0	0	0	114.6	S59 L60 L65 I257	S59-L63 WeakPolarHBondContact O-CG 3.41Å; S59-L63 PolarHBondContact O-N 2.97Å; L60-L63 HydrophobicContact CD2-CD1 3.91Å; L60-L63 WeakPolarHBondContact O-CB 3.26Å; L60-L63 PolarHBondContact O-N 3.08Å; L63-L65 VanDerWaalsContact C-N 3.26Å; L63-L65 HydrophobicContact CB-CD2 4.34Å; L63-L65 WeakPolarHBondContact O-CA 3.14Å; L63-L65 PolarHBondContact O-N 3.33Å; L63-I257 HydrophobicContact CD1-CD1 4.43Å
64	K	55.6	Low	52.3	Low	74 Å²	74	85.7 Å²	85.7	32%	0.322	45%	0.448	S	S	.	.			trans	18.1	69.3	174.2	-76.8	-178	177	169.8	0	111.9	A62 K124 S125	A62-K64 PolarHBondContact O-N 3.32Å; K64-K124 HydrophobicContact CD-CG 4.3Å; K64-S125 CarbonylContact C-O 3.59Å
65	L	48.8	Very low	49.7	Very low	50 Å²	50	94.5 Å²	94.5	26%	0.262	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	134.9	-168.2	-67.6	175.4	0	0	0	108.6	L63 I67 S125 P127	L63-L65 VanDerWaalsContact C-N 3.26Å; L63-L65 HydrophobicContact CB-CD2 4.34Å; L63-L65 WeakPolarHBondContact O-CA 3.14Å; L63-L65 PolarHBondContact O-N 3.33Å; L65-I67 PolarHBondContact O-N 2.79Å; L65-I67 VanDerWaalsContact O-N 3.1Å; L65-S125 PolarHBondContact N-O 2.58Å; L65-S125 VanDerWaalsContact N-O 3.08Å; L65-S125 WeakPolarHBondContact O-CB 3.5Å; L65-S125 PolarHBondContact O-OG 3.1Å; L65-P127 HydrophobicContact CD1-CB 3.77Å; L65-P127 HydrophobicContact CG-CB 4.41Å
66	P	35.8	Very low	47.2	Very low	89 Å²	89	92.7 Å²	92.7	58%	0.578	49%	0.492	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67	113.1	173	-14.5	26.1	0	0	0	108.9	R262	P66-R262 PolarHBondContact O-NH2 2.61Å
67	I	33.1	Very low	44.8	Very low	84 Å²	84	96.5 Å²	96.5	43%	0.431	52%	0.517	S	S	.	.			trans	-82.8	113.8	154.1	-74.2	171.4	0	0	0	105.2	L65 S69 S125	L65-I67 PolarHBondContact O-N 2.79Å; L65-I67 VanDerWaalsContact O-N 3.1Å; I67-S69 PolarHBondContact O-N 2.71Å; I67-S125 WeakPolarHBondContact CD1-OG 2.73Å; I67-S125 VanDerWaalsContact CG1-OG 3.23Å; I67-S125 WeakPolarHBondContact CG1-OG 3.4Å
68	H	30.4	Very low	42.2	Very low	157 Å²	157	105.3 Å²	105.3	73%	0.727	56%	0.559	S	S	*	*			trans	-63.6	108.2	161.7	-108.6	-24.4	0	0	0	106.5	I70	H68-I70 PolarHBondContact O-N 2.99Å; H68-I70 VanDerWaalsContact O-N 3.09Å
69	S	26.6	Very low	39.8	Very low	72 Å²	72	108.4 Å²	108.4	50%	0.503	58%	0.582	S	S	.	*			trans	-54.2	117.7	159.9	55.1	0	0	0	0	106.2	I67 H71	I67-S69 PolarHBondContact O-N 2.71Å; S69-H71 PolarHBondContact O-N 3.2Å
70	I	26.3	Very low	37.5	Very low	158 Å²	158	113.8 Å²	113.8	81%	0.81	60%	0.599	S	S	*	*			trans	-48.2	115.2	168.7	-64.7	165.3	0	0	0	105.8	H68 K72	H68-I70 PolarHBondContact O-N 2.99Å; H68-I70 VanDerWaalsContact O-N 3.09Å; I70-K72 PolarHBondContact O-N 2.81Å
71	H	24.2	Very low	35.2	Very low	155 Å²	155	120.8 Å²	120.8	72%	0.718	64%	0.637	S	S	*	*			trans	-55.8	103.6	-180	-163	-87.5	0	0	0	106.5	S69 D73	S69-H71 PolarHBondContact O-N 3.2Å; H71-D73 VanDerWaalsContact C-N 3.34Å; H71-D73 IonicContact CE1-OD1 3.08Å; H71-D73 IonicContact ND1-OD1 2.61Å; H71-D73 PolarHBondContact ND1-OD1 2.8Å; H71-D73 PolarHBondContact O-N 3.36Å
72	K	26.7	Very low	33	Very low	169 Å²	169	126.8 Å²	126.8	74%	0.735	67%	0.67	S	S	*	*			trans	-68.6	102.4	172.3	-85	-176.5	176.2	176.1	0	105.3	I70 N74	I70-K72 PolarHBondContact O-N 2.81Å; K72-N74 PolarHBondContact O-N 3.01Å
73	D	25.8	Very low	31.1	Very low	134 Å²	134	128.9 Å²	128.9	72%	0.717	68%	0.677	S	S	*	*			trans	-66.1	69.1	167	-69.4	-23.7	0	0	0	109.2	H71 K75	H71-D73 VanDerWaalsContact C-N 3.34Å; H71-D73 IonicContact CE1-OD1 3.08Å; H71-D73 IonicContact ND1-OD1 2.61Å; H71-D73 PolarHBondContact ND1-OD1 2.8Å; H71-D73 PolarHBondContact O-N 3.36Å; D73-K75 PolarHBondContact O-N 3.34Å
74	N	27.3	Very low	29.4	Very low	126 Å²	126	131.4 Å²	131.4	67%	0.674	69%	0.69	S	S	*	*			trans	-78.6	74.5	171.4	-71.7	-13.5	0	0	0	107.7	K72 A76	K72-N74 PolarHBondContact O-N 3.01Å; N74-A76 PolarHBondContact O-N 2.78Å; N74-A76 VanDerWaalsContact O-N 3.11Å
75	K	25	Very low	27.8	Very low	210 Å²	210	132.9 Å²	132.9	91%	0.913	71%	0.706	S	S	*	*			trans	-77.2	71	150.9	-74.2	-169.3	179.1	-176.8	0	107.7	D73	D73-K75 PolarHBondContact O-N 3.34Å
76	A	27.5	Very low	26.6	Very low	76 Å²	76	135.1 Å²	135.1	63%	0.628	73%	0.726	S	S	*	*			trans	-136.8	89.4	171.2	0	0	0	0	0	107.5	N74	N74-A76 PolarHBondContact O-N 2.78Å; N74-A76 VanDerWaalsContact O-N 3.11Å
77	T	26.4	Very low	26.1	Very low	134 Å²	134	138.2 Å²	138.2	82%	0.822	74%	0.736	S	S	*	*			trans	32.7	113.4	141.1	-16.8	0	0	0	0	117.2	T79	T77-T79 PolarHBondContact O-N 2.96Å
78	Q	23.7	Very low	25.6	Very low	186 Å²	186	141.9 Å²	141.9	87%	0.869	76%	0.755	S	S	*	*			trans	-37.6	125.2	159.6	-70.3	166.9	-6.1	0	0	111.9
79	T	26.6	Very low	25.2	Very low	138 Å²	138	139.1 Å²	139.1	85%	0.847	75%	0.754	S	S	*	*			trans	-147.6	118.3	142.3	-37.8	0	0	0	0	106.8	T77	T77-T79 PolarHBondContact O-N 2.96Å
80	E	25	Very low	25	Very low	179 Å²	179	138.8 Å²	138.8	84%	0.836	76%	0.762	S	S	*	*			trans	-62.6	129.8	178.9	-60.2	166.7	168.5	0	0	109.6
81	D	25.5	Very low	24.8	Very low	153 Å²	153	142.4 Å²	142.4	82%	0.818	77%	0.767	S	S	*	*			trans	-165.9	105.9	136.6	-115.4	-23.2	0	0	0	109.5	T83	D81-T83 PolarHBondContact O-N 3.3Å
82	L	23.8	Very low	24.7	Very low	158 Å²	158	141.5 Å²	141.5	83%	0.827	77%	0.773	S	S	*	*			trans	-66.3	113.9	163.3	-93.8	83.6	0	0	0	107.5
83	T	29.8	Very low	24.5	Very low	112 Å²	112	136.7 Å²	136.7	69%	0.687	77%	0.77	S	S	*	*			trans	-141.8	97.7	154.1	-5.8	0	0	0	0	108.2	D81 T85	D81-T83 PolarHBondContact O-N 3.3Å; T83-T85 PolarHBondContact O-N 2.9Å; T83-T85 PolarHBondContact O-OG1 3.43Å
84	D	23.8	Very low	24.5	Very low	145 Å²	145	137 Å²	137	78%	0.775	77%	0.772	S	S	*	*			trans	-54.3	75.1	168.6	-68.9	-49.9	0	0	0	110.6	S86	D84-S86 PolarHBondContact O-N 3Å
85	T	22.8	Very low	24.3	Very low	106 Å²	106	137.3 Å²	137.3	65%	0.65	78%	0.784	S	S	*	*			trans	-84.6	81.7	170.3	-42.2	0	0	0	0	106.3	T83 L87	T83-T85 PolarHBondContact O-N 2.9Å; T83-T85 PolarHBondContact O-OG1 3.43Å; T85-L87 PolarHBondContact O-N 2.95Å
86	S	23.8	Very low	24.5	Very low	96 Å²	96	130 Å²	130	67%	0.671	76%	0.759	S	S	*	*			trans	-52	87.3	162	-66.5	0	0	0	0	108.6	D84 I88	D84-S86 PolarHBondContact O-N 3Å; S86-I88 PolarHBondContact O-N 2.89Å
87	L	23.5	Very low	24.5	Very low	154 Å²	154	136.1 Å²	136.1	81%	0.806	77%	0.766	S	S	*	*			trans	-71.8	78.9	168.5	-77.7	174.7	0	0	0	108.1	T85 S89	T85-L87 PolarHBondContact O-N 2.95Å; L87-S89 VanDerWaalsContact C-N 3.32Å; L87-S89 PolarHBondContact O-N 3.41Å
88	I	22.6	Very low	25	Very low	162 Å²	162	132.6 Å²	132.6	83%	0.831	75%	0.746	S	S	*	*			trans	-62.7	95.6	159.5	-62.1	167	0	0	0	106	S86	S86-I88 PolarHBondContact O-N 2.89Å
89	S	23.6	Very low	25.2	Very low	99 Å²	99	125.9 Å²	125.9	69%	0.692	72%	0.717	S	S	*	*			trans	-136.5	87.2	170.8	-179.8	0	0	0	0	110.8	L87 Y91	L87-S89 VanDerWaalsContact C-N 3.32Å; L87-S89 PolarHBondContact O-N 3.41Å; S89-Y91 PolarHBondContact O-N 3.35Å
90	G	21.3	Very low	25.4	Very low	65 Å²	65	122.1 Å²	122.1	67%	0.67	70%	0.697	S	S	*	*				85.3	5.1	119.7	0	0	0	0	0	120.4	T92	G90-T92 VanDerWaalsContact C-N 3.28Å; G90-T92 PolarHBondContact O-N 2.96Å
91	Y	21.7	Very low	25.9	Very low	233 Å²	233	114.7 Å²	114.7	91%	0.914	66%	0.663	S	S	*	*			trans	-84.4	74.8	171.3	-80.3	-85.8	0	0	0	111.7	S89	S89-Y91 PolarHBondContact O-N 3.35Å
92	T	21.8	Very low	26.3	Very low	137 Å²	137	111 Å²	111	84%	0.84	65%	0.649	S	S	*	*			trans	-72.8	128.4	156.5	47.7	0	0	0	0	109.2	G90	G90-T92 VanDerWaalsContact C-N 3.28Å; G90-T92 PolarHBondContact O-N 2.96Å
93	G	24	Very low	26.9	Very low	67 Å²	67	110.5 Å²	110.5	69%	0.691	64%	0.642	S	S	*	*	S	Bend	trans	119.1	48.9	153.2	0	0	0	0	0	116.8
94	L	24.4	Very low	26.9	Very low	142 Å²	142	109.1 Å²	109.1	74%	0.743	63%	0.629	S	S	*	*			trans	-154.5	89.1	131.6	-72.9	-172.4	0	0	0	105.8	S96	L94-S96 PolarHBondContact O-N 2.9Å
95	S	24.6	Very low	27.2	Very low	132 Å²	132	103.8 Å²	103.8	92%	0.923	61%	0.605	S	S	*	*			trans	-73.3	67.4	160.7	-172.6	0	0	0	0	106.8	R97	S95-R97 PolarHBondContact O-N 3.26Å
96	S	28.4	Very low	27.6	Very low	57 Å²	57	101.8 Å²	101.8	40%	0.399	60%	0.6	S	S	.	*			trans	-72.5	119.5	162.7	49.3	0	0	0	0	105.4	L94 C98	L94-S96 PolarHBondContact O-N 2.9Å; S96-C98 PolarHBondContact O-N 2.74Å
97	R	27.9	Very low	27.8	Very low	204 Å²	204	102 Å²	102	77%	0.77	60%	0.601	S	S	*	*			trans	-67.7	61.6	164.8	-161.4	-176.4	-163.9	178	2.3	107.9	S95 V99	S95-R97 PolarHBondContact O-N 3.26Å; R97-V99 PolarHBondContact O-N 2.87Å
98	C	36.5	Very low	28.1	Very low	60 Å²	60	101 Å²	101	41%	0.405	60%	0.595	S	S	.	*			trans	-75.5	119.9	175	55	0	0	0	0	106.5	S96 S100	S96-C98 PolarHBondContact O-N 2.74Å; C98-S100 PolarHBondContact O-N 2.81Å
99	V	27.4	Very low	28.4	Very low	44 Å²	44	100.9 Å²	100.9	27%	0.267	59%	0.589	S	S	.	*			trans	-66.1	107.3	174.3	-175.4	0	0	0	0	106.9	R97 I101 Q103 M104 E150	R97-V99 PolarHBondContact O-N 2.87Å; V99-I101 PolarHBondContact O-N 2.82Å; V99-Q103 HydrophobicContact CG1-CB 4.48Å; V99-M104 HydrophobicContact CB-CE 4.03Å; V99-M104 HydrophobicContact CG1-CE 3.8Å; V99-M104 HydrophobicContact CG1-CG 3.69Å; V99-M104 HydrophobicContact CG1-SD 3.98Å; V99-E150 HydrophobicContact CG2-CG 4.48Å
100	S	32.2	Very low	28.4	Very low	60 Å²	60	100.7 Å²	100.7	42%	0.42	59%	0.588	S	S	.	*			trans	-63.6	127.8	169.9	173.4	0	0	0	0	108	C98 S102 Q103	C98-S100 PolarHBondContact O-N 2.81Å; S100-S102 PolarHBondContact O-N 2.82Å; S100-S102 PolarHBondContact OG-N 3.26Å; S100-S102 PolarHBondContact OG-OG 2.74Å; S100-S102 VanDerWaalsContact OG-OG 3.1Å; S100-Q103 WeakPolarHBondContact O-CB 3.21Å; S100-Q103 PolarHBondContact O-N 3.09Å
101	I	34.9	Very low	28.6	Very low	23 Å²	23	101.7 Å²	101.7	12%	0.118	58%	0.584	C	S	.	*	H	α-helix	trans	-56.9	-16.1	176.9	-82.6	-176	0	0	0	112.7	Y61 V99 Q103 M104 A105	Y61-I101 HydrophobicContact CD1-CD1 3.18Å; Y61-I101 HydrophobicContact CD1-CG1 4.12Å; Y61-I101 HydrophobicContact CE1-CD1 3.18Å; Y61-I101 HydrophobicContact CE1-CG1 3.65Å; Y61-I101 HydrophobicContact CG-CD1 4.23Å; V99-I101 PolarHBondContact O-N 2.82Å; I101-Q103 PolarHBondContact O-N 2.91Å; I101-M104 HydrophobicContact CG1-CE 4.03Å; I101-M104 PolarHBondContact O-N 2.69Å; I101-M104 VanDerWaalsContact O-N 3.08Å; I101-A105 HydrophobicContact CG2-CB 3.55Å; I101-A105 WeakPolarHBondContact O-CB 3.47Å; I101-A105 PolarHBondContact O-N 3.45Å
102	S	32.9	Very low	28.8	Very low	75 Å²	75	98.4 Å²	98.4	52%	0.524	58%	0.582	S	S	.	*	H	α-helix	trans	-49.1	-34.6	167.1	-46.9	0	0	0	0	111.7	S100	S100-S102 PolarHBondContact O-N 2.82Å; S100-S102 PolarHBondContact OG-N 3.26Å; S100-S102 PolarHBondContact OG-OG 2.74Å; S100-S102 VanDerWaalsContact OG-OG 3.1Å
103	Q	36.7	Very low	29	Very low	147 Å²	147	97.7 Å²	97.7	69%	0.687	58%	0.578	S	S	*	*	H	α-helix	trans	-83.9	-34.9	177	-68.7	176.3	-19.8	0	0	113.7	V99 S100 I101	V99-Q103 HydrophobicContact CG1-CB 4.48Å; S100-Q103 WeakPolarHBondContact O-CB 3.21Å; S100-Q103 PolarHBondContact O-N 3.09Å; I101-Q103 PolarHBondContact O-N 2.91Å
104	M	29.4	Very low	29.2	Very low	83 Å²	83	103.8 Å²	103.8	41%	0.409	59%	0.586	S	S	.	*	H	α-helix	trans	-86.2	-37.2	-178.9	-74.2	-169.8	-66.8	0	0	114.3	V99 I101 A106 S107	V99-M104 HydrophobicContact CB-CE 4.03Å; V99-M104 HydrophobicContact CG1-CE 3.8Å; V99-M104 HydrophobicContact CG1-CG 3.69Å; V99-M104 HydrophobicContact CG1-SD 3.98Å; I101-M104 HydrophobicContact CG1-CE 4.03Å; I101-M104 PolarHBondContact O-N 2.69Å; I101-M104 VanDerWaalsContact O-N 3.08Å; M104-A106 VanDerWaalsContact C-N 3.27Å; M104-A106 PolarHBondContact O-N 2.82Å; M104-S107 WeakPolarHBondContact O-CB 3.28Å; M104-S107 PolarHBondContact O-N 2.99Å
105	A	30.3	Very low	29.2	Very low	33 Å²	33	105.1 Å²	105.1	27%	0.273	59%	0.593	S	S	.	*	H	α-helix	trans	-66	-30.9	179.8	0	0	0	0	0	112.3	I101 S107 I108 F109	I101-A105 HydrophobicContact CG2-CB 3.55Å; I101-A105 WeakPolarHBondContact O-CB 3.47Å; I101-A105 PolarHBondContact O-N 3.45Å; A105-S107 PolarHBondContact O-N 3.2Å; A105-I108 PolarHBondContact O-N 3.35Å; A105-F109 PolarHBondContact O-N 2.85Å; A105-F109 VanDerWaalsContact O-N 3.1Å
106	A	31.5	Very low	29.3	Very low	65 Å²	65	103.4 Å²	103.4	54%	0.537	58%	0.582	S	S	.	*	H	α-helix	trans	-59.7	-25.8	173.5	0	0	0	0	0	112.5	M104	M104-A106 VanDerWaalsContact C-N 3.27Å; M104-A106 PolarHBondContact O-N 2.82Å
107	S	29.2	Very low	29.3	Very low	101 Å²	101	109.9 Å²	109.9	71%	0.706	61%	0.608	S	S	*	*	H	α-helix	trans	-85.5	-23.8	-180	-170.6	0	0	0	0	114.2	M104 A105	M104-S107 WeakPolarHBondContact O-CB 3.28Å; M104-S107 PolarHBondContact O-N 2.99Å; A105-S107 PolarHBondContact O-N 3.2Å
108	I	28.7	Very low	29.3	Very low	131 Å²	131	105.8 Å²	105.8	67%	0.672	60%	0.601	S	S	*	*	H	α-helix	trans	-97.7	-30.3	-176.4	-50.2	177.8	0	0	0	110.9	A105	A105-I108 PolarHBondContact O-N 3.35Å
109	F	28.6	Very low	28.9	Very low	160 Å²	160	111 Å²	111	70%	0.702	63%	0.625	S	S	*	*			trans	-116.8	57.6	176.8	-59.4	-77.9	0	0	0	110.3	A105 S111	A105-F109 PolarHBondContact O-N 2.85Å; A105-F109 VanDerWaalsContact O-N 3.1Å; F109-S111 PolarHBondContact O-N 2.95Å
110	S	24.7	Very low	29.3	Very low	96 Å²	96	112.7 Å²	112.7	67%	0.671	64%	0.639	S	S	*	*			trans	-78.2	74.4	168.3	-169.2	0	0	0	0	109.1
111	S	25.1	Very low	29.4	Very low	85 Å²	85	117.8 Å²	117.8	59%	0.594	66%	0.656	S	S	*	*			trans	-95.3	118.2	155.6	23.8	0	0	0	0	107.2	F109 T113	F109-S111 PolarHBondContact O-N 2.95Å; S111-T113 PolarHBondContact O-N 2.76Å; S111-T113 PolarHBondContact O-OG1 2.97Å
112	D	25.7	Very low	29.5	Very low	164 Å²	164	122.5 Å²	122.5	88%	0.877	68%	0.678	S	S	*	*			trans	-45.6	68.1	-179.2	-80.2	-49.1	0	0	0	115.3
113	T	26.7	Very low	29.9	Very low	123 Å²	123	123.6 Å²	123.6	76%	0.755	68%	0.678	S	S	*	*			trans	-106.3	93.1	-178.9	-28.4	0	0	0	0	108.3	S111 N115	S111-T113 PolarHBondContact O-N 2.76Å; S111-T113 PolarHBondContact O-OG1 2.97Å; T113-N115 PolarHBondContact O-N 2.98Å
114	K	27.1	Very low	30.4	Very low	195 Å²	195	120.9 Å²	120.9	85%	0.848	66%	0.664	S	S	*	*			trans	-32.1	126	168.5	-77.2	172.6	171.9	173.6	0	112.5	S116	K114-S116 PolarHBondContact O-N 3.08Å
115	N	25.6	Very low	31.8	Very low	169 Å²	169	117.5 Å²	117.5	90%	0.904	65%	0.648	S	S	*	*			trans	9.1	103.9	152.1	-63.4	-10.5	0	0	0	116.2	T113	T113-N115 PolarHBondContact O-N 2.98Å
116	S	26.1	Very low	33.8	Very low	97 Å²	97	116.8 Å²	116.8	68%	0.678	64%	0.641	S	S	*	*			trans	-128.1	106	149	87.4	0	0	0	0	108.4	K114 N118	K114-S116 PolarHBondContact O-N 3.08Å; S116-N118 VanDerWaalsContact C-N 3.25Å; S116-N118 PolarHBondContact O-N 2.89Å
117	M	28	Very low	36.1	Very low	192 Å²	192	113.8 Å²	113.8	95%	0.946	62%	0.616	S	S	*	*			trans	-76.9	77.6	178.9	-163	168.1	173.9	0	0	107.4
118	N	27.3	Very low	38.8	Very low	118 Å²	118	109.2 Å²	109.2	63%	0.631	58%	0.583	S	S	*	*			trans	-118.8	103.6	172.1	-75	-41.2	0	0	0	107.2	S116 S120	S116-N118 VanDerWaalsContact C-N 3.25Å; S116-N118 PolarHBondContact O-N 2.89Å; N118-S120 PolarHBondContact O-N 2.92Å
119	D	28.2	Very low	41.6	Very low	171 Å²	171	103 Å²	103	91%	0.914	55%	0.551	S	S	*	*			trans	-65.2	41	160.3	-81.8	-35.2	0	0	0	110.8	Q121	D119-Q121 PolarHBondContact O-N 2.89Å
120	S	35.8	Very low	44.4	Very low	79 Å²	79	97 Å²	97	55%	0.552	52%	0.524	S	S	*	.			trans	-62.9	118	160	57.8	0	0	0	0	104.6	N118 E122	N118-S120 PolarHBondContact O-N 2.92Å; S120-E122 PolarHBondContact O-N 3.17Å
121	Q	35.8	Very low	47.4	Very low	167 Å²	167	92.5 Å²	92.5	78%	0.78	49%	0.492	S	S	*	.			trans	-49.8	81.8	152.7	-78.1	-174.7	-18.3	0	0	106.7	D119 N123	D119-Q121 PolarHBondContact O-N 2.89Å; Q121-N123 PolarHBondContact O-N 3.44Å
122	E	36.4	Very low	50.4	Low	122 Å²	122	88.6 Å²	88.6	57%	0.57	47%	0.465	S	S	*	.			trans	-56.3	102.3	159.7	-75.4	-174	137.3	0	0	102	S120 K124	S120-E122 PolarHBondContact O-N 3.17Å; E122-K124 HydrophobicContact CB-CD 4.3Å; E122-K124 HydrophobicContact CB-CG 3.92Å; E122-K124 WeakPolarHBondContact O-CG 3.41Å; E122-K124 PolarHBondContact O-N 3.48Å; E122-K124 WeakPolarHBondContact OE2-CE 3.37Å; E122-K124 IonicContact OE2-NZ 2.73Å; E122-K124 PolarHBondContact OE2-NZ 3.1Å
123	N	40.2	Very low	53.4	Low	98 Å²	98	81.3 Å²	81.3	52%	0.524	43%	0.426	S	S	.	.			trans	-61.3	69.1	172.8	-73.2	-43.5	0	0	0	106.8	Q121 S125	Q121-N123 PolarHBondContact O-N 3.44Å; N123-S125 PolarHBondContact O-N 3.15Å
124	K	47.6	Very low	56	Low	90 Å²	90	79.1 Å²	79.1	39%	0.391	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	76.1	-178.6	-78.4	170.7	179.2	153.5	0	105.6	K64 E122 C126	K64-K124 HydrophobicContact CD-CG 4.3Å; E122-K124 HydrophobicContact CB-CD 4.3Å; E122-K124 HydrophobicContact CB-CG 3.92Å; E122-K124 WeakPolarHBondContact O-CG 3.41Å; E122-K124 PolarHBondContact O-N 3.48Å; E122-K124 WeakPolarHBondContact OE2-CE 3.37Å; E122-K124 IonicContact OE2-NZ 2.73Å; E122-K124 PolarHBondContact OE2-NZ 3.1Å; K124-C126 PolarHBondContact O-N 3.41Å; K124-C126 VanDerWaalsContact O-N 3.12Å
125	S	59	Low	58.4	Low	12 Å²	12	75.4 Å²	75.4	8%	0.084	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	118.1	178.1	104.1	0	0	0	0	107.4	K64 L65 I67 N123	K64-S125 CarbonylContact C-O 3.59Å; L65-S125 PolarHBondContact N-O 2.58Å; L65-S125 VanDerWaalsContact N-O 3.08Å; L65-S125 WeakPolarHBondContact O-CB 3.5Å; L65-S125 PolarHBondContact O-OG 3.1Å; I67-S125 WeakPolarHBondContact CD1-OG 2.73Å; I67-S125 VanDerWaalsContact CG1-OG 3.23Å; I67-S125 WeakPolarHBondContact CG1-OG 3.4Å; N123-S125 PolarHBondContact O-N 3.15Å
126	C	71.4	Confident	60.7	Low	17 Å²	17	74.6 Å²	74.6	12%	0.115	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-79.6	147.4	169.4	-58.3	0	0	0	0	107.9	K124 Q144 L145	K124-C126 PolarHBondContact O-N 3.41Å; K124-C126 VanDerWaalsContact O-N 3.12Å; C126-Q144 HydrophobicContact CB-CG 4.29Å; C126-Q144 WeakPolarHBondContact O-CG 3.32Å; C126-Q144 PolarHBondContact O-NE2 3.26Å; C126-L145 WeakPolarHBondContact CB-O 3.41Å
127	P	81.7	Confident	63.1	Low	2 Å²	2	71.9 Å²	71.9	1%	0.013	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-66.7	151.8	-173.6	28.4	-36.2	0	0	0	112.1	L60 L65 I129 L145	L60-P127 HydrophobicContact CB-CG 4.01Å; L60-P127 WeakPolarHBondContact O-CD 3.11Å; L60-P127 VanDerWaalsContact O-CG 3.28Å; L60-P127 WeakPolarHBondContact O-CG 3.46Å; L65-P127 HydrophobicContact CD1-CB 3.77Å; L65-P127 HydrophobicContact CG-CB 4.41Å; P127-I129 HydrophobicContact CG-CG2 4.4Å; P127-L145 HydrophobicContact CG-CD2 4.5Å; P127-L145 PolarHBondContact O-N 3.27Å
128	F	85.2	Confident	65.7	Low	6 Å²	6	66.2 Å²	66.2	3%	0.026	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	131.7	165.1	-76.6	-102.5	0	0	0	109.2	G143 Q144 P178 I181 L182 V258	F128-G143 CarbonylContact C-O 3.43Å; F128-G143 VanDerWaalsContact CA-O 3.29Å; F128-G143 WeakPolarHBondContact CA-O 3.43Å; F128-Q144 HydrophobicContact CD1-CB 4.26Å; F128-Q144 HydrophobicContact CD2-CG 4.41Å; F128-Q144 HydrophobicContact CE1-CB 3.96Å; F128-Q144 HydrophobicContact CE2-CB 4.25Å; F128-Q144 HydrophobicContact CE2-CG 4.14Å; F128-Q144 HydrophobicContact CZ-CB 3.95Å; F128-Q144 HydrophobicContact CZ-CG 4.29Å; F128-P178 HydrophobicContact CB-CB 4.27Å; F128-P178 HydrophobicContact CB-CG 3.98Å; F128-P178 HydrophobicContact CD1-CB 4.21Å; F128-P178 HydrophobicContact CD2-CB 3.58Å; F128-P178 HydrophobicContact CD2-CG 4.11Å; F128-P178 HydrophobicContact CE1-CB 4.49Å; F128-P178 HydrophobicContact CE2-CB 3.9Å; F128-P178 HydrophobicContact CG-CB 3.74Å; F128-P178 HydrophobicContact CG-CG 4.02Å; F128-P178 HydrophobicContact CZ-CB 4.35Å; F128-I181 HydrophobicContact CD1-CB 4.26Å; F128-I181 HydrophobicContact CD1-CD1 3.93Å; F128-I181 HydrophobicContact CD1-CG2 4.13Å; F128-I181 HydrophobicContact CE1-CB 4.11Å; F128-I181 HydrophobicContact CE1-CG2 3.9Å; F128-L182 HydrophobicContact CE1-CD2 4.3Å; F128-L182 HydrophobicContact CE1-CG 4.17Å; F128-L182 HydrophobicContact CZ-CD1 3.96Å; F128-L182 HydrophobicContact CZ-CD2 3.77Å; F128-L182 HydrophobicContact CZ-CG 3.63Å; F128-V258 HydrophobicContact CB-CB 4Å; F128-V258 HydrophobicContact CB-CG2 4.38Å; F128-V258 PolarHBondContact O-N 2.96Å
