A0A3Q0KJR1_SCHMA Loading...

Spindle assembly checkpoint component MAD1 (Mitotic arrest deficient protein 1), putative

AlphaFold DB , UniProt , Accession A0A3Q0KJR1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 354 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42	Very low	65.3	Low	239 Å²	239	109.4 Å²	109.4	100%	1.177	58%	0.582	S	S	*	*				0	-3.1	0	-68.4	-168.9	172.8	0	0	115.6
2	A	48.8	Very low	66.1	Low	54 Å²	54	106 Å²	106	45%	0.446	56%	0.559	S	S	.	*			trans	-87.6	-9.9	-175	0	0	0	0	0	116.2	S5 R6	A2-S5 PolarHBondContact O-OG 3Å; A2-R6 WeakPolarHBondContact O-CG 3.05Å
3	S	58.9	Low	66.7	Low	99 Å²	99	102.1 Å²	102.1	69%	0.692	55%	0.551	S	S	*	*	H	α-helix	trans	-76.2	-37.1	-170.7	-50.5	0	0	0	0	113.9	R6 E7	S3-R6 PolarHBondContact O-N 2.91Å; S3-E7 PolarHBondContact O-N 2.67Å; S3-E7 VanDerWaalsContact O-N 3.14Å
4	G	64.5	Low	67.2	Low	49 Å²	49	97.9 Å²	97.9	51%	0.505	54%	0.537	S	S	.	.	H	α-helix	trans	-69.8	-37.4	-175.5	0	0	0	0	0	114.4	R6 L8	G4-R6 VanDerWaalsContact C-N 3.34Å; G4-L8 WeakPolarHBondContact O-CD1 3.14Å; G4-L8 WeakPolarHBondContact O-CG 3.28Å; G4-L8 PolarHBondContact O-N 2.75Å
5	S	69.7	Low	67.6	Low	69 Å²	69	94.4 Å²	94.4	48%	0.483	52%	0.52	S	S	.	.	H	α-helix	trans	-70.2	-32.8	177	58.8	0	0	0	0	112.3	A2 L9	A2-S5 PolarHBondContact O-OG 3Å; S5-L9 PolarHBondContact O-N 2.89Å; S5-L9 VanDerWaalsContact O-N 3.08Å
6	R	67.7	Low	68	Low	182 Å²	182	92.5 Å²	92.5	69%	0.687	51%	0.508	S	S	*	.	H	α-helix	trans	-68.6	-42.8	176.7	-74.5	179.3	171.2	-179.2	-3	111.8	A2 S3 G4 L9 R10	A2-R6 WeakPolarHBondContact O-CG 3.05Å; S3-R6 PolarHBondContact O-N 2.91Å; G4-R6 VanDerWaalsContact C-N 3.34Å; R6-L9 PolarHBondContact O-N 3.23Å; R6-R10 PolarHBondContact O-N 2.65Å
7	E	72.7	Confident	68.3	Low	103 Å²	103	93.4 Å²	93.4	48%	0.481	51%	0.508	S	S	.	.	H	α-helix	trans	-65.7	-40.8	177.5	-163.8	56.2	-150.4	0	0	111.8	S3 L9 R10 L11	S3-E7 PolarHBondContact O-N 2.67Å; S3-E7 VanDerWaalsContact O-N 3.14Å; E7-L9 PolarHBondContact O-N 2.69Å; E7-R10 WeakPolarHBondContact O-CB 3.33Å; E7-R10 PolarHBondContact O-N 3.48Å; E7-R10 VanDerWaalsContact O-N 3.15Å; E7-L11 HydrophobicContact CG-CD1 4.47Å; E7-L11 WeakPolarHBondContact O-CG 3.12Å; E7-L11 PolarHBondContact O-N 2.76Å
8	L	71.1	Confident	68.6	Low	50 Å²	50	94.3 Å²	94.3	26%	0.262	51%	0.512	S	S	.	.	H	α-helix	trans	-59.8	-42.5	173	-80	162.3	0	0	0	112.9	G4 R10 L11 F12 I49	G4-L8 WeakPolarHBondContact O-CD1 3.14Å; G4-L8 WeakPolarHBondContact O-CG 3.28Å; G4-L8 PolarHBondContact O-N 2.75Å; L8-R10 VanDerWaalsContact C-N 3.34Å; L8-L11 PolarHBondContact O-N 2.92Å; L8-F12 VanDerWaalsContact O-CB 3.32Å; L8-F12 WeakPolarHBondContact O-CB 3.49Å; L8-F12 PolarHBondContact O-N 2.78Å; L8-I49 HydrophobicContact CD2-CG1 3.97Å; L8-I49 HydrophobicContact CD2-CG2 4.44Å
9	L	75.3	Confident	68.5	Low	118 Å²	118	89.7 Å²	89.7	62%	0.618	49%	0.488	S	S	*	.	H	α-helix	trans	-63.7	-39.5	174.6	-88.4	155.1	0	0	0	111.8	S5 R6 E7 F12 A13	S5-L9 PolarHBondContact O-N 2.89Å; S5-L9 VanDerWaalsContact O-N 3.08Å; R6-L9 PolarHBondContact O-N 3.23Å; E7-L9 PolarHBondContact O-N 2.69Å; L9-F12 PolarHBondContact O-N 2.74Å; L9-A13 WeakPolarHBondContact O-CB 3.3Å; L9-A13 PolarHBondContact O-N 3.25Å
10	R	74.5	Confident	68.3	Low	142 Å²	142	89.3 Å²	89.3	54%	0.536	49%	0.492	S	S	.	.	H	α-helix	trans	-62.2	-49.4	175.3	-119.5	-171.1	173.9	116.2	3.5	111.5	R6 E7 L8 F12 A13 A14	R6-R10 PolarHBondContact O-N 2.65Å; E7-R10 WeakPolarHBondContact O-CB 3.33Å; E7-R10 PolarHBondContact O-N 3.48Å; E7-R10 VanDerWaalsContact O-N 3.15Å; L8-R10 VanDerWaalsContact C-N 3.34Å; R10-F12 VanDerWaalsContact C-N 3.32Å; R10-F12 PolarHBondContact O-N 2.83Å; R10-A13 PolarHBondContact O-N 3.05Å; R10-A14 WeakPolarHBondContact O-CB 3.36Å; R10-A14 PolarHBondContact O-N 3.18Å
11	L	73.7	Confident	68.2	Low	98 Å²	98	87.5 Å²	87.5	51%	0.513	48%	0.484	S	S	.	.	H	α-helix	trans	-61.4	-39.8	176.6	-72.5	169.3	0	0	0	111.8	E7 L8 A14 T15	E7-L11 HydrophobicContact CG-CD1 4.47Å; E7-L11 WeakPolarHBondContact O-CG 3.12Å; E7-L11 PolarHBondContact O-N 2.76Å; L8-L11 PolarHBondContact O-N 2.92Å; L11-A14 PolarHBondContact O-N 3.09Å; L11-T15 WeakPolarHBondContact O-CB 3.49Å; L11-T15 PolarHBondContact O-N 3.39Å; L11-T15 PolarHBondContact O-OG1 3.48Å
12	F	74.1	Confident	69.2	Low	69 Å²	69	80.4 Å²	80.4	30%	0.303	45%	0.45	S	S	.	.	H	α-helix	trans	-64.3	-46.9	176.6	-171.8	-104.5	0	0	0	112	L8 L9 R10 T15 I16 V45 V46 I49	L8-F12 VanDerWaalsContact O-CB 3.32Å; L8-F12 WeakPolarHBondContact O-CB 3.49Å; L8-F12 PolarHBondContact O-N 2.78Å; L9-F12 PolarHBondContact O-N 2.74Å; R10-F12 VanDerWaalsContact C-N 3.32Å; R10-F12 PolarHBondContact O-N 2.83Å; F12-T15 PolarHBondContact O-N 3.47Å; F12-I16 HydrophobicContact CD1-CD1 3.67Å; F12-I16 HydrophobicContact CD1-CG1 4.49Å; F12-I16 HydrophobicContact CE1-CD1 3.17Å; F12-I16 HydrophobicContact CE1-CG1 4.26Å; F12-I16 HydrophobicContact CE2-CD1 4.3Å; F12-I16 HydrophobicContact CG-CD1 4.43Å; F12-I16 HydrophobicContact CZ-CD1 3.54Å; F12-I16 HydrophobicContact CZ-CG1 4.37Å; F12-I16 WeakPolarHBondContact O-CG1 3.43Å; F12-I16 PolarHBondContact O-N 3.12Å; F12-V45 HydrophobicContact CD2-CG1 3.67Å; F12-V45 HydrophobicContact CE2-CG1 4.11Å; F12-V46 HydrophobicContact CE2-CG2 4.49Å; F12-I49 HydrophobicContact CD2-CD1 4.23Å
13	A	74.8	Confident	69.8	Low	55 Å²	55	79.2 Å²	79.2	46%	0.455	44%	0.44	S	S	.	.	H	α-helix	trans	-62.1	-45	176.8	0	0	0	0	0	111.6	L9 R10 T15 I16 Q17	L9-A13 WeakPolarHBondContact O-CB 3.3Å; L9-A13 PolarHBondContact O-N 3.25Å; R10-A13 PolarHBondContact O-N 3.05Å; A13-T15 VanDerWaalsContact C-N 3.35Å; A13-T15 PolarHBondContact O-N 3.49Å; A13-I16 PolarHBondContact O-N 3.41Å; A13-Q17 WeakPolarHBondContact O-CB 3.28Å; A13-Q17 PolarHBondContact O-N 3.46Å
14	A	72.6	Confident	69.8	Low	43 Å²	43	77.4 Å²	77.4	36%	0.355	44%	0.437	S	S	.	.	H	α-helix	trans	-61.5	-42.1	176.1	0	0	0	0	0	111.7	R10 L11 Q17 N18	R10-A14 WeakPolarHBondContact O-CB 3.36Å; R10-A14 PolarHBondContact O-N 3.18Å; L11-A14 PolarHBondContact O-N 3.09Å; A14-Q17 PolarHBondContact O-N 3.38Å; A14-N18 WeakPolarHBondContact O-CB 3.05Å; A14-N18 PolarHBondContact O-N 2.97Å; A14-N18 PolarHBondContact O-ND2 3.29Å; A14-N18 PolarHBondContact O-OD1 2.81Å
15	T	73.2	Confident	69.6	Low	46 Å²	46	81.8 Å²	81.8	28%	0.282	44%	0.444	S	S	.	.	H	α-helix	trans	-67.2	-41.5	178.7	-52.8	0	0	0	0	111.7	L11 F12 A13 Q17 N18 A19 L41 V45	L11-T15 WeakPolarHBondContact O-CB 3.49Å; L11-T15 PolarHBondContact O-N 3.39Å; L11-T15 PolarHBondContact O-OG1 3.48Å; F12-T15 PolarHBondContact O-N 3.47Å; A13-T15 VanDerWaalsContact C-N 3.35Å; A13-T15 PolarHBondContact O-N 3.49Å; T15-Q17 VanDerWaalsContact C-N 3.35Å; T15-N18 PolarHBondContact O-N 3Å; T15-A19 WeakPolarHBondContact O-CB 3.16Å; T15-A19 PolarHBondContact O-N 3.24Å; T15-L41 HydrophobicContact CG2-CD2 4.26Å; T15-L41 HydrophobicContact CG2-CG 4.41Å; T15-V45 HydrophobicContact CG2-CG2 3.83Å
16	I	73.7	Confident	69	Low	64 Å²	64	81.7 Å²	81.7	33%	0.328	44%	0.437	S	S	.	.	H	α-helix	trans	-63.1	-43.6	174.3	-72.5	178	0	0	0	110.8	F12 A13 A19 S20	F12-I16 HydrophobicContact CD1-CD1 3.67Å; F12-I16 HydrophobicContact CD1-CG1 4.49Å; F12-I16 HydrophobicContact CE1-CD1 3.17Å; F12-I16 HydrophobicContact CE1-CG1 4.26Å; F12-I16 HydrophobicContact CE2-CD1 4.3Å; F12-I16 HydrophobicContact CG-CD1 4.43Å; F12-I16 HydrophobicContact CZ-CD1 3.54Å; F12-I16 HydrophobicContact CZ-CG1 4.37Å; F12-I16 WeakPolarHBondContact O-CG1 3.43Å; F12-I16 PolarHBondContact O-N 3.12Å; A13-I16 PolarHBondContact O-N 3.41Å; I16-A19 PolarHBondContact O-N 3.31Å; I16-S20 WeakPolarHBondContact O-CB 3.43Å; I16-S20 PolarHBondContact O-N 3.18Å
17	Q	74.5	Confident	68.4	Low	108 Å²	108	84.1 Å²	84.1	51%	0.505	45%	0.446	S	S	.	.	H	α-helix	trans	-64	-46.8	178.7	-173.8	169.8	-8.8	0	0	110.6	A13 A14 T15 A19 S20 T21	A13-Q17 WeakPolarHBondContact O-CB 3.28Å; A13-Q17 PolarHBondContact O-N 3.46Å; A14-Q17 PolarHBondContact O-N 3.38Å; T15-Q17 VanDerWaalsContact C-N 3.35Å; Q17-A19 VanDerWaalsContact C-N 3.32Å; Q17-A19 PolarHBondContact O-N 2.97Å; Q17-S20 CarbonylContact O-C 3.57Å; Q17-S20 PolarHBondContact O-N 3.5Å; Q17-S20 VanDerWaalsContact O-N 3.13Å; Q17-T21 WeakPolarHBondContact O-CB 3.23Å; Q17-T21 PolarHBondContact O-N 3.2Å; Q17-T21 PolarHBondContact O-OG1 3.4Å
18	N	72.8	Confident	67.4	Low	109 Å²	109	81.1 Å²	81.1	58%	0.583	43%	0.432	S	S	*	.	H	α-helix	trans	-60.3	-41.8	175.5	-70.7	-9.5	0	0	0	111.6	A14 T15 S20 T21 L22	A14-N18 WeakPolarHBondContact O-CB 3.05Å; A14-N18 PolarHBondContact O-N 2.97Å; A14-N18 PolarHBondContact O-ND2 3.29Å; A14-N18 PolarHBondContact O-OD1 2.81Å; T15-N18 PolarHBondContact O-N 3Å; N18-S20 VanDerWaalsContact C-N 3.34Å; N18-S20 PolarHBondContact O-N 3.16Å; N18-T21 PolarHBondContact O-N 3.1Å; N18-L22 WeakPolarHBondContact O-CB 3.43Å; N18-L22 PolarHBondContact O-N 3.11Å
19	A	66.1	Low	66.8	Low	8 Å²	8	86.9 Å²	86.9	7%	0.066	46%	0.461	C	S	.	.	H	α-helix	trans	-64.2	-38.6	175.5	0	0	0	0	0	112.1	T15 I16 Q17 A23 T38 L41	T15-A19 WeakPolarHBondContact O-CB 3.16Å; T15-A19 PolarHBondContact O-N 3.24Å; I16-A19 PolarHBondContact O-N 3.31Å; Q17-A19 VanDerWaalsContact C-N 3.32Å; Q17-A19 PolarHBondContact O-N 2.97Å; A19-A23 WeakPolarHBondContact O-CB 3.41Å; A19-A23 PolarHBondContact O-N 3.33Å; A19-T38 HydrophobicContact CB-CG2 4.19Å; A19-L41 HydrophobicContact CB-CD2 3.78Å