129	I	86.7	Confident	68.6	Low	0 Å²	0	63.5 Å²	63.5	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	148.4	-175.9	63.3	169.7	0	0	0	110.6	L60 P127 V131 G143 L145 F155 M157 L255 S256	L60-I129 HydrophobicContact CD1-CG2 3.66Å; P127-I129 HydrophobicContact CG-CG2 4.4Å; I129-V131 HydrophobicContact CD1-CG2 3.58Å; I129-V131 HydrophobicContact CG1-CG2 3.94Å; I129-G143 PolarHBondContact N-O 3.18Å; I129-G143 PolarHBondContact O-N 2.9Å; I129-G143 VanDerWaalsContact O-N 3.14Å; I129-L145 HydrophobicContact CD1-CB 3.95Å; I129-L145 HydrophobicContact CD1-CD1 4.1Å; I129-L145 HydrophobicContact CD1-CG 4.42Å; I129-L145 HydrophobicContact CG1-CB 4.25Å; I129-L145 HydrophobicContact CG2-CB 4.39Å; I129-F155 HydrophobicContact CD1-CD2 4.41Å; I129-F155 HydrophobicContact CD1-CE2 3.87Å; I129-M157 HydrophobicContact CD1-CE 4.26Å; I129-M157 HydrophobicContact CD1-CG 4.14Å; I129-M157 HydrophobicContact CD1-SD 3.87Å; I129-M157 HydrophobicContact CG1-CE 3.67Å; I129-M157 HydrophobicContact CG1-CG 4.44Å; I129-M157 HydrophobicContact CG1-SD 3.97Å; I129-L255 HydrophobicContact CD1-CD1 4.3Å; I129-S256 CarbonylContact C-O 3.52Å; I129-S256 VanDerWaalsContact CA-O 3.31Å; I129-S256 WeakPolarHBondContact CA-O 3.5Å
130	R	88.1	Confident	71.3	Confident	35 Å²	35	55.4 Å²	55.4	13%	0.132	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	126.7	165.9	175.5	-179.2	172.9	-85.4	6	107.8	V140 H141 L142 E170 E254 L255 S256 V258	R130-V140 HydrophobicContact CG-CG1 3.88Å; R130-H141 CarbonylContact C-O 3.32Å; R130-H141 WeakPolarHBondContact CA-O 3.39Å; R130-L142 HydrophobicContact CB-CD2 3.52Å; R130-L142 HydrophobicContact CG-CD2 3.64Å; R130-E170 IonicContact CZ-OE1 3.35Å; R130-E170 IonicContact NE-OE1 3.81Å; R130-E170 IonicContact NH2-OE1 2.69Å; R130-E170 PolarHBondContact NH2-OE1 3.08Å; R130-E254 IonicContact NH1-OE2 3.93Å; R130-E254 PolarHBondContact NH1-OE2 3.32Å; R130-E254 IonicContact NH2-OE2 3.31Å; R130-L255 WeakPolarHBondContact O-CA 2.83Å; R130-S256 PolarHBondContact N-O 2.87Å; R130-S256 PolarHBondContact O-N 3.42Å; R130-V258 HydrophobicContact CB-CG2 4.28Å
131	V	88.5	Confident	73.8	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	129.7	179.5	-176.8	0	0	0	0	108.6	I129 T133 V140 H141 F155 M157 I247 V252 E254 L255	I129-V131 HydrophobicContact CD1-CG2 3.58Å; I129-V131 HydrophobicContact CG1-CG2 3.94Å; V131-T133 HydrophobicContact CG1-CG2 4.14Å; V131-V140 CarbonylContact O-C 3.57Å; V131-H141 HydrophobicContact CB-CB 4.35Å; V131-H141 PolarHBondContact N-O 3.11Å; V131-H141 PolarHBondContact O-N 3.1Å; V131-F155 HydrophobicContact CG1-CZ 4.03Å; V131-F155 HydrophobicContact CG2-CE2 4.05Å; V131-F155 HydrophobicContact CG2-CZ 3.92Å; V131-M157 HydrophobicContact CB-SD 4.37Å; V131-M157 HydrophobicContact CG2-CE 4.39Å; V131-M157 HydrophobicContact CG2-SD 3.68Å; V131-I247 HydrophobicContact CG1-CD1 4.42Å; V131-I247 HydrophobicContact CG1-CG2 4.41Å; V131-V252 HydrophobicContact CG1-CB 4.34Å; V131-V252 HydrophobicContact CG1-CG1 3.76Å; V131-V252 HydrophobicContact CG1-CG2 3.71Å; V131-E254 WeakPolarHBondContact CA-O 3.14Å; V131-L255 HydrophobicContact CG2-CD1 4.02Å; V131-L255 HydrophobicContact CG2-CG 4.27Å
132	V	87	Confident	76.3	Confident	4 Å²	4	44.5 Å²	44.5	2%	0.024	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	121.8	172.6	-174.3	0	0	0	0	108.6	I138 L139 V140 R253 E254	V132-I138 HydrophobicContact CG1-CG2 3.61Å; V132-L139 CarbonylContact C-O 3.47Å; V132-L139 VanDerWaalsContact CA-O 3.3Å; V132-L139 WeakPolarHBondContact CA-O 3.4Å; V132-V140 HydrophobicContact CG2-CG2 4.27Å; V132-R253 PolarHBondContact O-N 2.87Å; V132-E254 HydrophobicContact CB-CB 3.96Å; V132-E254 HydrophobicContact CB-CG 4.48Å; V132-E254 HydrophobicContact CG2-CB 3.92Å; V132-E254 PolarHBondContact N-O 2.82Å; V132-E254 PolarHBondContact O-N 3Å
133	T	88.1	Confident	78.7	Confident	10 Å²	10	38.7 Å²	38.7	6%	0.061	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	158	176	67.1	0	0	0	0	111.7	V131 I138 L139 H141 I247 E251	V131-T133 HydrophobicContact CG1-CG2 4.14Å; T133-I138 VanDerWaalsContact O-CA 3.3Å; T133-I138 WeakPolarHBondContact O-CA 3.43Å; T133-L139 PolarHBondContact N-O 3.03Å; T133-L139 PolarHBondContact O-N 2.9Å; T133-H141 PolarHBondContact OG1-NE2 2.95Å; T133-I247 HydrophobicContact CG2-CG2 3.9Å; T133-E251 CarbonylContact C-O 3.53Å; T133-E251 WeakPolarHBondContact CA-O 3.49Å
134	H	81.5	Confident	80.9	Confident	78 Å²	78	35.4 Å²	35.4	36%	0.361	18%	0.184	S	C	.	.			trans	-131.4	9.7	-173.8	69.2	-82.5	0	0	0	115.9	G137 E251	H134-G137 CarbonylContact C-O 3.58Å; H134-G137 VanDerWaalsContact CA-O 3.26Å; H134-G137 WeakPolarHBondContact CA-O 3.28Å; H134-E251 PolarHBondContact CE1-O 3.02Å; H134-E251 PolarHBondContact N-O 3.14Å; H134-E251 PolarHBondContact ND1-O 3.48Å
135	K	77.6	Confident	82.8	Confident	117 Å²	117	31.1 Å²	31.1	51%	0.509	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-51.3	-170.6	-168.1	-155.1	-162.1	143.7	0	114.3	R248 E251	K135-R248 VanDerWaalsContact CE-NH2 3.35Å; K135-E251 HydrophobicContact CB-CB 4.47Å; K135-E251 HydrophobicContact CB-CG 4.04Å; K135-E251 WeakPolarHBondContact CD-OE1 3.34Å; K135-E251 WeakPolarHBondContact CE-OE1 3.43Å; K135-E251 HydrophobicContact CG-CG 4.29Å; K135-E251 IonicContact NZ-OE1 2.79Å; K135-E251 PolarHBondContact NZ-OE1 2.73Å
136	N	74	Confident	84	Confident	152 Å²	152	32.3 Å²	32.3	81%	0.813	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-119.4	31.4	-176.4	-67.8	-3.6	0	0	0	110.9
137	G	77.3	Confident	84.5	Confident	40 Å²	40	32.1 Å²	32.1	41%	0.412	17%	0.169	S	C	.	.	S	Bend	trans	115.7	169.6	-164	0	0	0	0	0	111.4	H134	H134-G137 CarbonylContact C-O 3.58Å; H134-G137 VanDerWaalsContact CA-O 3.26Å; H134-G137 WeakPolarHBondContact CA-O 3.28Å
138	I	83	Confident	84.7	Confident	72 Å²	72	32.9 Å²	32.9	37%	0.369	17%	0.172	S	C	.	.			trans	-84.2	117.5	-179.9	-59.5	177.4	0	0	0	108.4	V132 T133 P165	V132-I138 HydrophobicContact CG1-CG2 3.61Å; T133-I138 VanDerWaalsContact O-CA 3.3Å; T133-I138 WeakPolarHBondContact O-CA 3.43Å; I138-P165 HydrophobicContact CG2-CG 4.01Å; I138-P165 VanDerWaalsContact O-CD 3.29Å; I138-P165 WeakPolarHBondContact O-CD 3.42Å
139	L	86.5	Confident	84.6	Confident	62 Å²	62	33.7 Å²	33.7	33%	0.325	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	139.2	174.6	-68.9	175.1	0	0	0	110	V132 T133 F163 D164	V132-L139 CarbonylContact C-O 3.47Å; V132-L139 VanDerWaalsContact CA-O 3.3Å; V132-L139 WeakPolarHBondContact CA-O 3.4Å; T133-L139 PolarHBondContact N-O 3.03Å; T133-L139 PolarHBondContact O-N 2.9Å; L139-F163 WeakPolarHBondContact CA-O 3.35Å; L139-D164 HydrophobicContact CD2-CB 4.16Å
140	V	86.2	Confident	84.1	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.006	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	126.9	172.2	-175.8	0	0	0	0	108.3	R130 V131 V132 L142 S162 F163 P165	R130-V140 HydrophobicContact CG-CG1 3.88Å; V131-V140 CarbonylContact O-C 3.57Å; V132-V140 HydrophobicContact CG2-CG2 4.27Å; V140-L142 HydrophobicContact CG1-CD2 4.5Å; V140-S162 CarbonylContact O-C 3.19Å; V140-S162 VanDerWaalsContact O-CA 3.28Å; V140-S162 WeakPolarHBondContact O-CA 3.31Å; V140-F163 HydrophobicContact CB-CD1 4.33Å; V140-F163 HydrophobicContact CB-CD2 4.34Å; V140-F163 HydrophobicContact CB-CE1 3.85Å; V140-F163 HydrophobicContact CB-CE2 3.88Å; V140-F163 HydrophobicContact CB-CZ 3.62Å; V140-F163 HydrophobicContact CG1-CE1 3.81Å; V140-F163 HydrophobicContact CG1-CE2 4.34Å; V140-F163 HydrophobicContact CG1-CZ 3.62Å; V140-F163 HydrophobicContact CG2-CE2 4.14Å; V140-F163 HydrophobicContact CG2-CZ 4.24Å; V140-F163 PolarHBondContact N-O 3.34Å; V140-F163 PolarHBondContact O-N 3.43Å; V140-P165 HydrophobicContact CG2-CB 4.1Å; V140-P165 HydrophobicContact CG2-CG 4.08Å
141	H	88.4	Confident	83.9	Confident	15 Å²	15	42 Å²	42	7%	0.069	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	123.6	177.7	-51.4	-82.6	0	0	0	109.3	R130 V131 T133 V160 I161 S162 I247	R130-H141 CarbonylContact C-O 3.32Å; R130-H141 WeakPolarHBondContact CA-O 3.39Å; V131-H141 HydrophobicContact CB-CB 4.35Å; V131-H141 PolarHBondContact N-O 3.11Å; V131-H141 PolarHBondContact O-N 3.1Å; T133-H141 PolarHBondContact OG1-NE2 2.95Å; H141-V160 HydrophobicContact CB-CG1 3.9Å; H141-I161 CarbonylContact C-O 3.54Å; H141-I161 WeakPolarHBondContact CA-O 3.29Å; H141-S162 WeakPolarHBondContact ND1-CB 3.38Å; H141-S162 PolarHBondContact ND1-OG 2.94Å; H141-I247 HydrophobicContact CB-CD1 4.39Å
142	L	87.2	Confident	83.5	Confident	1 Å²	1	47 Å²	47	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	124.8	173.7	-60.4	174.7	0	0	0	108.5	R130 V140 V160 I161 F163 I173 L176 I181 V258	R130-L142 HydrophobicContact CB-CD2 3.52Å; R130-L142 HydrophobicContact CG-CD2 3.64Å; V140-L142 HydrophobicContact CG1-CD2 4.5Å; L142-V160 CarbonylContact O-C 3.6Å; L142-V160 VanDerWaalsContact O-CA 3.29Å; L142-V160 WeakPolarHBondContact O-CA 3.24Å; L142-I161 PolarHBondContact N-O 2.91Å; L142-I161 PolarHBondContact O-N 3.21Å; L142-F163 HydrophobicContact CD1-CE1 3.99Å; L142-F163 HydrophobicContact CG-CE1 4.26Å; L142-I173 HydrophobicContact CD1-CG2 3.83Å; L142-I173 WeakPolarHBondContact CD1-O 3.46Å; L142-L176 HydrophobicContact CD1-CD1 4.44Å; L142-I181 HydrophobicContact CB-CD1 3.98Å; L142-I181 HydrophobicContact CB-CG1 4.5Å; L142-V258 HydrophobicContact CD2-CG2 4.14Å
143	G	86.8	Confident	83.2	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.6	-176.9	-179.6	0	0	0	0	0	112.8	F128 I129 M157 N159	F128-G143 CarbonylContact C-O 3.43Å; F128-G143 VanDerWaalsContact CA-O 3.29Å; F128-G143 WeakPolarHBondContact CA-O 3.43Å; I129-G143 PolarHBondContact N-O 3.18Å; I129-G143 PolarHBondContact O-N 2.9Å; I129-G143 VanDerWaalsContact O-N 3.14Å; G143-M157 VanDerWaalsContact CA-CE 3.47Å; G143-M157 VanDerWaalsContact N-CE 3.25Å; G143-N159 WeakPolarHBondContact CA-O 3.42Å
144	Q	87	Confident	83.2	Confident	30 Å²	30	55 Å²	55	14%	0.14	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	124.8	-179.4	-168.1	173.7	20.8	0	0	110.2	C126 F128 I146 M157 R158	C126-Q144 HydrophobicContact CB-CG 4.29Å; C126-Q144 WeakPolarHBondContact O-CG 3.32Å; C126-Q144 PolarHBondContact O-NE2 3.26Å; F128-Q144 HydrophobicContact CD1-CB 4.26Å; F128-Q144 HydrophobicContact CD2-CG 4.41Å; F128-Q144 HydrophobicContact CE1-CB 3.96Å; F128-Q144 HydrophobicContact CE2-CB 4.25Å; F128-Q144 HydrophobicContact CE2-CG 4.14Å; F128-Q144 HydrophobicContact CZ-CB 3.95Å; F128-Q144 HydrophobicContact CZ-CG 4.29Å; Q144-I146 HydrophobicContact CB-CD1 4.46Å; Q144-I146 HydrophobicContact CG-CD1 4.12Å; Q144-M157 CarbonylContact O-C 3.55Å; Q144-M157 WeakPolarHBondContact O-CA 3.44Å; Q144-R158 PolarHBondContact N-O 3.49Å; Q144-R158 PolarHBondContact O-N 3.15Å
145	L	87.1	Confident	83.5	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	134.6	169.7	179.8	60.7	0	0	0	109	V57 L60 Y61 C126 P127 I129 F155	V57-L145 HydrophobicContact CG1-CD1 4.15Å; V57-L145 HydrophobicContact CG1-CD2 4.07Å; L60-L145 HydrophobicContact CB-CD2 4.15Å; Y61-L145 HydrophobicContact CD2-CD2 4.24Å; Y61-L145 HydrophobicContact CD2-CG 4.22Å; C126-L145 WeakPolarHBondContact CB-O 3.41Å; P127-L145 HydrophobicContact CG-CD2 4.5Å; P127-L145 PolarHBondContact O-N 3.27Å; I129-L145 HydrophobicContact CD1-CB 3.95Å; I129-L145 HydrophobicContact CD1-CD1 4.1Å; I129-L145 HydrophobicContact CD1-CG 4.42Å; I129-L145 HydrophobicContact CG1-CB 4.25Å; I129-L145 HydrophobicContact CG2-CB 4.39Å; L145-F155 HydrophobicContact CD1-CB 3.96Å; L145-F155 HydrophobicContact CD1-CD2 3.56Å; L145-F155 HydrophobicContact CD1-CE2 4.42Å; L145-F155 HydrophobicContact CD1-CG 4.05Å
146	I	85.2	Confident	84	Confident	37 Å²	37	46.9 Å²	46.9	19%	0.19	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	-43	-177.6	-63.5	-60.3	0	0	0	113	Y61 Q144 I156 R158	Y61-I146 VanDerWaalsContact CE2-C 3.48Å; Y61-I146 WeakPolarHBondContact CE2-O 3.45Å; Y61-I146 PolarHBondContact OH-O 3.02Å; Q144-I146 HydrophobicContact CB-CD1 4.46Å; Q144-I146 HydrophobicContact CG-CD1 4.12Å; I146-I156 HydrophobicContact CB-CG2 4.46Å; I146-I156 PolarHBondContact N-O 2.92Å; I146-R158 HydrophobicContact CD1-CB 3.87Å; I146-R158 HydrophobicContact CG1-CB 3.49Å; I146-R158 VanDerWaalsContact CG1-CB 3.49Å
147	S	82.2	Confident	84.8	Confident	13 Å²	13	39.7 Å²	39.7	9%	0.091	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	164.1	-179.1	62	0	0	0	0	110.9	F155 I156	S147-F155 CarbonylContact O-C 3.6Å; S147-F155 WeakPolarHBondContact O-CA 3.36Å; S147-F155 WeakPolarHBondContact O-CB 3.23Å; S147-I156 PolarHBondContact O-N 2.95Å
148	I	85	Confident	85.1	Confident	17 Å²	17	42.5 Å²	42.5	9%	0.087	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	141.2	176	-56.5	168.3	0	0	0	106.7	L54 V57 M58 Y61 F155	L54-I148 HydrophobicContact CD1-CG2 4.23Å; V57-I148 HydrophobicContact CG1-CD1 3.66Å; V57-I148 HydrophobicContact CG1-CG1 3.71Å; M58-I148 HydrophobicContact CB-CD1 4.42Å; M58-I148 HydrophobicContact CG-CD1 3.95Å; M58-I148 HydrophobicContact SD-CD1 3.24Å; M58-I148 WeakPolarHBondContact SD-CD1 3.47Å; M58-I148 HydrophobicContact SD-CG1 4.45Å; M58-I148 HydrophobicContact SD-CG2 4.29Å; Y61-I148 HydrophobicContact CD1-CD1 3.97Å; Y61-I148 HydrophobicContact CD1-CG1 4.3Å; Y61-I148 HydrophobicContact CG-CD1 4.1Å; Y61-I148 HydrophobicContact CG-CG1 4.42Å; I148-F155 HydrophobicContact CG1-CB 4.34Å
149	S	83.5	Confident	85	Confident	24 Å²	24	40.1 Å²	40.1	17%	0.168	19%	0.187	C	C	.	.			trans	-67.9	152.2	179.3	60.6	0	0	0	0	111.9	D151 Q152 R153 S154	S149-D151 WeakPolarHBondContact CB-OD1 3.19Å; S149-D151 PolarHBondContact O-N 3.46Å; S149-D151 PolarHBondContact OG-OD1 3.43Å; S149-Q152 WeakPolarHBondContact O-CA 3.22Å; S149-Q152 PolarHBondContact O-N 3.09Å; S149-R153 PolarHBondContact OG-N 2.76Å; S149-S154 WeakPolarHBondContact CB-OG 3.43Å; S149-S154 PolarHBondContact N-O 3.3Å; S149-S154 PolarHBondContact OG-N 3.24Å; S149-S154 VanDerWaalsContact OG-N 3.08Å; S149-S154 PolarHBondContact OG-O 2.81Å; S149-S154 PolarHBondContact OG-OG 2.81Å
150	E	76.2	Confident	85	Confident	114 Å²	114	37.1 Å²	37.1	53%	0.533	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-34.7	179	-171.9	175.2	-168.1	0	0	112.2	V99 Q152	V99-E150 HydrophobicContact CG2-CG 4.48Å; E150-Q152 PolarHBondContact O-N 3.26Å
151	D	83	Confident	84.9	Confident	94 Å²	94	37.1 Å²	37.1	50%	0.503	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-4.3	175.7	72.5	-14.1	0	0	0	113.7	S149 R153	S149-D151 WeakPolarHBondContact CB-OD1 3.19Å; S149-D151 PolarHBondContact O-N 3.46Å; S149-D151 PolarHBondContact OG-OD1 3.43Å; D151-R153 HydrophobicContact CB-CG 4.48Å; D151-R153 WeakPolarHBondContact O-CG 2.89Å; D151-R153 PolarHBondContact O-N 3.48Å; D151-R153 VanDerWaalsContact O-N 3.1Å; D151-R153 PolarHBondContact OD1-N 2.99Å; D151-R153 VanDerWaalsContact OD1-N 3.13Å; D151-R153 WeakPolarHBondContact OD2-CB 3.12Å; D151-R153 WeakPolarHBondContact OD2-CD 3.16Å
152	Q	80.3	Confident	84.8	Confident	107 Å²	107	37 Å²	37	50%	0.5	17%	0.172	S	C	.	.	S	Bend	trans	53.5	28.1	-178.1	-56.7	178	12.8	0	0	113.5	L54 S149 E150 L249	L54-Q152 HydrophobicContact CD1-CB 3.89Å; L54-Q152 HydrophobicContact CD2-CB 3.74Å; L54-Q152 HydrophobicContact CG-CB 4.47Å; S149-Q152 WeakPolarHBondContact O-CA 3.22Å; S149-Q152 PolarHBondContact O-N 3.09Å; E150-Q152 PolarHBondContact O-N 3.26Å; Q152-L249 WeakPolarHBondContact O-CD1 3.4Å
153	R	82	Confident	84.6	Confident	180 Å²	180	37 Å²	37	68%	0.679	17%	0.172	S	C	*	.	S	Bend	trans	-104.4	-5.1	176.9	-66.8	174.9	-179.3	-168	-1.7	112.9	S149 D151 L249	S149-R153 PolarHBondContact OG-N 2.76Å; D151-R153 HydrophobicContact CB-CG 4.48Å; D151-R153 WeakPolarHBondContact O-CG 2.89Å; D151-R153 PolarHBondContact O-N 3.48Å; D151-R153 VanDerWaalsContact O-N 3.1Å; D151-R153 PolarHBondContact OD1-N 2.99Å; D151-R153 VanDerWaalsContact OD1-N 3.13Å; D151-R153 WeakPolarHBondContact OD2-CB 3.12Å; D151-R153 WeakPolarHBondContact OD2-CD 3.16Å; R153-L249 WeakPolarHBondContact O-CB 3.23Å; R153-L249 PolarHBondContact O-N 2.81Å
154	S	86.7	Confident	84.2	Confident	2 Å²	2	38.6 Å²	38.6	1%	0.014	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	167.1	-173.2	51.7	0	0	0	0	112.3	S149 F246 I247	S149-S154 WeakPolarHBondContact CB-OG 3.43Å; S149-S154 PolarHBondContact N-O 3.3Å; S149-S154 PolarHBondContact OG-N 3.24Å; S149-S154 VanDerWaalsContact OG-N 3.08Å; S149-S154 PolarHBondContact OG-O 2.81Å; S149-S154 PolarHBondContact OG-OG 2.81Å; S154-F246 VanDerWaalsContact CB-CE2 3.44Å; S154-F246 WeakPolarHBondContact OG-CE2 3.22Å; S154-F246 WeakPolarHBondContact OG-CZ 2.92Å; S154-I247 CarbonylContact C-O 3.53Å; S154-I247 WeakPolarHBondContact CA-O 3.31Å; S154-I247 WeakPolarHBondContact CB-O 3.5Å
155	F	88.1	Confident	83.6	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	162.7	173.5	59.8	-86.9	0	0	0	110.2	V57 I129 V131 L145 S147 I148 M157 I247 L249 V252 L255	V57-F155 HydrophobicContact CG1-CB 4.11Å; V57-F155 HydrophobicContact CG1-CD1 4.25Å; V57-F155 HydrophobicContact CG1-CG 4.15Å; V57-F155 HydrophobicContact CG2-CD1 4.2Å; V57-F155 HydrophobicContact CG2-CE1 4.23Å; I129-F155 HydrophobicContact CD1-CD2 4.41Å; I129-F155 HydrophobicContact CD1-CE2 3.87Å; V131-F155 HydrophobicContact CG1-CZ 4.03Å; V131-F155 HydrophobicContact CG2-CE2 4.05Å; V131-F155 HydrophobicContact CG2-CZ 3.92Å; L145-F155 HydrophobicContact CD1-CB 3.96Å; L145-F155 HydrophobicContact CD1-CD2 3.56Å; L145-F155 HydrophobicContact CD1-CE2 4.42Å; L145-F155 HydrophobicContact CD1-CG 4.05Å; S147-F155 CarbonylContact O-C 3.6Å; S147-F155 WeakPolarHBondContact O-CA 3.36Å; S147-F155 WeakPolarHBondContact O-CB 3.23Å; I148-F155 HydrophobicContact CG1-CB 4.34Å; F155-M157 HydrophobicContact CD2-CG 3.94Å; F155-M157 HydrophobicContact CE2-CG 3.75Å; F155-M157 HydrophobicContact CE2-SD 3.77Å; F155-I247 HydrophobicContact CE1-CB 4.32Å; F155-I247 HydrophobicContact CE1-CG2 4.06Å; F155-I247 HydrophobicContact CE2-CB 4.11Å; F155-I247 HydrophobicContact CE2-CD1 4.13Å; F155-I247 HydrophobicContact CE2-CG2 4.44Å; F155-I247 HydrophobicContact CZ-CB 3.95Å; F155-I247 HydrophobicContact CZ-CD1 4.36Å; F155-I247 HydrophobicContact CZ-CG2 3.79Å; F155-I247 PolarHBondContact N-O 3.4Å; F155-I247 PolarHBondContact O-N 3.22Å; F155-L249 HydrophobicContact CD1-CD2 3.68Å; F155-L249 HydrophobicContact CD1-CG 4.23Å; F155-L249 HydrophobicContact CE1-CD2 3.7Å; F155-L249 HydrophobicContact CE1-CG 4.47Å; F155-V252 HydrophobicContact CE1-CG2 3.9Å; F155-V252 HydrophobicContact CZ-CG2 4.07Å; F155-L255 HydrophobicContact CZ-CD1 4.23Å