20	S	65.2	Low	66	Low	80 Å²	80	84.8 Å²	84.8	56%	0.559	45%	0.45	S	S	*	.	H	α-helix	trans	-71.8	-37.9	176	-172.8	0	0	0	0	112.5	I16 Q17 N18 A23 G24	I16-S20 WeakPolarHBondContact O-CB 3.43Å; I16-S20 PolarHBondContact O-N 3.18Å; Q17-S20 CarbonylContact O-C 3.57Å; Q17-S20 PolarHBondContact O-N 3.5Å; Q17-S20 VanDerWaalsContact O-N 3.13Å; N18-S20 VanDerWaalsContact C-N 3.34Å; N18-S20 PolarHBondContact O-N 3.16Å; S20-A23 CarbonylContact O-C 3.57Å; S20-A23 PolarHBondContact O-N 2.88Å; S20-G24 PolarHBondContact O-N 2.72Å
21	T	66.2	Low	65.3	Low	53 Å²	53	84.6 Å²	84.6	33%	0.325	46%	0.459	S	S	.	.	H	α-helix	trans	-66.8	-49.7	175	-57.3	0	0	0	0	109.5	Q17 N18 A23 G24 E25	Q17-T21 WeakPolarHBondContact O-CB 3.23Å; Q17-T21 PolarHBondContact O-N 3.2Å; Q17-T21 PolarHBondContact O-OG1 3.4Å; N18-T21 PolarHBondContact O-N 3.1Å; T21-A23 PolarHBondContact O-N 3.02Å; T21-G24 CarbonylContact O-C 3.58Å; T21-G24 WeakPolarHBondContact O-CA 3.42Å; T21-G24 PolarHBondContact O-N 3.46Å; T21-E25 HydrophobicContact CG2-CG 4.3Å; T21-E25 WeakPolarHBondContact O-CB 3.42Å; T21-E25 WeakPolarHBondContact O-CG 3.42Å; T21-E25 PolarHBondContact O-N 3.43Å
22	L	63.7	Low	65	Low	90 Å²	90	84 Å²	84	47%	0.471	46%	0.457	S	S	.	.	H	α-helix	trans	-55.3	-37.1	172	-175.9	68.4	0	0	0	110.4	N18 M26	N18-L22 WeakPolarHBondContact O-CB 3.43Å; N18-L22 PolarHBondContact O-N 3.11Å; L22-M26 HydrophobicContact CD1-CE 4.25Å; L22-M26 HydrophobicContact CD1-CG 4.17Å; L22-M26 HydrophobicContact CD2-CE 3.84Å; L22-M26 HydrophobicContact CG-CE 3.6Å; L22-M26 HydrophobicContact CG-CG 4.32Å; L22-M26 WeakPolarHBondContact O-CB 3.4Å; L22-M26 VanDerWaalsContact O-CG 3.25Å; L22-M26 WeakPolarHBondContact O-CG 3.15Å; L22-M26 PolarHBondContact O-N 2.04Å
23	A	60.7	Low	64.5	Low	29 Å²	29	83.3 Å²	83.3	24%	0.24	46%	0.461	C	S	.	.	H	α-helix	trans	-73.4	-23.6	176.9	0	0	0	0	0	115.4	A19 S20 T21 M26 F28 T38	A19-A23 WeakPolarHBondContact O-CB 3.41Å; A19-A23 PolarHBondContact O-N 3.33Å; S20-A23 CarbonylContact O-C 3.57Å; S20-A23 PolarHBondContact O-N 2.88Å; T21-A23 PolarHBondContact O-N 3.02Å; A23-M26 VanDerWaalsContact O-O 3.1Å; A23-F28 HydrophobicContact CB-CD2 4.47Å; A23-F28 HydrophobicContact CB-CE2 3.6Å; A23-F28 HydrophobicContact CB-CZ 4.43Å; A23-F28 WeakPolarHBondContact O-CD2 3.39Å; A23-F28 VanDerWaalsContact O-CE2 3.28Å; A23-F28 WeakPolarHBondContact O-CE2 3.38Å; A23-T38 HydrophobicContact CB-CG2 4.3Å
24	G	59.9	Low	63.9	Low	60 Å²	60	81 Å²	81	62%	0.619	44%	0.442	S	S	*	.	H	α-helix	trans	-84.9	-35.8	172.2	0	0	0	0	0	112.8	S20 T21	S20-G24 PolarHBondContact O-N 2.72Å; T21-G24 CarbonylContact O-C 3.58Å; T21-G24 WeakPolarHBondContact O-CA 3.42Å; T21-G24 PolarHBondContact O-N 3.46Å
25	E	60.5	Low	63.8	Low	141 Å²	141	85.2 Å²	85.2	66%	0.659	45%	0.452	S	S	*	.	H	α-helix	trans	-75.2	-42.6	177.9	-74.8	-177.8	178.8	0	0	112.1	T21 R27	T21-E25 HydrophobicContact CG2-CG 4.3Å; T21-E25 WeakPolarHBondContact O-CB 3.42Å; T21-E25 WeakPolarHBondContact O-CG 3.42Å; T21-E25 PolarHBondContact O-N 3.43Å; E25-R27 VanDerWaalsContact C-N 3.27Å; E25-R27 PolarHBondContact O-N 3.12Å
26	M	56	Low	63.8	Low	67 Å²	67	88.7 Å²	88.7	33%	0.33	46%	0.463	S	S	.	.	S	Bend	trans	-64	97.9	161.9	-69.4	-158.7	-79	0	0	106.3	L22 A23 F28 M37	L22-M26 HydrophobicContact CD1-CE 4.25Å; L22-M26 HydrophobicContact CD1-CG 4.17Å; L22-M26 HydrophobicContact CD2-CE 3.84Å; L22-M26 HydrophobicContact CG-CE 3.6Å; L22-M26 HydrophobicContact CG-CG 4.32Å; L22-M26 WeakPolarHBondContact O-CB 3.4Å; L22-M26 VanDerWaalsContact O-CG 3.25Å; L22-M26 WeakPolarHBondContact O-CG 3.15Å; L22-M26 PolarHBondContact O-N 2.04Å; A23-M26 VanDerWaalsContact O-O 3.1Å; M26-F28 HydrophobicContact CB-CD1 4.01Å; M26-F28 HydrophobicContact CB-CD2 3.98Å; M26-F28 HydrophobicContact CB-CE1 3.74Å; M26-F28 HydrophobicContact CB-CE2 3.8Å; M26-F28 HydrophobicContact CB-CG 4.14Å; M26-F28 HydrophobicContact CB-CZ 3.69Å; M26-F28 HydrophobicContact CE-CE1 3.41Å; M26-F28 VanDerWaalsContact CE-CE1 3.41Å; M26-F28 HydrophobicContact CE-CE2 4.07Å; M26-F28 HydrophobicContact CE-CZ 3.05Å; M26-F28 HydrophobicContact CG-CE1 4.32Å; M26-F28 HydrophobicContact CG-CZ 4.3Å; M26-F28 WeakPolarHBondContact O-CD2 3.25Å; M26-F28 WeakPolarHBondContact O-CG 3.16Å; M26-F28 PolarHBondContact O-N 2.77Å; M26-F28 HydrophobicContact SD-CE1 3.66Å; M26-F28 HydrophobicContact SD-CZ 3.88Å; M26-M37 HydrophobicContact CE-CE 3.72Å; M26-M37 HydrophobicContact SD-CE 4.32Å
27	R	55.3	Low	63.7	Low	233 Å²	233	90 Å²	90	88%	0.879	47%	0.469	S	S	*	.			trans	-61.7	80.4	166.4	-63.8	-177.8	-168.9	169.2	3.9	107.3	E25 I29	E25-R27 VanDerWaalsContact C-N 3.27Å; E25-R27 PolarHBondContact O-N 3.12Å; R27-I29 PolarHBondContact O-N 3.27Å
28	F	50.6	Low	63.5	Low	40 Å²	40	86.1 Å²	86.1	18%	0.175	45%	0.453	C	S	.	.			trans	-67.6	106.1	-177.3	-68.9	-72.6	0	0	0	108.3	A23 M26 D30 A34 M37	A23-F28 HydrophobicContact CB-CD2 4.47Å; A23-F28 HydrophobicContact CB-CE2 3.6Å; A23-F28 HydrophobicContact CB-CZ 4.43Å; A23-F28 WeakPolarHBondContact O-CD2 3.39Å; A23-F28 VanDerWaalsContact O-CE2 3.28Å; A23-F28 WeakPolarHBondContact O-CE2 3.38Å; M26-F28 HydrophobicContact CB-CD1 4.01Å; M26-F28 HydrophobicContact CB-CD2 3.98Å; M26-F28 HydrophobicContact CB-CE1 3.74Å; M26-F28 HydrophobicContact CB-CE2 3.8Å; M26-F28 HydrophobicContact CB-CG 4.14Å; M26-F28 HydrophobicContact CB-CZ 3.69Å; M26-F28 HydrophobicContact CE-CE1 3.41Å; M26-F28 VanDerWaalsContact CE-CE1 3.41Å; M26-F28 HydrophobicContact CE-CE2 4.07Å; M26-F28 HydrophobicContact CE-CZ 3.05Å; M26-F28 HydrophobicContact CG-CE1 4.32Å; M26-F28 HydrophobicContact CG-CZ 4.3Å; M26-F28 WeakPolarHBondContact O-CD2 3.25Å; M26-F28 WeakPolarHBondContact O-CG 3.16Å; M26-F28 PolarHBondContact O-N 2.77Å; M26-F28 HydrophobicContact SD-CE1 3.66Å; M26-F28 HydrophobicContact SD-CZ 3.88Å; F28-D30 PolarHBondContact O-N 3.31Å; F28-A34 HydrophobicContact CB-CB 4.14Å; F28-A34 HydrophobicContact CD1-CB 3.71Å; F28-A34 HydrophobicContact CD2-CB 3.17Å; F28-A34 HydrophobicContact CE1-CB 3.67Å; F28-A34 HydrophobicContact CE2-CB 3Å; F28-A34 HydrophobicContact CG-CB 3.45Å; F28-A34 VanDerWaalsContact CG-CB 3.45Å; F28-A34 HydrophobicContact CZ-CB 3.27Å; F28-M37 HydrophobicContact CE1-CE 3.42Å; F28-M37 VanDerWaalsContact CE1-CE 3.42Å; F28-M37 HydrophobicContact CZ-CE 3.86Å
29	I	59.2	Low	63.5	Low	171 Å²	171	83.1 Å²	83.1	88%	0.877	44%	0.44	S	S	*	.	S	Bend	trans	-56.6	-26.3	163.1	-60.9	170.6	0	0	0	109.1	R27	R27-I29 PolarHBondContact O-N 3.27Å
30	D	59.5	Low	63.9	Low	74 Å²	74	87.3 Å²	87.3	40%	0.396	46%	0.458	S	S	.	.			trans	-126.9	96.4	172.5	-178.4	23.6	0	0	0	113	F28 N32 S33 A34	F28-D30 PolarHBondContact O-N 3.31Å; D30-N32 PolarHBondContact O-N 2.91Å; D30-N32 VanDerWaalsContact O-N 3.08Å; D30-N32 WeakPolarHBondContact OD1-CB 3.21Å; D30-N32 PolarHBondContact OD1-N 3.44Å; D30-S33 PolarHBondContact O-N 3.47Å; D30-S33 VanDerWaalsContact O-N 3.12Å; D30-S33 WeakPolarHBondContact OD2-CB 3.4Å; D30-S33 PolarHBondContact OD2-N 3.46Å; D30-S33 PolarHBondContact OD2-OG 3.19Å; D30-A34 PolarHBondContact O-N 3.39Å
31	L	59.8	Low	64.5	Low	138 Å²	138	86.9 Å²	86.9	72%	0.723	45%	0.449	S	S	*	.	H	α-helix	trans	-54.7	-21.9	172.8	-71.6	168	0	0	0	113.4	A34 F35	L31-A34 WeakPolarHBondContact O-CB 3.17Å; L31-F35 WeakPolarHBondContact O-CB 3.31Å; L31-F35 PolarHBondContact O-N 3.3Å; L31-F35 VanDerWaalsContact O-N 3.12Å
32	N	67.7	Low	64.9	Low	86 Å²	86	88.1 Å²	88.1	46%	0.46	45%	0.451	S	S	.	.	H	α-helix	trans	-73	-41.9	178	-170.1	41.2	0	0	0	111.5	D30 A34 F35 K36	D30-N32 PolarHBondContact O-N 2.91Å; D30-N32 VanDerWaalsContact O-N 3.08Å; D30-N32 WeakPolarHBondContact OD1-CB 3.21Å; D30-N32 PolarHBondContact OD1-N 3.44Å; N32-A34 VanDerWaalsContact C-N 3.33Å; N32-F35 PolarHBondContact O-N 2.89Å; N32-K36 WeakPolarHBondContact O-CG 3.03Å; N32-K36 PolarHBondContact O-N 2.87Å
33	S	63.3	Low	65.5	Low	55 Å²	55	89 Å²	89	39%	0.385	45%	0.453	S	S	.	.	H	α-helix	trans	-65.6	-39.2	176.2	-67.4	0	0	0	0	111.4	D30 F35 K36 M37	D30-S33 PolarHBondContact O-N 3.47Å; D30-S33 VanDerWaalsContact O-N 3.12Å; D30-S33 WeakPolarHBondContact OD2-CB 3.4Å; D30-S33 PolarHBondContact OD2-N 3.46Å; D30-S33 PolarHBondContact OD2-OG 3.19Å; S33-F35 PolarHBondContact O-N 3.41Å; S33-K36 PolarHBondContact O-N 2.85Å; S33-M37 WeakPolarHBondContact O-CG 3.42Å; S33-M37 PolarHBondContact O-N 2.67Å
34	A	61.5	Low	65.9	Low	7 Å²	7	95.5 Å²	95.5	6%	0.058	47%	0.471	C	S	.	.	H	α-helix	trans	-53.4	-52.1	169.6	0	0	0	0	0	113.5	F28 D30 L31 N32 K36 M37 T38	F28-A34 HydrophobicContact CB-CB 4.14Å; F28-A34 HydrophobicContact CD1-CB 3.71Å; F28-A34 HydrophobicContact CD2-CB 3.17Å; F28-A34 HydrophobicContact CE1-CB 3.67Å; F28-A34 HydrophobicContact CE2-CB 3Å; F28-A34 HydrophobicContact CG-CB 3.45Å; F28-A34 VanDerWaalsContact CG-CB 3.45Å; F28-A34 HydrophobicContact CZ-CB 3.27Å; D30-A34 PolarHBondContact O-N 3.39Å; L31-A34 WeakPolarHBondContact O-CB 3.17Å; N32-A34 VanDerWaalsContact C-N 3.33Å; A34-K36 VanDerWaalsContact C-N 3.34Å; A34-K36 PolarHBondContact O-N 2.82Å; A34-M37 PolarHBondContact O-N 2.9Å; A34-T38 WeakPolarHBondContact O-CG2 3.49Å; A34-T38 PolarHBondContact O-N 2.95Å; A34-T38 PolarHBondContact O-OG1 3.05Å
35	F	70	Confident	66.3	Low	131 Å²	131	93.9 Å²	93.9	58%	0.575	45%	0.449	S	S	*	.	H	α-helix	trans	-63.9	-42.1	-177.9	-177.6	-100.6	0	0	0	110.8	L31 N32 S33 T38 C39	L31-F35 WeakPolarHBondContact O-CB 3.31Å; L31-F35 PolarHBondContact O-N 3.3Å; L31-F35 VanDerWaalsContact O-N 3.12Å; N32-F35 PolarHBondContact O-N 2.89Å; S33-F35 PolarHBondContact O-N 3.41Å; F35-T38 WeakPolarHBondContact CA-OG1 3.47Å; F35-T38 PolarHBondContact O-N 3.19Å; F35-T38 PolarHBondContact O-OG1 2.91Å; F35-C39 VanDerWaalsContact CE1-SG 3.55Å; F35-C39 WeakPolarHBondContact CZ-SG 3.31Å; F35-C39 WeakPolarHBondContact O-CB 3.05Å; F35-C39 PolarHBondContact O-N 3.29Å; F35-C39 PolarHBondContact O-SG 3.48Å; F35-C39 VanDerWaalsContact O-SG 3.32Å
36	K	73.4	Confident	66.8	Low	118 Å²	118	90.2 Å²	90.2	51%	0.513	44%	0.436	S	S	.	.	H	α-helix	trans	-60.6	-47.6	174.8	-74.2	179.3	-179.1	-177.6	0	112.2	N32 S33 A34 T38 C39 E40	N32-K36 WeakPolarHBondContact O-CG 3.03Å; N32-K36 PolarHBondContact O-N 2.87Å; S33-K36 PolarHBondContact O-N 2.85Å; A34-K36 VanDerWaalsContact C-N 3.34Å; A34-K36 PolarHBondContact O-N 2.82Å; K36-T38 VanDerWaalsContact C-N 3.35Å; K36-T38 PolarHBondContact O-N 3.27Å; K36-C39 PolarHBondContact O-N 3.46Å; K36-E40 WeakPolarHBondContact O-CB 3.43Å; K36-E40 WeakPolarHBondContact O-CG 3.38Å; K36-E40 PolarHBondContact O-N 3.07Å
37	M	71	Confident	67.5	Low	92 Å²	92	91 Å²	91	45%	0.453	44%	0.442	S	S	.	.	H	α-helix	trans	-63.4	-40.9	178.9	-72.2	-166.8	-66.8	0	0	112.4	M26 F28 S33 A34 E40 L41	M26-M37 HydrophobicContact CE-CE 3.72Å; M26-M37 HydrophobicContact SD-CE 4.32Å; F28-M37 HydrophobicContact CE1-CE 3.42Å; F28-M37 VanDerWaalsContact CE1-CE 3.42Å; F28-M37 HydrophobicContact CZ-CE 3.86Å; S33-M37 WeakPolarHBondContact O-CG 3.42Å; S33-M37 PolarHBondContact O-N 2.67Å; A34-M37 PolarHBondContact O-N 2.9Å; M37-E40 PolarHBondContact O-N 3Å; M37-L41 WeakPolarHBondContact O-CB 3.49Å; M37-L41 PolarHBondContact O-N 3.09Å
38	T	71.5	Confident	68.1	Low	27 Å²	27	85.8 Å²	85.8	17%	0.166	43%	0.431	C	S	.	.	H	α-helix	trans	-68.1	-39	177	46.9	0	0	0	0	112.2	A19 A23 A34 F35 K36 L41 Q42	A19-T38 HydrophobicContact CB-CG2 4.19Å; A23-T38 HydrophobicContact CB-CG2 4.3Å; A34-T38 WeakPolarHBondContact O-CG2 3.49Å; A34-T38 PolarHBondContact O-N 2.95Å; A34-T38 PolarHBondContact O-OG1 3.05Å; F35-T38 WeakPolarHBondContact CA-OG1 3.47Å; F35-T38 PolarHBondContact O-N 3.19Å; F35-T38 PolarHBondContact O-OG1 2.91Å; K36-T38 VanDerWaalsContact C-N 3.35Å; K36-T38 PolarHBondContact O-N 3.27Å; T38-L41 PolarHBondContact O-N 2.85Å; T38-Q42 WeakPolarHBondContact O-CB 3.49Å; T38-Q42 VanDerWaalsContact O-CG 3.25Å; T38-Q42 WeakPolarHBondContact O-CG 3.46Å; T38-Q42 PolarHBondContact O-N 3.44Å
39	C	73.3	Confident	68.9	Low	45 Å²	45	85.8 Å²	85.8	30%	0.304	43%	0.432	S	S	.	.	H	α-helix	trans	-65.7	-42.9	172.6	-73.3	0	0	0	0	112.7	F35 K36 L41 Q42 Q43	F35-C39 VanDerWaalsContact CE1-SG 3.55Å; F35-C39 WeakPolarHBondContact CZ-SG 3.31Å; F35-C39 WeakPolarHBondContact O-CB 3.05Å; F35-C39 PolarHBondContact O-N 3.29Å; F35-C39 PolarHBondContact O-SG 3.48Å; F35-C39 VanDerWaalsContact O-SG 3.32Å; K36-C39 PolarHBondContact O-N 3.46Å; C39-L41 VanDerWaalsContact C-N 3.32Å; C39-L41 PolarHBondContact O-N 3.48Å; C39-Q42 PolarHBondContact O-N 3.45Å; C39-Q43 WeakPolarHBondContact O-CB 3.42Å; C39-Q43 PolarHBondContact O-N 3.35Å
40	E	74.4	Confident	69.3	Low	97 Å²	97	85.2 Å²	85.2	45%	0.453	42%	0.42	S	S	.	.	H	α-helix	trans	-60.9	-42.2	175.2	-77.8	-177	-164.8	0	0	111.2	K36 M37 Q43 R44	K36-E40 WeakPolarHBondContact O-CB 3.43Å; K36-E40 WeakPolarHBondContact O-CG 3.38Å; K36-E40 PolarHBondContact O-N 3.07Å; M37-E40 PolarHBondContact O-N 3Å; E40-Q43 PolarHBondContact O-N 3.45Å; E40-R44 WeakPolarHBondContact O-CG 3.4Å; E40-R44 PolarHBondContact O-N 3.36Å
41	L	77.1	Confident	69.6	Low	70 Å²	70	84.1 Å²	84.1	37%	0.366	42%	0.418	S	S	.	.	H	α-helix	trans	-64	-45.6	175.8	-174.8	65	0	0	0	111.5	T15 A19 M37 T38 C39 Q43 R44 V45	T15-L41 HydrophobicContact CG2-CD2 4.26Å; T15-L41 HydrophobicContact CG2-CG 4.41Å; A19-L41 HydrophobicContact CB-CD2 3.78Å; M37-L41 WeakPolarHBondContact O-CB 3.49Å; M37-L41 PolarHBondContact O-N 3.09Å; T38-L41 PolarHBondContact O-N 2.85Å; C39-L41 VanDerWaalsContact C-N 3.32Å; C39-L41 PolarHBondContact O-N 3.48Å; L41-Q43 VanDerWaalsContact C-N 3.32Å; L41-Q43 PolarHBondContact O-N 3.23Å; L41-R44 PolarHBondContact O-N 2.85Å; L41-V45 VanDerWaalsContact O-CG2 3.27Å; L41-V45 WeakPolarHBondContact O-CG2 3.47Å; L41-V45 PolarHBondContact O-N 3.24Å
42	Q	75.1	Confident	69.5	Low	80 Å²	80	82.2 Å²	82.2	37%	0.374	41%	0.405	S	S	.	.	H	α-helix	trans	-59.2	-42.5	176	-76	171.7	-7.9	0	0	111.9	T38 C39 V45 V46	T38-Q42 WeakPolarHBondContact O-CB 3.49Å; T38-Q42 VanDerWaalsContact O-CG 3.25Å; T38-Q42 WeakPolarHBondContact O-CG 3.46Å; T38-Q42 PolarHBondContact O-N 3.44Å; C39-Q42 PolarHBondContact O-N 3.45Å; Q42-V45 PolarHBondContact O-N 2.93Å; Q42-V46 WeakPolarHBondContact O-CG2 3.44Å; Q42-V46 PolarHBondContact O-N 2.65Å
43	Q	75.4	Confident	69	Low	107 Å²	107	83.5 Å²	83.5	50%	0.5	41%	0.407	S	S	.	.	H	α-helix	trans	-63.9	-46.5	177.1	-174.2	61.2	39.7	0	0	111.4	C39 E40 L41 V45 V46 D47	C39-Q43 WeakPolarHBondContact O-CB 3.42Å; C39-Q43 PolarHBondContact O-N 3.35Å; E40-Q43 PolarHBondContact O-N 3.45Å; L41-Q43 VanDerWaalsContact C-N 3.32Å; L41-Q43 PolarHBondContact O-N 3.23Å; Q43-V45 VanDerWaalsContact C-N 3.28Å; Q43-V45 PolarHBondContact O-N 3.29Å; Q43-V46 PolarHBondContact O-N 2.98Å; Q43-V46 VanDerWaalsContact O-N 3.1Å; Q43-D47 PolarHBondContact NE2-OD1 3.06Å; Q43-D47 VanDerWaalsContact O-CG 3.26Å; Q43-D47 PolarHBondContact O-N 3.18Å
44	R	68.7	Low	68.7	Low	167 Å²	167	87.8 Å²	87.8	63%	0.63	42%	0.418	S	S	*	.	H	α-helix	trans	-59.4	-39.3	176.8	-77	-174.2	178.9	175.6	0.8	112.7	E40 L41 D47 L48	E40-R44 WeakPolarHBondContact O-CG 3.4Å; E40-R44 PolarHBondContact O-N 3.36Å; L41-R44 PolarHBondContact O-N 2.85Å; R44-D47 PolarHBondContact O-N 3.26Å; R44-L48 WeakPolarHBondContact O-CB 3.14Å; R44-L48 PolarHBondContact O-N 3.47Å
45	V	69.7	Low	68.4	Low	25 Å²	25	93.3 Å²	93.3	15%	0.152	44%	0.443	C	S	.	.	H	α-helix	trans	-64.9	-43.8	175.6	174.5	0	0	0	0	110.4	F12 T15 L41 Q42 Q43 D47 L48 I49	F12-V45 HydrophobicContact CD2-CG1 3.67Å; F12-V45 HydrophobicContact CE2-CG1 4.11Å; T15-V45 HydrophobicContact CG2-CG2 3.83Å; L41-V45 VanDerWaalsContact O-CG2 3.27Å; L41-V45 WeakPolarHBondContact O-CG2 3.47Å; L41-V45 PolarHBondContact O-N 3.24Å; Q42-V45 PolarHBondContact O-N 2.93Å; Q43-V45 VanDerWaalsContact C-N 3.28Å; Q43-V45 PolarHBondContact O-N 3.29Å; V45-D47 PolarHBondContact O-N 3.38Å; V45-L48 PolarHBondContact O-N 3.08Å; V45-I49 HydrophobicContact CG1-CD1 3.87Å; V45-I49 HydrophobicContact CG1-CG1 4.46Å; V45-I49 WeakPolarHBondContact O-CG1 3.45Å; V45-I49 PolarHBondContact O-N 3.02Å
46	V	70.1	Confident	67.5	Low	65 Å²	65	90.7 Å²	90.7	39%	0.394	43%	0.434	S	S	.	.	H	α-helix	trans	-61.8	-43.8	175.7	171.4	0	0	0	0	111.4	F12 Q42 Q43 L48 I49 Y50	F12-V46 HydrophobicContact CE2-CG2 4.49Å; Q42-V46 WeakPolarHBondContact O-CG2 3.44Å; Q42-V46 PolarHBondContact O-N 2.65Å; Q43-V46 PolarHBondContact O-N 2.98Å; Q43-V46 VanDerWaalsContact O-N 3.1Å; V46-L48 VanDerWaalsContact C-N 3.34Å; V46-L48 PolarHBondContact O-N 3.12Å; V46-I49 PolarHBondContact O-N 3.32Å; V46-Y50 WeakPolarHBondContact O-CB 3.25Å; V46-Y50 PolarHBondContact O-N 3.08Å
47	D	70.1	Confident	66.8	Low	84 Å²	84	93.6 Å²	93.6	45%	0.449	44%	0.442	S	S	.	.	H	α-helix	trans	-63	-41.1	178.5	-66.1	-20.9	0	0	0	111.3	Q43 R44 V45 Y50 S51	Q43-D47 PolarHBondContact NE2-OD1 3.06Å; Q43-D47 VanDerWaalsContact O-CG 3.26Å; Q43-D47 PolarHBondContact O-N 3.18Å; R44-D47 PolarHBondContact O-N 3.26Å; V45-D47 PolarHBondContact O-N 3.38Å; D47-Y50 PolarHBondContact O-N 3.22Å; D47-S51 WeakPolarHBondContact O-CB 3.28Å; D47-S51 PolarHBondContact O-N 2.94Å; D47-S51 PolarHBondContact O-OG 2.86Å
48	L	69.5	Low	66.1	Low	123 Å²	123	92.4 Å²	92.4	64%	0.644	44%	0.44	S	S	*	.	H	α-helix	trans	-64.3	-41.3	175.1	-171.2	71.2	0	0	0	111.9	R44 V45 V46 Y50 S51 H52	R44-L48 WeakPolarHBondContact O-CB 3.14Å; R44-L48 PolarHBondContact O-N 3.47Å; V45-L48 PolarHBondContact O-N 3.08Å; V46-L48 VanDerWaalsContact C-N 3.34Å; V46-L48 PolarHBondContact O-N 3.12Å; L48-Y50 VanDerWaalsContact C-N 3.34Å; L48-S51 PolarHBondContact O-OG 2.68Å; L48-H52 VanDerWaalsContact O-CB 3.27Å; L48-H52 WeakPolarHBondContact O-CB 3.46Å; L48-H52 PolarHBondContact O-N 3.3Å
49	I	66.9	Low	65.3	Low	39 Å²	39	96 Å²	96	20%	0.2	46%	0.458	C	S	.	.	H	α-helix	trans	-66.7	-40.1	176.3	-65.3	169.7	0	0	0	110.4	L8 F12 V45 V46 H52 K53	L8-I49 HydrophobicContact CD2-CG1 3.97Å; L8-I49 HydrophobicContact CD2-CG2 4.44Å; F12-I49 HydrophobicContact CD2-CD1 4.23Å; V45-I49 HydrophobicContact CG1-CD1 3.87Å; V45-I49 HydrophobicContact CG1-CG1 4.46Å; V45-I49 WeakPolarHBondContact O-CG1 3.45Å; V45-I49 PolarHBondContact O-N 3.02Å; V46-I49 PolarHBondContact O-N 3.32Å; I49-H52 PolarHBondContact O-N 3.37Å; I49-K53 PolarHBondContact O-N 3.19Å
50	Y	67.3	Low	64.6	Low	160 Å²	160	99.1 Å²	99.1	63%	0.627	47%	0.468	S	S	*	.	H	α-helix	trans	-72.3	-39.3	-179	-157.3	-88.5	0	0	0	111.8	V46 D47 L48 H52 K53 K54	V46-Y50 WeakPolarHBondContact O-CB 3.25Å; V46-Y50 PolarHBondContact O-N 3.08Å; D47-Y50 PolarHBondContact O-N 3.22Å; L48-Y50 VanDerWaalsContact C-N 3.34Å; Y50-H52 VanDerWaalsContact C-N 3.34Å; Y50-K53 PolarHBondContact O-N 2.79Å; Y50-K54 PolarHBondContact O-N 2.8Å
51	S	65.9	Low	63.6	Low	50 Å²	50	96.8 Å²	96.8	35%	0.35	47%	0.465	S	S	.	.	H	α-helix	trans	-62.4	-43.9	171.8	71.2	0	0	0	0	110.4	D47 L48 K53 K54 H55	D47-S51 WeakPolarHBondContact O-CB 3.28Å; D47-S51 PolarHBondContact O-N 2.94Å; D47-S51 PolarHBondContact O-OG 2.86Å; L48-S51 PolarHBondContact O-OG 2.68Å; S51-K53 VanDerWaalsContact C-N 3.35Å; S51-K53 PolarHBondContact O-N 2.94Å; S51-K54 WeakPolarHBondContact O-CA 3.1Å; S51-K54 WeakPolarHBondContact O-CB 3.17Å; S51-K54 PolarHBondContact O-N 3.2Å; S51-K54 VanDerWaalsContact O-N 3.09Å; S51-H55 PolarHBondContact O-CD2 2.92Å; S51-H55 PolarHBondContact O-N 3.29Å