156	I	88.6	Confident	82.9	Confident	24 Å²	24	45.5 Å²	45.5	12%	0.123	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	130.2	-177.8	-59.6	180	0	0	0	108.4	I146 S147 D244 V245 F246	I146-I156 HydrophobicContact CB-CG2 4.46Å; I146-I156 PolarHBondContact N-O 2.92Å; S147-I156 PolarHBondContact O-N 2.95Å; I156-D244 HydrophobicContact CG2-CB 3.77Å; I156-V245 WeakPolarHBondContact CA-O 3.21Å; I156-F246 HydrophobicContact CG1-CD2 4.2Å
157	M	89.7	Confident	82.1	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	148.2	169	-66.8	178.5	63.4	0	0	110.2	I129 V131 G143 Q144 F155 V160 D244 V245 I247	I129-M157 HydrophobicContact CD1-CE 4.26Å; I129-M157 HydrophobicContact CD1-CG 4.14Å; I129-M157 HydrophobicContact CD1-SD 3.87Å; I129-M157 HydrophobicContact CG1-CE 3.67Å; I129-M157 HydrophobicContact CG1-CG 4.44Å; I129-M157 HydrophobicContact CG1-SD 3.97Å; V131-M157 HydrophobicContact CB-SD 4.37Å; V131-M157 HydrophobicContact CG2-CE 4.39Å; V131-M157 HydrophobicContact CG2-SD 3.68Å; G143-M157 VanDerWaalsContact CA-CE 3.47Å; G143-M157 VanDerWaalsContact N-CE 3.25Å; Q144-M157 CarbonylContact O-C 3.55Å; Q144-M157 WeakPolarHBondContact O-CA 3.44Å; F155-M157 HydrophobicContact CD2-CG 3.94Å; F155-M157 HydrophobicContact CE2-CG 3.75Å; F155-M157 HydrophobicContact CE2-SD 3.77Å; M157-V160 HydrophobicContact CB-CG2 3.47Å; M157-V160 VanDerWaalsContact CB-CG2 3.47Å; M157-V160 HydrophobicContact CE-CG1 4.44Å; M157-V160 HydrophobicContact CE-CG2 4.41Å; M157-D244 CarbonylContact O-C 3.55Å; M157-D244 WeakPolarHBondContact O-CA 3.26Å; M157-V245 PolarHBondContact N-O 3.03Å; M157-V245 PolarHBondContact O-N 3.22Å; M157-I247 HydrophobicContact CG-CD1 4.3Å; M157-I247 HydrophobicContact SD-CD1 3.5Å; M157-I247 WeakPolarHBondContact SD-CD1 3.37Å
158	R	84.1	Confident	81.2	Confident	99 Å²	99	50.4 Å²	50.4	37%	0.374	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	159.1	172.7	-179.9	174.1	-69.2	169.4	0.7	109.7	Q144 I146 V160 D244	Q144-R158 PolarHBondContact N-O 3.49Å; Q144-R158 PolarHBondContact O-N 3.15Å; I146-R158 HydrophobicContact CD1-CB 3.87Å; I146-R158 HydrophobicContact CG1-CB 3.49Å; I146-R158 VanDerWaalsContact CG1-CB 3.49Å; R158-V160 PolarHBondContact O-N 3.07Å; R158-D244 WeakPolarHBondContact CB-OD1 3.29Å; R158-D244 WeakPolarHBondContact CG-OD1 3.16Å; R158-D244 IonicContact CZ-OD1 3.76Å; R158-D244 IonicContact CZ-OD2 2.81Å; R158-D244 IonicContact NE-OD1 2.81Å; R158-D244 PolarHBondContact NE-OD1 3.07Å; R158-D244 IonicContact NE-OD2 3.32Å; R158-D244 IonicContact NH2-OD1 3.86Å; R158-D244 PolarHBondContact NH2-OD1 2.88Å; R158-D244 VanDerWaalsContact NH2-OD1 3.15Å; R158-D244 IonicContact NH2-OD2 3.95Å; R158-D244 PolarHBondContact NH2-OD2 2.85Å
159	N	82.1	Confident	80.2	Confident	22 Å²	22	54 Å²	54	12%	0.118	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	54.9	56	177	-70.8	-21	0	0	0	110.2	G143 I181 L182 T185 P242	G143-N159 WeakPolarHBondContact CA-O 3.42Å; N159-I181 WeakPolarHBondContact O-CG2 3.4Å; N159-L182 HydrophobicContact CB-CD2 4.37Å; N159-L182 VanDerWaalsContact ND2-CD2 3.27Å; N159-L182 WeakPolarHBondContact ND2-CD2 3.29Å; N159-T185 HydrophobicContact CB-CG2 4.06Å; N159-T185 VanDerWaalsContact CB-OG1 3.24Å; N159-T185 WeakPolarHBondContact CB-OG1 3.42Å; N159-T185 WeakPolarHBondContact O-CG2 3.39Å; N159-P242 PolarHBondContact OD1-O 3.29Å
160	V	84.8	Confident	79.1	Confident	0 Å²	0	56 Å²	56	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	125.6	-168.4	-170.9	0	0	0	0	111	H141 L142 M157 R158 T241 V245	H141-V160 HydrophobicContact CB-CG1 3.9Å; L142-V160 CarbonylContact O-C 3.6Å; L142-V160 VanDerWaalsContact O-CA 3.29Å; L142-V160 WeakPolarHBondContact O-CA 3.24Å; M157-V160 HydrophobicContact CB-CG2 3.47Å; M157-V160 VanDerWaalsContact CB-CG2 3.47Å; M157-V160 HydrophobicContact CE-CG1 4.44Å; M157-V160 HydrophobicContact CE-CG2 4.41Å; R158-V160 PolarHBondContact O-N 3.07Å; V160-T241 PolarHBondContact N-O 3.2Å; V160-T241 PolarHBondContact O-N 2.87Å; V160-V245 HydrophobicContact CB-CB 4.44Å; V160-V245 HydrophobicContact CB-CG2 3.86Å; V160-V245 HydrophobicContact CG1-CG2 4.46Å; V160-V245 HydrophobicContact CG2-CB 3.95Å; V160-V245 HydrophobicContact CG2-CG2 3.75Å
161	I	84.8	Confident	78.2	Confident	1 Å²	1	60.7 Å²	60.7	1%	0.005	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	117.5	169.1	-57.7	176.3	0	0	0	107.3	H141 L142 I173 L176 I181 L184 T185 L238 I240	H141-I161 CarbonylContact C-O 3.54Å; H141-I161 WeakPolarHBondContact CA-O 3.29Å; L142-I161 PolarHBondContact N-O 2.91Å; L142-I161 PolarHBondContact O-N 3.21Å; I161-I173 HydrophobicContact CG2-CG2 4.43Å; I161-L176 HydrophobicContact CD1-CD1 4.09Å; I161-I181 HydrophobicContact CD1-CB 4.4Å; I161-I181 HydrophobicContact CD1-CG1 4.41Å; I161-I181 HydrophobicContact CD1-CG2 4.11Å; I161-I181 HydrophobicContact CG1-CG2 4.38Å; I161-L184 HydrophobicContact CD1-CB 3.87Å; I161-L184 HydrophobicContact CD1-CD1 3.61Å; I161-L184 HydrophobicContact CD1-CG 4.39Å; I161-T185 HydrophobicContact CD1-CG2 4.32Å; I161-T185 HydrophobicContact CG1-CG2 3.73Å; I161-L238 HydrophobicContact CG2-CD1 3.35Å; I161-L238 HydrophobicContact CG2-CD2 4.45Å; I161-L238 HydrophobicContact CG2-CG 4.04Å; I161-I240 HydrophobicContact CG1-CG1 4.27Å; I161-I240 HydrophobicContact CG2-CG1 4.27Å
162	S	85.8	Confident	77.2	Confident	11 Å²	11	59.3 Å²	59.3	8%	0.077	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	131.4	-179.5	-50.3	0	0	0	0	110.4	V140 H141 L239	V140-S162 CarbonylContact O-C 3.19Å; V140-S162 VanDerWaalsContact O-CA 3.28Å; V140-S162 WeakPolarHBondContact O-CA 3.31Å; H141-S162 WeakPolarHBondContact ND1-CB 3.38Å; H141-S162 PolarHBondContact ND1-OG 2.94Å; S162-L239 PolarHBondContact N-O 3.13Å; S162-L239 PolarHBondContact O-N 3.43Å
163	F	82.8	Confident	76.6	Confident	1 Å²	1	54.6 Å²	54.6	0%	0.004	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	157.5	178.3	60.8	-83.2	0	0	0	112.5	L139 V140 L142 V168 E170 I173 L238	L139-F163 WeakPolarHBondContact CA-O 3.35Å; V140-F163 HydrophobicContact CB-CD1 4.33Å; V140-F163 HydrophobicContact CB-CD2 4.34Å; V140-F163 HydrophobicContact CB-CE1 3.85Å; V140-F163 HydrophobicContact CB-CE2 3.88Å; V140-F163 HydrophobicContact CB-CZ 3.62Å; V140-F163 HydrophobicContact CG1-CE1 3.81Å; V140-F163 HydrophobicContact CG1-CE2 4.34Å; V140-F163 HydrophobicContact CG1-CZ 3.62Å; V140-F163 HydrophobicContact CG2-CE2 4.14Å; V140-F163 HydrophobicContact CG2-CZ 4.24Å; V140-F163 PolarHBondContact N-O 3.34Å; V140-F163 PolarHBondContact O-N 3.43Å; L142-F163 HydrophobicContact CD1-CE1 3.99Å; L142-F163 HydrophobicContact CG-CE1 4.26Å; F163-V168 HydrophobicContact CB-CB 4.2Å; F163-V168 HydrophobicContact CB-CG2 3.92Å; F163-V168 HydrophobicContact CD2-CB 3.93Å; F163-V168 HydrophobicContact CD2-CG1 4.4Å; F163-V168 HydrophobicContact CG-CB 4.38Å; F163-E170 HydrophobicContact CE2-CB 4.46Å; F163-E170 HydrophobicContact CE2-CG 4.31Å; F163-I173 HydrophobicContact CD1-CB 4.43Å; F163-I173 HydrophobicContact CD1-CG2 3.68Å; F163-I173 HydrophobicContact CE1-CB 3.93Å; F163-I173 HydrophobicContact CE1-CG2 3.27Å; F163-I173 HydrophobicContact CE2-CB 4.44Å; F163-I173 HydrophobicContact CZ-CB 3.92Å; F163-I173 HydrophobicContact CZ-CG2 3.8Å; F163-L238 HydrophobicContact CB-CD1 3.7Å; F163-L238 HydrophobicContact CD1-CD1 4.19Å; F163-L238 HydrophobicContact CG-CD1 4.29Å
164	D	80.4	Confident	75.8	Confident	34 Å²	34	47.4 Å²	47.4	18%	0.182	22%	0.22	C	C	.	.			trans	-85.6	119	168.8	179.7	-14.3	0	0	0	108.7	L139 L166 R167 V168	L139-D164 HydrophobicContact CD2-CB 4.16Å; D164-L166 PolarHBondContact O-N 3.04Å; D164-L166 WeakPolarHBondContact OD1-CB 3.24Å; D164-L166 PolarHBondContact OD1-N 3.13Å; D164-R167 HydrophobicContact CB-CB 4.13Å; D164-R167 HydrophobicContact CB-CG 4.18Å; D164-R167 CarbonylContact O-C 3.6Å; D164-R167 PolarHBondContact O-N 2.89Å; D164-R167 VanDerWaalsContact O-N 3.07Å; D164-R167 VanDerWaalsContact OD2-CD 3.29Å; D164-R167 WeakPolarHBondContact OD2-CD 3.27Å; D164-R167 WeakPolarHBondContact OD2-CG 3.44Å; D164-R167 IonicContact OD2-NE 3.03Å; D164-R167 PolarHBondContact OD2-NE 3.38Å; D164-V168 PolarHBondContact O-N 3.41Å
165	P	72.9	Confident	75	Confident	27 Å²	27	50.8 Å²	50.8	18%	0.175	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-19.6	-177.4	28.9	-34.8	0	0	0	113.2	I138 V140 R167 E170	I138-P165 HydrophobicContact CG2-CG 4.01Å; I138-P165 VanDerWaalsContact O-CD 3.29Å; I138-P165 WeakPolarHBondContact O-CD 3.42Å; V140-P165 HydrophobicContact CG2-CB 4.1Å; V140-P165 HydrophobicContact CG2-CG 4.08Å; P165-R167 VanDerWaalsContact C-N 3.33Å; P165-E170 HydrophobicContact CB-CB 4.39Å
166	L	73.9	Confident	74.2	Confident	149 Å²	149	51.2 Å²	51.2	78%	0.78	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-21.7	175.1	-60.7	178.7	0	0	0	112.4	D164	D164-L166 PolarHBondContact O-N 3.04Å; D164-L166 WeakPolarHBondContact OD1-CB 3.24Å; D164-L166 PolarHBondContact OD1-N 3.13Å
167	R	66.9	Low	73.6	Confident	128 Å²	128	54.2 Å²	54.2	48%	0.483	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113	-4.6	-174.7	-58.1	-177.8	178.7	-170.6	-3	113.1	D164 P165 L234 G236	D164-R167 HydrophobicContact CB-CB 4.13Å; D164-R167 HydrophobicContact CB-CG 4.18Å; D164-R167 CarbonylContact O-C 3.6Å; D164-R167 PolarHBondContact O-N 2.89Å; D164-R167 VanDerWaalsContact O-N 3.07Å; D164-R167 VanDerWaalsContact OD2-CD 3.29Å; D164-R167 WeakPolarHBondContact OD2-CD 3.27Å; D164-R167 WeakPolarHBondContact OD2-CG 3.44Å; D164-R167 IonicContact OD2-NE 3.03Å; D164-R167 PolarHBondContact OD2-NE 3.38Å; P165-R167 VanDerWaalsContact C-N 3.33Å; R167-L234 CarbonylContact C-O 3.58Å; R167-L234 WeakPolarHBondContact CA-O 3.29Å; R167-L234 VanDerWaalsContact CB-O 3.26Å; R167-L234 WeakPolarHBondContact CB-O 3.27Å; R167-L234 CarbonylContact O-C 3.59Å; R167-G236 PolarHBondContact O-N 3.35Å
168	V	64	Low	73	Confident	24 Å²	24	55 Å²	55	15%	0.145	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134.1	134.5	176.2	-173.8	0	0	0	0	106.8	F163 D164 E170 I173	F163-V168 HydrophobicContact CB-CB 4.2Å; F163-V168 HydrophobicContact CB-CG2 3.92Å; F163-V168 HydrophobicContact CD2-CB 3.93Å; F163-V168 HydrophobicContact CD2-CG1 4.4Å; F163-V168 HydrophobicContact CG-CB 4.38Å; D164-V168 PolarHBondContact O-N 3.41Å; V168-E170 VanDerWaalsContact C-N 3.3Å; V168-E170 PolarHBondContact O-N 3.47Å; V168-I173 HydrophobicContact CB-CD1 4.49Å; V168-I173 HydrophobicContact CG1-CD1 3.22Å; V168-I173 HydrophobicContact CG1-CG1 3.91Å
169	N	63.7	Low	72.3	Confident	92 Å²	92	53.7 Å²	53.7	49%	0.492	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	97.1	-180	-175.3	-19.7	0	0	0	108.9	R171 K172	N169-R171 PolarHBondContact O-N 3.33Å; N169-R171 VanDerWaalsContact O-N 3.14Å; N169-R171 WeakPolarHBondContact OD1-CB 3.26Å; N169-R171 PolarHBondContact OD1-N 3.26Å; N169-K172 PolarHBondContact O-N 2.94Å
170	E	59.7	Low	71.9	Confident	68 Å²	68	55.1 Å²	55.1	32%	0.318	28%	0.276	S	S	.	.	H	α-helix	trans	-53.4	-40.7	-172.9	-177.4	175.7	-171.3	0	0	110	R130 F163 P165 V168 K172 I173 S174	R130-E170 IonicContact CZ-OE1 3.35Å; R130-E170 IonicContact NE-OE1 3.81Å; R130-E170 IonicContact NH2-OE1 2.69Å; R130-E170 PolarHBondContact NH2-OE1 3.08Å; F163-E170 HydrophobicContact CE2-CB 4.46Å; F163-E170 HydrophobicContact CE2-CG 4.31Å; P165-E170 HydrophobicContact CB-CB 4.39Å; V168-E170 VanDerWaalsContact C-N 3.3Å; V168-E170 PolarHBondContact O-N 3.47Å; E170-K172 PolarHBondContact O-N 2.83Å; E170-K172 VanDerWaalsContact O-N 3.1Å; E170-I173 PolarHBondContact O-N 3.37Å; E170-I173 VanDerWaalsContact O-N 3.07Å; E170-S174 WeakPolarHBondContact O-CB 3.47Å; E170-S174 PolarHBondContact O-N 3.41Å; E170-S174 PolarHBondContact O-OG 2.92Å
171	R	57.1	Low	71.3	Confident	212 Å²	212	55.1 Å²	55.1	80%	0.8	28%	0.276	S	S	*	.	H	α-helix	trans	-57.3	-30.7	-178.3	-61.5	-175.1	-178.1	172.9	0.8	113.8	N169 T175	N169-R171 PolarHBondContact O-N 3.33Å; N169-R171 VanDerWaalsContact O-N 3.14Å; N169-R171 WeakPolarHBondContact OD1-CB 3.26Å; N169-R171 PolarHBondContact OD1-N 3.26Å; R171-T175 VanDerWaalsContact O-CG2 3.22Å; R171-T175 WeakPolarHBondContact O-CG2 3.3Å; R171-T175 PolarHBondContact O-OG1 2.91Å
172	K	63.9	Low	70.7	Confident	64 Å²	64	56.9 Å²	56.9	28%	0.278	29%	0.286	S	S	.	.	H	α-helix	trans	-82.6	-30.3	179.5	-71.5	-170.2	177.7	-177.7	0	113	N169 E170 T175 H207	N169-K172 PolarHBondContact O-N 2.94Å; E170-K172 PolarHBondContact O-N 2.83Å; E170-K172 VanDerWaalsContact O-N 3.1Å; K172-T175 PolarHBondContact O-OG1 2.9Å; K172-H207 PolarHBondContact NZ-O 2.86Å
173	I	67.6	Low	69.8	Low	9 Å²	9	58.5 Å²	58.5	5%	0.046	30%	0.3	C	S	.	.	H	α-helix	trans	-98.1	-35.4	-175.6	-55.4	-160	0	0	0	111.5	L142 I161 F163 V168 E170 T175 L176 L238	L142-I173 HydrophobicContact CD1-CG2 3.83Å; L142-I173 WeakPolarHBondContact CD1-O 3.46Å; I161-I173 HydrophobicContact CG2-CG2 4.43Å; F163-I173 HydrophobicContact CD1-CB 4.43Å; F163-I173 HydrophobicContact CD1-CG2 3.68Å; F163-I173 HydrophobicContact CE1-CB 3.93Å; F163-I173 HydrophobicContact CE1-CG2 3.27Å; F163-I173 HydrophobicContact CE2-CB 4.44Å; F163-I173 HydrophobicContact CZ-CB 3.92Å; F163-I173 HydrophobicContact CZ-CG2 3.8Å; V168-I173 HydrophobicContact CB-CD1 4.49Å; V168-I173 HydrophobicContact CG1-CD1 3.22Å; V168-I173 HydrophobicContact CG1-CG1 3.91Å; E170-I173 PolarHBondContact O-N 3.37Å; E170-I173 VanDerWaalsContact O-N 3.07Å; I173-T175 PolarHBondContact O-N 3.13Å; I173-L176 HydrophobicContact CB-CD1 4.4Å; I173-L176 HydrophobicContact CG2-CD1 3.63Å; I173-L176 HydrophobicContact CG2-CG 4.38Å; I173-L176 VanDerWaalsContact O-CB 3.29Å; I173-L176 WeakPolarHBondContact O-CB 3.39Å; I173-L176 WeakPolarHBondContact O-CG 3.3Å; I173-L176 PolarHBondContact O-N 3.46Å; I173-L176 VanDerWaalsContact O-N 3.09Å; I173-L238 HydrophobicContact CD1-CD1 3.78Å; I173-L238 HydrophobicContact CD1-CD2 4.21Å
174	S	64.9	Low	69	Low	28 Å²	28	59.1 Å²	59.1	20%	0.196	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-21.6	177.7	67.2	0	0	0	0	113.2	E170 L176	E170-S174 WeakPolarHBondContact O-CB 3.47Å; E170-S174 PolarHBondContact O-N 3.41Å; E170-S174 PolarHBondContact O-OG 2.92Å; S174-L176 VanDerWaalsContact C-N 3.34Å
175	T	69.2	Low	68.3	Low	74 Å²	74	57.6 Å²	57.6	45%	0.454	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	0.6	176.8	51.1	0	0	0	0	113.4	R171 K172 I173 K177	R171-T175 VanDerWaalsContact O-CG2 3.22Å; R171-T175 WeakPolarHBondContact O-CG2 3.3Å; R171-T175 PolarHBondContact O-OG1 2.91Å; K172-T175 PolarHBondContact O-OG1 2.9Å; I173-T175 PolarHBondContact O-N 3.13Å; T175-K177 PolarHBondContact O-N 2.87Å
176	L	71.8	Confident	67.9	Low	9 Å²	9	62 Å²	62	5%	0.047	31%	0.313	C	S	.	.			trans	-60.8	129.1	179.7	-72.3	175.1	0	0	0	111	L142 I161 I173 S174 E180 I181 L184 Y203 V258	L142-L176 HydrophobicContact CD1-CD1 4.44Å; I161-L176 HydrophobicContact CD1-CD1 4.09Å; I173-L176 HydrophobicContact CB-CD1 4.4Å; I173-L176 HydrophobicContact CG2-CD1 3.63Å; I173-L176 HydrophobicContact CG2-CG 4.38Å; I173-L176 VanDerWaalsContact O-CB 3.29Å; I173-L176 WeakPolarHBondContact O-CB 3.39Å; I173-L176 WeakPolarHBondContact O-CG 3.3Å; I173-L176 PolarHBondContact O-N 3.46Å; I173-L176 VanDerWaalsContact O-N 3.09Å; S174-L176 VanDerWaalsContact C-N 3.34Å; L176-E180 WeakPolarHBondContact CA-OE2 3.28Å; L176-E180 HydrophobicContact CB-CB 4.5Å; L176-E180 HydrophobicContact CD2-CB 3.93Å; L176-I181 HydrophobicContact CB-CG1 4.01Å; L176-L184 HydrophobicContact CD1-CD1 3.77Å; L176-L184 HydrophobicContact CD2-CD1 4.31Å; L176-Y203 HydrophobicContact CD2-CE1 4.26Å; L176-V258 VanDerWaalsContact O-CG1 3.3Å; L176-V258 WeakPolarHBondContact O-CG1 3.46Å
177	K	76.3	Confident	66.8	Low	87 Å²	87	58.5 Å²	58.5	38%	0.378	30%	0.301	S	S	.	.			trans	-74.5	155.7	174.5	-66.6	176.6	-176.9	171.2	0	110.1	T175 A179 E180 I181	T175-K177 PolarHBondContact O-N 2.87Å; K177-A179 PolarHBondContact O-N 2.74Å; K177-A179 VanDerWaalsContact O-N 3.13Å; K177-E180 HydrophobicContact CB-CG 4.32Å; K177-E180 PolarHBondContact N-OE2 3.09Å; K177-E180 WeakPolarHBondContact O-CA 3.33Å; K177-E180 WeakPolarHBondContact O-CB 3.34Å; K177-E180 PolarHBondContact O-N 3.43Å; K177-I181 PolarHBondContact O-N 3.39Å
178	P	76.2	Confident	65.8	Low	15 Å²	15	55.6 Å²	55.6	10%	0.097	29%	0.292	C	S	.	.	H	α-helix	trans	-50.1	-40.3	174.9	-34.5	42.2	0	0	0	114.4	F128 E180 I181 L182 V258 V260	F128-P178 HydrophobicContact CB-CB 4.27Å; F128-P178 HydrophobicContact CB-CG 3.98Å; F128-P178 HydrophobicContact CD1-CB 4.21Å; F128-P178 HydrophobicContact CD2-CB 3.58Å; F128-P178 HydrophobicContact CD2-CG 4.11Å; F128-P178 HydrophobicContact CE1-CB 4.49Å; F128-P178 HydrophobicContact CE2-CB 3.9Å; F128-P178 HydrophobicContact CG-CB 3.74Å; F128-P178 HydrophobicContact CG-CG 4.02Å; F128-P178 HydrophobicContact CZ-CB 4.35Å; P178-E180 VanDerWaalsContact C-N 3.31Å; P178-E180 PolarHBondContact O-N 2.86Å; P178-I181 PolarHBondContact O-N 3.41Å; P178-L182 WeakPolarHBondContact O-CG 3.38Å; P178-L182 PolarHBondContact O-N 2.84Å; P178-V258 HydrophobicContact CG-CG1 4.15Å; P178-V260 HydrophobicContact CG-CG2 3.91Å
179	A	69.9	Low	64.6	Low	73 Å²	73	62.2 Å²	62.2	60%	0.603	33%	0.326	S	S	*	.	H	α-helix	trans	-64.9	-33.6	176.5	0	0	0	0	0	113	K177 A183	K177-A179 PolarHBondContact O-N 2.74Å; K177-A179 VanDerWaalsContact O-N 3.13Å; A179-A183 WeakPolarHBondContact O-CB 3.42Å; A179-A183 PolarHBondContact O-N 3.11Å
180	E	73.6	Confident	63.4	Low	51 Å²	51	66.8 Å²	66.8	24%	0.238	34%	0.344	C	S	.	.	H	α-helix	trans	-74.7	-41.5	176.4	-62	172.2	147.5	0	0	110.1	L176 K177 P178 L182 A183 L184 Y203	L176-E180 WeakPolarHBondContact CA-OE2 3.28Å; L176-E180 HydrophobicContact CB-CB 4.5Å; L176-E180 HydrophobicContact CD2-CB 3.93Å; K177-E180 HydrophobicContact CB-CG 4.32Å; K177-E180 PolarHBondContact N-OE2 3.09Å; K177-E180 WeakPolarHBondContact O-CA 3.33Å; K177-E180 WeakPolarHBondContact O-CB 3.34Å; K177-E180 PolarHBondContact O-N 3.43Å; P178-E180 VanDerWaalsContact C-N 3.31Å; P178-E180 PolarHBondContact O-N 2.86Å; E180-L182 VanDerWaalsContact C-N 3.28Å; E180-L182 PolarHBondContact O-N 2.98Å; E180-A183 PolarHBondContact O-N 3.28Å; E180-A183 VanDerWaalsContact O-N 3.15Å; E180-L184 WeakPolarHBondContact O-CB 3.35Å; E180-L184 WeakPolarHBondContact O-CG 3.39Å; E180-L184 PolarHBondContact O-N 3.43Å; E180-Y203 PolarHBondContact OE1-OH 3.29Å
181	I	72.7	Confident	62.2	Low	0 Å²	0	66.2 Å²	66.2	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-56.1	-46.5	173.7	-61.7	168.3	0	0	0	110.3	F128 L142 N159 I161 L176 K177 P178 L184 T185 V258	F128-I181 HydrophobicContact CD1-CB 4.26Å; F128-I181 HydrophobicContact CD1-CD1 3.93Å; F128-I181 HydrophobicContact CD1-CG2 4.13Å; F128-I181 HydrophobicContact CE1-CB 4.11Å; F128-I181 HydrophobicContact CE1-CG2 3.9Å; L142-I181 HydrophobicContact CB-CD1 3.98Å; L142-I181 HydrophobicContact CB-CG1 4.5Å; N159-I181 WeakPolarHBondContact O-CG2 3.4Å; I161-I181 HydrophobicContact CD1-CB 4.4Å; I161-I181 HydrophobicContact CD1-CG1 4.41Å; I161-I181 HydrophobicContact CD1-CG2 4.11Å; I161-I181 HydrophobicContact CG1-CG2 4.38Å; L176-I181 HydrophobicContact CB-CG1 4.01Å; K177-I181 PolarHBondContact O-N 3.39Å; P178-I181 PolarHBondContact O-N 3.41Å; I181-L184 PolarHBondContact O-N 3.04Å; I181-T185 HydrophobicContact CG2-CG2 4.42Å; I181-T185 WeakPolarHBondContact O-CB 3.39Å; I181-T185 VanDerWaalsContact O-CG2 3.29Å; I181-T185 WeakPolarHBondContact O-CG2 3.12Å; I181-T185 PolarHBondContact O-N 2.91Å; I181-T185 PolarHBondContact O-OG1 3.33Å; I181-V258 HydrophobicContact CD1-CG1 4.41Å
182	L	72.3	Confident	61.3	Low	39 Å²	39	64.7 Å²	64.7	20%	0.204	35%	0.35	C	S	.	.	H	α-helix	trans	-60.7	-50	174.1	-73.1	175.9	0	0	0	111.9	F128 N159 P178 E180 L184 T185 E186	F128-L182 HydrophobicContact CE1-CD2 4.3Å; F128-L182 HydrophobicContact CE1-CG 4.17Å; F128-L182 HydrophobicContact CZ-CD1 3.96Å; F128-L182 HydrophobicContact CZ-CD2 3.77Å; F128-L182 HydrophobicContact CZ-CG 3.63Å; N159-L182 HydrophobicContact CB-CD2 4.37Å; N159-L182 VanDerWaalsContact ND2-CD2 3.27Å; N159-L182 WeakPolarHBondContact ND2-CD2 3.29Å; P178-L182 WeakPolarHBondContact O-CG 3.38Å; P178-L182 PolarHBondContact O-N 2.84Å; E180-L182 VanDerWaalsContact C-N 3.28Å; E180-L182 PolarHBondContact O-N 2.98Å; L182-L184 PolarHBondContact O-N 2.95Å; L182-L184 VanDerWaalsContact O-N 3.15Å; L182-T185 WeakPolarHBondContact CA-OG1 3.29Å; L182-T185 PolarHBondContact O-N 3.47Å; L182-T185 VanDerWaalsContact O-N 3.1Å; L182-T185 PolarHBondContact O-OG1 3.14Å; L182-E186 VanDerWaalsContact O-CB 3.23Å; L182-E186 WeakPolarHBondContact O-CB 3.3Å; L182-E186 VanDerWaalsContact O-CG 3.24Å; L182-E186 WeakPolarHBondContact O-CG 3.23Å; L182-E186 PolarHBondContact O-N 3.48Å
183	A	65.9	Low	60	Low	45 Å²	45	69.5 Å²	69.5	37%	0.372	37%	0.373	S	S	.	.	H	α-helix	trans	-60.1	-29.5	-179.7	0	0	0	0	0	113.7	A179 E180	A179-A183 WeakPolarHBondContact O-CB 3.42Å; A179-A183 PolarHBondContact O-N 3.11Å; E180-A183 PolarHBondContact O-N 3.28Å; E180-A183 VanDerWaalsContact O-N 3.15Å
184	L	65.2	Low	58.5	Low	13 Å²	13	72.8 Å²	72.8	7%	0.068	41%	0.409	C	S	.	.	H	α-helix	trans	-81.9	-33.5	177.4	-62.6	173.3	0	0	0	112.1	I161 L176 E180 I181 L182 L200	I161-L184 HydrophobicContact CD1-CB 3.87Å; I161-L184 HydrophobicContact CD1-CD1 3.61Å; I161-L184 HydrophobicContact CD1-CG 4.39Å; L176-L184 HydrophobicContact CD1-CD1 3.77Å; L176-L184 HydrophobicContact CD2-CD1 4.31Å; E180-L184 WeakPolarHBondContact O-CB 3.35Å; E180-L184 WeakPolarHBondContact O-CG 3.39Å; E180-L184 PolarHBondContact O-N 3.43Å; I181-L184 PolarHBondContact O-N 3.04Å; L182-L184 PolarHBondContact O-N 2.95Å; L182-L184 VanDerWaalsContact O-N 3.15Å; L184-L200 HydrophobicContact CB-CD1 4.42Å; L184-L200 HydrophobicContact CB-CD2 3.97Å; L184-L200 HydrophobicContact CB-CG 3.94Å; L184-L200 HydrophobicContact CD1-CD2 4.29Å; L184-L200 HydrophobicContact CD2-CB 4.34Å; L184-L200 HydrophobicContact CD2-CD2 3.47Å; L184-L200 VanDerWaalsContact CD2-CD2 3.47Å; L184-L200 HydrophobicContact CD2-CG 3.56Å; L184-L200 HydrophobicContact CG-CD2 4.06Å; L184-L200 HydrophobicContact CG-CG 4.27Å; L184-L200 WeakPolarHBondContact O-CD1 3.37Å
185	T	66.4	Low	57.2	Low	3 Å²	3	81.2 Å²	81.2	2%	0.018	44%	0.442	C	S	.	.	H	α-helix	trans	-91.5	-31.4	-175.6	51.9	0	0	0	0	112.8	N159 I161 I181 L182 S187 I240 P242	N159-T185 HydrophobicContact CB-CG2 4.06Å; N159-T185 VanDerWaalsContact CB-OG1 3.24Å; N159-T185 WeakPolarHBondContact CB-OG1 3.42Å; N159-T185 WeakPolarHBondContact O-CG2 3.39Å; I161-T185 HydrophobicContact CD1-CG2 4.32Å; I161-T185 HydrophobicContact CG1-CG2 3.73Å; I181-T185 HydrophobicContact CG2-CG2 4.42Å; I181-T185 WeakPolarHBondContact O-CB 3.39Å; I181-T185 VanDerWaalsContact O-CG2 3.29Å; I181-T185 WeakPolarHBondContact O-CG2 3.12Å; I181-T185 PolarHBondContact O-N 2.91Å; I181-T185 PolarHBondContact O-OG1 3.33Å; L182-T185 WeakPolarHBondContact CA-OG1 3.29Å; L182-T185 PolarHBondContact O-N 3.47Å; L182-T185 VanDerWaalsContact O-N 3.1Å; L182-T185 PolarHBondContact O-OG1 3.14Å; T185-S187 PolarHBondContact O-N 3.46Å; T185-I240 HydrophobicContact CG2-CG2 3.73Å; T185-P242 WeakPolarHBondContact O-CB 3.38Å
186	E	64.6	Low	55.7	Low	118 Å²	118	86.9 Å²	86.9	55%	0.551	46%	0.455	S	S	*	.	S	Bend	trans	-63.4	106.5	175.6	-73.4	177.3	-169.7	0	0	109.5	L182 K188	L182-E186 VanDerWaalsContact O-CB 3.23Å; L182-E186 WeakPolarHBondContact O-CB 3.3Å; L182-E186 VanDerWaalsContact O-CG 3.24Å; L182-E186 WeakPolarHBondContact O-CG 3.23Å; L182-E186 PolarHBondContact O-N 3.48Å; E186-K188 PolarHBondContact O-N 3.35Å
187	S	50.1	Low	54.1	Low	77 Å²	77	87.9 Å²	87.9	54%	0.538	47%	0.467	S	S	.	.			trans	-62.2	127.4	171.9	84.7	0	0	0	0	107.9	T185 L189	T185-S187 PolarHBondContact O-N 3.46Å; S187-L189 PolarHBondContact O-N 2.79Å
188	K	46.4	Very low	52.5	Low	67 Å²	67	89 Å²	89	29%	0.291	48%	0.478	S	S	.	.			trans	-67.3	69.8	168.4	-71.9	177.8	-179.6	162.7	0	110	E186 Q190 S191 R196 G197	E186-K188 PolarHBondContact O-N 3.35Å; K188-Q190 PolarHBondContact O-N 2.84Å; K188-S191 PolarHBondContact O-N 2.99Å; K188-R196 HydrophobicContact CD-CB 4.26Å; K188-R196 VanDerWaalsContact CD-O 3.3Å; K188-R196 WeakPolarHBondContact CD-O 3.47Å; K188-R196 PolarHBondContact NZ-O 3.16Å; K188-G197 PolarHBondContact NZ-O 3.26Å
189	L	39.2	Very low	50.9	Low	162 Å²	162	92.3 Å²	92.3	85%	0.848	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-0.8	160.6	-80	178.4	0	0	0	112	S187	S187-L189 PolarHBondContact O-N 2.79Å
190	Q	38.4	Very low	49.6	Very low	189 Å²	189	90.4 Å²	90.4	88%	0.883	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.8	27.7	172.8	-122.8	169.3	32.2	0	0	114.3	K188 Q192	K188-Q190 PolarHBondContact O-N 2.84Å; Q190-Q192 VanDerWaalsContact C-N 3.31Å; Q190-Q192 PolarHBondContact O-N 3.23Å
191	S	35.4	Very low	48.1	Very low	56 Å²	56	90.3 Å²	90.3	39%	0.392	48%	0.478	S	S	.	.			trans	-93.3	60.9	158.4	77.1	0	0	0	0	111.4	K188 H193	K188-S191 PolarHBondContact O-N 2.99Å; S191-H193 PolarHBondContact O-N 3.23Å
192	Q	38.2	Very low	46.7	Very low	179 Å²	179	93.9 Å²	93.9	84%	0.836	50%	0.498	S	S	*	.	S	Bend	trans	-63.2	-8.1	152.6	-91	-94.5	-18.8	0	0	111.4	Q190	Q190-Q192 VanDerWaalsContact C-N 3.31Å; Q190-Q192 PolarHBondContact O-N 3.23Å
193	H	36.1	Very low	45.3	Very low	165 Å²	165	96.3 Å²	96.3	76%	0.764	51%	0.505	S	S	*	.	S	Bend	trans	-114.6	98	168.2	-70.7	-9.2	0	0	0	109.5	S191 K195	S191-H193 PolarHBondContact O-N 3.23Å; H193-K195 PolarHBondContact O-N 3.36Å
194	G	34.9	Very low	44.4	Very low	78 Å²	78	96.6 Å²	96.6	80%	0.804	50%	0.5	S	S	*	.	S	Bend	trans	-65.8	60.3	-171.6	0	0	0	0	0	116
195	K	38.8	Very low	43.5	Very low	205 Å²	205	101.7 Å²	101.7	89%	0.891	52%	0.523	S	S	*	.			trans	-142.7	15	176.1	-97	-173.2	-179.1	179.6	0	115.3	H193	H193-K195 PolarHBondContact O-N 3.36Å
196	R	37.8	Very low	42.2	Very low	193 Å²	193	105.7 Å²	105.7	73%	0.728	55%	0.545	S	S	*	.			trans	-128.2	78.7	-174.8	-109.2	178.8	-179.4	150.6	1.2	110	K188 N198	K188-R196 HydrophobicContact CD-CB 4.26Å; K188-R196 VanDerWaalsContact CD-O 3.3Å; K188-R196 WeakPolarHBondContact CD-O 3.47Å; K188-R196 PolarHBondContact NZ-O 3.16Å; R196-N198 PolarHBondContact O-N 2.98Å
197	G	37.1	Very low	41	Very low	30 Å²	30	104.9 Å²	104.9	31%	0.309	54%	0.54	S	S	.	.			trans	-40.2	136.5	165.3	0	0	0	0	0	110.7	K188 L199	K188-G197 PolarHBondContact NZ-O 3.26Å; G197-L199 PolarHBondContact O-N 2.82Å
198	N	42.8	Very low	40.5	Very low	112 Å²	112	105.1 Å²	105.1	60%	0.599	53%	0.534	S	S	*	.			trans	-11.6	104.3	152.8	-3.6	-6.8	0	0	0	108.9	R196 L200 S201 D202	R196-N198 PolarHBondContact O-N 2.98Å; N198-L200 HydrophobicContact CB-CB 4.34Å; N198-L200 PolarHBondContact O-N 2.84Å; N198-S201 WeakPolarHBondContact CB-OG 3.42Å; N198-S201 PolarHBondContact O-N 3.48Å; N198-S201 PolarHBondContact O-OG 2.76Å; N198-D202 PolarHBondContact O-N 3.39Å
199	L	42.1	Very low	40.1	Very low	83 Å²	83	107.1 Å²	107.1	44%	0.435	55%	0.546	S	S	.	.	H	α-helix	trans	-58.3	-16.3	177.6	-71.5	170.8	0	0	0	110.5	G197 Y203	G197-L199 PolarHBondContact O-N 2.82Å; L199-Y203 WeakPolarHBondContact O-CA 3.29Å; L199-Y203 WeakPolarHBondContact O-CB 3.3Å; L199-Y203 PolarHBondContact O-N 2.71Å
200	L	44.2	Very low	39.7	Very low	34 Å²	34	107.3 Å²	107.3	18%	0.178	54%	0.54	C	S	.	.	H	α-helix	trans	-57.5	-54.2	165.6	-89.7	158	0	0	0	115.2	L184 N198 D202 L204 L238 I240	L184-L200 HydrophobicContact CB-CD1 4.42Å; L184-L200 HydrophobicContact CB-CD2 3.97Å; L184-L200 HydrophobicContact CB-CG 3.94Å; L184-L200 HydrophobicContact CD1-CD2 4.29Å; L184-L200 HydrophobicContact CD2-CB 4.34Å; L184-L200 HydrophobicContact CD2-CD2 3.47Å; L184-L200 VanDerWaalsContact CD2-CD2 3.47Å; L184-L200 HydrophobicContact CD2-CG 3.56Å; L184-L200 HydrophobicContact CG-CD2 4.06Å; L184-L200 HydrophobicContact CG-CG 4.27Å; L184-L200 WeakPolarHBondContact O-CD1 3.37Å; N198-L200 HydrophobicContact CB-CB 4.34Å; N198-L200 PolarHBondContact O-N 2.84Å; L200-D202 VanDerWaalsContact C-N 3.28Å; L200-D202 PolarHBondContact O-N 3.17Å; L200-L204 HydrophobicContact CD2-CD1 3.67Å; L200-L204 HydrophobicContact CD2-CG 4.33Å; L200-L204 WeakPolarHBondContact O-CB 3.08Å; L200-L204 VanDerWaalsContact O-CG 3.29Å; L200-L204 WeakPolarHBondContact O-CG 3.38Å; L200-L204 PolarHBondContact O-N 2.93Å; L200-L238 HydrophobicContact CD2-CD2 4.25Å; L200-I240 HydrophobicContact CD1-CB 4.47Å; L200-I240 HydrophobicContact CD1-CD1 3.21Å; L200-I240 HydrophobicContact CD1-CG1 4.39Å; L200-I240 HydrophobicContact CD1-CG2 4.27Å; L200-I240 HydrophobicContact CD2-CD1 3.04Å; L200-I240 HydrophobicContact CG-CD1 3.65Å
201	S	42.2	Very low	39.3	Very low	48 Å²	48	104.1 Å²	104.1	34%	0.336	53%	0.529	S	S	.	.	H	α-helix	trans	-62	-44.3	178.6	30.6	0	0	0	0	108.4	N198 Q205	N198-S201 WeakPolarHBondContact CB-OG 3.42Å; N198-S201 PolarHBondContact O-N 3.48Å; N198-S201 PolarHBondContact O-OG 2.76Å; S201-Q205 WeakPolarHBondContact O-CA 3.45Å; S201-Q205 WeakPolarHBondContact O-CB 3.3Å; S201-Q205 PolarHBondContact O-N 2.88Å
202	D	43	Very low	39	Very low	76 Å²	76	106.7 Å²	106.7	41%	0.406	54%	0.542	S	S	.	.	H	α-helix	trans	-71.8	-43.2	-179.1	-65.4	-15.1	0	0	0	113.2	N198 L200 N206	N198-D202 PolarHBondContact O-N 3.39Å; L200-D202 VanDerWaalsContact C-N 3.28Å; L200-D202 PolarHBondContact O-N 3.17Å; D202-N206 WeakPolarHBondContact O-CA 3.48Å; D202-N206 WeakPolarHBondContact O-CB 3.37Å; D202-N206 PolarHBondContact O-N 2.81Å; D202-N206 PolarHBondContact O-ND2 2.99Å
203	Y	42.7	Very low	38.5	Very low	90 Å²	90	103.4 Å²	103.4	35%	0.353	53%	0.534	S	S	.	.	H	α-helix	trans	-69	-43.3	-178.7	-169.2	-85.8	0	0	0	110.9	L176 E180 L199 H207	L176-Y203 HydrophobicContact CD2-CE1 4.26Å; E180-Y203 PolarHBondContact OE1-OH 3.29Å; L199-Y203 WeakPolarHBondContact O-CA 3.29Å; L199-Y203 WeakPolarHBondContact O-CB 3.3Å; L199-Y203 PolarHBondContact O-N 2.71Å; Y203-H207 WeakPolarHBondContact O-CB 3.49Å; Y203-H207 PolarHBondContact O-N 3.22Å
204	L	47.4	Very low	38	Very low	50 Å²	50	104.4 Å²	104.4	26%	0.262	54%	0.539	S	S	.	.	H	α-helix	trans	-72.9	-42	176.1	-62.8	172.9	0	0	0	111.5	L200 M208 L238	L200-L204 HydrophobicContact CD2-CD1 3.67Å; L200-L204 HydrophobicContact CD2-CG 4.33Å; L200-L204 WeakPolarHBondContact O-CB 3.08Å; L200-L204 VanDerWaalsContact O-CG 3.29Å; L200-L204 WeakPolarHBondContact O-CG 3.38Å; L200-L204 PolarHBondContact O-N 2.93Å; L204-M208 HydrophobicContact CB-CE 4.25Å; L204-M208 VanDerWaalsContact O-CB 3.22Å; L204-M208 WeakPolarHBondContact O-CB 3.16Å; L204-M208 WeakPolarHBondContact O-CE 3.39Å; L204-M208 WeakPolarHBondContact O-CG 3.29Å; L204-M208 PolarHBondContact O-N 3.34Å; L204-L238 HydrophobicContact CD1-CD2 3.5Å; L204-L238 VanDerWaalsContact CD1-CD2 3.5Å
205	Q	45.8	Very low	37.8	Very low	120 Å²	120	108.5 Å²	108.5	56%	0.561	54%	0.543	S	S	*	.	H	α-helix	trans	-65.4	-47.6	177.9	-165.1	93.4	26.2	0	0	111	S201 M208 M209	S201-Q205 WeakPolarHBondContact O-CA 3.45Å; S201-Q205 WeakPolarHBondContact O-CB 3.3Å; S201-Q205 PolarHBondContact O-N 2.88Å; Q205-M208 PolarHBondContact O-N 2.93Å; Q205-M209 HydrophobicContact CG-SD 4.28Å; Q205-M209 WeakPolarHBondContact O-CG 3.48Å; Q205-M209 PolarHBondContact O-N 2.85Å
206	N	38.3	Very low	37.1	Very low	88 Å²	88	103 Å²	103	47%	0.471	53%	0.53	S	S	.	.	H	α-helix	trans	-67.1	-42.4	-178.8	-66.8	-27.7	0	0	0	111.2	D202 M208 M209 F210	D202-N206 WeakPolarHBondContact O-CA 3.48Å; D202-N206 WeakPolarHBondContact O-CB 3.37Å; D202-N206 PolarHBondContact O-N 2.81Å; D202-N206 PolarHBondContact O-ND2 2.99Å; N206-M208 VanDerWaalsContact C-N 3.3Å; N206-M208 PolarHBondContact O-N 2.8Å; N206-M209 PolarHBondContact O-N 2.9Å; N206-F210 WeakPolarHBondContact O-CD2 3.16Å; N206-F210 PolarHBondContact O-N 2.85Å
207	H	39.4	Very low	36.5	Very low	100 Å²	100	99.3 Å²	99.3	46%	0.463	53%	0.534	S	S	.	.	H	α-helix	trans	-78.8	-12.4	-179	-150.8	-56.7	0	0	0	113.6	K172 Y203	K172-H207 PolarHBondContact NZ-O 2.86Å; Y203-H207 WeakPolarHBondContact O-CB 3.49Å; Y203-H207 PolarHBondContact O-N 3.22Å
208	M	40.4	Very low	35.8	Very low	82 Å²	82	104.1 Å²	104.1	40%	0.404	56%	0.562	S	S	.	*	H	α-helix	trans	-89.4	-29.3	168.8	-69.4	-168.7	-60.1	0	0	112.6	L204 Q205 N206 F210	L204-M208 HydrophobicContact CB-CE 4.25Å; L204-M208 VanDerWaalsContact O-CB 3.22Å; L204-M208 WeakPolarHBondContact O-CB 3.16Å; L204-M208 WeakPolarHBondContact O-CE 3.39Å; L204-M208 WeakPolarHBondContact O-CG 3.29Å; L204-M208 PolarHBondContact O-N 3.34Å; Q205-M208 PolarHBondContact O-N 2.93Å; N206-M208 VanDerWaalsContact C-N 3.3Å; N206-M208 PolarHBondContact O-N 2.8Å; M208-F210 VanDerWaalsContact C-N 3.35Å; M208-F210 PolarHBondContact O-N 2.83Å
209	M	37.9	Very low	34.9	Very low	109 Å²	109	106.5 Å²	106.5	54%	0.537	57%	0.569	S	S	.	*	H	α-helix	trans	-68.8	-27.7	174.2	-83.2	173.1	55.9	0	0	113.8	Q205 N206 N211 V212	Q205-M209 HydrophobicContact CG-SD 4.28Å; Q205-M209 WeakPolarHBondContact O-CG 3.48Å; Q205-M209 PolarHBondContact O-N 2.85Å; N206-M209 PolarHBondContact O-N 2.9Å; M209-N211 PolarHBondContact O-N 2.88Å; M209-V212 PolarHBondContact O-N 3.41Å
210	F	30.4	Very low	34.2	Very low	166 Å²	166	108.8 Å²	108.8	73%	0.728	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	-6.6	-180	-94.4	-78.2	0	0	0	115.5	N206 M208	N206-F210 WeakPolarHBondContact O-CD2 3.16Å; N206-F210 PolarHBondContact O-N 2.85Å; M208-F210 VanDerWaalsContact C-N 3.35Å; M208-F210 PolarHBondContact O-N 2.83Å
211	N	30.4	Very low	33.2	Very low	123 Å²	123	115.5 Å²	115.5	66%	0.658	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	6.3	172.3	-74	4.5	0	0	0	113.9	M209	M209-N211 PolarHBondContact O-N 2.88Å
212	V	29.9	Very low	32.5	Very low	110 Å²	110	121.6 Å²	121.6	67%	0.667	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.2	-12.8	-179.2	-176	0	0	0	0	113	M209 E214	M209-V212 PolarHBondContact O-N 3.41Å; V212-E214 PolarHBondContact O-N 3.49Å
213	T	26.7	Very low	31.6	Very low	109 Å²	109	127.6 Å²	127.6	67%	0.669	66%	0.664	S	S	*	*	G	3₁₀ helix	trans	-87.2	-3.4	-168.3	-44.3	0	0	0	0	115.4	N215	T213-N215 PolarHBondContact O-N 2.89Å
214	E	26.9	Very low	30.8	Very low	186 Å²	186	128.5 Å²	128.5	87%	0.869	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-76.7	-12.7	-174.1	-105.3	-176.1	174.7	0	0	116.2	V212	V212-E214 PolarHBondContact O-N 3.49Å
215	N	29.1	Very low	29.7	Very low	164 Å²	164	133.3 Å²	133.3	88%	0.877	71%	0.705	S	S	*	*	G	3₁₀ helix	trans	-146.3	40.6	-176.3	-81.2	-31.8	0	0	0	116.1	T213	T213-N215 PolarHBondContact O-N 2.89Å
216	S	25.8	Very low	28.8	Very low	90 Å²	90	132 Å²	132	63%	0.629	71%	0.705	S	S	*	*			trans	-137.6	81.5	163.5	58.5	0	0	0	0	112.3	C218	S216-C218 PolarHBondContact O-N 2.98Å
217	S	24.2	Very low	28.2	Very low	116 Å²	116	132.5 Å²	132.5	81%	0.811	72%	0.715	S	S	*	*			trans	-53.9	119.1	150.8	50.1	0	0	0	0	108.2	E219	S217-E219 PolarHBondContact O-N 3.14Å
218	C	22.3	Very low	27.5	Very low	131 Å²	131	136.3 Å²	136.3	89%	0.885	73%	0.733	S	S	*	*			trans	-54	105.5	173.2	-63.1	0	0	0	0	110.1	S216	S216-C218 PolarHBondContact O-N 2.98Å
219	E	24	Very low	26.6	Very low	162 Å²	162	138.6 Å²	138.6	76%	0.757	74%	0.743	S	S	*	*			trans	-154.8	127.5	157.3	-117.7	178.3	-165.4	0	0	110.6	S217	S217-E219 PolarHBondContact O-N 3.14Å
220	N	27	Very low	26	Very low	131 Å²	131	141.8 Å²	141.8	70%	0.701	75%	0.754	S	S	*	*			trans	80.3	98.1	159.7	-55.4	-38	0	0	0	117.8	K222	N220-K222 VanDerWaalsContact C-N 3.3Å; N220-K222 PolarHBondContact O-N 2.81Å
221	N	24.6	Very low	26	Very low	175 Å²	175	140.5 Å²	140.5	94%	0.936	75%	0.75	S	S	*	*			trans	-37.8	88.2	146.9	-66.5	-38.1	0	0	0	111.9
222	K	27.5	Very low	25.9	Very low	175 Å²	175	141.6 Å²	141.6	76%	0.761	75%	0.751	S	S	*	*			trans	-127	124.2	153.5	-74.2	-175.1	-179.9	177.9	0	106	N220 V224	N220-K222 VanDerWaalsContact C-N 3.3Å; N220-K222 PolarHBondContact O-N 2.81Å; K222-V224 PolarHBondContact O-N 3.27Å
223	Q	24	Very low	26.2	Very low	202 Å²	202	139 Å²	139	94%	0.944	74%	0.741	S	S	*	*			trans	-62.2	74.6	175.8	-170.6	171.1	17.9	0	0	108.3	N225	Q223-N225 PolarHBondContact O-N 3.06Å
224	V	25.8	Very low	26.6	Very low	110 Å²	110	138.6 Å²	138.6	67%	0.667	73%	0.734	S	S	*	*			trans	-74.5	112.3	174.3	176.4	0	0	0	0	105.1	K222 V226	K222-V224 PolarHBondContact O-N 3.27Å; V224-V226 HydrophobicContact CG1-CG2 4.37Å; V224-V226 WeakPolarHBondContact O-CG2 3.3Å; V224-V226 PolarHBondContact O-N 3.28Å
225	N	23	Very low	27.1	Very low	150 Å²	150	136 Å²	136	80%	0.802	72%	0.722	S	S	*	*			trans	-59.5	84.7	168.9	-163.2	-1.1	0	0	0	107.1	Q223 S227	Q223-N225 PolarHBondContact O-N 3.06Å; N225-S227 PolarHBondContact O-N 2.77Å
226	V	27.5	Very low	27.7	Very low	93 Å²	93	128.7 Å²	128.7	56%	0.564	69%	0.685	S	S	*	*			trans	-72.5	88.3	174.5	-167	0	0	0	0	105.5	V224 E228 Q229	V224-V226 HydrophobicContact CG1-CG2 4.37Å; V224-V226 WeakPolarHBondContact O-CG2 3.3Å; V224-V226 PolarHBondContact O-N 3.28Å; V226-E228 PolarHBondContact O-N 3.1Å; V226-Q229 HydrophobicContact CG1-CB 4Å
227	S	25.8	Very low	29.1	Very low	99 Å²	99	128.4 Å²	128.4	69%	0.692	68%	0.681	S	S	*	*			trans	-38.8	108.4	158.2	36	0	0	0	0	108.3	N225 Q229	N225-S227 PolarHBondContact O-N 2.77Å; S227-Q229 PolarHBondContact O-N 3.15Å
228	E	24	Very low	31	Very low	180 Å²	180	125 Å²	125	84%	0.841	65%	0.654	S	S	*	*			trans	18.2	65.4	159.9	-63.1	177.4	170.6	0	0	113.4	V226 K230	V226-E228 PolarHBondContact O-N 3.1Å; E228-K230 PolarHBondContact O-N 3Å
229	Q	22.9	Very low	33.2	Very low	129 Å²	129	123.7 Å²	123.7	60%	0.603	64%	0.637	S	S	*	*			trans	-68.7	95.9	167.1	-168.8	168.9	11.8	0	0	103.2	V226 S227 H231	V226-Q229 HydrophobicContact CG1-CB 4Å; S227-Q229 PolarHBondContact O-N 3.15Å; Q229-H231 PolarHBondContact O-CD2 3.39Å; Q229-H231 PolarHBondContact O-N 2.93Å
230	K	23.9	Very low	35.3	Very low	176 Å²	176	118.1 Å²	118.1	77%	0.765	61%	0.612	S	S	*	*			trans	-55.1	81.7	169	-76.5	-178.8	175.6	-179	0	106.8	E228 E232	E228-K230 PolarHBondContact O-N 3Å; K230-E232 PolarHBondContact O-N 3.22Å