52	H	56.8	Low	62.9	Low	98 Å²	98	98 Å²	98	45%	0.454	47%	0.471	S	S	.	.	H	α-helix	trans	-62.5	-39.3	175.2	-167.2	-89.2	0	0	0	112.4	L48 I49 Y50 K54 H55 L56	L48-H52 VanDerWaalsContact O-CB 3.27Å; L48-H52 WeakPolarHBondContact O-CB 3.46Å; L48-H52 PolarHBondContact O-N 3.3Å; I49-H52 PolarHBondContact O-N 3.37Å; Y50-H52 VanDerWaalsContact C-N 3.34Å; H52-K54 VanDerWaalsContact C-N 3.34Å; H52-H55 PolarHBondContact O-N 2.73Å; H52-L56 VanDerWaalsContact CE1-CD1 3.49Å; H52-L56 WeakPolarHBondContact CE1-CD1 3.46Å; H52-L56 WeakPolarHBondContact ND1-CD1 3.23Å; H52-L56 WeakPolarHBondContact O-CB 3.14Å; H52-L56 WeakPolarHBondContact O-CG 3.14Å; H52-L56 PolarHBondContact O-N 3.18Å
53	K	57.4	Low	62.5	Low	113 Å²	113	98.3 Å²	98.3	49%	0.491	48%	0.478	S	S	.	.	H	α-helix	trans	-64.4	-37.1	172.1	-83.5	-174.8	176.4	179.7	0	112.6	I49 Y50 S51 R57	I49-K53 PolarHBondContact O-N 3.19Å; Y50-K53 PolarHBondContact O-N 2.79Å; S51-K53 VanDerWaalsContact C-N 3.35Å; S51-K53 PolarHBondContact O-N 2.94Å; K53-R57 WeakPolarHBondContact O-CG 3.48Å; K53-R57 PolarHBondContact O-N 2.7Å
54	K	57.6	Low	61.8	Low	145 Å²	145	101.5 Å²	101.5	63%	0.63	49%	0.486	S	S	*	.	H	α-helix	trans	-63.5	-47.7	173.6	-169.5	-178	177.8	-174.3	0	109.7	Y50 S51 H52 L56 R57 T58	Y50-K54 PolarHBondContact O-N 2.8Å; S51-K54 WeakPolarHBondContact O-CA 3.1Å; S51-K54 WeakPolarHBondContact O-CB 3.17Å; S51-K54 PolarHBondContact O-N 3.2Å; S51-K54 VanDerWaalsContact O-N 3.09Å; H52-K54 VanDerWaalsContact C-N 3.34Å; K54-L56 PolarHBondContact O-N 3.28Å; K54-R57 PolarHBondContact O-N 2.96Å; K54-T58 PolarHBondContact O-N 2.97Å; K54-T58 PolarHBondContact O-OG1 3.18Å
55	H	54.6	Low	61.5	Low	123 Å²	123	98.1 Å²	98.1	57%	0.569	48%	0.479	S	S	*	.	H	α-helix	trans	-61.7	-41.3	176.3	-77.8	-71.4	0	0	0	113.1	S51 H52 T58 L59	S51-H55 PolarHBondContact O-CD2 2.92Å; S51-H55 PolarHBondContact O-N 3.29Å; H52-H55 PolarHBondContact O-N 2.73Å; H55-T58 PolarHBondContact O-N 3.19Å; H55-L59 WeakPolarHBondContact O-CB 3.42Å; H55-L59 PolarHBondContact O-N 2.78Å
56	L	52.8	Low	61.3	Low	77 Å²	77	104 Å²	104	40%	0.403	50%	0.503	S	S	.	.	H	α-helix	trans	-62.5	-44.1	174.6	-83.4	167.1	0	0	0	111.9	H52 K54 T58 L59 E60	H52-L56 VanDerWaalsContact CE1-CD1 3.49Å; H52-L56 WeakPolarHBondContact CE1-CD1 3.46Å; H52-L56 WeakPolarHBondContact ND1-CD1 3.23Å; H52-L56 WeakPolarHBondContact O-CB 3.14Å; H52-L56 WeakPolarHBondContact O-CG 3.14Å; H52-L56 PolarHBondContact O-N 3.18Å; K54-L56 PolarHBondContact O-N 3.28Å; L56-T58 VanDerWaalsContact C-N 3.32Å; L56-T58 PolarHBondContact O-N 2.95Å; L56-L59 PolarHBondContact O-N 3.15Å; L56-E60 WeakPolarHBondContact O-CB 3.48Å; L56-E60 WeakPolarHBondContact O-CG 3.16Å; L56-E60 PolarHBondContact O-N 3.31Å
57	R	57.6	Low	60.6	Low	179 Å²	179	107.5 Å²	107.5	68%	0.675	52%	0.515	S	S	*	.	H	α-helix	trans	-64.5	-37.9	174.7	-74.7	-175.5	-173.2	176.6	1.6	112.3	K53 K54 A61	K53-R57 WeakPolarHBondContact O-CG 3.48Å; K53-R57 PolarHBondContact O-N 2.7Å; K54-R57 PolarHBondContact O-N 2.96Å; R57-A61 VanDerWaalsContact O-CB 3.32Å; R57-A61 WeakPolarHBondContact O-CB 3.47Å; R57-A61 PolarHBondContact O-N 3.46Å
58	T	56.3	Low	59.9	Low	67 Å²	67	109.8 Å²	109.8	41%	0.411	52%	0.523	S	S	.	.	H	α-helix	trans	-66.9	-41.3	175.9	-54.7	0	0	0	0	110.9	K54 H55 L56 A61 I62	K54-T58 PolarHBondContact O-N 2.97Å; K54-T58 PolarHBondContact O-OG1 3.18Å; H55-T58 PolarHBondContact O-N 3.19Å; L56-T58 VanDerWaalsContact C-N 3.32Å; L56-T58 PolarHBondContact O-N 2.95Å; T58-A61 PolarHBondContact O-N 3.2Å; T58-I62 HydrophobicContact CG2-CD1 3.93Å; T58-I62 WeakPolarHBondContact O-CB 3.48Å; T58-I62 WeakPolarHBondContact O-CD1 3.12Å; T58-I62 WeakPolarHBondContact O-CG1 3.42Å; T58-I62 PolarHBondContact O-N 3Å
59	L	54.5	Low	59.2	Low	103 Å²	103	108.6 Å²	108.6	54%	0.539	52%	0.517	S	S	.	.	H	α-helix	trans	-65.2	-45.1	174.4	-86.7	162.4	0	0	0	111.9	H55 L56 A61 I62 V63	H55-L59 WeakPolarHBondContact O-CB 3.42Å; H55-L59 PolarHBondContact O-N 2.78Å; L56-L59 PolarHBondContact O-N 3.15Å; L59-A61 VanDerWaalsContact C-N 3.28Å; L59-A61 PolarHBondContact O-N 3.12Å; L59-I62 PolarHBondContact O-N 2.98Å; L59-V63 WeakPolarHBondContact O-CB 3.44Å; L59-V63 VanDerWaalsContact O-CG2 3.27Å; L59-V63 WeakPolarHBondContact O-CG2 3.35Å; L59-V63 PolarHBondContact O-N 3.31Å
60	E	58.3	Low	58.4	Low	110 Å²	110	111.6 Å²	111.6	51%	0.514	54%	0.537	S	S	.	.	H	α-helix	trans	-59.4	-39.3	173.9	-78.2	177.8	178.4	0	0	111.7	L56 R64	L56-E60 WeakPolarHBondContact O-CB 3.48Å; L56-E60 WeakPolarHBondContact O-CG 3.16Å; L56-E60 PolarHBondContact O-N 3.31Å; E60-R64 WeakPolarHBondContact O-CG 3.32Å; E60-R64 PolarHBondContact O-N 3.34Å
61	A	54.4	Low	57.4	Low	48 Å²	48	108.1 Å²	108.1	40%	0.397	54%	0.537	S	S	.	.	H	α-helix	trans	-66.3	-44.6	174.7	0	0	0	0	0	112	R57 T58 L59 V63 R64 I65	R57-A61 VanDerWaalsContact O-CB 3.32Å; R57-A61 WeakPolarHBondContact O-CB 3.47Å; R57-A61 PolarHBondContact O-N 3.46Å; T58-A61 PolarHBondContact O-N 3.2Å; L59-A61 VanDerWaalsContact C-N 3.28Å; L59-A61 PolarHBondContact O-N 3.12Å; A61-V63 VanDerWaalsContact C-N 3.33Å; A61-V63 PolarHBondContact O-N 3.46Å; A61-R64 PolarHBondContact O-N 2.99Å; A61-I65 VanDerWaalsContact O-CG1 3.28Å; A61-I65 WeakPolarHBondContact O-CG1 3.36Å; A61-I65 PolarHBondContact O-N 3.4Å
62	I	61.2	Low	56.4	Low	94 Å²	94	109.7 Å²	109.7	48%	0.482	55%	0.547	S	S	.	.	H	α-helix	trans	-62.6	-40.5	176.7	-68.9	163.5	0	0	0	110.8	T58 L59 I65 K66	T58-I62 HydrophobicContact CG2-CD1 3.93Å; T58-I62 WeakPolarHBondContact O-CB 3.48Å; T58-I62 WeakPolarHBondContact O-CD1 3.12Å; T58-I62 WeakPolarHBondContact O-CG1 3.42Å; T58-I62 PolarHBondContact O-N 3Å; L59-I62 PolarHBondContact O-N 2.98Å; I62-I65 PolarHBondContact O-N 2.95Å; I62-K66 WeakPolarHBondContact O-CB 3.2Å; I62-K66 PolarHBondContact O-N 2.85Å
63	V	68.3	Low	55.5	Low	87 Å²	87	111.9 Å²	111.9	53%	0.527	56%	0.562	S	S	.	*	H	α-helix	trans	-64.6	-41.4	176.8	171.1	0	0	0	0	111.1	L59 A61 K66 Q67	L59-V63 WeakPolarHBondContact O-CB 3.44Å; L59-V63 VanDerWaalsContact O-CG2 3.27Å; L59-V63 WeakPolarHBondContact O-CG2 3.35Å; L59-V63 PolarHBondContact O-N 3.31Å; A61-V63 VanDerWaalsContact C-N 3.33Å; A61-V63 PolarHBondContact O-N 3.46Å; V63-K66 PolarHBondContact O-N 3.48Å; V63-Q67 WeakPolarHBondContact O-CB 3.32Å; V63-Q67 PolarHBondContact O-N 2.93Å
64	R	59.2	Low	54.6	Low	174 Å²	174	113.7 Å²	113.7	66%	0.657	58%	0.577	S	S	*	*	H	α-helix	trans	-63.9	-44.9	175.1	-75.6	-173.9	-171.5	-169.1	1.7	112.7	E60 A61 K66 Q67 E68	E60-R64 WeakPolarHBondContact O-CG 3.32Å; E60-R64 PolarHBondContact O-N 3.34Å; A61-R64 PolarHBondContact O-N 2.99Å; R64-K66 VanDerWaalsContact C-N 3.31Å; R64-K66 PolarHBondContact O-N 2.85Å; R64-Q67 PolarHBondContact O-N 3.49Å; R64-Q67 VanDerWaalsContact O-N 3.13Å; R64-E68 PolarHBondContact O-N 3.38Å
65	I	62.6	Low	53.4	Low	97 Å²	97	114.8 Å²	114.8	50%	0.497	59%	0.589	S	S	.	*	H	α-helix	trans	-58	-47.7	176.4	-67.1	163.7	0	0	0	109.7	A61 I62 Q67 E68 D69	A61-I65 VanDerWaalsContact O-CG1 3.28Å; A61-I65 WeakPolarHBondContact O-CG1 3.36Å; A61-I65 PolarHBondContact O-N 3.4Å; I62-I65 PolarHBondContact O-N 2.95Å; I65-Q67 VanDerWaalsContact C-N 3.27Å; I65-Q67 PolarHBondContact O-N 3.5Å; I65-E68 PolarHBondContact O-N 3.12Å; I65-D69 VanDerWaalsContact O-CG 3.28Å; I65-D69 PolarHBondContact O-N 3.36Å
66	K	65.2	Low	52.1	Low	149 Å²	149	111.9 Å²	111.9	65%	0.648	59%	0.592	S	S	*	*	H	α-helix	trans	-63.2	-32.1	178.6	-154.4	176.2	-177.6	-175.4	0	112.8	I62 V63 R64 T70	I62-K66 WeakPolarHBondContact O-CB 3.2Å; I62-K66 PolarHBondContact O-N 2.85Å; V63-K66 PolarHBondContact O-N 3.48Å; R64-K66 VanDerWaalsContact C-N 3.31Å; R64-K66 PolarHBondContact O-N 2.85Å; K66-T70 PolarHBondContact O-N 2.85Å; K66-T70 PolarHBondContact O-OG1 2.77Å
67	Q	56	Low	51	Low	138 Å²	138	117.2 Å²	117.2	65%	0.645	62%	0.615	S	S	*	*	H	α-helix	trans	-75.2	-34.7	177.8	-151.4	171.3	20.5	0	0	112.5	V63 R64 I65 T70 S71	V63-Q67 WeakPolarHBondContact O-CB 3.32Å; V63-Q67 PolarHBondContact O-N 2.93Å; R64-Q67 PolarHBondContact O-N 3.49Å; R64-Q67 VanDerWaalsContact O-N 3.13Å; I65-Q67 VanDerWaalsContact C-N 3.27Å; I65-Q67 PolarHBondContact O-N 3.5Å; Q67-T70 PolarHBondContact O-N 3.41Å; Q67-S71 PolarHBondContact O-N 3.45Å; Q67-S71 PolarHBondContact O-OG 3.13Å
68	E	55.4	Low	49.7	Very low	131 Å²	131	114.4 Å²	114.4	61%	0.612	62%	0.623	S	S	*	*	H	α-helix	trans	-70	-37.7	172	-76.8	175.3	174.3	0	0	112	R64 I65 T70 S71 S72	R64-E68 PolarHBondContact O-N 3.38Å; I65-E68 PolarHBondContact O-N 3.12Å; E68-T70 VanDerWaalsContact C-N 3.26Å; E68-T70 PolarHBondContact O-N 3.39Å; E68-S71 WeakPolarHBondContact CA-OG 3.37Å; E68-S71 PolarHBondContact O-N 3.48Å; E68-S71 PolarHBondContact O-OG 3.33Å; E68-S72 PolarHBondContact O-N 2.81Å; E68-S72 VanDerWaalsContact O-N 3.15Å; E68-S72 PolarHBondContact O-OG 2.97Å
69	D	54.2	Low	48.3	Very low	99 Å²	99	120.9 Å²	120.9	53%	0.529	65%	0.649	S	S	.	*	H	α-helix	trans	-67.3	-27.6	175	-67.1	-25.2	0	0	0	112.4	I65	I65-D69 VanDerWaalsContact O-CG 3.28Å; I65-D69 PolarHBondContact O-N 3.36Å
70	T	50.6	Low	47.1	Very low	101 Å²	101	121.7 Å²	121.7	62%	0.62	66%	0.662	S	S	*	*	H	α-helix	trans	-82.8	-25.6	177.2	-40.5	0	0	0	0	112.2	K66 Q67 E68	K66-T70 PolarHBondContact O-N 2.85Å; K66-T70 PolarHBondContact O-OG1 2.77Å; Q67-T70 PolarHBondContact O-N 3.41Å; E68-T70 VanDerWaalsContact C-N 3.26Å; E68-T70 PolarHBondContact O-N 3.39Å
71	S	46.6	Very low	45.6	Very low	88 Å²	88	124 Å²	124	62%	0.615	67%	0.672	S	S	*	*	H	α-helix	trans	-89.9	-14.3	-179.6	39.1	0	0	0	0	113.8	Q67 E68	Q67-S71 PolarHBondContact O-N 3.45Å; Q67-S71 PolarHBondContact O-OG 3.13Å; E68-S71 WeakPolarHBondContact CA-OG 3.37Å; E68-S71 PolarHBondContact O-N 3.48Å; E68-S71 PolarHBondContact O-OG 3.33Å