231	H	31.2	Very low	37.2	Very low	139 Å²	139	114 Å²	114	64%	0.644	59%	0.592	S	S	*	*			trans	-69.2	78.1	155.1	-69.6	-74	0	0	0	104.4	Q229 A233	Q229-H231 PolarHBondContact O-CD2 3.39Å; Q229-H231 PolarHBondContact O-N 2.93Å; H231-A233 HydrophobicContact CB-CB 4.42Å; H231-A233 PolarHBondContact O-N 2.7Å
232	E	28.5	Very low	39	Very low	147 Å²	147	108.6 Å²	108.6	69%	0.687	57%	0.566	S	S	*	*			trans	-65.4	56.3	149	-91.6	179.9	166.3	0	0	107.4	K230 L234	K230-E232 PolarHBondContact O-N 3.22Å; E232-L234 HydrophobicContact CB-CD1 4.31Å; E232-L234 HydrophobicContact CB-CG 4.2Å; E232-L234 HydrophobicContact CG-CG 4.38Å; E232-L234 PolarHBondContact O-N 3.15Å
233	A	34.9	Very low	41.2	Very low	56 Å²	56	103.8 Å²	103.8	46%	0.463	56%	0.555	S	S	.	*			trans	-71.1	72.7	155	0	0	0	0	0	104	H231 H235	H231-A233 HydrophobicContact CB-CB 4.42Å; H231-A233 PolarHBondContact O-N 2.7Å; A233-H235 PolarHBondContact O-N 2.95Å
234	L	35.3	Very low	44.1	Very low	100 Å²	100	97.6 Å²	97.6	52%	0.524	53%	0.528	S	S	.	.			trans	-64.2	56.5	175.2	-80.6	159.3	0	0	0	107.9	R167 E232 G236	R167-L234 CarbonylContact C-O 3.58Å; R167-L234 WeakPolarHBondContact CA-O 3.29Å; R167-L234 VanDerWaalsContact CB-O 3.26Å; R167-L234 WeakPolarHBondContact CB-O 3.27Å; R167-L234 CarbonylContact O-C 3.59Å; E232-L234 HydrophobicContact CB-CD1 4.31Å; E232-L234 HydrophobicContact CB-CG 4.2Å; E232-L234 HydrophobicContact CG-CG 4.38Å; E232-L234 PolarHBondContact O-N 3.15Å; L234-G236 PolarHBondContact O-N 2.99Å
235	H	38.1	Very low	46.9	Very low	131 Å²	131	93.8 Å²	93.8	61%	0.606	51%	0.505	S	S	*	.			trans	-68.9	99.5	-179.8	-71.7	-57.6	0	0	0	108	A233	A233-H235 PolarHBondContact O-N 2.95Å
236	G	41.3	Very low	50.1	Low	10 Å²	10	92.3 Å²	92.3	10%	0.103	49%	0.492	C	S	.	.			trans	-68.6	150.3	172.2	0	0	0	0	0	109.6	R167 L234 L238	R167-G236 PolarHBondContact O-N 3.35Å; L234-G236 PolarHBondContact O-N 2.99Å; G236-L238 PolarHBondContact O-N 3.35Å
237	P	55.7	Low	53	Low	85 Å²	85	88.1 Å²	88.1	55%	0.552	47%	0.466	S	S	*	.			trans	-60	115.1	176.8	25.2	-32.3	0	0	0	109.5	L239	P237-L239 HydrophobicContact CB-CD2 4.49Å; P237-L239 PolarHBondContact O-N 2.97Å
238	L	63.2	Low	56	Low	44 Å²	44	88.4 Å²	88.4	23%	0.23	45%	0.452	C	S	.	.			trans	-78.8	105.5	165.3	-175.4	67.3	0	0	0	107.1	I161 F163 I173 L200 L204 G236 I240	I161-L238 HydrophobicContact CG2-CD1 3.35Å; I161-L238 HydrophobicContact CG2-CD2 4.45Å; I161-L238 HydrophobicContact CG2-CG 4.04Å; F163-L238 HydrophobicContact CB-CD1 3.7Å; F163-L238 HydrophobicContact CD1-CD1 4.19Å; F163-L238 HydrophobicContact CG-CD1 4.29Å; I173-L238 HydrophobicContact CD1-CD1 3.78Å; I173-L238 HydrophobicContact CD1-CD2 4.21Å; L200-L238 HydrophobicContact CD2-CD2 4.25Å; L204-L238 HydrophobicContact CD1-CD2 3.5Å; L204-L238 VanDerWaalsContact CD1-CD2 3.5Å; G236-L238 PolarHBondContact O-N 3.35Å; L238-I240 HydrophobicContact CD2-CD1 3.82Å; L238-I240 HydrophobicContact CD2-CG1 4.39Å; L238-I240 HydrophobicContact CG-CD1 4.02Å; L238-I240 HydrophobicContact CG-CG1 4.04Å
239	L	68.9	Low	58.8	Low	104 Å²	104	80.1 Å²	80.1	55%	0.545	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	118.4	179	-65	177.6	0	0	0	109.3	S162 P237	S162-L239 PolarHBondContact N-O 3.13Å; S162-L239 PolarHBondContact O-N 3.43Å; P237-L239 HydrophobicContact CB-CD2 4.49Å; P237-L239 PolarHBondContact O-N 2.97Å
240	I	68.1	Low	61.8	Low	45 Å²	45	77.7 Å²	77.7	23%	0.231	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	112.6	-178.4	-61.3	-179.9	0	0	0	107.7	I161 T185 L200 L238 P242	I161-I240 HydrophobicContact CG1-CG1 4.27Å; I161-I240 HydrophobicContact CG2-CG1 4.27Å; T185-I240 HydrophobicContact CG2-CG2 3.73Å; L200-I240 HydrophobicContact CD1-CB 4.47Å; L200-I240 HydrophobicContact CD1-CD1 3.21Å; L200-I240 HydrophobicContact CD1-CG1 4.39Å; L200-I240 HydrophobicContact CD1-CG2 4.27Å; L200-I240 HydrophobicContact CD2-CD1 3.04Å; L200-I240 HydrophobicContact CG-CD1 3.65Å; L238-I240 HydrophobicContact CD2-CD1 3.82Å; L238-I240 HydrophobicContact CD2-CG1 4.39Å; L238-I240 HydrophobicContact CG-CD1 4.02Å; L238-I240 HydrophobicContact CG-CG1 4.04Å; I240-P242 WeakPolarHBondContact O-CD 3.39Å
241	T	67.3	Low	64.8	Low	44 Å²	44	70.5 Å²	70.5	27%	0.27	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	101.3	-174.8	-47.7	0	0	0	0	107.5	V160 S243 V245	V160-T241 PolarHBondContact N-O 3.2Å; V160-T241 PolarHBondContact O-N 2.87Å; T241-S243 PolarHBondContact O-N 3.45Å; T241-V245 HydrophobicContact CG2-CG2 3.77Å
242	P	63.1	Low	67.4	Low	61 Å²	61	63.9 Å²	63.9	40%	0.396	35%	0.349	S	S	.	.	S	Bend	trans	-62.6	-25.6	170.2	22.5	-31	0	0	0	111.9	N159 T185 I240	N159-P242 PolarHBondContact OD1-O 3.29Å; T185-P242 WeakPolarHBondContact O-CB 3.38Å; I240-P242 WeakPolarHBondContact O-CD 3.39Å
243	S	73.3	Confident	70	Confident	75 Å²	75	62 Å²	62	52%	0.524	34%	0.336	S	S	.	.	S	Bend	trans	-76.1	173	-179.4	-52.2	0	0	0	0	113.4	T241	T241-S243 PolarHBondContact O-N 3.45Å
244	D	84.5	Confident	72.3	Confident	72 Å²	72	61.2 Å²	61.2	39%	0.385	32%	0.323	S	S	.	.			trans	-72	130.2	176.6	-66.6	-15.4	0	0	0	110.9	I156 M157 R158	I156-D244 HydrophobicContact CG2-CB 3.77Å; M157-D244 CarbonylContact O-C 3.55Å; M157-D244 WeakPolarHBondContact O-CA 3.26Å; R158-D244 WeakPolarHBondContact CB-OD1 3.29Å; R158-D244 WeakPolarHBondContact CG-OD1 3.16Å; R158-D244 IonicContact CZ-OD1 3.76Å; R158-D244 IonicContact CZ-OD2 2.81Å; R158-D244 IonicContact NE-OD1 2.81Å; R158-D244 PolarHBondContact NE-OD1 3.07Å; R158-D244 IonicContact NE-OD2 3.32Å; R158-D244 IonicContact NH2-OD1 3.86Å; R158-D244 PolarHBondContact NH2-OD1 2.88Å; R158-D244 VanDerWaalsContact NH2-OD1 3.15Å; R158-D244 IonicContact NH2-OD2 3.95Å; R158-D244 PolarHBondContact NH2-OD2 2.85Å
245	V	85.2	Confident	74.6	Confident	30 Å²	30	56.9 Å²	56.9	18%	0.182	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	126.9	178	-177.9	0	0	0	0	108.7	I156 M157 V160 T241 I247	I156-V245 WeakPolarHBondContact CA-O 3.21Å; M157-V245 PolarHBondContact N-O 3.03Å; M157-V245 PolarHBondContact O-N 3.22Å; V160-V245 HydrophobicContact CB-CB 4.44Å; V160-V245 HydrophobicContact CB-CG2 3.86Å; V160-V245 HydrophobicContact CG1-CG2 4.46Å; V160-V245 HydrophobicContact CG2-CB 3.95Å; V160-V245 HydrophobicContact CG2-CG2 3.75Å; T241-V245 HydrophobicContact CG2-CG2 3.77Å; V245-I247 HydrophobicContact CG1-CG1 4.25Å
246	F	89.1	Confident	76.7	Confident	119 Å²	119	51 Å²	51	52%	0.522	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	124.8	178.4	-179.4	-92.2	0	0	0	110.5	S154 I156 R248	S154-F246 VanDerWaalsContact CB-CE2 3.44Å; S154-F246 WeakPolarHBondContact OG-CE2 3.22Å; S154-F246 WeakPolarHBondContact OG-CZ 2.92Å; I156-F246 HydrophobicContact CG1-CD2 4.2Å; F246-R248 HydrophobicContact CD1-CG 4.37Å; F246-R248 HydrophobicContact CE1-CG 3.74Å
247	I	88.3	Confident	78.5	Confident	5 Å²	5	53.8 Å²	53.8	3%	0.026	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	127.9	-179.9	-64.1	168.3	0	0	0	109.5	V131 T133 H141 S154 F155 M157 V245 V252	V131-I247 HydrophobicContact CG1-CD1 4.42Å; V131-I247 HydrophobicContact CG1-CG2 4.41Å; T133-I247 HydrophobicContact CG2-CG2 3.9Å; H141-I247 HydrophobicContact CB-CD1 4.39Å; S154-I247 CarbonylContact C-O 3.53Å; S154-I247 WeakPolarHBondContact CA-O 3.31Å; S154-I247 WeakPolarHBondContact CB-O 3.5Å; F155-I247 HydrophobicContact CE1-CB 4.32Å; F155-I247 HydrophobicContact CE1-CG2 4.06Å; F155-I247 HydrophobicContact CE2-CB 4.11Å; F155-I247 HydrophobicContact CE2-CD1 4.13Å; F155-I247 HydrophobicContact CE2-CG2 4.44Å; F155-I247 HydrophobicContact CZ-CB 3.95Å; F155-I247 HydrophobicContact CZ-CD1 4.36Å; F155-I247 HydrophobicContact CZ-CG2 3.79Å; F155-I247 PolarHBondContact N-O 3.4Å; F155-I247 PolarHBondContact O-N 3.22Å; M157-I247 HydrophobicContact CG-CD1 4.3Å; M157-I247 HydrophobicContact SD-CD1 3.5Å; M157-I247 WeakPolarHBondContact SD-CD1 3.37Å; V245-I247 HydrophobicContact CG1-CG1 4.25Å; I247-V252 HydrophobicContact CG2-CG2 3.6Å
248	R	88.7	Confident	79.3	Confident	105 Å²	105	50.1 Å²	50.1	40%	0.396	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	132.7	175.2	-61.3	-170.4	-63.5	166.6	8.8	109.7	K135 F246 S250 E251	K135-R248 VanDerWaalsContact CE-NH2 3.35Å; F246-R248 HydrophobicContact CD1-CG 4.37Å; F246-R248 HydrophobicContact CE1-CG 3.74Å; R248-S250 PolarHBondContact O-N 3.31Å; R248-E251 HydrophobicContact CB-CG 4.06Å; R248-E251 IonicContact CZ-OE1 3.93Å; R248-E251 IonicContact NE-OE1 3.15Å; R248-E251 PolarHBondContact NE-OE1 3.14Å; R248-E251 IonicContact NH2-OE1 2.91Å; R248-E251 PolarHBondContact NH2-OE1 3Å; R248-E251 WeakPolarHBondContact O-CB 3.16Å; R248-E251 PolarHBondContact O-N 3.21Å
249	L	84	Confident	79.3	Confident	5 Å²	5	50 Å²	50	3%	0.026	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-59.7	-31.3	178.5	-70.5	168.5	0	0	0	112.4	I53 L54 V57 Q152 R153 F155 E251 V252	I53-L249 HydrophobicContact CB-CD2 4.29Å; I53-L249 HydrophobicContact CG2-CD2 3.53Å; L54-L249 HydrophobicContact CB-CD1 3.95Å; L54-L249 HydrophobicContact CD1-CD1 3.81Å; L54-L249 HydrophobicContact CG-CD1 4.39Å; V57-L249 HydrophobicContact CG2-CD2 4.2Å; Q152-L249 WeakPolarHBondContact O-CD1 3.4Å; R153-L249 WeakPolarHBondContact O-CB 3.23Å; R153-L249 PolarHBondContact O-N 2.81Å; F155-L249 HydrophobicContact CD1-CD2 3.68Å; F155-L249 HydrophobicContact CD1-CG 4.23Å; F155-L249 HydrophobicContact CE1-CD2 3.7Å; F155-L249 HydrophobicContact CE1-CG 4.47Å; L249-E251 PolarHBondContact O-N 2.82Å; L249-V252 PolarHBondContact O-N 3.38Å; L249-V252 VanDerWaalsContact O-N 3.15Å
250	S	84.8	Confident	78.5	Confident	78 Å²	78	48.8 Å²	48.8	55%	0.545	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-63.3	-20.2	174.4	62.7	0	0	0	0	113.6	R248	R248-S250 PolarHBondContact O-N 3.31Å
251	E	87.1	Confident	77.4	Confident	25 Å²	25	50.8 Å²	50.8	12%	0.117	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-95.1	-12	179.2	-60.8	174	170.5	0	0	112.1	T133 H134 K135 R248 L249	T133-E251 CarbonylContact C-O 3.53Å; T133-E251 WeakPolarHBondContact CA-O 3.49Å; H134-E251 PolarHBondContact CE1-O 3.02Å; H134-E251 PolarHBondContact N-O 3.14Å; H134-E251 PolarHBondContact ND1-O 3.48Å; K135-E251 HydrophobicContact CB-CB 4.47Å; K135-E251 HydrophobicContact CB-CG 4.04Å; K135-E251 WeakPolarHBondContact CD-OE1 3.34Å; K135-E251 WeakPolarHBondContact CE-OE1 3.43Å; K135-E251 HydrophobicContact CG-CG 4.29Å; K135-E251 IonicContact NZ-OE1 2.79Å; K135-E251 PolarHBondContact NZ-OE1 2.73Å; R248-E251 HydrophobicContact CB-CG 4.06Å; R248-E251 IonicContact CZ-OE1 3.93Å; R248-E251 IonicContact NE-OE1 3.15Å; R248-E251 PolarHBondContact NE-OE1 3.14Å; R248-E251 IonicContact NH2-OE1 2.91Å; R248-E251 PolarHBondContact NH2-OE1 3Å; R248-E251 WeakPolarHBondContact O-CB 3.16Å; R248-E251 PolarHBondContact O-N 3.21Å; L249-E251 PolarHBondContact O-N 2.82Å
252	V	86.6	Confident	75.8	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.006	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	127.5	-177.6	-178.3	0	0	0	0	109.8	I53 V131 F155 I247 L249 E254 L255	I53-V252 HydrophobicContact CD1-CB 3.95Å; I53-V252 HydrophobicContact CD1-CG1 3.87Å; I53-V252 VanDerWaalsContact CD1-O 3.31Å; I53-V252 WeakPolarHBondContact CD1-O 3.38Å; I53-V252 HydrophobicContact CG2-CB 4.28Å; I53-V252 HydrophobicContact CG2-CG1 3.99Å; V131-V252 HydrophobicContact CG1-CB 4.34Å; V131-V252 HydrophobicContact CG1-CG1 3.76Å; V131-V252 HydrophobicContact CG1-CG2 3.71Å; F155-V252 HydrophobicContact CE1-CG2 3.9Å; F155-V252 HydrophobicContact CZ-CG2 4.07Å; I247-V252 HydrophobicContact CG2-CG2 3.6Å; L249-V252 PolarHBondContact O-N 3.38Å; L249-V252 VanDerWaalsContact O-N 3.15Å; V252-E254 WeakPolarHBondContact CG1-O 3.22Å; V252-L255 HydrophobicContact CG1-CB 4.34Å
253	R	82.1	Confident	74.4	Confident	106 Å²	106	60.6 Å²	60.6	40%	0.4	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	-43	175	-170.9	-174.4	178.6	-160.6	-1.8	111.4	V132	V132-R253 PolarHBondContact O-N 2.87Å
254	E	83.9	Confident	72.6	Confident	41 Å²	41	62.5 Å²	62.5	19%	0.192	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	147.4	-178	-60.4	170.7	-165.9	0	0	109.9	R130 V131 V132 V252	R130-E254 IonicContact NH1-OE2 3.93Å; R130-E254 PolarHBondContact NH1-OE2 3.32Å; R130-E254 IonicContact NH2-OE2 3.31Å; V131-E254 WeakPolarHBondContact CA-O 3.14Å; V132-E254 HydrophobicContact CB-CB 3.96Å; V132-E254 HydrophobicContact CB-CG 4.48Å; V132-E254 HydrophobicContact CG2-CB 3.92Å; V132-E254 PolarHBondContact N-O 2.82Å; V132-E254 PolarHBondContact O-N 3Å; V252-E254 WeakPolarHBondContact CG1-O 3.22Å
255	L	84.2	Confident	69.9	Low	8 Å²	8	67.1 Å²	67.1	4%	0.042	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	129	176.1	-169.7	145.8	0	0	0	109.9	I53 L56 V57 L60 I129 R130 V131 F155 V252	I53-L255 HydrophobicContact CG2-CD1 4.22Å; L56-L255 HydrophobicContact CD2-CB 4.21Å; L56-L255 HydrophobicContact CD2-CD2 3.54Å; L56-L255 HydrophobicContact CD2-CG 4.47Å; L56-L255 HydrophobicContact CG-CD2 3.84Å; V57-L255 HydrophobicContact CG2-CD1 3.41Å; V57-L255 VanDerWaalsContact CG2-CD1 3.41Å; L60-L255 HydrophobicContact CD1-CD2 3.38Å; I129-L255 HydrophobicContact CD1-CD1 4.3Å; R130-L255 WeakPolarHBondContact O-CA 2.83Å; V131-L255 HydrophobicContact CG2-CD1 4.02Å; V131-L255 HydrophobicContact CG2-CG 4.27Å; F155-L255 HydrophobicContact CZ-CD1 4.23Å; V252-L255 HydrophobicContact CG1-CB 4.34Å
256	S	81.6	Confident	67.3	Low	9 Å²	9	70.8 Å²	70.8	6%	0.063	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	161.1	176	63.2	0	0	0	0	111.9	I129 R130	I129-S256 CarbonylContact C-O 3.52Å; I129-S256 VanDerWaalsContact CA-O 3.31Å; I129-S256 WeakPolarHBondContact CA-O 3.5Å; R130-S256 PolarHBondContact N-O 2.87Å; R130-S256 PolarHBondContact O-N 3.42Å
257	I	79.4	Confident	64.8	Low	67 Å²	67	74.7 Å²	74.7	34%	0.344	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	135.3	174.5	-53.6	175.8	0	0	0	108.2	L60 L63 P259	L60-I257 HydrophobicContact CD1-CG1 4.02Å; L60-I257 HydrophobicContact CD2-CD1 3.22Å; L60-I257 HydrophobicContact CD2-CG1 3.33Å; L60-I257 HydrophobicContact CG-CG1 4.33Å; L63-I257 HydrophobicContact CD1-CD1 4.43Å; I257-P259 VanDerWaalsContact O-CD 3.3Å; I257-P259 WeakPolarHBondContact O-CD 3.39Å
258	V	72	Confident	62.3	Low	8 Å²	8	84 Å²	84	5%	0.048	40%	0.404	C	S	.	.			trans	-78.3	113	167.3	-178.1	0	0	0	0	107.5	F128 R130 L142 L176 P178 I181 V260	F128-V258 HydrophobicContact CB-CB 4Å; F128-V258 HydrophobicContact CB-CG2 4.38Å; F128-V258 PolarHBondContact O-N 2.96Å; R130-V258 HydrophobicContact CB-CG2 4.28Å; L142-V258 HydrophobicContact CD2-CG2 4.14Å; L176-V258 VanDerWaalsContact O-CG1 3.3Å; L176-V258 WeakPolarHBondContact O-CG1 3.46Å; P178-V258 HydrophobicContact CG-CG1 4.15Å; I181-V258 HydrophobicContact CD1-CG1 4.41Å; V258-V260 PolarHBondContact O-N 2.96Å
259	P	63.5	Low	59.3	Low	42 Å²	42	87 Å²	87	27%	0.273	43%	0.425	S	S	.	.			trans	-62.5	123.6	-174	22.1	-30.4	0	0	0	111	I257 I261 I506	I257-P259 VanDerWaalsContact O-CD 3.3Å; I257-P259 WeakPolarHBondContact O-CD 3.39Å; P259-I261 VanDerWaalsContact C-N 3.31Å; P259-I261 HydrophobicContact CB-CG1 4.47Å; P259-I261 PolarHBondContact O-N 3.09Å; P259-I261 VanDerWaalsContact O-N 3.07Å; P259-I506 HydrophobicContact CG-CG1 4.49Å
260	V	52.7	Low	56.6	Low	78 Å²	78	97.4 Å²	97.4	47%	0.473	46%	0.464	S	S	.	.			trans	-77.5	87.4	164.9	-175.6	0	0	0	0	106.2	P178 V258 R262	P178-V260 HydrophobicContact CG-CG2 3.91Å; V258-V260 PolarHBondContact O-N 2.96Å; V260-R262 HydrophobicContact CG1-CG 4.41Å; V260-R262 PolarHBondContact O-N 2.81Å
261	I	43.4	Very low	54.1	Low	88 Å²	88	102.4 Å²	102.4	45%	0.451	48%	0.478	S	S	.	.			trans	-65.1	99.3	174.2	-56.2	174	0	0	0	107.7	P259 F263	P259-I261 VanDerWaalsContact C-N 3.31Å; P259-I261 HydrophobicContact CB-CG1 4.47Å; P259-I261 PolarHBondContact O-N 3.09Å; P259-I261 VanDerWaalsContact O-N 3.07Å; I261-F263 HydrophobicContact CG2-CD2 4.07Å; I261-F263 HydrophobicContact CG2-CE2 3.96Å; I261-F263 PolarHBondContact O-N 2.98Å
262	R	34.5	Very low	51.4	Low	149 Å²	149	106.5 Å²	106.5	56%	0.562	51%	0.505	S	S	*	.			trans	-73.2	103.4	170.6	-67.4	-171.1	-178	-171.1	1.1	108.4	P66 V260 D264	P66-R262 PolarHBondContact O-NH2 2.61Å; V260-R262 HydrophobicContact CG1-CG 4.41Å; V260-R262 PolarHBondContact O-N 2.81Å; R262-D264 PolarHBondContact O-N 3.24Å
263	F	33.4	Very low	48.8	Very low	161 Å²	161	111.5 Å²	111.5	71%	0.706	54%	0.54	S	S	*	.			trans	-76.9	69.4	161.7	-83.4	-89	0	0	0	109.1	I261	I261-F263 HydrophobicContact CG2-CD2 4.07Å; I261-F263 HydrophobicContact CG2-CE2 3.96Å; I261-F263 PolarHBondContact O-N 2.98Å
264	D	36.2	Very low	46.3	Very low	115 Å²	115	113.4 Å²	113.4	62%	0.615	56%	0.558	S	S	*	*			trans	-108.4	-3.6	170	-121.2	-17.9	0	0	0	113.5	R262	R262-D264 PolarHBondContact O-N 3.24Å
265	H	28.3	Very low	43.9	Very low	169 Å²	169	120.6 Å²	120.6	78%	0.782	59%	0.588	S	S	*	*			trans	-121.8	92.1	166.6	-68.7	-3.4	0	0	0	108.3	K267	H265-K267 VanDerWaalsContact C-N 3.34Å; H265-K267 PolarHBondContact O-N 3.01Å
266	P	30.3	Very low	41.4	Very low	107 Å²	107	129.7 Å²	129.7	70%	0.695	62%	0.622	S	S	*	*			trans	-52.7	112.1	154.9	23.8	-30.8	0	0	0	105	K268	P266-K268 VanDerWaalsContact C-N 3.33Å; P266-K268 PolarHBondContact O-N 3.04Å
267	K	35.8	Very low	39	Very low	201 Å²	201	137.6 Å²	137.6	87%	0.874	66%	0.658	S	S	*	*			trans	-47.9	108.8	170.7	-79	177.9	177.2	174.8	0	104.5	H265 M269	H265-K267 VanDerWaalsContact C-N 3.34Å; H265-K267 PolarHBondContact O-N 3.01Å; K267-M269 PolarHBondContact O-N 3.44Å
268	K	34.8	Very low	36.5	Very low	202 Å²	202	142.9 Å²	142.9	88%	0.878	68%	0.679	S	S	*	*			trans	-59.7	90.2	170.1	-75.6	-177.6	179.1	178	0	103.9	P266 R270	P266-K268 VanDerWaalsContact C-N 3.33Å; P266-K268 PolarHBondContact O-N 3.04Å; K268-R270 PolarHBondContact O-N 2.94Å
269	M	26.6	Very low	34.5	Very low	167 Å²	167	151.4 Å²	151.4	82%	0.823	72%	0.715	S	S	*	*			trans	-60.7	101.4	172.5	-167.2	166.6	77.8	0	0	102.1	K267 Q271	K267-M269 PolarHBondContact O-N 3.44Å; M269-Q271 VanDerWaalsContact C-N 3.26Å; M269-Q271 PolarHBondContact O-N 2.81Å
270	R	28.4	Very low	32.7	Very low	224 Å²	224	153.2 Å²	153.2	85%	0.845	74%	0.741	S	S	*	*			trans	-51.9	106.1	174.3	-78.7	-179.7	174.7	157.7	-2	103.6	K268 T272	K268-R270 PolarHBondContact O-N 2.94Å; R270-T272 PolarHBondContact O-N 3.31Å
271	Q	31.3	Very low	31.5	Very low	182 Å²	182	154.1 Å²	154.1	85%	0.85	76%	0.757	S	S	*	*			trans	-63.8	86.3	162.6	-89.4	-176.5	-5.4	0	0	103.4	M269 S273	M269-Q271 VanDerWaalsContact C-N 3.26Å; M269-Q271 PolarHBondContact O-N 2.81Å; Q271-S273 PolarHBondContact O-N 2.86Å
272	T	31.4	Very low	30.6	Very low	112 Å²	112	156.7 Å²	156.7	69%	0.687	78%	0.777	S	S	*	*			trans	-61.3	97.6	156.4	48.2	0	0	0	0	103	R270 L274	R270-T272 PolarHBondContact O-N 3.31Å; T272-L274 PolarHBondContact O-N 3.08Å
273	S	30.5	Very low	30.2	Very low	106 Å²	106	156.2 Å²	156.2	74%	0.741	78%	0.781	S	S	*	*			trans	-59.5	84.9	166.6	51.5	0	0	0	0	105.6	Q271 K275	Q271-S273 PolarHBondContact O-N 2.86Å; S273-K275 PolarHBondContact O-N 2.96Å
274	L	30.8	Very low	29.9	Very low	146 Å²	146	155.1 Å²	155.1	76%	0.764	79%	0.788	S	S	*	*			trans	-70.9	85.9	171.2	-146.6	153.6	0	0	0	103	T272 R276	T272-L274 PolarHBondContact O-N 3.08Å; L274-R276 VanDerWaalsContact C-N 3.28Å; L274-R276 PolarHBondContact O-N 2.76Å
275	K	33.4	Very low	29.6	Very low	191 Å²	191	155.4 Å²	155.4	83%	0.83	78%	0.783	S	S	*	*			trans	-51.9	104.3	170.5	-98.2	-175.7	173.7	-178.2	0	104.6	S273 E277	S273-K275 PolarHBondContact O-N 2.96Å; K275-E277 PolarHBondContact O-N 2.88Å
276	R	31.7	Very low	29.6	Very low	199 Å²	199	156.3 Å²	156.3	75%	0.751	79%	0.788	S	S	*	*			trans	-75.4	77.7	-177	-151.9	-175.1	-81.8	165.4	-13.7	105.8	L274 F278	L274-R276 VanDerWaalsContact C-N 3.28Å; L274-R276 PolarHBondContact O-N 2.76Å; R276-F278 HydrophobicContact CB-CD2 4.41Å; R276-F278 HydrophobicContact CG-CD2 3.81Å; R276-F278 HydrophobicContact CG-CE2 3.59Å; R276-F278 HydrophobicContact CG-CZ 4.21Å; R276-F278 PolarHBondContact O-N 3.01Å
277	E	30.6	Very low	29.5	Very low	176 Å²	176	160.9 Å²	160.9	82%	0.822	79%	0.793	S	S	*	*			trans	-71.7	85.2	168.2	-114	-177.2	165.6	0	0	107.2	K275 K279	K275-E277 PolarHBondContact O-N 2.88Å; E277-K279 PolarHBondContact O-N 2.76Å
278	F	26.8	Very low	29	Very low	178 Å²	178	154.4 Å²	154.4	78%	0.781	78%	0.783	S	S	*	*			trans	-69.2	83.5	163.2	-81.7	-76.8	0	0	0	108.1	R276	R276-F278 HydrophobicContact CB-CD2 4.41Å; R276-F278 HydrophobicContact CG-CD2 3.81Å; R276-F278 HydrophobicContact CG-CE2 3.59Å; R276-F278 HydrophobicContact CG-CZ 4.21Å; R276-F278 PolarHBondContact O-N 3.01Å
279	K	30.2	Very low	28.8	Very low	186 Å²	186	152.1 Å²	152.1	81%	0.809	78%	0.779	S	S	*	*			trans	-103	110	159.8	-119.7	177.9	179.2	179.1	0	107.2	E277 A281	E277-K279 PolarHBondContact O-N 2.76Å; K279-A281 PolarHBondContact O-N 3.22Å
280	G	24.9	Very low	28.9	Very low	80 Å²	80	149.3 Å²	149.3	83%	0.825	78%	0.776	S	S	*	*			trans	-55.8	127.8	-175.7	0	0	0	0	0	112.2
281	A	27.6	Very low	29.1	Very low	98 Å²	98	145.5 Å²	145.5	81%	0.81	77%	0.768	S	S	*	*			trans	-134.2	75.7	158.4	0	0	0	0	0	106.7	K279 E283	K279-A281 PolarHBondContact O-N 3.22Å; A281-E283 VanDerWaalsContact C-N 3.31Å; A281-E283 PolarHBondContact O-N 3.21Å
282	T	24.9	Very low	28.9	Very low	142 Å²	142	143.8 Å²	143.8	87%	0.871	76%	0.764	S	S	*	*			trans	-61.1	95.9	156.3	22.3	0	0	0	0	107.8
283	E	26.9	Very low	28.9	Very low	139 Å²	139	144.8 Å²	144.8	65%	0.65	76%	0.764	S	S	*	*			trans	-144.2	89.2	153.7	-143.1	-175.2	-170.1	0	0	108.9	A281 K285	A281-E283 VanDerWaalsContact C-N 3.31Å; A281-E283 PolarHBondContact O-N 3.21Å; E283-K285 VanDerWaalsContact C-N 3.29Å; E283-K285 VanDerWaalsContact CD-CE 3.45Å; E283-K285 HydrophobicContact CG-CG 4.32Å; E283-K285 PolarHBondContact O-N 3.38Å; E283-K285 WeakPolarHBondContact OE1-CE 3.49Å; E283-K285 IonicContact OE1-NZ 2.74Å; E283-K285 PolarHBondContact OE1-NZ 3.06Å; E283-K285 IonicContact OE2-NZ 2.85Å; E283-K285 PolarHBondContact OE2-NZ 3.24Å
284	V	26.9	Very low	28.9	Very low	138 Å²	138	145.6 Å²	145.6	84%	0.836	77%	0.765	S	S	*	*			trans	-71.1	88.9	168.4	179.3	0	0	0	0	106.8
285	K	30.5	Very low	28.6	Very low	121 Å²	121	145.3 Å²	145.3	53%	0.526	76%	0.764	S	S	.	*			trans	-93.9	98.8	163.8	-77.3	-178.1	173.8	140.3	0	108.2	E283 Y287	E283-K285 VanDerWaalsContact C-N 3.29Å; E283-K285 VanDerWaalsContact CD-CE 3.45Å; E283-K285 HydrophobicContact CG-CG 4.32Å; E283-K285 PolarHBondContact O-N 3.38Å; E283-K285 WeakPolarHBondContact OE1-CE 3.49Å; E283-K285 IonicContact OE1-NZ 2.74Å; E283-K285 PolarHBondContact OE1-NZ 3.06Å; E283-K285 IonicContact OE2-NZ 2.85Å; E283-K285 PolarHBondContact OE2-NZ 3.24Å; K285-Y287 HydrophobicContact CB-CD2 4.08Å; K285-Y287 HydrophobicContact CB-CE2 3.89Å; K285-Y287 HydrophobicContact CD-CE2 4.36Å; K285-Y287 PolarHBondContact O-N 3.26Å
286	Q	27.9	Very low	28.4	Very low	187 Å²	187	142.7 Å²	142.7	87%	0.874	76%	0.764	S	S	*	*			trans	-57	102.4	163.2	-82.8	-174.5	-33.4	0	0	108.4
287	Y	26.8	Very low	28.2	Very low	204 Å²	204	138.1 Å²	138.1	80%	0.8	76%	0.763	S	S	*	*			trans	-94.5	121.2	161.5	-84.3	-84.5	0	0	0	108.3	K285	K285-Y287 HydrophobicContact CB-CD2 4.08Å; K285-Y287 HydrophobicContact CB-CE2 3.89Å; K285-Y287 HydrophobicContact CD-CE2 4.36Å; K285-Y287 PolarHBondContact O-N 3.26Å
288	G	26.8	Very low	28.2	Very low	64 Å²	64	139.4 Å²	139.4	66%	0.66	77%	0.766	S	S	*	*			trans	-58.3	147.9	-179.8	0	0	0	0	0	112.1	S290	G288-S290 PolarHBondContact O-N 2.89Å
289	L	30.6	Very low	28.3	Very low	154 Å²	154	139.6 Å²	139.6	81%	0.806	77%	0.773	S	S	*	*			trans	-64.4	91.1	-179.8	-143.5	110.5	0	0	0	109.6	Q291	L289-Q291 HydrophobicContact CD2-CG 4.07Å; L289-Q291 PolarHBondContact O-N 3.31Å
290	S	28.9	Very low	28.3	Very low	108 Å²	108	136 Å²	136	76%	0.755	77%	0.772	S	S	*	*			trans	-69.1	98.9	167.9	-63.6	0	0	0	0	108.3	G288 D292	G288-S290 PolarHBondContact O-N 2.89Å; S290-D292 PolarHBondContact O-N 2.92Å; S290-D292 VanDerWaalsContact O-N 3.08Å
291	Q	32.2	Very low	28.2	Very low	145 Å²	145	140.7 Å²	140.7	68%	0.678	77%	0.772	S	S	*	*			trans	-71	93.3	167.6	-71.1	175.8	3.1	0	0	107.9	L289 I293	L289-Q291 HydrophobicContact CD2-CG 4.07Å; L289-Q291 PolarHBondContact O-N 3.31Å; Q291-I293 VanDerWaalsContact C-N 3.25Å; Q291-I293 HydrophobicContact CB-CG1 4.49Å; Q291-I293 PolarHBondContact O-N 2.96Å
292	D	27.6	Very low	28.3	Very low	145 Å²	145	140.8 Å²	140.8	78%	0.775	77%	0.767	S	S	*	*			trans	-69.1	90.8	164.8	-77.4	-22.3	0	0	0	108	S290 V294	S290-D292 PolarHBondContact O-N 2.92Å; S290-D292 VanDerWaalsContact O-N 3.08Å; D292-V294 VanDerWaalsContact C-N 3.28Å; D292-V294 PolarHBondContact O-N 3.03Å
293	I	30.2	Very low	28.3	Very low	133 Å²	133	139.1 Å²	139.1	68%	0.682	76%	0.757	S	S	*	*			trans	-68.6	90.6	169.9	-60.3	170	0	0	0	106.4	Q291 N295	Q291-I293 VanDerWaalsContact C-N 3.25Å; Q291-I293 HydrophobicContact CB-CG1 4.49Å; Q291-I293 PolarHBondContact O-N 2.96Å; I293-N295 PolarHBondContact O-N 3.25Å
294	V	29.8	Very low	28.3	Very low	124 Å²	124	140.1 Å²	140.1	75%	0.752	77%	0.767	S	S	*	*			trans	-69.6	103.7	170.6	-179.5	0	0	0	0	107.7	D292 T296	D292-V294 VanDerWaalsContact C-N 3.28Å; D292-V294 PolarHBondContact O-N 3.03Å; V294-T296 PolarHBondContact O-N 3.07Å; V294-T296 VanDerWaalsContact O-N 3.11Å
295	N	24.8	Very low	28.3	Very low	139 Å²	139	143.2 Å²	143.2	74%	0.743	77%	0.769	S	S	*	*			trans	-55.6	108	176	-85.8	-31.3	0	0	0	111.3	I293 S297	I293-N295 PolarHBondContact O-N 3.25Å; N295-S297 VanDerWaalsContact C-N 3.31Å; N295-S297 PolarHBondContact O-N 3.01Å; N295-S297 VanDerWaalsContact O-N 3.11Å
296	T	28.7	Very low	28	Very low	137 Å²	137	140.9 Å²	140.9	84%	0.84	78%	0.78	S	S	*	*			trans	-79.7	82	162.3	53.1	0	0	0	0	108.9	V294 K298	V294-T296 PolarHBondContact O-N 3.07Å; V294-T296 VanDerWaalsContact O-N 3.11Å; T296-K298 PolarHBondContact O-N 3.04Å; T296-K298 VanDerWaalsContact O-N 3.14Å
297	S	29	Very low	28.2	Very low	103 Å²	103	137.4 Å²	137.4	72%	0.72	78%	0.776	S	S	*	*			trans	-72.8	102.9	170.1	54.2	0	0	0	0	109.9	N295 L299	N295-S297 VanDerWaalsContact C-N 3.31Å; N295-S297 PolarHBondContact O-N 3.01Å; N295-S297 VanDerWaalsContact O-N 3.11Å; S297-L299 PolarHBondContact O-N 2.74Å
298	K	29.3	Very low	28.1	Very low	203 Å²	203	136.2 Å²	136.2	88%	0.883	78%	0.783	S	S	*	*			trans	-0.7	105.6	151.5	-58.6	177.5	-179.1	-179.9	0	115.4	T296	T296-K298 PolarHBondContact O-N 3.04Å; T296-K298 VanDerWaalsContact O-N 3.14Å
299	L	29.3	Very low	28.2	Very low	181 Å²	181	137.9 Å²	137.9	95%	0.948	79%	0.785	S	S	*	*			trans	-92.7	103	151.4	-80.4	166.2	0	0	0	106.9	S297	S297-L299 PolarHBondContact O-N 2.74Å
300	S	29.7	Very low	28	Very low	111 Å²	111	135.8 Å²	135.8	78%	0.776	78%	0.783	S	S	*	*			trans	-69.8	127	178.9	45.9	0	0	0	0	111.2	S302	S300-S302 PolarHBondContact O-N 3.01Å
301	E	24.3	Very low	27.9	Very low	178 Å²	178	138 Å²	138	83%	0.832	79%	0.786	S	S	*	*			trans	-59.9	113.6	170.1	-171.2	174.1	-171.9	0	0	110.8	T303	E301-T303 HydrophobicContact CG-CG2 4.42Å
302	S	28.3	Very low	27.5	Very low	101 Å²	101	139 Å²	139	71%	0.706	79%	0.79	S	S	*	*			trans	-96.2	95.1	169.7	51.8	0	0	0	0	109.7	S300 N304	S300-S302 PolarHBondContact O-N 3.01Å; S302-N304 PolarHBondContact O-N 3.14Å
303	T	25.3	Very low	27.5	Very low	106 Å²	106	138.2 Å²	138.2	65%	0.65	80%	0.795	S	S	*	*			trans	-71.2	88.3	166.5	45.9	0	0	0	0	110	E301 K305	E301-T303 HydrophobicContact CG-CG2 4.42Å; T303-K305 PolarHBondContact O-N 3.43Å
304	N	27.9	Very low	27.5	Very low	160 Å²	160	138.7 Å²	138.7	86%	0.856	80%	0.799	S	S	*	*			trans	-83.5	93.2	165	-78.1	-21.7	0	0	0	109.1	S302	S302-N304 PolarHBondContact O-N 3.14Å
305	K	27.1	Very low	27.2	Very low	203 Å²	203	141 Å²	141	88%	0.883	80%	0.801	S	S	*	*			trans	-84.4	123	161.6	-73.9	-82	-175.1	176.6	0	107.8	T303	T303-K305 PolarHBondContact O-N 3.43Å
306	G	24.3	Very low	27.3	Very low	73 Å²	73	139.2 Å²	139.2	75%	0.753	80%	0.8	S	S	*	*			trans	118.6	100	159.8	0	0	0	0	0	115
307	S	30.3	Very low	27.3	Very low	114 Å²	114	138.8 Å²	138.8	80%	0.797	80%	0.797	S	S	*	*				-173.6	100	127.1	22.6	0	0	0	0	108	S309	S307-S309 PolarHBondContact O-N 2.76Å; S307-S309 VanDerWaalsContact O-N 3.08Å
308	D	25.9	Very low	27.1	Very low	179 Å²	179	141.3 Å²	141.3	96%	0.957	80%	0.803	S	S	*	*			trans	-57.3	106.1	162.4	-69.6	-47.6	0	0	0	108.3
309	S	28.1	Very low	27.1	Very low	98 Å²	98	139 Å²	139	69%	0.685	80%	0.798	S	S	*	*			trans	-113.6	98	160.2	51.2	0	0	0	0	107.8	S307 L311	S307-S309 PolarHBondContact O-N 2.76Å; S307-S309 VanDerWaalsContact O-N 3.08Å; S309-L311 VanDerWaalsContact C-N 3.32Å; S309-L311 PolarHBondContact O-N 3.07Å
310	S	26.6	Very low	27	Very low	110 Å²	110	134.7 Å²	134.7	77%	0.769	79%	0.789	S	S	*	*			trans	-58.3	90.6	166.4	162.6	0	0	0	0	109.1	Q312	S310-Q312 PolarHBondContact O-N 3.37Å
311	L	27.4	Very low	26.8	Very low	156 Å²	156	136.9 Å²	136.9	82%	0.817	79%	0.792	S	S	*	*			trans	-82	99.9	164.9	-74.1	174.8	0	0	0	108.2	S309 C313	S309-L311 VanDerWaalsContact C-N 3.32Å; S309-L311 PolarHBondContact O-N 3.07Å; L311-C313 PolarHBondContact O-N 3.1Å
312	Q	24	Very low	27	Very low	164 Å²	164	133.3 Å²	133.3	77%	0.766	79%	0.787	S	S	*	*			trans	-43	121.4	166.9	-83.5	171.8	-68.3	0	0	110.2	S310 N314	S310-Q312 PolarHBondContact O-N 3.37Å; Q312-N314 PolarHBondContact O-N 2.84Å
313	C	27.2	Very low	27	Very low	130 Å²	130	133.6 Å²	133.6	88%	0.878	79%	0.789	S	S	*	*			trans	-72	108.8	162.4	-64.7	0	0	0	0	107.1	L311 E315	L311-C313 PolarHBondContact O-N 3.1Å; C313-E315 PolarHBondContact O-N 2.79Å
314	N	29.2	Very low	27.2	Very low	143 Å²	143	135.4 Å²	135.4	77%	0.765	80%	0.795	S	S	*	*			trans	-68	114.2	171.4	-65.9	-28	0	0	0	109.1	Q312	Q312-N314 PolarHBondContact O-N 2.84Å
315	E	23.8	Very low	27.1	Very low	171 Å²	171	133 Å²	133	80%	0.799	79%	0.79	S	S	*	*				31.1	108	129.7	-156.4	166.4	-177.7	0	0	118.6	C313	C313-E315 PolarHBondContact O-N 2.79Å
316	S	28	Very low	27.3	Very low	102 Å²	102	129.9 Å²	129.9	71%	0.713	79%	0.788	S	S	*	*				40	104.7	128.4	-34.9	0	0	0	0	118.8
317	T	27.5	Very low	27.6	Very low	128 Å²	128	132.8 Å²	132.8	79%	0.785	79%	0.786	S	S	*	*			trans	-109.6	104.2	151.1	-37.8	0	0	0	0	108.6	I319	T317-I319 HydrophobicContact CG2-CG1 4.38Å; T317-I319 PolarHBondContact O-N 3.35Å
318	D	24.9	Very low	27.6	Very low	156 Å²	156	132.7 Å²	132.7	83%	0.834	78%	0.783	S	S	*	*			trans	-60.4	114.6	164.2	-70.5	-48.4	0	0	0	109.2
319	I	29.5	Very low	27.8	Very low	154 Å²	154	129.9 Å²	129.9	79%	0.79	78%	0.776	S	S	*	*			trans	-119.6	117.9	159.5	-59.1	-179.5	0	0	0	107.6	T317	T317-I319 HydrophobicContact CG2-CG1 4.38Å; T317-I319 PolarHBondContact O-N 3.35Å
320	A	28.7	Very low	27.7	Very low	92 Å²	92	132.1 Å²	132.1	76%	0.76	78%	0.78	S	S	*	*			trans	-57	142.7	-169.8	0	0	0	0	0	114.1	S322	A320-S322 PolarHBondContact O-N 3.47Å
321	N	24.4	Very low	27.9	Very low	156 Å²	156	134.3 Å²	134.3	83%	0.834	78%	0.783	S	S	*	*			trans	-56.6	123	162	-60.5	-51.7	0	0	0	109.9
322	S	29.6	Very low	27.8	Very low	103 Å²	103	133.1 Å²	133.1	72%	0.72	78%	0.782	S	S	*	*			trans	-112.4	108.7	156.1	-176.6	0	0	0	0	107.5	A320	A320-S322 PolarHBondContact O-N 3.47Å
323	S	28.2	Very low	28	Very low	107 Å²	107	128.8 Å²	128.8	75%	0.748	78%	0.782	S	S	*	*			trans	-98.1	96.7	175.3	-58.3	0	0	0	0	107.8
324	D	29	Very low	27.9	Very low	145 Å²	145	130.8 Å²	130.8	78%	0.775	78%	0.779	S	S	*	*			trans	-99.3	95.8	164.3	-77.5	-33.6	0	0	0	108.5	V326	D324-V326 PolarHBondContact O-N 2.84Å
325	S	25.7	Very low	27.8	Very low	110 Å²	110	131.8 Å²	131.8	77%	0.769	78%	0.783	S	S	*	*			trans	-65.5	117.9	164.6	55.8	0	0	0	0	109.2
326	V	31.4	Very low	27.9	Very low	136 Å²	136	128.4 Å²	128.4	82%	0.824	78%	0.777	S	S	*	*			trans	-112.2	110.8	163.6	-176.5	0	0	0	0	107.3	D324	D324-V326 PolarHBondContact O-N 2.84Å
327	D	29.3	Very low	27.7	Very low	135 Å²	135	128.4 Å²	128.4	72%	0.722	78%	0.784	S	S	*	*			trans	-61	142.1	-178.9	-82.6	-46.9	0	0	0	112.7	C329	D327-C329 PolarHBondContact O-N 2.92Å
328	P	32.2	Very low	27.7	Very low	111 Å²	111	128 Å²	128	72%	0.721	78%	0.78	S	S	*	*			trans	-73.8	112.1	177.6	28.2	-31.9	0	0	0	111.5	N330	P328-N330 PolarHBondContact O-N 2.9Å
329	C	28.4	Very low	27.8	Very low	120 Å²	120	128.4 Å²	128.4	81%	0.811	78%	0.782	S	S	*	*			trans	-69.1	99.2	172.1	-74.3	0	0	0	0	111.3	D327 N331	D327-C329 PolarHBondContact O-N 2.92Å; C329-N331 PolarHBondContact O-N 2.69Å
330	N	26.6	Very low	27.8	Very low	145 Å²	145	127 Å²	127	78%	0.775	78%	0.781	S	S	*	*			trans	-77.9	89.2	164.7	-86.3	-26.8	0	0	0	110.4	P328	P328-N330 PolarHBondContact O-N 2.9Å
331	N	30.5	Very low	27.5	Very low	157 Å²	157	130.8 Å²	130.8	84%	0.84	79%	0.788	S	S	*	*			trans	-102.9	90.2	165.1	-78.5	-6.2	0	0	0	110.1	C329 G333	C329-N331 PolarHBondContact O-N 2.69Å; N331-G333 PolarHBondContact O-N 2.75Å
332	T	26.5	Very low	27.5	Very low	130 Å²	130	126.9 Å²	126.9	80%	0.798	78%	0.784	S	S	*	*			trans	-72.7	96.3	162	-57.9	0	0	0	0	107.7
333	G	27.9	Very low	27.3	Very low	74 Å²	74	131.7 Å²	131.7	76%	0.763	79%	0.793	S	S	*	*			trans	-119.7	80.3	174	0	0	0	0	0	110.3	N331 L335	N331-G333 PolarHBondContact O-N 2.75Å; G333-L335 PolarHBondContact O-N 3Å
334	Q	24.2	Very low	27.3	Very low	172 Å²	172	132.4 Å²	132.4	80%	0.804	80%	0.798	S	S	*	*			trans	-63	119.7	161.3	-72.5	173.9	0	0	0	108.2
335	L	26.7	Very low	27.1	Very low	163 Å²	163	134.2 Å²	134.2	85%	0.853	80%	0.799	S	S	*	*			trans	-151.4	116.2	151.1	-78.8	-172.3	0	0	0	112.2	G333	G333-L335 PolarHBondContact O-N 3Å
336	C	26.3	Very low	27	Very low	100 Å²	100	137.7 Å²	137.7	68%	0.676	80%	0.803	S	S	*	*			trans	69.4	90.7	138.2	-62	0	0	0	0	119.8	V338	C336-V338 HydrophobicContact CB-CG2 4.27Å; C336-V338 PolarHBondContact O-N 3.33Å
337	A	24.1	Very low	26.8	Very low	103 Å²	103	136.6 Å²	136.6	85%	0.851	80%	0.797	S	S	*	*			trans	-65.5	109.7	142.9	0	0	0	0	0	109.3
338	V	28.3	Very low	26.6	Very low	119 Å²	119	138.5 Å²	138.5	72%	0.721	80%	0.801	S	S	*	*			trans	-101	102.4	169.1	178.3	0	0	0	0	107.6	C336	C336-V338 HydrophobicContact CB-CG2 4.27Å; C336-V338 PolarHBondContact O-N 3.33Å
339	L	26.4	Very low	26.6	Very low	164 Å²	164	139.2 Å²	139.2	86%	0.859	80%	0.804	S	S	*	*			trans	-87.4	118.3	162.3	-75	162.1	0	0	0	107.4
340	T	29.7	Very low	26.5	Very low	126 Å²	126	140.4 Å²	140.4	77%	0.773	80%	0.802	S	S	*	*			trans	-151.5	109.6	155.4	40.3	0	0	0	0	109.8
341	D	22.3	Very low	26.6	Very low	171 Å²	171	142.8 Å²	142.8	91%	0.914	81%	0.808	S	S	*	*			trans	-57.4	148.3	158.5	-69.4	-49.8	0	0	0	111.2
342	G	25	Very low	26.4	Very low	73 Å²	73	145.4 Å²	145.4	75%	0.753	81%	0.812	S	S	*	*			trans	170.1	91.4	171.8	0	0	0	0	0	114.7
343	F	24.3	Very low	26.4	Very low	205 Å²	205	145.2 Å²	145.2	90%	0.899	82%	0.815	S	S	*	*			trans	-36.7	136.1	168.8	-70.4	-100.2	0	0	0	115.4
344	S	28.9	Very low	26.4	Very low	122 Å²	122	145 Å²	145	85%	0.853	81%	0.812	S	S	*	*			trans	-145.7	117.6	148.7	-170.9	0	0	0	0	110.3
345	K	23.5	Very low	26.4	Very low	182 Å²	182	146.7 Å²	146.7	79%	0.791	82%	0.817	S	S	*	*			trans	-102.5	128.9	169.1	-74.3	-173.4	174.7	-174.9	0	107.4
346	Q	23.7	Very low	26.6	Very low	183 Å²	183	149.2 Å²	149.2	86%	0.855	82%	0.821	S	S	*	*			trans	147.1	136.3	162.5	-92.2	168	3.7	0	0	106.2
347	T	29	Very low	26.6	Very low	114 Å²	114	149.3 Å²	149.3	70%	0.699	82%	0.823	S	S	*	*			cis	-159.6	141.4	21.3	9.3	0	0	0	0	106.8	T349	T347-T349 PolarHBondContact O-N 2.81Å
348	E	24.7	Very low	26.8	Very low	174 Å²	174	149.3 Å²	149.3	81%	0.813	82%	0.817	S	S	*	*			trans	-56.1	116.6	163.8	-171.3	171.7	-159.3	0	0	109.6
349	T	31.2	Very low	26.9	Very low	126 Å²	126	151.7 Å²	151.7	77%	0.773	83%	0.825	S	S	*	*			trans	-114.6	99.9	165	48.7	0	0	0	0	108.4	T347 Q351	T347-T349 PolarHBondContact O-N 2.81Å; T349-Q351 PolarHBondContact O-N 2.66Å
350	D	26.2	Very low	27.1	Very low	146 Å²	146	153.2 Å²	153.2	78%	0.781	82%	0.824	S	S	*	*			trans	-53.8	108.3	161.8	-77.5	-48.3	0	0	0	110.3
351	Q	30.1	Very low	27.1	Very low	194 Å²	194	156.2 Å²	156.2	91%	0.907	83%	0.827	S	S	*	*			trans	-114.1	88.5	162.8	-129.5	178.5	47.2	0	0	109.7	T349	T349-Q351 PolarHBondContact O-N 2.66Å
352	K	25.7	Very low	27.4	Very low	213 Å²	213	152.9 Å²	152.9	93%	0.926	82%	0.823	S	S	*	*			trans	-87.3	100	171.2	-144.5	-179.6	-167.3	174	0	108
353	C	26.3	Very low	27.5	Very low	126 Å²	126	155.9 Å²	155.9	85%	0.851	82%	0.821	S	S	*	*			trans	-149.8	114.4	165.7	-155.2	0	0	0	0	105.9
354	G	27.5	Very low	28	Very low	68 Å²	68	154 Å²	154	70%	0.701	82%	0.821	S	S	*	*			cis	117.1	83.3	49.8	0	0	0	0	0	107.5
355	K	24.2	Very low	28	Very low	208 Å²	208	158.1 Å²	158.1	90%	0.904	82%	0.823	S	S	*	*			trans	9.2	119.3	161.4	-62.8	173.3	179.1	176.4	0	117.6
356	K	31.3	Very low	28.3	Very low	216 Å²	216	158.5 Å²	158.5	94%	0.939	83%	0.83	S	S	*	*			trans	-130.5	142.3	143.2	-79.4	-171.3	-179	175.4	0	111.1
357	S	26.8	Very low	28.5	Very low	103 Å²	103	158.7 Å²	158.7	72%	0.72	83%	0.831	S	S	*	*			trans	-88.4	169.6	-161.5	50.8	0	0	0	0	113.7
358	S	27	Very low	28.4	Very low	102 Å²	102	161.1 Å²	161.1	71%	0.713	83%	0.834	S	S	*	*			trans	70.5	101	139.7	58.5	0	0	0	0	118.6
359	L	31.7	Very low	28.7	Very low	170 Å²	170	162.9 Å²	162.9	89%	0.89	84%	0.839	S	S	*	*			trans	-140.6	104.3	138.5	-118.6	134.8	0	0	0	111.6
360	K	30.4	Very low	28.6	Very low	195 Å²	195	161.6 Å²	161.6	85%	0.848	83%	0.831	S	S	*	*			trans	27.7	115.3	151.5	-74.4	175	172.4	176.9	0	120
361	K	28.3	Very low	28.9	Very low	190 Å²	190	163.3 Å²	163.3	83%	0.826	83%	0.834	S	S	*	*			trans	-47	130.7	149	-71.8	172	171.5	176.2	0	111.7
362	A	30.1	Very low	28.7	Very low	101 Å²	101	163.6 Å²	163.6	84%	0.835	83%	0.827	S	S	*	*			trans	-117.3	103.6	150.2	0	0	0	0	0	107.1
363	N	27.7	Very low	29	Very low	135 Å²	135	161.8 Å²	161.8	72%	0.722	83%	0.827	S	S	*	*			trans	-81.2	121.1	171.4	-72.9	-27.8	0	0	0	107.7
364	N	32.9	Very low	29	Very low	165 Å²	165	163.5 Å²	163.5	88%	0.882	82%	0.822	S	S	*	*			trans	-118.7	110.9	155	-83.7	-20.8	0	0	0	108.3
365	K	29.6	Very low	29	Very low	210 Å²	210	169.4 Å²	169.4	91%	0.913	83%	0.832	S	S	*	*			trans	-62.8	132.5	166.8	-75	172.7	167	-177	0	108.5
366	M	29.6	Very low	29.2	Very low	189 Å²	189	163.4 Å²	163.4	93%	0.931	83%	0.828	S	S	*	*			trans	-133.9	129.9	153.4	-173.4	170.3	143.5	0	0	107.9
367	E	29.2	Very low	28.7	Very low	187 Å²	187	157 Å²	157	87%	0.874	82%	0.824	S	S	*	*			trans	-66.1	142.4	-163.5	-78.4	166.8	129	0	0	114.8
368	E	26.8	Very low	28.8	Very low	165 Å²	165	161.4 Å²	161.4	77%	0.771	83%	0.833	S	S	*	*			trans	-67.9	119.6	162.6	179.6	-178.3	176	0	0	110.3	V370	E368-V370 HydrophobicContact CG-CB 4.33Å; E368-V370 HydrophobicContact CG-CG2 3.54Å; E368-V370 WeakPolarHBondContact OE1-CG2 3.15Å