72	S	44.4	Very low	44.4	Very low	82 Å²	82	129.3 Å²	129.3	57%	0.573	69%	0.689	S	S	*	*	S	Bend	trans	-92.4	-6.1	177.4	49.5	0	0	0	0	114.8	E68	E68-S72 PolarHBondContact O-N 2.81Å; E68-S72 VanDerWaalsContact O-N 3.15Å; E68-S72 PolarHBondContact O-OG 2.97Å
73	N	38.5	Very low	42.6	Very low	144 Å²	144	133.8 Å²	133.8	77%	0.77	71%	0.708	S	S	*	*	S	Bend	trans	-100.8	17	-179.9	-109.9	-6.6	0	0	0	115.3
74	L	38	Very low	40.7	Very low	152 Å²	152	136 Å²	136	80%	0.796	72%	0.722	S	S	*	*			trans	-110.7	25.3	170.8	-70.9	175.3	0	0	0	113.3
75	N	33.1	Very low	39	Very low	168 Å²	168	138.2 Å²	138.2	90%	0.898	73%	0.73	S	S	*	*			trans	-102.5	61.1	164.7	-87.4	9.9	0	0	0	110.3
76	G	27.6	Very low	37.3	Very low	61 Å²	61	141.3 Å²	141.3	63%	0.629	75%	0.748	S	S	*	*	S	Bend	trans	-128.3	96.1	163.5	0	0	0	0	0	108
77	E	29	Very low	35.4	Very low	189 Å²	189	142 Å²	142	88%	0.883	75%	0.754	S	S	*	*			trans	46.2	101.1	154.6	-63.2	172.7	129.8	0	0	118.2
78	S	30	Very low	34.2	Very low	121 Å²	121	141.1 Å²	141.1	85%	0.846	76%	0.762	S	S	*	*				-173.9	108.3	122.3	-80.7	0	0	0	0	110.7	C80	S78-C80 PolarHBondContact O-N 3.23Å
79	Q	27.4	Very low	32.6	Very low	202 Å²	202	143.6 Å²	143.6	94%	0.944	77%	0.774	S	S	*	*			trans	-55.3	112.8	148	-81.1	173.2	-32.5	0	0	108.2
80	C	29.5	Very low	31.3	Very low	121 Å²	121	145 Å²	145	82%	0.818	79%	0.785	S	S	*	*			trans	-151.7	142.8	140.1	-145.9	0	0	0	0	111.2	S78	S78-C80 PolarHBondContact O-N 3.23Å
81	Q	26.7	Very low	30.1	Very low	157 Å²	157	147 Å²	147	73%	0.734	79%	0.793	S	S	*	*			trans	-57	154	-168.6	-74.6	158.5	-0.7	0	0	117
82	Q	27.8	Very low	29	Very low	161 Å²	161	151 Å²	151	75%	0.752	80%	0.802	S	S	*	*			trans	67	99.9	136.2	-72.7	169.9	-7.7	0	0	120.1
83	Q	24.4	Very low	28.3	Very low	188 Å²	188	155.5 Å²	155.5	88%	0.879	81%	0.813	S	S	*	*				39.6	95.5	106.3	-159	175.1	33.5	0	0	118.9
84	T	28.1	Very low	27.7	Very low	132 Å²	132	153.8 Å²	153.8	81%	0.81	81%	0.808	S	S	*	*			trans	-163.6	106.4	141.2	39	0	0	0	0	106.9
85	R	23.6	Very low	27.1	Very low	222 Å²	222	152.7 Å²	152.7	84%	0.838	80%	0.803	S	S	*	*				30.5	97.5	92.2	-158.2	177.9	-172.2	171.7	1.9	114.2
86	D	27.8	Very low	27	Very low	162 Å²	162	153.7 Å²	153.7	87%	0.866	80%	0.802	S	S	*	*			trans	-161.2	142.9	133.9	-108.6	-25	0	0	0	111.5
87	E	24.7	Very low	27	Very low	164 Å²	164	158.7 Å²	158.7	77%	0.766	81%	0.809	S	S	*	*			trans	-92.8	135.1	-178.5	-68.1	166.2	110.5	0	0	110.6
88	S	30.7	Very low	27.1	Very low	119 Å²	119	156.7 Å²	156.7	83%	0.832	80%	0.804	S	S	*	*			trans	178.1	104.8	154.9	-87.5	0	0	0	0	106.8
89	E	21.4	Very low	26.8	Very low	183 Å²	183	157.7 Å²	157.7	86%	0.855	80%	0.8	S	S	*	*				59	118	73	-115.4	-177.2	-166.9	0	0	114.9
90	V	26.5	Very low	27	Very low	127 Å²	127	154.6 Å²	154.6	77%	0.77	80%	0.795	S	S	*	*			trans	78.4	109	156.1	-166.7	0	0	0	0	118.6
91	D	26.9	Very low	26.6	Very low	145 Å²	145	153.8 Å²	153.8	78%	0.775	79%	0.79	S	S	*	*				-161.9	139.3	110.7	-155.3	19.7	0	0	0	113.3
92	E	23.6	Very low	26.4	Very low	171 Å²	171	151.8 Å²	151.8	80%	0.799	79%	0.789	S	S	*	*			trans	-103.2	129.1	177.7	-105.3	-178.8	117.1	0	0	109.1
93	Q	29.2	Very low	26.3	Very low	176 Å²	176	151.7 Å²	151.7	82%	0.822	79%	0.793	S	S	*	*			trans	-161	105.6	160.8	-129.5	170	-2.6	0	0	107.7
94	V	26.6	Very low	26.2	Very low	108 Å²	108	149.3 Å²	149.3	66%	0.655	79%	0.786	S	S	*	*				70	112.8	64.2	-173	0	0	0	0	114
95	D	24.1	Very low	26.3	Very low	130 Å²	130	149.8 Å²	149.8	70%	0.695	78%	0.784	S	S	*	*			trans	60.6	110.2	155	-63.6	-30.5	0	0	0	122.5
96	H	30.4	Very low	26.3	Very low	189 Å²	189	147 Å²	147	88%	0.875	78%	0.781	S	S	*	*			trans	-141	89.7	135	-101.7	-8.3	0	0	0	111
97	E	28.5	Very low	26.4	Very low	165 Å²	165	147 Å²	147	77%	0.771	78%	0.78	S	S	*	*			trans	-67.4	124	149.8	-73.2	-172.5	124.8	0	0	108.6
98	N	31.4	Very low	26.2	Very low	147 Å²	147	144.3 Å²	144.3	79%	0.786	78%	0.779	S	S	*	*			trans	-118.5	94	166.5	-117.8	-2.2	0	0	0	108.2
99	N	23.2	Very low	25.9	Very low	143 Å²	143	141.6 Å²	141.6	77%	0.765	77%	0.77	S	S	*	*			trans	-76.3	123.5	159.3	-82.7	-31.3	0	0	0	108.4
100	V	31.1	Very low	26	Very low	137 Å²	137	139.6 Å²	139.6	83%	0.83	77%	0.765	S	S	*	*			trans	-130.5	120	157.9	178.6	0	0	0	0	109
101	S	22.6	Very low	25.9	Very low	103 Å²	103	140.6 Å²	140.6	72%	0.72	77%	0.766	S	S	*	*			trans	-76.2	151.3	-175.7	-55.9	0	0	0	0	114.1
102	V	22.9	Very low	25.9	Very low	115 Å²	115	138.6 Å²	138.6	70%	0.697	76%	0.763	S	S	*	*			trans	3.6	124	140.5	-173.4	0	0	0	0	117.6
103	N	24.6	Very low	25.9	Very low	159 Å²	159	139.7 Å²	139.7	85%	0.85	77%	0.769	S	S	*	*			trans	-118.6	121.6	144.1	-94.7	-8.2	0	0	0	109
104	N	21.7	Very low	25.9	Very low	138 Å²	138	140.7 Å²	140.7	74%	0.738	77%	0.773	S	S	*	*			trans	-87.3	140.1	156.6	-77.5	-33.4	0	0	0	107.4
105	D	30.3	Very low	25.7	Very low	142 Å²	142	138.9 Å²	138.9	76%	0.759	78%	0.776	S	S	*	*			trans	-157.6	105.6	150.1	-81.6	-38	0	0	0	104.4
106	E	23.9	Very low	25.6	Very low	164 Å²	164	141.9 Å²	141.9	77%	0.766	79%	0.786	S	S	*	*				84.9	139.2	73.3	-160.3	175.7	167.6	0	0	112.6
107	L	29.5	Very low	25.6	Very low	161 Å²	161	144.6 Å²	144.6	84%	0.843	79%	0.789	S	S	*	*			trans	105.8	135.2	168.1	-58.2	156.6	0	0	0	115.8
108	S	21.8	Very low	25.3	Very low	108 Å²	108	144 Å²	144	76%	0.755	79%	0.788	S	S	*	*			cis	179.7	137.5	-21	-164.8	0	0	0	0	106.4
109	G	23.3	Very low	25.2	Very low	62 Å²	62	142.9 Å²	142.9	64%	0.639	79%	0.79	S	S	*	*			trans	78.8	153.6	149.2	0	0	0	0	0	118.7
110	N	23.8	Very low	25.2	Very low	142 Å²	142	142.2 Å²	142.2	76%	0.759	79%	0.786	S	S	*	*			cis	-173.9	161.9	-3.6	-104.2	-16.1	0	0	0	107.3
111	N	24.4	Very low	25.3	Very low	148 Å²	148	142.3 Å²	142.3	79%	0.791	79%	0.788	S	S	*	*			trans	76.3	132	153.7	-67.2	-1.4	0	0	0	117.2
112	S	27.7	Very low	25.3	Very low	102 Å²	102	145 Å²	145	71%	0.713	79%	0.789	S	S	*	*			cis	-155.7	145.1	11.3	-74.4	0	0	0	0	110.2
113	Q	23.4	Very low	25.4	Very low	195 Å²	195	145.6 Å²	145.6	91%	0.911	79%	0.788	S	S	*	*			trans	-75.7	126.6	156.5	-75.1	176.8	-68.4	0	0	109.8
114	E	27.9	Very low	25.5	Very low	196 Å²	196	143.6 Å²	143.6	92%	0.916	78%	0.782	S	S	*	*			trans	-169	122.9	153.9	-128.3	156	176.5	0	0	104.2
115	G	23.6	Very low	25.9	Very low	70 Å²	70	143.5 Å²	143.5	72%	0.722	78%	0.781	S	S	*	*			cis	141.8	109.9	42.8	0	0	0	0	0	104.7
116	Q	22.1	Very low	25.6	Very low	194 Å²	194	145.1 Å²	145.1	91%	0.907	78%	0.781	S	S	*	*			trans	-2.1	130.1	164.6	-63.6	166.9	-37.5	0	0	118.4
117	R	29.1	Very low	25.7	Very low	245 Å²	245	145.8 Å²	145.8	93%	0.925	79%	0.785	S	S	*	*				-150.7	119.9	128.2	-94.3	-162.9	-166.3	-151	2.7	111.2
118	M	22.7	Very low	25.9	Very low	154 Å²	154	142.8 Å²	142.8	76%	0.759	78%	0.783	S	S	*	*			trans	-61.6	130.7	165.6	-61.8	-88.3	-79.2	0	0	109.4	D120	M118-D120 WeakPolarHBondContact CE-OD2 3.36Å
119	C	29.7	Very low	26.1	Very low	122 Å²	122	145.1 Å²	145.1	82%	0.824	79%	0.785	S	S	*	*			trans	-123.9	74.3	156.5	-79	0	0	0	0	107.3
120	D	22.7	Very low	26.3	Very low	129 Å²	129	150 Å²	150	69%	0.69	80%	0.797	S	S	*	*			trans	-73.4	115.5	153.5	-70.3	-46.1	0	0	0	107	M118	M118-D120 WeakPolarHBondContact CE-OD2 3.36Å
121	T	33.1	Very low	26.1	Very low	140 Å²	140	151.4 Å²	151.4	86%	0.859	80%	0.799	S	S	*	*			trans	-125.2	96.1	156.7	-47.1	0	0	0	0	107
122	E	23.1	Very low	26.1	Very low	160 Å²	160	150.6 Å²	150.6	75%	0.748	80%	0.799	S	S	*	*			trans	-73.6	147.9	174.2	-157.6	-175.1	158.4	0	0	110.5
123	N	24.4	Very low	26	Very low	127 Å²	127	151.5 Å²	151.5	68%	0.679	81%	0.806	S	S	*	*			trans	60	122.7	152.7	-92.8	-31.1	0	0	0	120.2
124	T	27.7	Very low	26.1	Very low	116 Å²	116	146.3 Å²	146.3	71%	0.712	80%	0.796	S	S	*	*				-178.8	137.4	96.3	16.1	0	0	0	0	114.3
125	N	29.8	Very low	25.8	Very low	136 Å²	136	143.5 Å²	143.5	73%	0.727	79%	0.787	S	S	*	*			trans	61.7	109.9	145.5	-60.6	-27.4	0	0	0	119.4
126	K	24.7	Very low	26.2	Very low	176 Å²	176	147.5 Å²	147.5	77%	0.765	79%	0.792	S	S	*	*				61.5	122	76.4	-74.8	-168.1	176.5	-174.6	0	114.9
127	E	25	Very low	26.3	Very low	178 Å²	178	146.4 Å²	146.4	83%	0.832	79%	0.787	S	S	*	*			trans	73.3	104.7	147.6	-71.1	168.1	157.1	0	0	119.1
128	A	35.2	Very low	26.2	Very low	98 Å²	98	141.7 Å²	141.7	81%	0.81	78%	0.779	S	S	*	*				-159.2	100.6	127.6	0	0	0	0	0	109.6
129	I	24.9	Very low	26.3	Very low	157 Å²	157	138.9 Å²	138.9	81%	0.805	77%	0.774	S	S	*	*			trans	-56.9	128.4	158	-64.8	158.6	0	0	0	106.9
130	N	27.5	Very low	26.2	Very low	165 Å²	165	140.2 Å²	140.2	88%	0.882	77%	0.771	S	S	*	*			trans	-149.6	135.8	146.2	-100.5	-30	0	0	0	112.3
131	E	20.4	Very low	26.3	Very low	171 Å²	171	139.1 Å²	139.1	80%	0.799	77%	0.771	S	S	*	*			trans	-84.7	144.2	-168.5	-168.5	174.6	-175.9	0	0	110.5
132	V	23.5	Very low	26.1	Very low	131 Å²	131	137.4 Å²	137.4	79%	0.794	77%	0.765	S	S	*	*			trans	21.5	116.1	153	-171.2	0	0	0	0	117.8
133	S	26.6	Very low	26.2	Very low	122 Å²	122	136.3 Å²	136.3	85%	0.853	76%	0.764	S	S	*	*			trans	-141.8	128.8	140.1	-167.1	0	0	0	0	111.4
134	A	24	Very low	26.4	Very low	85 Å²	85	134.5 Å²	134.5	70%	0.702	77%	0.767	S	S	*	*			trans	-72	157.7	171.4	0	0	0	0	0	110.9
135	N	23	Very low	26.4	Very low	137 Å²	137	136.6 Å²	136.6	73%	0.733	77%	0.773	S	S	*	*			trans	91	94.2	161.4	-147.3	21.8	0	0	0	116
136	N	31.6	Very low	26.1	Very low	155 Å²	155	135.2 Å²	135.2	83%	0.829	77%	0.77	S	S	*	*			trans	-150	97.1	134.4	-86.7	-30.3	0	0	0	107.7
137	Q	23.3	Very low	26.3	Very low	171 Å²	171	133.3 Å²	133.3	80%	0.799	77%	0.773	S	S	*	*			trans	-53.8	129.2	142.7	-69.3	177.2	-0.3	0	0	106.7