369	K	29.5	Very low	28.9	Very low	212 Å²	212	166.1 Å²	166.1	92%	0.922	84%	0.841	S	S	*	*			trans	-107.6	90.6	158.1	-105.7	-173.3	175.6	-172.8	0	108
370	V	29.4	Very low	28.7	Very low	98 Å²	98	163 Å²	163	59%	0.594	83%	0.833	S	S	*	*			trans	-89.1	97.5	166	168.2	0	0	0	0	106.6	E368 R372	E368-V370 HydrophobicContact CG-CB 4.33Å; E368-V370 HydrophobicContact CG-CG2 3.54Å; E368-V370 WeakPolarHBondContact OE1-CG2 3.15Å; V370-R372 HydrophobicContact CG1-CG 4.21Å
371	E	32.3	Very low	28.8	Very low	182 Å²	182	161.5 Å²	161.5	85%	0.85	84%	0.835	S	S	*	*			trans	-98.8	111.5	164.4	-162.1	166.2	-167.8	0	0	107.8
372	R	27.3	Very low	28.8	Very low	201 Å²	201	158.1 Å²	158.1	76%	0.758	84%	0.835	S	S	*	*			trans	-73	121.9	176.9	-64.5	172.9	178.3	168.1	-2.5	108.4	V370	V370-R372 HydrophobicContact CG1-CG 4.21Å
373	L	30.5	Very low	28.8	Very low	175 Å²	175	157.6 Å²	157.6	92%	0.916	83%	0.825	S	S	*	*			trans	-121.1	102.2	151.9	-80.2	170.2	0	0	0	106.9
374	E	27.5	Very low	28.9	Very low	161 Å²	161	157.7 Å²	157.7	75%	0.752	83%	0.831	S	S	*	*			trans	-78.3	163.5	168.3	-63.5	-176.9	146.3	0	0	110.1
375	E	27.7	Very low	29	Very low	193 Å²	193	158.2 Å²	158.2	90%	0.902	83%	0.825	S	S	*	*			trans	79.8	102.8	160.5	-56	-167.6	156	0	0	118.3
376	G	27.4	Very low	28.9	Very low	81 Å²	81	156 Å²	156	84%	0.835	82%	0.818	S	S	*	*			trans	176.5	48.1	168.1	0	0	0	0	0	112.8	E378	G376-E378 PolarHBondContact O-N 2.75Å
377	G	20.5	Very low	28.9	Very low	83 Å²	83	153.6 Å²	153.6	86%	0.856	81%	0.808	S	S	*	*			trans	-83.9	97.2	171.3	0	0	0	0	0	110.6
378	E	29.5	Very low	28.9	Very low	195 Å²	195	153.4 Å²	153.4	91%	0.911	80%	0.804	S	S	*	*			trans	-132.7	151.2	161.1	-82	-164.8	153.6	0	0	111.6	G376	G376-E378 PolarHBondContact O-N 2.75Å
379	K	29.9	Very low	29	Very low	200 Å²	200	154.6 Å²	154.6	87%	0.87	81%	0.807	S	S	*	*			trans	-76.1	153.4	-153.2	-69.8	160	174.9	168.8	0	113.6
380	S	26.6	Very low	28.9	Very low	104 Å²	104	149 Å²	149	73%	0.727	80%	0.795	S	S	*	*			trans	-28.9	132.4	158.7	51.1	0	0	0	0	116.1
381	D	33.1	Very low	28.8	Very low	164 Å²	164	152.2 Å²	152.2	88%	0.877	80%	0.804	S	S	*	*			trans	-152	96.2	138.4	-94.4	-29.4	0	0	0	109.8	S383	D381-S383 PolarHBondContact O-N 3.17Å; D381-S383 VanDerWaalsContact O-N 3.07Å
382	S	28.2	Very low	28.6	Very low	120 Å²	120	150.7 Å²	150.7	84%	0.839	80%	0.801	S	S	*	*			trans	-72.4	90	167.1	56.1	0	0	0	0	109.1
383	S	30.4	Very low	28.6	Very low	90 Å²	90	151 Å²	151	63%	0.629	80%	0.802	S	S	*	*			trans	-99.5	99	168.3	-172.6	0	0	0	0	109.8	D381 K385	D381-S383 PolarHBondContact O-N 3.17Å; D381-S383 VanDerWaalsContact O-N 3.07Å; S383-K385 VanDerWaalsContact C-N 3.28Å; S383-K385 PolarHBondContact O-N 2.87Å
384	T	29.4	Very low	28.6	Very low	137 Å²	137	148.1 Å²	148.1	84%	0.84	80%	0.797	S	S	*	*			trans	-60.3	88.8	166.2	-37.1	0	0	0	0	108.4	H386	T384-H386 VanDerWaalsContact C-N 3.34Å; T384-H386 PolarHBondContact O-N 2.86Å
385	K	34.2	Very low	28.6	Very low	176 Å²	176	146.3 Å²	146.3	77%	0.765	80%	0.797	S	S	*	*			trans	-71.6	93.1	175.6	-69.8	-177.2	-176.5	176.7	0	109	S383 L387	S383-K385 VanDerWaalsContact C-N 3.28Å; S383-K385 PolarHBondContact O-N 2.87Å; K385-L387 PolarHBondContact O-N 2.96Å
386	H	27.8	Very low	28.7	Very low	162 Å²	162	141.2 Å²	141.2	75%	0.75	79%	0.788	S	S	*	*			trans	-55.8	99	165.9	-167	-68.8	0	0	0	108.7	T384 K388	T384-H386 VanDerWaalsContact C-N 3.34Å; T384-H386 PolarHBondContact O-N 2.86Å; H386-K388 PolarHBondContact O-N 3.27Å
387	L	29.4	Very low	28.7	Very low	139 Å²	139	145.4 Å²	145.4	73%	0.728	79%	0.786	S	S	*	*			trans	-62.7	99.2	171.5	-89.5	107	0	0	0	108.5	K385 F389	K385-L387 PolarHBondContact O-N 2.96Å; L387-F389 PolarHBondContact O-N 3.48Å
388	K	28.6	Very low	29.2	Very low	184 Å²	184	148.3 Å²	148.3	80%	0.8	78%	0.78	S	S	*	*			trans	-70.9	105.1	165.9	-82.4	-179.4	175.7	177.1	0	107.7	H386 S390	H386-K388 PolarHBondContact O-N 3.27Å; K388-S390 PolarHBondContact O-N 2.9Å; K388-S390 VanDerWaalsContact O-N 3.11Å
389	F	29.2	Very low	29.1	Very low	189 Å²	189	147.2 Å²	147.2	83%	0.829	77%	0.773	S	S	*	*			trans	-64	107.3	161.1	-70.2	-82.1	0	0	0	107.9	L387 E391	L387-F389 PolarHBondContact O-N 3.48Å; F389-E391 PolarHBondContact O-N 3.27Å; F389-E391 VanDerWaalsContact O-N 3.14Å
390	S	28.7	Very low	28.9	Very low	96 Å²	96	142.7 Å²	142.7	67%	0.671	77%	0.765	S	S	*	*			trans	-70.7	101.9	166.8	54.1	0	0	0	0	107.8	K388 N392	K388-S390 PolarHBondContact O-N 2.9Å; K388-S390 VanDerWaalsContact O-N 3.11Å; S390-N392 PolarHBondContact O-N 3.09Å
391	E	27.4	Very low	29.2	Very low	165 Å²	165	143.4 Å²	143.4	77%	0.771	76%	0.761	S	S	*	*			trans	-66.8	98.2	170.3	-155.2	177	-157.5	0	0	107.6	F389 R393	F389-E391 PolarHBondContact O-N 3.27Å; F389-E391 VanDerWaalsContact O-N 3.14Å; E391-R393 PolarHBondContact O-N 2.9Å
392	N	26.2	Very low	29.3	Very low	150 Å²	150	143.1 Å²	143.1	80%	0.802	76%	0.759	S	S	*	*			trans	-66.4	82.7	172.7	-74.8	-22.1	0	0	0	108.7	S390 S394	S390-N392 PolarHBondContact O-N 3.09Å; N392-S394 PolarHBondContact O-N 2.91Å
393	R	28.5	Very low	29.1	Very low	206 Å²	206	143.5 Å²	143.5	78%	0.777	76%	0.76	S	S	*	*			trans	-66.2	111.4	164	-89.7	-175.9	174.4	176.9	-1.5	107.9	E391 T395	E391-R393 PolarHBondContact O-N 2.9Å; R393-T395 PolarHBondContact O-N 2.96Å
394	S	29.8	Very low	29.2	Very low	116 Å²	116	150 Å²	150	81%	0.811	77%	0.771	S	S	*	*			trans	-62.1	108.2	166	43.8	0	0	0	0	108.8	N392 A396	N392-S394 PolarHBondContact O-N 2.91Å; S394-A396 VanDerWaalsContact C-N 3.27Å; S394-A396 PolarHBondContact O-N 2.7Å
395	T	27.9	Very low	29.3	Very low	123 Å²	123	150.8 Å²	150.8	76%	0.755	77%	0.77	S	S	*	*			trans	-64.6	84.2	172.8	-42.6	0	0	0	0	109.2	R393 Q397	R393-T395 PolarHBondContact O-N 2.96Å; T395-Q397 HydrophobicContact CG2-CG 4.15Å; T395-Q397 PolarHBondContact O-N 2.94Å
396	A	29	Very low	28.8	Very low	85 Å²	85	147.7 Å²	147.7	70%	0.702	77%	0.769	S	S	*	*			trans	-71	90	162.1	0	0	0	0	0	107.5	S394 I398	S394-A396 VanDerWaalsContact C-N 3.27Å; S394-A396 PolarHBondContact O-N 2.7Å; A396-I398 VanDerWaalsContact C-N 3.26Å; A396-I398 PolarHBondContact O-N 3.28Å
397	Q	27.9	Very low	28.9	Very low	170 Å²	170	147.5 Å²	147.5	79%	0.794	77%	0.774	S	S	*	*			trans	-62.1	87.6	167.3	-77.9	-173.9	5.9	0	0	109	T395 K399	T395-Q397 HydrophobicContact CG2-CG 4.15Å; T395-Q397 PolarHBondContact O-N 2.94Å; Q397-K399 PolarHBondContact O-N 3.02Å
398	I	31.2	Very low	29	Very low	143 Å²	143	147.5 Å²	147.5	73%	0.733	77%	0.774	S	S	*	*			trans	-85.3	100.1	160.7	-58.6	178	0	0	0	106	A396 C400	A396-I398 VanDerWaalsContact C-N 3.26Å; A396-I398 PolarHBondContact O-N 3.28Å; I398-C400 VanDerWaalsContact C-N 3.31Å; I398-C400 PolarHBondContact O-N 3.06Å
399	K	27.9	Very low	28.9	Very low	173 Å²	173	144.5 Å²	144.5	75%	0.752	78%	0.777	S	S	*	*			trans	-57	86.7	175.6	-134.9	178.1	-173.6	178.6	0	109.6	Q397 N401	Q397-K399 PolarHBondContact O-N 3.02Å; K399-N401 PolarHBondContact O-N 3.04Å; K399-N401 VanDerWaalsContact O-N 3.16Å
400	C	26.1	Very low	28.9	Very low	105 Å²	105	142.5 Å²	142.5	71%	0.709	77%	0.77	S	S	*	*			trans	-82.5	85.8	170.1	-71.6	0	0	0	0	108.5	I398	I398-C400 VanDerWaalsContact C-N 3.31Å; I398-C400 PolarHBondContact O-N 3.06Å
401	N	32.3	Very low	28.7	Very low	119 Å²	119	143.6 Å²	143.6	64%	0.636	78%	0.777	S	S	*	*			trans	-76.3	124.2	169.2	-68	-15	0	0	0	108.5	K399	K399-N401 PolarHBondContact O-N 3.04Å; K399-N401 VanDerWaalsContact O-N 3.16Å
402	N	34.6	Very low	28.9	Very low	157 Å²	157	141 Å²	141	84%	0.84	77%	0.772	S	S	*	*			trans	87.4	64.3	166.8	-52.2	-20.6	0	0	0	117	R404	N402-R404 PolarHBondContact O-N 2.81Å
403	C	24.1	Very low	28.8	Very low	128 Å²	128	142 Å²	142	87%	0.865	77%	0.772	S	S	*	*			trans	-77.4	106.4	146.9	-76.9	0	0	0	0	108.7
404	R	34.1	Very low	28.8	Very low	228 Å²	228	143.5 Å²	143.5	86%	0.86	78%	0.778	S	S	*	*			trans	-123.1	116.3	162.8	-150.5	173.8	-166.1	176.2	3.7	108	N402	N402-R404 PolarHBondContact O-N 2.81Å
405	N	31.2	Very low	28.6	Very low	153 Å²	153	144.1 Å²	144.1	82%	0.818	77%	0.772	S	S	*	*			trans	75.9	87.8	165.8	-61	-4	0	0	0	117.5
406	C	24.1	Very low	28.4	Very low	111 Å²	111	145.5 Å²	145.5	75%	0.75	77%	0.774	S	S	*	*			trans	-64.8	156.1	146.7	-55	0	0	0	0	110.6
407	N	28.8	Very low	28.5	Very low	158 Å²	158	147.7 Å²	147.7	85%	0.845	78%	0.781	S	S	*	*			trans	89.7	85.7	165.2	-49.4	-19.2	0	0	0	116.5
408	N	31.3	Very low	28.4	Very low	138 Å²	138	151.2 Å²	151.2	74%	0.738	79%	0.787	S	S	*	*				-153.7	102.5	129.5	-147.7	0.2	0	0	0	111.5	Q410	N408-Q410 PolarHBondContact O-N 2.79Å
409	S	26.5	Very low	28	Very low	122 Å²	122	153.4 Å²	153.4	85%	0.853	79%	0.794	S	S	*	*			trans	-73.3	93	160.2	51.2	0	0	0	0	108.6
410	Q	29.4	Very low	28.2	Very low	147 Å²	147	151.8 Å²	151.8	69%	0.687	80%	0.799	S	S	*	*			trans	-151.1	111.6	161.4	-136.1	166.4	12.9	0	0	111.4	N408 V412	N408-Q410 PolarHBondContact O-N 2.79Å; Q410-V412 PolarHBondContact O-N 2.97Å
411	S	24.6	Very low	28.2	Very low	118 Å²	118	151.7 Å²	151.7	83%	0.825	80%	0.797	S	S	*	*			trans	-55	110.3	164.4	51.8	0	0	0	0	109.5
412	V	32.4	Very low	28	Very low	110 Å²	110	153.8 Å²	153.8	67%	0.667	81%	0.806	S	S	*	*			trans	-115.2	98.4	168.2	-179.6	0	0	0	0	107.6	Q410 R414	Q410-V412 PolarHBondContact O-N 2.97Å; V412-R414 PolarHBondContact O-N 3.38Å; V412-R414 VanDerWaalsContact O-N 3.16Å
413	H	23.6	Very low	27.6	Very low	173 Å²	173	150 Å²	150	80%	0.801	80%	0.804	S	S	*	*			trans	-54.2	111.6	157.6	-110.3	-87.7	0	0	0	107.9
414	R	27.2	Very low	27.7	Very low	236 Å²	236	152.9 Å²	152.9	89%	0.891	81%	0.805	S	S	*	*			trans	-98	111.3	166.6	-109.9	-178.5	179.2	163.3	0.4	109	V412	V412-R414 PolarHBondContact O-N 3.38Å; V412-R414 VanDerWaalsContact O-N 3.16Å
415	N	26.7	Very low	27.6	Very low	129 Å²	129	150.5 Å²	150.5	69%	0.69	80%	0.801	S	S	*	*			trans	-68.4	139.8	172.9	-70.6	-61.6	0	0	0	111.7
416	L	23.1	Very low	27.6	Very low	153 Å²	153	150.8 Å²	150.8	80%	0.801	80%	0.798	S	S	*	*			trans	33	118.7	142.5	-72.1	147.8	0	0	0	119.9
417	P	30.8	Very low	27.8	Very low	131 Å²	131	152.4 Å²	152.4	85%	0.851	80%	0.803	S	S	*	*			trans	-88.1	119.4	148.4	17.4	-1.7	0	0	0	111.7
418	R	27	Very low	28	Very low	243 Å²	243	148.4 Å²	148.4	92%	0.917	80%	0.8	S	S	*	*			trans	1.9	135.5	153.8	-71.9	173.9	172.7	173.2	-3.7	121
419	Q	23.3	Very low	27.8	Very low	189 Å²	189	151.2 Å²	151.2	88%	0.883	81%	0.809	S	S	*	*			trans	-63.1	149.2	156.7	-63.6	165.8	1.6	0	0	112.8
420	V	30.4	Very low	28.3	Very low	139 Å²	139	150 Å²	150	84%	0.842	81%	0.806	S	S	*	*			trans	-143.3	133.3	144.1	-179.1	0	0	0	0	108.7
421	P	26	Very low	28.5	Very low	103 Å²	103	152.5 Å²	152.5	67%	0.669	82%	0.815	S	S	*	*			trans	-102.4	175.5	-175.2	36.8	-26.2	0	0	0	113.1
422	I	28.1	Very low	29	Very low	163 Å²	163	152.9 Å²	152.9	84%	0.836	81%	0.814	S	S	*	*			trans	141.3	115.7	141.3	-69.4	152.6	0	0	0	110.6
423	G	28.1	Very low	29.3	Very low	78 Å²	78	156 Å²	156	80%	0.804	83%	0.826	S	S	*	*			trans	-179.5	64.6	174	0	0	0	0	0	109.5
424	Q	26.3	Very low	29.8	Very low	189 Å²	189	152.6 Å²	152.6	88%	0.883	82%	0.822	S	S	*	*			trans	-77.7	128.4	174.1	-66.9	177.4	-56.8	0	0	109.6
425	K	30.8	Very low	30.1	Very low	178 Å²	178	146.9 Å²	146.9	77%	0.774	81%	0.813	S	S	*	*			trans	-156	116.1	150	-119.7	179.5	178.5	-175.2	0	111.3
426	E	31.3	Very low	30.4	Very low	159 Å²	159	148.6 Å²	148.6	74%	0.743	82%	0.816	S	S	*	*			trans	50.5	98.7	141.5	-67.3	165.3	-177.4	0	0	117.6
427	V	28.4	Very low	30.9	Very low	144 Å²	144	150.5 Å²	150.5	87%	0.873	82%	0.818	S	S	*	*				60.4	87.5	89.7	-173.8	0	0	0	0	112.3
428	G	32.7	Very low	31.2	Very low	75 Å²	75	150.3 Å²	150.3	77%	0.773	82%	0.815	S	S	*	*			trans	-136.4	101.7	161.3	0	0	0	0	0	108.3	A430	G428-A430 PolarHBondContact O-N 3.03Å
429	E	27.8	Very low	31.5	Very low	197 Å²	197	147.9 Å²	147.9	92%	0.921	81%	0.811	S	S	*	*			trans	-61.6	115	174.5	-69	-178.6	138.1	0	0	110.6
430	A	36.3	Very low	32	Very low	96 Å²	96	142.4 Å²	142.4	79%	0.793	81%	0.805	S	S	*	*			trans	-142.2	123.2	159	0	0	0	0	0	109.6	G428	G428-A430 PolarHBondContact O-N 3.03Å
431	K	33.9	Very low	32.2	Very low	200 Å²	200	147 Å²	147	87%	0.87	81%	0.807	S	S	*	*			trans	-52.9	148	-172.9	-76.2	168.5	176	171.9	0	113.6	L433	K431-L433 PolarHBondContact O-N 3.01Å
432	P	35.8	Very low	32.7	Very low	126 Å²	126	149.9 Å²	149.9	82%	0.818	82%	0.817	S	S	*	*			trans	-68.9	127.4	179.2	27.6	-33.2	0	0	0	111.6	S434	P432-S434 PolarHBondContact O-N 3.41Å
433	L	37.9	Very low	33.2	Very low	176 Å²	176	151.8 Å²	151.8	92%	0.921	82%	0.819	S	S	*	*			trans	-73	112.2	165.7	-76.6	167.3	0	0	0	108.9	K431	K431-L433 PolarHBondContact O-N 3.01Å
434	S	33.7	Very low	33.5	Very low	100 Å²	100	153.1 Å²	153.1	70%	0.699	82%	0.816	S	S	*	*			trans	-58.3	137	-180	175.2	0	0	0	0	112.8	P432 H436	P432-S434 PolarHBondContact O-N 3.41Å; S434-H436 PolarHBondContact O-N 3.05Å
435	V	33	Very low	33.8	Very low	117 Å²	117	148.8 Å²	148.8	71%	0.709	81%	0.813	S	S	*	*			trans	-73.2	109.5	177	-179.9	0	0	0	0	109.8	K437	V435-K437 HydrophobicContact CG1-CG 4.31Å
436	H	34.6	Very low	33.9	Very low	165 Å²	165	148.4 Å²	148.4	76%	0.764	81%	0.814	S	S	*	*			trans	-115.8	86.9	157.2	-88.3	-62.2	0	0	0	110.3	S434 T438	S434-H436 PolarHBondContact O-N 3.05Å; H436-T438 VanDerWaalsContact C-N 3.34Å; H436-T438 PolarHBondContact O-N 2.95Å
437	K	33.7	Very low	33.7	Very low	193 Å²	193	143.7 Å²	143.7	84%	0.839	81%	0.808	S	S	*	*			trans	-77.5	86.1	158.8	-73.8	-169.1	176.1	-177.6	0	108.3	V435 K439	V435-K437 HydrophobicContact CG1-CG 4.31Å; K437-K439 PolarHBondContact O-N 2.74Å
438	T	36.8	Very low	34	Very low	127 Å²	127	149.1 Å²	149.1	78%	0.779	81%	0.812	S	S	*	*			trans	-70.9	99.5	166.1	41.1	0	0	0	0	108.8	H436 G440	H436-T438 VanDerWaalsContact C-N 3.34Å; H436-T438 PolarHBondContact O-N 2.95Å; T438-G440 PolarHBondContact O-N 3.16Å
439	K	33.6	Very low	34	Very low	192 Å²	192	156.9 Å²	156.9	84%	0.835	82%	0.818	S	S	*	*			trans	-52.4	109.8	161.6	-78.6	179.1	173.4	178.4	0	108	K437 R441	K437-K439 PolarHBondContact O-N 2.74Å; K439-R441 PolarHBondContact O-N 2.85Å
440	G	32.2	Very low	34.5	Very low	74 Å²	74	158.9 Å²	158.9	76%	0.763	82%	0.817	S	S	*	*			trans	-56.8	105.2	169.2	0	0	0	0	0	108.9	T438 N442	T438-G440 PolarHBondContact O-N 3.16Å; G440-N442 PolarHBondContact O-N 2.85Å
441	R	35.3	Very low	34.7	Very low	235 Å²	235	165.2 Å²	165.2	89%	0.887	82%	0.821	S	S	*	*			trans	-64.6	126.7	175.6	-79.5	177.3	167.8	173	-4.3	108.8	K439 K443	K439-R441 PolarHBondContact O-N 2.85Å; R441-K443 PolarHBondContact O-N 3.16Å
442	N	36	Very low	34.7	Very low	164 Å²	164	159.5 Å²	159.5	88%	0.877	82%	0.819	S	S	*	*			trans	-51.8	106.7	162.9	-61.5	-35	0	0	0	108.6	G440 S444	G440-N442 PolarHBondContact O-N 2.85Å; N442-S444 VanDerWaalsContact C-N 3.31Å; N442-S444 PolarHBondContact O-N 3.33Å
443	K	38.5	Very low	34.9	Very low	203 Å²	203	164.9 Å²	164.9	88%	0.883	82%	0.823	S	S	*	*			trans	-75.2	95.2	165.9	-76.5	-171.1	178.7	-179.6	0	107.2	R441 A445	R441-K443 PolarHBondContact O-N 3.16Å; K443-A445 VanDerWaalsContact C-N 3.34Å; K443-A445 PolarHBondContact O-N 2.95Å
444	S	34.3	Very low	34.9	Very low	106 Å²	106	168 Å²	168	74%	0.741	82%	0.822	S	S	*	*			trans	-53	99.5	155.3	-178.4	0	0	0	0	108	N442 E446	N442-S444 VanDerWaalsContact C-N 3.31Å; N442-S444 PolarHBondContact O-N 3.33Å; S444-E446 PolarHBondContact O-N 2.82Å
445	A	34.2	Very low	35.4	Very low	98 Å²	98	171 Å²	171	81%	0.81	83%	0.829	S	S	*	*			trans	-94.8	86.2	165.9	0	0	0	0	0	107.6	K443	K443-A445 VanDerWaalsContact C-N 3.34Å; K443-A445 PolarHBondContact O-N 2.95Å
446	E	31.3	Very low	35.8	Very low	170 Å²	170	171.1 Å²	171.1	79%	0.794	83%	0.833	S	S	*	*			trans	-26.5	125.6	157	-165.9	67.4	-156.3	0	0	114	S444	S444-E446 PolarHBondContact O-N 2.82Å
447	G	28.4	Very low	36	Very low	59 Å²	59	170.1 Å²	170.1	61%	0.608	83%	0.833	S	S	*	*			trans	61.9	72.6	130.7	0	0	0	0	0	119.5
448	R	33.7	Very low	36	Very low	259 Å²	259	170.4 Å²	170.4	98%	0.977	84%	0.835	S	S	*	*			trans	-94.7	70.4	142.6	-93.8	-170.9	-175.2	-179.4	3.8	110.7	R450	R448-R450 PolarHBondContact O-N 3.46Å
449	R	34.1	Very low	36	Very low	238 Å²	238	171 Å²	171	90%	0.898	83%	0.828	S	S	*	*			trans	-75.2	110.6	153.4	-71.9	-175.1	176.4	177.2	0.4	107.5
450	R	38	Very low	35.9	Very low	238 Å²	238	173.3 Å²	173.3	90%	0.898	83%	0.832	S	S	*	*			trans	178	100.1	146.7	-101.2	167.5	-171.9	-165	4	111.4	R448	R448-R450 PolarHBondContact O-N 3.46Å
451	R	39.9	Very low	35.8	Very low	230 Å²	230	179.8 Å²	179.8	87%	0.868	84%	0.835	S	S	*	*				151.2	83.1	125.1	-81.2	-177.6	-172.3	-160.2	3.5	107.9	R453	R451-R453 PolarHBondContact O-N 3.02Å
452	G	33.9	Very low	35.8	Very low	80 Å²	80	173.7 Å²	173.7	83%	0.825	83%	0.828	S	S	*	*			trans	-57.2	106.1	155.2	0	0	0	0	0	107.3	R454	G452-R454 PolarHBondContact O-N 2.83Å
453	R	39.6	Very low	35.6	Very low	239 Å²	239	175.8 Å²	175.8	90%	0.902	83%	0.833	S	S	*	*			trans	-70.6	110.8	168.9	-71.6	-171.8	-179.9	-152.2	1.7	105.8	R451 L455	R451-R453 PolarHBondContact O-N 3.02Å; R453-L455 PolarHBondContact O-N 2.78Å
454	R	38.6	Very low	35.1	Very low	240 Å²	240	169.2 Å²	169.2	91%	0.906	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-46.7	127.5	172.9	-69.6	175.5	173.5	168.4	-3.7	108.7	G452	G452-R454 PolarHBondContact O-N 2.83Å
455	L	43.9	Very low	34.9	Very low	163 Å²	163	172.5 Å²	172.5	85%	0.853	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-53.6	126.5	167.1	-73.5	162.2	0	0	0	107.5	R453 N457	R453-L455 PolarHBondContact O-N 2.78Å; L455-N457 PolarHBondContact O-N 2.95Å; L455-N457 VanDerWaalsContact O-N 3.16Å
456	P	41.5	Very low	34.6	Very low	121 Å²	121	170.6 Å²	170.6	79%	0.786	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-59.2	124.2	177.5	22.1	-29.6	0	0	0	108.6	K458	P456-K458 PolarHBondContact O-N 3.49Å
457	N	37.9	Very low	34.6	Very low	144 Å²	144	172.1 Å²	172.1	77%	0.77	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-55.3	132.3	178.6	-165.7	-0.4	0	0	0	109.2	L455 Q459	L455-N457 PolarHBondContact O-N 2.95Å; L455-N457 VanDerWaalsContact O-N 3.16Å; N457-Q459 PolarHBondContact O-N 2.99Å
458	K	34.5	Very low	34.7	Very low	199 Å²	199	175.8 Å²	175.8	87%	0.865	84%	0.836	S	S	*	*			trans	-65.1	79.4	171.8	-72.6	179.4	175.7	179.5	0	108.7	P456 R460	P456-K458 PolarHBondContact O-N 3.49Å; K458-R460 PolarHBondContact O-N 3.19Å
459	Q	36.1	Very low	34.6	Very low	139 Å²	139	172 Å²	172	65%	0.65	83%	0.83	S	S	*	*			trans	-76.2	111.8	164.2	-111.3	171.3	-6.1	0	0	107.6	N457 Y461	N457-Q459 PolarHBondContact O-N 2.99Å; Q459-Y461 HydrophobicContact CB-CD2 4.34Å; Q459-Y461 HydrophobicContact CB-CE2 4.05Å; Q459-Y461 PolarHBondContact O-N 3.37Å
460	R	32	Very low	34.5	Very low	241 Å²	241	166 Å²	166	91%	0.909	82%	0.824	S	S	*	*			trans	-54.9	101.6	164.7	-66.6	174.7	178.6	174.8	-2	107.3	K458	K458-R460 PolarHBondContact O-N 3.19Å
461	Y	31.1	Very low	34.1	Very low	209 Å²	209	163.9 Å²	163.9	82%	0.82	82%	0.821	S	S	*	*			trans	-85.3	111.9	164.4	-85.2	-86.2	0	0	0	107.5	Q459	Q459-Y461 HydrophobicContact CB-CD2 4.34Å; Q459-Y461 HydrophobicContact CB-CE2 4.05Å; Q459-Y461 PolarHBondContact O-N 3.37Å
462	S	34	Very low	33.7	Very low	107 Å²	107	157.6 Å²	157.6	75%	0.748	81%	0.813	S	S	*	*			trans	-52.9	147	171.3	-42.4	0	0	0	0	111.1	G464	S462-G464 PolarHBondContact O-N 3.39Å
463	E	31.5	Very low	33.4	Very low	208 Å²	208	159.8 Å²	159.8	97%	0.972	81%	0.81	S	S	*	*			trans	-49	102.2	167.5	-72.7	169	149.8	0	0	109.9
464	G	29.1	Very low	32.8	Very low	65 Å²	65	155 Å²	155	67%	0.67	80%	0.802	S	S	*	*			trans	-118.8	111.2	174.8	0	0	0	0	0	107.9	S462 G466	S462-G464 PolarHBondContact O-N 3.39Å; G464-G466 VanDerWaalsContact C-N 3.26Å; G464-G466 PolarHBondContact O-N 3.03Å
465	D	28.9	Very low	32.2	Very low	176 Å²	176	151 Å²	151	94%	0.941	80%	0.797	S	S	*	*			trans	-61.5	75.9	-176.3	-140.3	-4.5	0	0	0	111.5
466	G	29.3	Very low	31.3	Very low	57 Å²	57	148.1 Å²	148.1	59%	0.588	79%	0.79	S	S	*	*			trans	-108.8	92.5	-172	0	0	0	0	0	111.8	G464 T468	G464-G466 VanDerWaalsContact C-N 3.26Å; G464-G466 PolarHBondContact O-N 3.03Å; G466-T468 PolarHBondContact O-N 2.87Å
467	K	30.8	Very low	30.4	Very low	202 Å²	202	148.1 Å²	148.1	88%	0.878	79%	0.794	S	S	*	*			trans	-54.8	92.8	172.1	-63.8	171.7	-179.5	171.8	0	111.3	Q469	K467-Q469 PolarHBondContact O-N 2.8Å
468	T	31.2	Very low	29.8	Very low	136 Å²	136	146.7 Å²	146.7	83%	0.834	80%	0.795	S	S	*	*			trans	-83.9	105.6	167.8	30	0	0	0	0	109.2	G466 S470	G466-T468 PolarHBondContact O-N 2.87Å; T468-S470 PolarHBondContact O-N 2.71Å
469	Q	30.3	Very low	29.4	Very low	181 Å²	181	141.5 Å²	141.5	85%	0.846	78%	0.783	S	S	*	*			trans	-62.3	104.7	167.3	-71.1	-168.3	4.9	0	0	109.2	K467 K471	K467-Q469 PolarHBondContact O-N 2.8Å; Q469-K471 PolarHBondContact O-N 2.8Å; Q469-K471 VanDerWaalsContact O-N 3.11Å
470	S	31.5	Very low	29	Very low	111 Å²	111	144.9 Å²	144.9	78%	0.776	80%	0.796	S	S	*	*			trans	-68.1	102.6	164.9	48.2	0	0	0	0	108.6	T468 S472	T468-S470 PolarHBondContact O-N 2.71Å; S470-S472 PolarHBondContact O-N 3.36Å
471	K	30.2	Very low	28.8	Very low	194 Å²	194	140.4 Å²	140.4	84%	0.843	79%	0.79	S	S	*	*			trans	-63.5	100.8	164.2	-86.6	179.3	174	177.5	0	108	Q469 V473	Q469-K471 PolarHBondContact O-N 2.8Å; Q469-K471 VanDerWaalsContact O-N 3.11Å; K471-V473 PolarHBondContact O-N 3.08Å
472	S	31.2	Very low	28.5	Very low	98 Å²	98	140 Å²	140	69%	0.685	79%	0.792	S	S	*	*			trans	-66.5	111.2	167.2	51.1	0	0	0	0	108.5	S470 N474	S470-S472 PolarHBondContact O-N 3.36Å; S472-N474 PolarHBondContact O-N 2.65Å
473	V	28.3	Very low	28	Very low	125 Å²	125	140 Å²	140	76%	0.758	79%	0.791	S	S	*	*			trans	-75.7	108.5	168.1	177.2	0	0	0	0	106.6	K471 I475	K471-V473 PolarHBondContact O-N 3.08Å; V473-I475 HydrophobicContact CG1-CG1 4.5Å; V473-I475 PolarHBondContact O-N 2.84Å
474	N	26.9	Very low	27.7	Very low	138 Å²	138	135.4 Å²	135.4	74%	0.738	78%	0.779	S	S	*	*			trans	-63.6	100.5	171.3	-71.2	-27.6	0	0	0	108.4	S472 S476	S472-N474 PolarHBondContact O-N 2.65Å; N474-S476 PolarHBondContact O-N 2.84Å
475	I	25.5	Very low	27.6	Very low	156 Å²	156	139 Å²	139	80%	0.8	79%	0.788	S	S	*	*			trans	-85	98.9	164.3	-44.4	175.4	0	0	0	105.3	V473	V473-I475 HydrophobicContact CG1-CG1 4.5Å; V473-I475 PolarHBondContact O-N 2.84Å
476	S	25.6	Very low	27.4	Very low	103 Å²	103	135 Å²	135	72%	0.72	77%	0.774	S	S	*	*			trans	-56.5	133.9	179	-54.9	0	0	0	0	111.5	N474 S478	N474-S476 PolarHBondContact O-N 2.84Å; S476-S478 PolarHBondContact O-N 3.28Å
477	S	22.5	Very low	27.2	Very low	122 Å²	122	137.8 Å²	137.8	85%	0.853	78%	0.78	S	S	*	*			trans	-58.9	120.2	173.4	-50	0	0	0	0	112.3
478	S	25.8	Very low	27.1	Very low	113 Å²	113	133.3 Å²	133.3	79%	0.79	77%	0.772	S	S	*	*			trans	-154.6	122.9	156.4	64.9	0	0	0	0	104.7	S476	S476-S478 PolarHBondContact O-N 3.28Å
479	S	26.4	Very low	26.8	Very low	90 Å²	90	135.2 Å²	135.2	63%	0.629	77%	0.771	S	S	*	*			cis	-157.2	128.4	37.3	38.1	0	0	0	0	106.7	L481	S479-L481 VanDerWaalsContact C-N 3.26Å; S479-L481 PolarHBondContact O-N 3.38Å
480	F	26.2	Very low	26.8	Very low	210 Å²	210	134.2 Å²	134.2	92%	0.921	77%	0.77	S	S	*	*			trans	-65.4	95.9	161.7	-75.7	-92.2	0	0	0	106.6	K482	F480-K482 VanDerWaalsContact C-N 3.29Å; F480-K482 PolarHBondContact O-N 3.06Å
481	L	27.9	Very low	26.6	Very low	147 Å²	147	134.9 Å²	134.9	77%	0.77	77%	0.77	S	S	*	*			trans	-64.6	100	167.9	-77.2	169.4	0	0	0	106.6	S479 C483	S479-L481 VanDerWaalsContact C-N 3.26Å; S479-L481 PolarHBondContact O-N 3.38Å; L481-C483 VanDerWaalsContact C-N 3.3Å; L481-C483 PolarHBondContact O-N 2.86Å
482	K	24.8	Very low	26.4	Very low	201 Å²	201	133.8 Å²	133.8	87%	0.874	77%	0.773	S	S	*	*			trans	-60.1	92.7	173.1	-147.5	160.5	-176	175.1	0	106.5	F480 P484	F480-K482 VanDerWaalsContact C-N 3.29Å; F480-K482 PolarHBondContact O-N 3.06Å; K482-P484 VanDerWaalsContact O-CD 3.23Å; K482-P484 WeakPolarHBondContact O-CD 3.01Å
483	C	23.8	Very low	26.1	Very low	106 Å²	106	131.7 Å²	131.7	72%	0.716	77%	0.767	S	S	*	*			trans	-60	117.7	173.7	-64.8	0	0	0	0	107.5	L481 T485	L481-C483 VanDerWaalsContact C-N 3.3Å; L481-C483 PolarHBondContact O-N 2.86Å; C483-T485 PolarHBondContact O-N 2.95Å; C483-T485 VanDerWaalsContact O-N 3.09Å
484	P	25.6	Very low	25.9	Very low	112 Å²	112	136.3 Å²	136.3	73%	0.727	77%	0.77	S	S	*	*			trans	-67.7	113.3	172.4	26	-28.7	0	0	0	107.6	K482 S486	K482-P484 VanDerWaalsContact O-CD 3.23Å; K482-P484 WeakPolarHBondContact O-CD 3.01Å; P484-S486 PolarHBondContact O-N 3.24Å
485	T	26	Very low	25.9	Very low	141 Å²	141	134.4 Å²	134.4	87%	0.865	77%	0.768	S	S	*	*			trans	-69.1	66.5	167.2	-42.3	0	0	0	0	108.5	C483 T487	C483-T485 PolarHBondContact O-N 2.95Å; C483-T485 VanDerWaalsContact O-N 3.09Å; T485-T487 PolarHBondContact O-N 2.83Å
486	S	24.9	Very low	26	Very low	91 Å²	91	134.2 Å²	134.2	64%	0.636	76%	0.764	S	S	*	*			trans	-91.3	97.8	169.5	60.7	0	0	0	0	107.7	P484	P484-S486 PolarHBondContact O-N 3.24Å
487	T	26.7	Very low	26	Very low	117 Å²	117	134.7 Å²	134.7	72%	0.718	76%	0.762	S	S	*	*			trans	-46.2	120.3	158	2.4	0	0	0	0	107.8	T485 H489	T485-T487 PolarHBondContact O-N 2.83Å; T487-H489 PolarHBondContact O-N 3.06Å
488	P	26.9	Very low	26.3	Very low	108 Å²	108	134.6 Å²	134.6	70%	0.701	76%	0.762	S	S	*	*			trans	-66	113.1	179.8	25.5	-30.6	0	0	0	107.7	L490	P488-L490 PolarHBondContact O-N 2.77Å
489	H	26.4	Very low	26.3	Very low	176 Å²	176	133.8 Å²	133.8	82%	0.815	76%	0.756	S	S	*	*			trans	-59	106.1	163.9	-79.1	-81.8	0	0	0	106.9	T487 T491	T487-H489 PolarHBondContact O-N 3.06Å; H489-T491 PolarHBondContact O-N 2.67Å
490	L	28.8	Very low	26.3	Very low	159 Å²	159	137.4 Å²	137.4	83%	0.832	76%	0.761	S	S	*	*			trans	-65.1	89.1	168.9	-64.7	174	0	0	0	106.9	P488 N492	P488-L490 PolarHBondContact O-N 2.77Å; L490-N492 PolarHBondContact O-N 2.74Å
491	T	28.1	Very low	26.4	Very low	125 Å²	125	139 Å²	139	77%	0.767	76%	0.761	S	S	*	*			trans	-62	123.1	165.5	50.7	0	0	0	0	106.7	H489 G493	H489-T491 PolarHBondContact O-N 2.67Å; T491-G493 PolarHBondContact O-N 2.94Å
492	N	26.8	Very low	26.5	Very low	172 Å²	172	140.8 Å²	140.8	92%	0.92	76%	0.758	S	S	*	*			trans	-56.8	74.6	174.8	-89.4	-18.7	0	0	0	111	L490 R494	L490-N492 PolarHBondContact O-N 2.74Å; N492-R494 PolarHBondContact O-N 3.22Å
493	G	24	Very low	26.8	Very low	53 Å²	53	138.5 Å²	138.5	55%	0.546	76%	0.756	S	S	.	*			trans	-80.2	95.8	168.9	0	0	0	0	0	107.6	T491 S495	T491-G493 PolarHBondContact O-N 2.94Å; G493-S495 VanDerWaalsContact C-N 3.26Å; G493-S495 PolarHBondContact O-N 2.76Å; G493-S495 PolarHBondContact O-OG 3.35Å
494	R	24.6	Very low	27.2	Very low	222 Å²	222	138.1 Å²	138.1	84%	0.838	75%	0.747	S	S	*	*			trans	-51.2	90.1	169.6	-179.1	180	177.9	172.4	0.4	109.4	N492 E496	N492-R494 PolarHBondContact O-N 3.22Å; R494-E496 IonicContact CZ-OE1 3.81Å; R494-E496 IonicContact NE-OE1 3.32Å; R494-E496 PolarHBondContact NE-OE1 3.44Å; R494-E496 IonicContact NH2-OE1 3.36Å; R494-E496 PolarHBondContact NH2-OE1 2.89Å
495	S	27.5	Very low	27.4	Very low	99 Å²	99	135 Å²	135	69%	0.692	73%	0.734	S	S	*	*			trans	-121.3	97.4	174.6	32.6	0	0	0	0	106.9	G493 T497	G493-S495 VanDerWaalsContact C-N 3.26Å; G493-S495 PolarHBondContact O-N 2.76Å; G493-S495 PolarHBondContact O-OG 3.35Å; S495-T497 PolarHBondContact O-N 3.27Å
496	E	26.3	Very low	27.5	Very low	151 Å²	151	131.5 Å²	131.5	71%	0.706	71%	0.71	S	S	*	*			trans	-67.2	75.4	176.5	-67.3	167.9	-177	0	0	109.5	R494	R494-E496 IonicContact CZ-OE1 3.81Å; R494-E496 IonicContact NE-OE1 3.32Å; R494-E496 PolarHBondContact NE-OE1 3.44Å; R494-E496 IonicContact NH2-OE1 3.36Å; R494-E496 PolarHBondContact NH2-OE1 2.89Å
497	T	26.8	Very low	27.5	Very low	113 Å²	113	132.8 Å²	132.8	69%	0.693	71%	0.714	S	S	*	*			trans	-142.9	117.9	156.5	50.7	0	0	0	0	108.9	S495 S499	S495-T497 PolarHBondContact O-N 3.27Å; T497-S499 VanDerWaalsContact C-N 3.3Å; T497-S499 PolarHBondContact O-N 3.46Å
498	S	27	Very low	27.5	Very low	120 Å²	120	130.6 Å²	130.6	84%	0.839	70%	0.703	S	S	*	*			trans	-61.8	87.9	175.5	60.2	0	0	0	0	109.8	K500	S498-K500 PolarHBondContact O-N 2.96Å
499	S	26.6	Very low	27.6	Very low	97 Å²	97	130.1 Å²	130.1	68%	0.678	69%	0.694	S	S	*	*			trans	-68.9	91.3	166.4	-87.1	0	0	0	0	107.7	T497 W501	T497-S499 VanDerWaalsContact C-N 3.3Å; T497-S499 PolarHBondContact O-N 3.46Å; S499-W501 PolarHBondContact O-N 3.42Å
500	K	26.7	Very low	27.8	Very low	166 Å²	166	125.4 Å²	125.4	72%	0.722	68%	0.677	S	S	*	*			trans	-55.2	108.9	160.8	-105.2	173.3	173.4	169.3	0	106.5	S498 Y502	S498-K500 PolarHBondContact O-N 2.96Å; K500-Y502 HydrophobicContact CB-CE2 4.31Å; K500-Y502 WeakPolarHBondContact O-CD2 3.42Å; K500-Y502 PolarHBondContact O-N 2.99Å
501	W	28.1	Very low	27.8	Very low	243 Å²	243	121.4 Å²	121.4	92%	0.92	66%	0.656	S	S	*	*			trans	-57.5	103.7	167.9	-58.2	87.3	0	0	0	107.6	S499 D503	S499-W501 PolarHBondContact O-N 3.42Å; W501-D503 PolarHBondContact O-N 2.81Å
502	Y	29.3	Very low	27.7	Very low	184 Å²	184	123 Å²	123	72%	0.722	65%	0.654	S	S	*	*			trans	-77.3	107.3	161.2	-75.7	-88.4	0	0	0	105.3	K500 D504	K500-Y502 HydrophobicContact CB-CE2 4.31Å; K500-Y502 WeakPolarHBondContact O-CD2 3.42Å; K500-Y502 PolarHBondContact O-N 2.99Å; Y502-D504 VanDerWaalsContact C-N 3.28Å; Y502-D504 PolarHBondContact O-N 2.85Å
503	D	31.3	Very low	28	Very low	153 Å²	153	121.1 Å²	121.1	82%	0.818	64%	0.64	S	S	*	*			trans	-69	92.7	168.7	-163.5	1.3	0	0	0	106.6	W501 G505	W501-D503 PolarHBondContact O-N 2.81Å; D503-G505 PolarHBondContact O-N 3Å
504	D	33.8	Very low	28.1	Very low	99 Å²	99	123.7 Å²	123.7	53%	0.529	65%	0.65	S	S	.	*			trans	-71.9	15.2	-176.7	-75.5	-25.4	0	0	0	112.7	Y502 I506	Y502-D504 VanDerWaalsContact C-N 3.28Å; Y502-D504 PolarHBondContact O-N 2.85Å; D504-I506 PolarHBondContact O-N 3.37Å; D504-I506 VanDerWaalsContact O-N 3.08Å
505	G	28.5	Very low	28.4	Very low	45 Å²	45	117.6 Å²	117.6	46%	0.464	64%	0.641	S	S	.	*			trans	66.2	13.6	170.6	0	0	0	0	0	114.3	D503 V507	D503-G505 PolarHBondContact O-N 3Å; G505-V507 PolarHBondContact O-N 3.24Å
506	I	27.5	Very low	28.7	Very low	69 Å²	69	119.2 Å²	119.2	35%	0.354	65%	0.647	S	S	.	*			trans	-78.2	92.4	176.4	-50.6	-179.7	0	0	0	108.1	P259 D504 S508	P259-I506 HydrophobicContact CG-CG1 4.49Å; D504-I506 PolarHBondContact O-N 3.37Å; D504-I506 VanDerWaalsContact O-N 3.08Å; I506-S508 VanDerWaalsContact C-N 3.34Å; I506-S508 WeakPolarHBondContact CG2-OG 3.37Å; I506-S508 PolarHBondContact O-N 3.36Å
507	V	26.5	Very low	28.8	Very low	117 Å²	117	119 Å²	119	71%	0.709	65%	0.651	S	S	*	*			trans	-71.6	95.1	166.2	-175.2	0	0	0	0	107.6	G505 I509	G505-V507 PolarHBondContact O-N 3.24Å; V507-I509 HydrophobicContact CG1-CG1 4.49Å
508	S	25.9	Very low	28.9	Very low	71 Å²	71	118.3 Å²	118.3	50%	0.497	65%	0.65	S	S	.	*			trans	-90.8	119.1	173.1	-54.8	0	0	0	0	108.5	I506	I506-S508 VanDerWaalsContact C-N 3.34Å; I506-S508 WeakPolarHBondContact CG2-OG 3.37Å; I506-S508 PolarHBondContact O-N 3.36Å
509	I	30	Very low	28.9	Very low	99 Å²	99	118.7 Å²	118.7	51%	0.508	65%	0.648	S	S	.	*			trans	-96.3	105.5	170.9	-55.7	173.8	0	0	0	106.9	V507 I511	V507-I509 HydrophobicContact CG1-CG1 4.49Å; I509-I511 HydrophobicContact CG2-CG1 4.34Å
510	T	29	Very low	29.2	Very low	77 Å²	77	120.2 Å²	120.2	47%	0.472	65%	0.646	S	S	.	*			trans	-91.9	120.3	176.4	-51.4	0	0	0	0	109.3
511	I	29.9	Very low	29.2	Very low	74 Å²	74	119.1 Å²	119.1	38%	0.379	65%	0.648	S	S	.	*			trans	-105.2	110.2	174	-53.2	172.9	0	0	0	108.2	L49 I509	L49-I511 HydrophobicContact CD1-CB 3.84Å; L49-I511 HydrophobicContact CD1-CD1 3.56Å; L49-I511 HydrophobicContact CD1-CG1 4.29Å; L49-I511 HydrophobicContact CD1-CG2 3.63Å; I509-I511 HydrophobicContact CG2-CG1 4.34Å
512	H	26.2	Very low	29.3	Very low	159 Å²	159	114.3 Å²	114.3	74%	0.736	64%	0.635	S	S	*	*			trans	-77.9	125.4	178.4	-76.6	-97.8	0	0	0	110.6
513	Q	32	Very low	29.2	Very low	133 Å²	133	110.9 Å²	110.9	62%	0.621	64%	0.638	S	S	*	*			trans	-82	110.9	165.1	-74.6	-179.7	-2.9	0	0	109	S515	Q513-S515 PolarHBondContact O-N 3.32Å
514	S	27.5	Very low	29.1	Very low	106 Å²	106	112.3 Å²	112.3	74%	0.741	64%	0.64	S	S	*	*			trans	-81.2	97.6	164.1	-52.7	0	0	0	0	107.9	T516	S514-T516 PolarHBondContact O-N 3.37Å
515	S	30.1	Very low	28.8	Very low	94 Å²	94	112.7 Å²	112.7	66%	0.657	65%	0.65	S	S	*	*			trans	-81.7	102.8	170.9	73.3	0	0	0	0	109.2	Q513 N517	Q513-S515 PolarHBondContact O-N 3.32Å; S515-N517 PolarHBondContact O-N 3.2Å
516	T	33.7	Very low	28.8	Very low	133 Å²	133	117.8 Å²	117.8	82%	0.816	67%	0.666	S	S	*	*			trans	-72.7	106.5	165.2	44.9	0	0	0	0	108.1	S514 S518	S514-T516 PolarHBondContact O-N 3.37Å; T516-S518 VanDerWaalsContact C-N 3.26Å; T516-S518 PolarHBondContact O-N 2.7Å
517	N	28	Very low	29	Very low	148 Å²	148	123.7 Å²	123.7	79%	0.791	69%	0.689	S	S	*	*			trans	-71.5	82.3	172.7	-75.9	-27.3	0	0	0	109.3	S515	S515-N517 PolarHBondContact O-N 3.2Å
518	S	28.8	Very low	29.3	Very low	97 Å²	97	127.8 Å²	127.8	68%	0.678	70%	0.697	S	S	*	*			trans	-91.7	94.6	162.9	177.4	0	0	0	0	108.5	T516 M520	T516-S518 VanDerWaalsContact C-N 3.26Å; T516-S518 PolarHBondContact O-N 2.7Å; S518-M520 PolarHBondContact O-N 3.11Å
519	T	28.2	Very low	29.6	Very low	128 Å²	128	129.8 Å²	129.8	79%	0.785	71%	0.711	S	S	*	*			trans	-68.6	81.3	166.3	15	0	0	0	0	109.2	N521	T519-N521 PolarHBondContact O-N 3.14Å
520	M	31.6	Very low	29.4	Very low	130 Å²	130	136.1 Å²	136.1	64%	0.64	73%	0.729	S	S	*	*			trans	-89.8	96.4	166.7	-146.8	161.1	81.7	0	0	108.1	S518 H522	S518-M520 PolarHBondContact O-N 3.11Å; M520-H522 WeakPolarHBondContact CE-CE1 3.41Å; M520-H522 WeakPolarHBondContact CE-NE2 3.1Å; M520-H522 PolarHBondContact O-N 2.82Å
521	N	26.7	Very low	29.8	Very low	143 Å²	143	138.3 Å²	138.3	77%	0.765	75%	0.745	S	S	*	*			trans	-63.1	96.8	175.2	-75.6	-41.3	0	0	0	109.5	T519 S523	T519-N521 PolarHBondContact O-N 3.14Å; N521-S523 PolarHBondContact O-N 3.11Å
522	H	30.7	Very low	30	Very low	141 Å²	141	146.6 Å²	146.6	65%	0.653	77%	0.771	S	S	*	*			trans	-82	99.2	166.9	-72.4	-67.4	0	0	0	109.4	M520 H524	M520-H522 WeakPolarHBondContact CE-CE1 3.41Å; M520-H522 WeakPolarHBondContact CE-NE2 3.1Å; M520-H522 PolarHBondContact O-N 2.82Å; H522-H524 PolarHBondContact O-N 3.06Å
523	S	27.8	Very low	30.3	Very low	113 Å²	113	143.9 Å²	143.9	79%	0.79	77%	0.77	S	S	*	*			trans	-52.3	120.4	169.6	-42.6	0	0	0	0	110.4	N521 S525	N521-S523 PolarHBondContact O-N 3.11Å; S523-S525 PolarHBondContact O-N 2.92Å; S523-S525 VanDerWaalsContact O-N 3.08Å
524	H	28.6	Very low	30.6	Very low	183 Å²	183	143.4 Å²	143.4	85%	0.847	78%	0.778	S	S	*	*			trans	-62.1	103.4	174.8	-66.1	-76.9	0	0	0	111.3	H522 L526	H522-H524 PolarHBondContact O-N 3.06Å; H524-L526 PolarHBondContact O-N 2.94Å
525	S	28.3	Very low	31	Very low	106 Å²	106	144.8 Å²	144.8	74%	0.741	78%	0.782	S	S	*	*			trans	-89.7	101.1	163.7	65.7	0	0	0	0	109.8	S523 F527	S523-S525 PolarHBondContact O-N 2.92Å; S523-S525 VanDerWaalsContact O-N 3.08Å; S525-F527 PolarHBondContact O-N 3.08Å
526	L	28	Very low	31.4	Very low	153 Å²	153	149.4 Å²	149.4	80%	0.801	79%	0.791	S	S	*	*			trans	-75.6	90.4	172.3	-75.3	162.5	0	0	0	109.8	H524	H524-L526 PolarHBondContact O-N 2.94Å
527	F	31.8	Very low	31.6	Very low	192 Å²	192	150.9 Å²	150.9	84%	0.842	79%	0.793	S	S	*	*			trans	-128	82.8	160.8	-75.7	-73.3	0	0	0	110	S525 S529	S525-F527 PolarHBondContact O-N 3.08Å; F527-S529 PolarHBondContact O-N 3.29Å
528	K	32.1	Very low	31.9	Very low	203 Å²	203	154.8 Å²	154.8	88%	0.883	80%	0.797	S	S	*	*			trans	-78.5	101.1	162.7	-80.4	-179.1	176.8	177.3	0	108.2	R530	K528-R530 PolarHBondContact O-N 3.06Å
529	S	32.6	Very low	32	Very low	113 Å²	113	155.8 Å²	155.8	79%	0.79	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-63.3	123.1	168.5	49.7	0	0	0	0	109.5	F527	F527-S529 PolarHBondContact O-N 3.29Å
530	R	26.6	Very low	32.6	Very low	233 Å²	233	157.1 Å²	157.1	88%	0.879	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-86.8	120.1	179.7	-147.4	178.2	-169.3	-179.5	2.8	108	K528 R532	K528-R530 PolarHBondContact O-N 3.06Å; R530-R532 PolarHBondContact O-N 2.85Å
531	P	35.6	Very low	32.5	Very low	123 Å²	123	164.7 Å²	164.7	80%	0.799	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-69.1	121.3	178.8	25	-29.9	0	0	0	109.8	S533	P531-S533 PolarHBondContact O-N 3.01Å
532	R	35.1	Very low	32.8	Very low	247 Å²	247	165.8 Å²	165.8	93%	0.932	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-69.9	116.3	173.2	-73.2	-178	175.8	178.5	-1.1	108.5	R530	R530-R532 PolarHBondContact O-N 2.85Å
533	S	33.4	Very low	32.9	Very low	103 Å²	103	167.1 Å²	167.1	72%	0.72	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-75.3	138	170.8	51.9	0	0	0	0	110.4	P531 V535	P531-S533 PolarHBondContact O-N 3.01Å; S533-V535 PolarHBondContact O-N 2.95Å
534	P	37.2	Very low	33.2	Very low	122 Å²	122	170.1 Å²	170.1	79%	0.792	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-72.5	123.5	-177.7	25.6	-30.9	0	0	0	111.2	K536	P534-K536 PolarHBondContact O-N 3.03Å
535	V	36.9	Very low	33.5	Very low	136 Å²	136	169.4 Å²	169.4	82%	0.824	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-68	118.1	174.2	178.2	0	0	0	0	108.4	S533 N537	S533-V535 PolarHBondContact O-N 2.95Å; V535-N537 PolarHBondContact O-N 3.01Å
536	K	37.4	Very low	33.8	Very low	191 Å²	191	173.3 Å²	173.3	83%	0.83	86%	0.858	S	S	*	*	P	Polyproline II helix	trans	-67.5	117.6	174.9	-76	179.8	175.4	179.9	0	109.8	P534 R538	P534-K536 PolarHBondContact O-N 3.03Å; K536-R538 PolarHBondContact O-N 2.74Å; K536-R538 VanDerWaalsContact O-N 3.08Å
537	N	37.3	Very low	34.2	Very low	164 Å²	164	174.7 Å²	174.7	88%	0.877	86%	0.862	S	S	*	*			trans	-55.7	107.5	167.9	-72.7	-38.1	0	0	0	110	V535	V535-N537 PolarHBondContact O-N 3.01Å
538	R	35	Very low	34.4	Very low	230 Å²	230	173.4 Å²	173.4	87%	0.868	86%	0.864	S	S	*	*			trans	-92.7	98.7	162.1	-82.9	-177.1	171.7	178.5	-2.6	107.4	K536	K536-R538 PolarHBondContact O-N 2.74Å; K536-R538 VanDerWaalsContact O-N 3.08Å
539	S	31.5	Very low	34.5	Very low	117 Å²	117	171.2 Å²	171.2	82%	0.818	86%	0.862	S	S	*	*			trans	-86.5	110.5	155.7	66.4	0	0	0	0	107.4
540	L	40.1	Very low	34.7	Very low	157 Å²	157	176 Å²	176	82%	0.822	87%	0.868	S	S	*	*			trans	-118.9	129.6	162.2	-83	162.4	0	0	0	106.4
541	K	30.3	Very low	35.4	Very low	289 Å²	289	170.8 Å²	170.8	100%	1.257	87%	0.867	S	S	*	*			trans	-45.3	0	173.1	-92	174.8	167.6	177.8	0	113.2

Retrieved 541 of 541 residues in 461.2 ms (Link to these results)

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