138	I	28.1	Very low	26.3	Very low	146 Å²	146	130.9 Å²	130.9	75%	0.749	77%	0.766	S	S	*	*			trans	-171.7	113.9	146.7	-90	142.1	0	0	0	107.6
139	S	24.9	Very low	26.1	Very low	94 Å²	94	131 Å²	131	66%	0.657	76%	0.761	S	S	*	*			trans	43.8	111.9	153.4	60.2	0	0	0	0	119.9	P141	S139-P141 VanDerWaalsContact O-CD 3.28Å; S139-P141 WeakPolarHBondContact O-CD 3.48Å
140	I	26.7	Very low	26.5	Very low	150 Å²	150	127.5 Å²	127.5	77%	0.769	75%	0.747	S	S	*	*			trans	-46.5	117.7	139.1	-58.7	160.3	0	0	0	108.9
141	P	25.1	Very low	26.9	Very low	106 Å²	106	128.8 Å²	128.8	69%	0.688	74%	0.744	S	S	*	*			trans	-87.7	105.1	151.3	25.5	-9.9	0	0	0	106.7	S139 D143	S139-P141 VanDerWaalsContact O-CD 3.28Å; S139-P141 WeakPolarHBondContact O-CD 3.48Å; P141-D143 PolarHBondContact O-N 3.37Å
142	S	28.4	Very low	27.7	Very low	105 Å²	105	128.1 Å²	128.1	73%	0.734	75%	0.747	S	S	*	*			trans	-65.2	81.8	155.7	-58	0	0	0	0	107	A144	S142-A144 VanDerWaalsContact C-N 3.3Å; S142-A144 PolarHBondContact O-N 2.75Å
143	D	26.4	Very low	28.4	Very low	136 Å²	136	125.3 Å²	125.3	73%	0.727	74%	0.737	S	S	*	*			trans	-74.7	98.5	162	-94	-23.6	0	0	0	107.2	P141 L145	P141-D143 PolarHBondContact O-N 3.37Å; D143-L145 PolarHBondContact O-N 3.19Å
144	A	26.8	Very low	28.8	Very low	90 Å²	90	124.7 Å²	124.7	74%	0.744	73%	0.732	S	S	*	*			trans	-51.4	85	157.6	0	0	0	0	0	108.6	S142 T146	S142-A144 VanDerWaalsContact C-N 3.3Å; S142-A144 PolarHBondContact O-N 2.75Å; A144-T146 PolarHBondContact O-N 2.74Å
145	L	28.9	Very low	29	Very low	159 Å²	159	124 Å²	124	83%	0.832	73%	0.732	S	S	*	*			trans	-71.5	86.8	168.5	-96.2	134.5	0	0	0	108	D143 T147	D143-L145 PolarHBondContact O-N 3.19Å; L145-T147 PolarHBondContact O-N 2.99Å
146	T	23.6	Very low	29.5	Very low	108 Å²	108	120.9 Å²	120.9	66%	0.663	73%	0.726	S	S	*	*			trans	-15.6	117.3	156.7	48.9	0	0	0	0	113.3	A144 N148	A144-T146 PolarHBondContact O-N 2.74Å; T146-N148 PolarHBondContact O-N 3.41Å
147	T	27.6	Very low	29.9	Very low	136 Å²	136	119.1 Å²	119.1	83%	0.834	72%	0.723	S	S	*	*			trans	-55.4	95.1	167.2	50.4	0	0	0	0	110.6	L145	L145-T147 PolarHBondContact O-N 2.99Å
148	N	26.6	Very low	30.8	Very low	126 Å²	126	116.9 Å²	116.9	67%	0.674	72%	0.716	S	S	*	*			trans	-140.7	117.6	164.1	-74.7	-39.2	0	0	0	109.3	T146	T146-N148 PolarHBondContact O-N 3.41Å
149	S	29.7	Very low	32	Very low	102 Å²	102	116.8 Å²	116.8	71%	0.713	72%	0.717	S	S	*	*	S	Bend	trans	76.1	93	161.6	-152.7	0	0	0	0	117.6
150	T	33.2	Very low	33.9	Very low	83 Å²	83	120.6 Å²	120.6	51%	0.509	72%	0.722	S	S	.	*			trans	-174	78.2	135.9	21.4	0	0	0	0	107.6	D152 T173	T150-D152 PolarHBondContact O-N 2.66Å; T150-T173 HydrophobicContact CG2-CG2 3.1Å
151	K	37	Very low	36	Very low	191 Å²	191	115.9 Å²	115.9	83%	0.83	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	-1.9	-178	-137.6	175.1	-176.7	178.2	0	113.2
152	D	36.9	Very low	38.5	Very low	158 Å²	158	120 Å²	120	85%	0.845	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	-3.5	-169	-65	-30.5	0	0	0	115.4	T150	T150-D152 PolarHBondContact O-N 2.66Å
153	A	38.4	Very low	40.9	Very low	71 Å²	71	116.8 Å²	116.8	59%	0.587	67%	0.673	S	S	*	*	S	Bend	trans	-90.4	-7.4	166.3	0	0	0	0	0	113.3	G155	A153-G155 VanDerWaalsContact C-N 3.29Å; A153-G155 PolarHBondContact O-N 3.18Å
154	C	34	Very low	43.5	Very low	110 Å²	110	111.7 Å²	111.7	74%	0.743	65%	0.647	S	S	*	*			trans	-91.9	35.4	-177.2	-70	0	0	0	0	113.5	A156	C154-A156 PolarHBondContact O-N 2.92Å
155	G	29.3	Very low	45.9	Very low	70 Å²	70	109.3 Å²	109.3	72%	0.722	62%	0.624	S	S	*	*			trans	-68.3	93.5	173.3	0	0	0	0	0	111.9	A153	A153-G155 VanDerWaalsContact C-N 3.29Å; A153-G155 PolarHBondContact O-N 3.18Å
156	A	33.2	Very low	48.1	Very low	71 Å²	71	103.3 Å²	103.3	59%	0.587	59%	0.593	S	S	*	*			trans	56.4	126.1	172.2	0	0	0	0	0	116.4	C154 N158	C154-A156 PolarHBondContact O-N 2.92Å; A156-N158 PolarHBondContact O-N 3.36Å
157	P	39.9	Very low	50.4	Low	119 Å²	119	104.9 Å²	104.9	77%	0.773	59%	0.593	S	S	*	*			trans	-74.9	75.5	177.7	34.8	-34.1	0	0	0	109.3	D159	P157-D159 PolarHBondContact O-N 3.09Å
158	N	43.1	Very low	52.5	Low	124 Å²	124	100.3 Å²	100.3	66%	0.663	57%	0.566	S	S	*	*			trans	-73	110.1	143.8	-66.5	-50.7	0	0	0	103.8	A156 K160	A156-N158 PolarHBondContact O-N 3.36Å; N158-K160 PolarHBondContact O-N 3.3Å
159	D	51.6	Low	54.3	Low	144 Å²	144	96.7 Å²	96.7	77%	0.77	55%	0.547	S	S	*	.			trans	-57.8	18.9	-179.9	-73.4	-36.2	0	0	0	115.1	P157 H161	P157-D159 PolarHBondContact O-N 3.09Å; D159-H161 PolarHBondContact O-N 3.26Å
160	K	65.3	Low	55.8	Low	174 Å²	174	98.2 Å²	98.2	76%	0.757	54%	0.538	S	S	*	.			trans	-85.9	93.4	-179.1	-60.8	-176.9	-175.4	176.5	0	108.5	N158 R162	N158-K160 PolarHBondContact O-N 3.3Å; K160-R162 PolarHBondContact O-N 2.99Å
161	H	71.8	Confident	56.7	Low	51 Å²	51	102 Å²	102	24%	0.236	55%	0.549	C	S	.	.			trans	-51.3	124.1	166.6	-67.7	-92.9	0	0	0	110.5	D159 C208 A210 C211 F223 H227	D159-H161 PolarHBondContact O-N 3.26Å; H161-C208 PolarHBondContact ND1-SG 3.06Å; H161-C208 VanDerWaalsContact ND1-SG 3.35Å; H161-A210 HydrophobicContact CB-CB 4.4Å; H161-A210 PolarHBondContact CE1-O 3.1Å; H161-A210 WeakPolarHBondContact ND1-CB 3.32Å; H161-C211 PolarHBondContact ND1-SG 2.84Å; H161-C211 VanDerWaalsContact ND1-SG 3.45Å; H161-F223 HydrophobicContact CB-CE2 4.02Å; H161-F223 HydrophobicContact CB-CZ 3.6Å; H161-F223 WeakPolarHBondContact O-CZ 3.4Å; H161-H227 AromaticContact CD2-CE1 3.55Å; H161-H227 AromaticContact CD2-ND1 3.74Å; H161-H227 AromaticContact CE1-CE1 3.48Å; H161-H227 PolarHBondContact CE1-CE1 3.39Å; H161-H227 VanDerWaalsContact CE1-CE1 3.48Å; H161-H227 AromaticContact CG-CE1 3.11Å; H161-H227 AromaticContact CG-ND1 3.72Å; H161-H227 AromaticContact CG-NE2 3.71Å; H161-H227 AromaticContact ND1-CE1 3.07Å; H161-H227 PolarHBondContact ND1-CE1 2.67Å; H161-H227 AromaticContact ND1-ND1 3.99Å; H161-H227 AromaticContact ND1-NE2 3.73Å; H161-H227 AromaticContact NE2-CE1 3.73Å
162	R	77.8	Confident	57.4	Low	191 Å²	191	99.7 Å²	99.7	72%	0.721	55%	0.546	S	S	*	.			trans	-118.6	141.7	176.9	-177	178.6	174.6	-163.8	-1.4	109.8	K160 V164 A209	K160-R162 PolarHBondContact O-N 2.99Å; R162-V164 HydrophobicContact CG-CG2 4.48Å; R162-A209 PolarHBondContact O-N 3.05Å
163	L	78.1	Confident	57.6	Low	39 Å²	39	95 Å²	95	20%	0.204	52%	0.523	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	131.5	168.5	-86	150.1	0	0	0	110.2	M206 A220 F223	L163-M206 HydrophobicContact CB-CE 3.96Å; L163-M206 HydrophobicContact CD2-CB 3.82Å; L163-M206 HydrophobicContact CD2-CE 4.35Å; L163-A220 HydrophobicContact CD1-CB 3.87Å; L163-F223 HydrophobicContact CD1-CB 3.59Å; L163-F223 HydrophobicContact CD1-CD1 3.5Å; L163-F223 VanDerWaalsContact CD1-CD1 3.5Å; L163-F223 HydrophobicContact CD1-CD2 4.06Å; L163-F223 HydrophobicContact CD1-CE1 4.16Å; L163-F223 HydrophobicContact CD1-CG 3.45Å; L163-F223 VanDerWaalsContact CD1-CG 3.45Å; L163-F223 HydrophobicContact CD2-CB 3.87Å; L163-F223 HydrophobicContact CD2-CD2 3.92Å; L163-F223 HydrophobicContact CD2-CG 3.98Å; L163-F223 HydrophobicContact CG-CB 3.88Å; L163-F223 HydrophobicContact CG-CD1 3.94Å; L163-F223 HydrophobicContact CG-CD2 3.59Å; L163-F223 HydrophobicContact CG-CE1 4.37Å; L163-F223 HydrophobicContact CG-CE2 4.04Å; L163-F223 HydrophobicContact CG-CG 3.53Å; L163-F223 HydrophobicContact CG-CZ 4.41Å
164	V	80.1	Confident	57.6	Low	29 Å²	29	99.4 Å²	99.4	18%	0.176	54%	0.536	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	144	178.8	-177.3	0	0	0	0	107.7	R162 S168 L169 M206 V207 A209	R162-V164 HydrophobicContact CG-CG2 4.48Å; V164-S168 WeakPolarHBondContact CG1-OG 3.4Å; V164-L169 HydrophobicContact CG1-CD2 3.94Å; V164-L169 HydrophobicContact CG1-CG 4.08Å; V164-M206 WeakPolarHBondContact O-CA 3.2Å; V164-V207 PolarHBondContact N-O 2.84Å; V164-V207 WeakPolarHBondContact O-CG1 3.37Å; V164-V207 PolarHBondContact O-N 2.93Å; V164-A209 HydrophobicContact CG2-CB 4.07Å
165	S	78.7	Confident	57.8	Low	39 Å²	39	100.6 Å²	100.6	27%	0.273	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	144.7	174.6	63.4	0	0	0	0	109.7	E167 S168 L169 N205	S165-E167 PolarHBondContact O-N 2.85Å; S165-S168 PolarHBondContact N-OG 3.33Å; S165-S168 PolarHBondContact O-N 2.9Å; S165-S168 VanDerWaalsContact O-N 3.11Å; S165-S168 PolarHBondContact O-OG 3.45Å; S165-S168 WeakPolarHBondContact OG-CB 3.47Å; S165-S168 PolarHBondContact OG-N 3.31Å; S165-S168 PolarHBondContact OG-OG 3.47Å; S165-L169 PolarHBondContact O-N 2.87Å; S165-N205 WeakPolarHBondContact CA-O 3.35Å
166	I	73.8	Confident	58	Low	34 Å²	34	99.1 Å²	99.1	17%	0.174	53%	0.527	C	S	.	.	H	α-helix	trans	-58.8	-40.5	178.7	-68	174.3	0	0	0	110.6	S168 L169 Y170 I204 N205 V207	I166-S168 VanDerWaalsContact C-N 3.26Å; I166-S168 PolarHBondContact O-N 3.39Å; I166-L169 PolarHBondContact O-N 3.32Å; I166-L169 VanDerWaalsContact O-N 3.1Å; I166-Y170 HydrophobicContact CG2-CD2 4.16Å; I166-Y170 HydrophobicContact CG2-CE2 3.5Å; I166-Y170 VanDerWaalsContact CG2-CE2 3.5Å; I166-Y170 VanDerWaalsContact O-CD2 3.28Å; I166-Y170 WeakPolarHBondContact O-CD2 3.5Å; I166-I204 HydrophobicContact CD1-CG2 4.15Å; I166-I204 VanDerWaalsContact CD1-O 3.23Å; I166-I204 WeakPolarHBondContact CD1-O 3.45Å; I166-N205 PolarHBondContact N-O 2.98Å; I166-V207 HydrophobicContact CB-CG1 4.48Å; I166-V207 HydrophobicContact CG1-CB 4.37Å; I166-V207 HydrophobicContact CG1-CG1 3.6Å
167	E	72.4	Confident	58.2	Low	140 Å²	140	102.7 Å²	102.7	65%	0.654	54%	0.542	S	S	*	.	H	α-helix	trans	-55.5	-40.4	176.5	-67.1	167.9	-171.4	0	0	112.3	S165 L169 Y170 H171	S165-E167 PolarHBondContact O-N 2.85Å; E167-L169 VanDerWaalsContact C-N 3.33Å; E167-L169 PolarHBondContact O-N 2.96Å; E167-Y170 PolarHBondContact O-N 2.92Å; E167-H171 PolarHBondContact O-CD2 2.98Å
168	S	72.6	Confident	58.1	Low	40 Å²	40	103.3 Å²	103.3	28%	0.28	53%	0.532	S	S	.	.	H	α-helix	trans	-72.8	-20.9	-180	63	0	0	0	0	114.4	V164 S165 I166	V164-S168 WeakPolarHBondContact CG1-OG 3.4Å; S165-S168 PolarHBondContact N-OG 3.33Å; S165-S168 PolarHBondContact O-N 2.9Å; S165-S168 VanDerWaalsContact O-N 3.11Å; S165-S168 PolarHBondContact O-OG 3.45Å; S165-S168 WeakPolarHBondContact OG-CB 3.47Å; S165-S168 PolarHBondContact OG-N 3.31Å; S165-S168 PolarHBondContact OG-OG 3.47Å; I166-S168 VanDerWaalsContact C-N 3.26Å; I166-S168 PolarHBondContact O-N 3.39Å
169	L	64.2	Low	57.8	Low	50 Å²	50	105.4 Å²	105.4	26%	0.262	54%	0.544	S	S	.	.	H	α-helix	trans	-74.7	-29.7	177.5	-70.2	177.3	0	0	0	112.8	V164 S165 I166 E167 H171 V207 F214	V164-L169 HydrophobicContact CG1-CD2 3.94Å; V164-L169 HydrophobicContact CG1-CG 4.08Å; S165-L169 PolarHBondContact O-N 2.87Å; I166-L169 PolarHBondContact O-N 3.32Å; I166-L169 VanDerWaalsContact O-N 3.1Å; E167-L169 VanDerWaalsContact C-N 3.33Å; E167-L169 PolarHBondContact O-N 2.96Å; L169-H171 VanDerWaalsContact C-N 3.35Å; L169-V207 HydrophobicContact CD1-CB 4.39Å; L169-V207 HydrophobicContact CD1-CG1 3.37Å; L169-V207 HydrophobicContact CD1-CG2 4.05Å; L169-V207 HydrophobicContact CG-CG1 4.35Å; L169-F214 HydrophobicContact CD1-CD1 4.41Å
170	Y	61.2	Low	57.2	Low	134 Å²	134	103.8 Å²	103.8	53%	0.525	54%	0.535	S	S	.	.	H	α-helix	trans	-76.6	-22	179.7	-68.6	-68.2	0	0	0	113.1	I166 E167 T173	I166-Y170 HydrophobicContact CG2-CD2 4.16Å; I166-Y170 HydrophobicContact CG2-CE2 3.5Å; I166-Y170 VanDerWaalsContact CG2-CE2 3.5Å; I166-Y170 VanDerWaalsContact O-CD2 3.28Å; I166-Y170 WeakPolarHBondContact O-CD2 3.5Å; E167-Y170 PolarHBondContact O-N 2.92Å; Y170-T173 PolarHBondContact O-OG1 2.7Å
171	H	51.2	Low	55.8	Low	162 Å²	162	99.3 Å²	99.3	75%	0.75	53%	0.525	S	S	*	.	H	α-helix	trans	-77	-22	178.3	-71.9	-59.4	0	0	0	113.7	E167 L169	E167-H171 PolarHBondContact O-CD2 2.98Å; L169-H171 VanDerWaalsContact C-N 3.35Å
172	D	51.1	Low	54.4	Low	143 Å²	143	102.6 Å²	102.6	77%	0.765	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	-1.1	-179	-73.5	-18.1	0	0	0	113.6
173	T	42.8	Very low	52.7	Low	59 Å²	59	97.2 Å²	97.2	36%	0.362	54%	0.54	S	S	.	.	S	Bend	trans	-104.4	110.6	175.7	23.4	0	0	0	0	110.9	T150 Y170	T150-T173 HydrophobicContact CG2-CG2 3.1Å; Y170-T173 PolarHBondContact O-OG1 2.7Å
174	L	37.2	Very low	51.2	Low	164 Å²	164	102.1 Å²	102.1	86%	0.859	57%	0.566	S	S	*	*			trans	-45.3	143.9	168.6	-107.3	85	0	0	0	110.4	G176	L174-G176 VanDerWaalsContact C-N 3.25Å; L174-G176 PolarHBondContact O-N 3.32Å
175	P	39.6	Very low	49.8	Very low	136 Å²	136	106.7 Å²	106.7	88%	0.883	59%	0.586	S	S	*	*			trans	-73.7	79.7	-172.7	31.7	-34.3	0	0	0	110.2
176	G	33.3	Very low	48.6	Very low	38 Å²	38	109.7 Å²	109.7	39%	0.392	60%	0.599	S	S	.	*			trans	-116.1	89.7	173.9	0	0	0	0	0	109.4	L174 F178	L174-G176 VanDerWaalsContact C-N 3.25Å; L174-G176 PolarHBondContact O-N 3.32Å; G176-F178 VanDerWaalsContact C-N 3.34Å; G176-F178 WeakPolarHBondContact O-CD2 3.36Å; G176-F178 PolarHBondContact O-N 2.94Å
177	T	35.6	Very low	47.7	Very low	146 Å²	146	110.7 Å²	110.7	90%	0.896	61%	0.607	S	S	*	*			trans	42.4	50.7	151.6	20.3	0	0	0	0	116.3
178	F	38.4	Very low	47.1	Very low	132 Å²	132	108.9 Å²	108.9	58%	0.579	60%	0.598	S	S	*	*			trans	-98.8	126	148.7	-70.4	-78.4	0	0	0	106.1	G176 N180	G176-F178 VanDerWaalsContact C-N 3.34Å; G176-F178 WeakPolarHBondContact O-CD2 3.36Å; G176-F178 PolarHBondContact O-N 2.94Å; F178-N180 WeakPolarHBondContact CB-OD1 3.45Å; F178-N180 PolarHBondContact O-N 3.46Å
179	D	36.2	Very low	46.5	Very low	168 Å²	168	107.5 Å²	107.5	90%	0.898	59%	0.588	S	S	*	*			trans	-61	77	165.9	-75.2	-40	0	0	0	107.7	S181	D179-S181 PolarHBondContact O-N 3.37Å
180	N	40	Very low	46.2	Very low	111 Å²	111	110.8 Å²	110.8	59%	0.594	61%	0.606	S	S	*	*			trans	-77.9	71.6	176.2	-68.1	-30.5	0	0	0	105.8	F178 P182	F178-N180 WeakPolarHBondContact CB-OD1 3.45Å; F178-N180 PolarHBondContact O-N 3.46Å; N180-P182 WeakPolarHBondContact O-CD 3.27Å; N180-P182 VanDerWaalsContact O-N 3.11Å
181	S	35.8	Very low	46	Very low	79 Å²	79	105.4 Å²	105.4	55%	0.552	59%	0.589	S	S	*	*			trans	-55.8	117.7	148	61.6	0	0	0	0	104.5	D179 T183	D179-S181 PolarHBondContact O-N 3.37Å; S181-T183 PolarHBondContact O-N 2.87Å; S181-T183 PolarHBondContact O-OG1 3.47Å
182	P	42	Very low	46.2	Very low	121 Å²	121	97.8 Å²	97.8	79%	0.786	55%	0.554	S	S	*	*			trans	-71.9	70.9	170.6	32.6	-32.5	0	0	0	105.6	N180 N184	N180-P182 WeakPolarHBondContact O-CD 3.27Å; N180-P182 VanDerWaalsContact O-N 3.11Å; P182-N184 PolarHBondContact O-N 3.48Å
183	T	43.1	Very low	46.3	Very low	78 Å²	78	96 Å²	96	48%	0.479	54%	0.541	S	S	.	.			trans	-68.7	80.7	158.1	37.2	0	0	0	0	104.7	S181 E185	S181-T183 PolarHBondContact O-N 2.87Å; S181-T183 PolarHBondContact O-OG1 3.47Å; T183-E185 VanDerWaalsContact CB-OE1 3.3Å; T183-E185 WeakPolarHBondContact CB-OE1 3.44Å; T183-E185 HydrophobicContact CG2-CG 4.14Å; T183-E185 WeakPolarHBondContact CG2-OE1 3.25Å; T183-E185 PolarHBondContact O-N 3.32Å
184	N	46.5	Very low	46.6	Very low	141 Å²	141	100 Å²	100	75%	0.754	56%	0.56	S	S	*	*			trans	-59.3	47.7	145.7	-129.8	-12.8	0	0	0	107.8	P182 N186	P182-N184 PolarHBondContact O-N 3.48Å; N184-N186 VanDerWaalsContact C-N 3.25Å; N184-N186 PolarHBondContact O-N 2.9Å
185	E	49.7	Very low	47.3	Very low	125 Å²	125	98.7 Å²	98.7	58%	0.584	54%	0.543	S	S	*	.			trans	-58.8	104.3	161.9	-83.8	170.7	-134.5	0	0	102.8	T183 V187	T183-E185 VanDerWaalsContact CB-OE1 3.3Å; T183-E185 WeakPolarHBondContact CB-OE1 3.44Å; T183-E185 HydrophobicContact CG2-CG 4.14Å; T183-E185 WeakPolarHBondContact CG2-OE1 3.25Å; T183-E185 PolarHBondContact O-N 3.32Å; E185-V187 HydrophobicContact CB-CG2 4.1Å; E185-V187 WeakPolarHBondContact O-CG2 3.45Å; E185-V187 PolarHBondContact O-N 3.43Å
186	N	53.1	Low	47.5	Very low	103 Å²	103	94.7 Å²	94.7	55%	0.551	51%	0.514	S	S	*	.			trans	-58.9	76.5	165.5	-71.4	-45.5	0	0	0	107.1	N184 Q188 T203	N184-N186 VanDerWaalsContact C-N 3.25Å; N184-N186 PolarHBondContact O-N 2.9Å; N186-Q188 PolarHBondContact O-N 2.89Å; N186-T203 HydrophobicContact CB-CG2 3.95Å; N186-T203 VanDerWaalsContact CG-CG2 3.49Å; N186-T203 WeakPolarHBondContact OD1-CB 3.36Å; N186-T203 WeakPolarHBondContact OD1-CG2 3.41Å
187	V	56.4	Low	47.9	Very low	55 Å²	55	102.4 Å²	102.4	33%	0.333	54%	0.54	S	S	.	.			trans	-66.4	123.2	177.5	176.3	0	0	0	0	105.3	E185 C189 I204 R216	E185-V187 HydrophobicContact CB-CG2 4.1Å; E185-V187 WeakPolarHBondContact O-CG2 3.45Å; E185-V187 PolarHBondContact O-N 3.43Å; V187-C189 PolarHBondContact O-N 3.38Å; V187-I204 HydrophobicContact CB-CD1 4.2Å; V187-I204 HydrophobicContact CG1-CD1 4.15Å; V187-I204 WeakPolarHBondContact O-CD1 3.37Å; V187-I204 WeakPolarHBondContact O-CG1 3.42Å; V187-R216 VanDerWaalsContact CG2-NH1 3.26Å
188	Q	59.1	Low	48.2	Very low	102 Å²	102	98.8 Å²	98.8	48%	0.477	52%	0.518	S	S	.	.			trans	-69.7	132.9	178.8	-63.3	-176.2	6.2	0	0	109.2	N186 N190	N186-Q188 PolarHBondContact O-N 2.89Å; Q188-N190 PolarHBondContact O-N 3.46Å; Q188-N190 VanDerWaalsContact O-N 3.12Å
189	C	60.2	Low	48.3	Very low	11 Å²	11	100.7 Å²	100.7	7%	0.074	53%	0.528	C	S	.	.			trans	-78.6	100.4	174.5	-165	0	0	0	0	110.5	V187 A191 C192 Q193 I204 C218	V187-C189 PolarHBondContact O-N 3.38Å; C189-A191 PolarHBondContact O-N 3.32Å; C189-C192 HydrophobicContact CB-CB 3.92Å; C189-C192 WeakPolarHBondContact CB-SG 3.38Å; C189-C192 PolarHBondContact O-N 3.32Å; C189-C192 PolarHBondContact SG-SG 3.04Å; C189-Q193 PolarHBondContact O-N 3.26Å; C189-I204 HydrophobicContact CB-CD1 3.78Å; C189-I204 HydrophobicContact CB-CG1 3.73Å; C189-C218 HydrophobicContact CB-CB 3.86Å
190	N	58.1	Low	48.7	Very low	119 Å²	119	100.4 Å²	100.4	64%	0.636	53%	0.527	S	S	*	.	H	α-helix	trans	-55.7	-32.6	176.2	-69.7	-17.4	0	0	0	112.7	Q188 C192	Q188-N190 PolarHBondContact O-N 3.46Å; Q188-N190 VanDerWaalsContact O-N 3.12Å; N190-C192 PolarHBondContact O-N 3.2Å
191	A	57.1	Low	49.2	Very low	21 Å²	21	97 Å²	97	17%	0.174	52%	0.518	C	S	.	.	H	α-helix	trans	-66.7	-34.6	175.6	0	0	0	0	0	113.2	C189 W225	C189-A191 PolarHBondContact O-N 3.32Å; A191-W225 HydrophobicContact CB-CE3 4.11Å; A191-W225 HydrophobicContact CB-CH2 4.48Å; A191-W225 HydrophobicContact CB-CZ3 3.57Å
192	C	54.8	Low	50.3	Low	1 Å²	1	95.4 Å²	95.4	1%	0.007	50%	0.503	C	S	.	.	H	α-helix	trans	-76.7	-29.1	-178.6	-54.9	0	0	0	0	112.3	C189 N190 L194 R195 M202 C218 C222	C189-C192 HydrophobicContact CB-CB 3.92Å; C189-C192 WeakPolarHBondContact CB-SG 3.38Å; C189-C192 PolarHBondContact O-N 3.32Å; C189-C192 PolarHBondContact SG-SG 3.04Å; N190-C192 PolarHBondContact O-N 3.2Å; C192-L194 PolarHBondContact O-N 3.22Å; C192-L194 VanDerWaalsContact O-N 3.16Å; C192-R195 PolarHBondContact O-N 3.07Å; C192-M202 HydrophobicContact CB-CE 3.86Å; C192-C218 HydrophobicContact CB-CB 4.32Å; C192-C218 WeakPolarHBondContact CB-SG 3.49Å; C192-C218 WeakPolarHBondContact SG-CB 3.38Å; C192-C218 CovalentContact SG-SG 2.04Å; C192-C218 PolarHBondContact SG-SG 3.35Å; C192-C222 PolarHBondContact SG-SG 3.02Å
193	Q	53.3	Low	51.4	Low	105 Å²	105	92.6 Å²	92.6	49%	0.491	48%	0.483	S	S	.	.	H	α-helix	trans	-56	-31.7	179	-71.2	-175.8	1.4	0	0	112.9	C189	C189-Q193 PolarHBondContact O-N 3.26Å
194	L	48.6	Very low	52.6	Low	145 Å²	145	89.7 Å²	89.7	76%	0.759	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-22.9	-175.6	-73	170.3	0	0	0	114.9	C192	C192-L194 PolarHBondContact O-N 3.22Å; C192-L194 VanDerWaalsContact O-N 3.16Å
195	R	51.6	Low	53.9	Low	135 Å²	135	86.8 Å²	86.8	51%	0.509	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	-29.9	-166.5	-87.1	-172.6	165.2	-164.3	-5.8	115.1	C192	C192-R195 PolarHBondContact O-N 3.07Å
196	N	44.4	Very low	55.3	Low	52 Å²	52	83.5 Å²	83.5	28%	0.278	43%	0.434	S	S	.	.			trans	-121.2	126.1	-169.9	-78.8	-10.3	0	0	0	107.8	V198 M202	N196-V198 HydrophobicContact CB-CB 3.64Å; N196-V198 HydrophobicContact CB-CG2 3.49Å; N196-V198 VanDerWaalsContact CB-CG2 3.49Å; N196-V198 PolarHBondContact O-N 2.99Å; N196-M202 HydrophobicContact CB-CE 4.3Å
197	Q	42.1	Very low	56.6	Low	201 Å²	201	78.8 Å²	78.8	94%	0.939	41%	0.409	S	S	*	.			trans	-63.3	35.4	149.4	-74.2	-173.2	-3.2	0	0	110.9	Q199	Q197-Q199 PolarHBondContact O-N 2.96Å
198	V	40.8	Very low	57.8	Low	70 Å²	70	76.1 Å²	76.1	42%	0.424	39%	0.393	S	S	.	.	S	Bend	trans	-84.7	110.5	168.1	174.9	0	0	0	0	103.2	N196 M202	N196-V198 HydrophobicContact CB-CB 3.64Å; N196-V198 HydrophobicContact CB-CG2 3.49Å; N196-V198 VanDerWaalsContact CB-CG2 3.49Å; N196-V198 PolarHBondContact O-N 2.99Å; V198-M202 HydrophobicContact CB-CE 3.39Å; V198-M202 HydrophobicContact CB-SD 3.96Å; V198-M202 HydrophobicContact CG1-CE 3.44Å; V198-M202 VanDerWaalsContact CG1-CE 3.44Å; V198-M202 HydrophobicContact CG1-CG 3.69Å; V198-M202 HydrophobicContact CG1-SD 3.39Å; V198-M202 WeakPolarHBondContact CG1-SD 3.47Å; V198-M202 HydrophobicContact CG2-CE 4.4Å
199	Q	41.2	Very low	58.5	Low	171 Å²	171	73.1 Å²	73.1	80%	0.799	39%	0.386	S	S	*	.			trans	-7.8	121.3	174.4	-56.8	-175.3	0.2	0	0	113.6	Q197 G201	Q197-Q199 PolarHBondContact O-N 2.96Å; Q199-G201 PolarHBondContact O-N 3.28Å; Q199-G201 VanDerWaalsContact O-N 3.09Å
200	N	45.6	Very low	59.1	Low	163 Å²	163	75.2 Å²	75.2	87%	0.872	40%	0.404	S	S	*	.	S	Bend	trans	-37.4	120.4	169.1	-66.5	-12.7	0	0	0	109.6
201	G	50.2	Low	59.9	Low	39 Å²	39	70.2 Å²	70.2	40%	0.402	38%	0.378	S	S	.	.			trans	106.7	34.8	177.6	0	0	0	0	0	117.1	Q199 T203	Q199-G201 PolarHBondContact O-N 3.28Å; Q199-G201 VanDerWaalsContact O-N 3.09Å; G201-T203 PolarHBondContact O-N 2.91Å
202	M	59	Low	60.3	Low	46 Å²	46	76.4 Å²	76.4	23%	0.227	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-61.4	119.7	165.3	-87.1	179.2	-81.8	0	0	110.7	C192 N196 V198 C218	C192-M202 HydrophobicContact CB-CE 3.86Å; N196-M202 HydrophobicContact CB-CE 4.3Å; V198-M202 HydrophobicContact CB-CE 3.39Å; V198-M202 HydrophobicContact CB-SD 3.96Å; V198-M202 HydrophobicContact CG1-CE 3.44Å; V198-M202 VanDerWaalsContact CG1-CE 3.44Å; V198-M202 HydrophobicContact CG1-CG 3.69Å; V198-M202 HydrophobicContact CG1-SD 3.39Å; V198-M202 WeakPolarHBondContact CG1-SD 3.47Å; V198-M202 HydrophobicContact CG2-CE 4.4Å; M202-C218 HydrophobicContact CB-CB 4.21Å
203	T	63.9	Low	60.7	Low	61 Å²	61	79.1 Å²	79.1	37%	0.374	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-67.2	146.3	172.3	66.6	0	0	0	0	109.7	N186 G201 N205	N186-T203 HydrophobicContact CB-CG2 3.95Å; N186-T203 VanDerWaalsContact CG-CG2 3.49Å; N186-T203 WeakPolarHBondContact OD1-CB 3.36Å; N186-T203 WeakPolarHBondContact OD1-CG2 3.41Å; G201-T203 PolarHBondContact O-N 2.91Å; T203-N205 PolarHBondContact OG1-OD1 3.26Å
204	I	69.3	Low	61.4	Low	17 Å²	17	78.9 Å²	78.9	9%	0.087	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-100.3	116.9	178.4	-61.7	168.1	0	0	0	109.1	I166 V187 C189 M206 R216 I217	I166-I204 HydrophobicContact CD1-CG2 4.15Å; I166-I204 VanDerWaalsContact CD1-O 3.23Å; I166-I204 WeakPolarHBondContact CD1-O 3.45Å; V187-I204 HydrophobicContact CB-CD1 4.2Å; V187-I204 HydrophobicContact CG1-CD1 4.15Å; V187-I204 WeakPolarHBondContact O-CD1 3.37Å; V187-I204 WeakPolarHBondContact O-CG1 3.42Å; C189-I204 HydrophobicContact CB-CD1 3.78Å; C189-I204 HydrophobicContact CB-CG1 3.73Å; I204-M206 WeakPolarHBondContact CG2-O 3.36Å; I204-R216 HydrophobicContact CB-CB 4.28Å; I204-R216 HydrophobicContact CD1-CB 3.68Å; I204-R216 HydrophobicContact CG1-CB 4.5Å; I204-R216 HydrophobicContact CG2-CB 3.49Å; I204-R216 VanDerWaalsContact CG2-CB 3.49Å; I204-R216 HydrophobicContact CG2-CG 4.3Å; I204-I217 VanDerWaalsContact CG2-N 3.27Å; I204-I217 WeakPolarHBondContact CG2-O 3.27Å
205	N	73.1	Confident	62.4	Low	81 Å²	81	73.1 Å²	73.1	43%	0.433	41%	0.413	S	S	.	.			trans	-115.2	-4	178.3	-60.1	18.2	0	0	0	112.6	S165 I166 T203	S165-N205 WeakPolarHBondContact CA-O 3.35Å; I166-N205 PolarHBondContact N-O 2.98Å; T203-N205 PolarHBondContact OG1-OD1 3.26Å
206	M	79.1	Confident	63.6	Low	55 Å²	55	72.1 Å²	72.1	27%	0.271	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	154	-174.1	-55.6	-67.3	-64.6	0	0	111.8	L163 V164 I204 I217	L163-M206 HydrophobicContact CB-CE 3.96Å; L163-M206 HydrophobicContact CD2-CB 3.82Å; L163-M206 HydrophobicContact CD2-CE 4.35Å; V164-M206 WeakPolarHBondContact O-CA 3.2Å; I204-M206 WeakPolarHBondContact CG2-O 3.36Å; M206-I217 CarbonylContact C-O 3.56Å; M206-I217 WeakPolarHBondContact CB-O 3.47Å; M206-I217 PolarHBondContact N-O 2.9Å; M206-I217 PolarHBondContact O-N 2.94Å
207	V	79.9	Confident	65.1	Low	4 Å²	4	70 Å²	70	2%	0.024	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	148	-174.1	34.3	0	0	0	0	109.7	V164 I166 L169 F214	V164-V207 PolarHBondContact N-O 2.84Å; V164-V207 WeakPolarHBondContact O-CG1 3.37Å; V164-V207 PolarHBondContact O-N 2.93Å; I166-V207 HydrophobicContact CB-CG1 4.48Å; I166-V207 HydrophobicContact CG1-CB 4.37Å; I166-V207 HydrophobicContact CG1-CG1 3.6Å; L169-V207 HydrophobicContact CD1-CB 4.39Å; L169-V207 HydrophobicContact CD1-CG1 3.37Å; L169-V207 HydrophobicContact CD1-CG2 4.05Å; L169-V207 HydrophobicContact CG-CG1 4.35Å; V207-F214 HydrophobicContact CG2-CB 3.62Å; V207-F214 HydrophobicContact CG2-CD1 3.59Å; V207-F214 HydrophobicContact CG2-CG 4.06Å
208	C	81.4	Confident	66.8	Low	0 Å²	0	61.4 Å²	61.4	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	118.3	168.8	-177.7	0	0	0	0	110.9	H161 A210 C211 P215 I217 F223	H161-C208 PolarHBondContact ND1-SG 3.06Å; H161-C208 VanDerWaalsContact ND1-SG 3.35Å; C208-A210 VanDerWaalsContact C-N 3.28Å; C208-A210 PolarHBondContact O-N 3.43Å; C208-A210 PolarHBondContact SG-N 3.29Å; C208-C211 HydrophobicContact CB-CB 4.26Å; C208-P215 HydrophobicContact CB-CG 4.1Å; C208-P215 PolarHBondContact N-O 2.94Å; C208-I217 HydrophobicContact CB-CD1 4.31Å; C208-F223 HydrophobicContact CB-CD2 4.1Å; C208-F223 HydrophobicContact CB-CE2 3.75Å
209	A	74	Confident	68.4	Low	39 Å²	39	59.7 Å²	59.7	32%	0.322	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-18.8	178.9	0	0	0	0	0	114.4	R162 V164 F214	R162-A209 PolarHBondContact O-N 3.05Å; V164-A209 HydrophobicContact CG2-CB 4.07Å; A209-F214 HydrophobicContact CB-CE1 4.39Å
210	A	74.3	Confident	70	Confident	54 Å²	54	54.5 Å²	54.5	45%	0.446	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	2.5	-175.5	0	0	0	0	0	113.9	H161 C208	H161-A210 HydrophobicContact CB-CB 4.4Å; H161-A210 PolarHBondContact CE1-O 3.1Å; H161-A210 WeakPolarHBondContact ND1-CB 3.32Å; C208-A210 VanDerWaalsContact C-N 3.28Å; C208-A210 PolarHBondContact O-N 3.43Å; C208-A210 PolarHBondContact SG-N 3.29Å
211	C	75.2	Confident	71.3	Confident	15 Å²	15	52.1 Å²	52.1	10%	0.101	32%	0.321	C	S	.	.	S	Bend	trans	-95.9	140.9	179.8	-75.8	0	0	0	0	110.3	H161 C208 G213 F214 P215	H161-C211 PolarHBondContact ND1-SG 2.84Å; H161-C211 VanDerWaalsContact ND1-SG 3.45Å; C208-C211 HydrophobicContact CB-CB 4.26Å; C211-G213 PolarHBondContact O-N 3.41Å; C211-F214 PolarHBondContact O-N 3.34Å; C211-P215 HydrophobicContact CB-CG 3.5Å
212	P	64.9	Low	72.6	Confident	150 Å²	150	50.6 Å²	50.6	97%	0.974	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-12	-170.1	20.5	-31.7	0	0	0	115.6
213	G	63.3	Low	73.5	Confident	59 Å²	59	49.7 Å²	49.7	61%	0.608	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-146.9	75.3	167.4	0	0	0	0	0	109.4	C211 P215	C211-G213 PolarHBondContact O-N 3.41Å; G213-P215 VanDerWaalsContact O-CD 3.25Å; G213-P215 WeakPolarHBondContact O-CD 3.42Å
214	F	67.3	Low	74.2	Confident	99 Å²	99	54.5 Å²	54.5	43%	0.434	31%	0.311	S	S	.	.			trans	10.3	70.8	170.2	-67.5	-73.9	0	0	0	115.2	L169 V207 A209 C211 R216	L169-F214 HydrophobicContact CD1-CD1 4.41Å; V207-F214 HydrophobicContact CG2-CB 3.62Å; V207-F214 HydrophobicContact CG2-CD1 3.59Å; V207-F214 HydrophobicContact CG2-CG 4.06Å; A209-F214 HydrophobicContact CB-CE1 4.39Å; C211-F214 PolarHBondContact O-N 3.34Å; F214-R216 PolarHBondContact O-N 2.95Å
215	P	70.9	Confident	74.4	Confident	24 Å²	24	56.1 Å²	56.1	16%	0.156	32%	0.316	C	S	.	.			trans	-65.5	118.5	-175.2	25.6	-30.7	0	0	0	106.6	C208 C211 G213 I217	C208-P215 HydrophobicContact CB-CG 4.1Å; C208-P215 PolarHBondContact N-O 2.94Å; C211-P215 HydrophobicContact CB-CG 3.5Å; G213-P215 VanDerWaalsContact O-CD 3.25Å; G213-P215 WeakPolarHBondContact O-CD 3.42Å; P215-I217 HydrophobicContact CG-CD1 4.38Å; P215-I217 WeakPolarHBondContact O-CG1 3.38Å; P215-I217 PolarHBondContact O-N 2.96Å
216	R	75.8	Confident	74.6	Confident	115 Å²	115	56.2 Å²	56.2	43%	0.434	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	122.1	174.2	-72	-170.6	-173.2	-178.3	2.5	107.6	V187 I204 F214	V187-R216 VanDerWaalsContact CG2-NH1 3.26Å; I204-R216 HydrophobicContact CB-CB 4.28Å; I204-R216 HydrophobicContact CD1-CB 3.68Å; I204-R216 HydrophobicContact CG1-CB 4.5Å; I204-R216 HydrophobicContact CG2-CB 3.49Å; I204-R216 VanDerWaalsContact CG2-CB 3.49Å; I204-R216 HydrophobicContact CG2-CG 4.3Å; F214-R216 PolarHBondContact O-N 2.95Å
217	I	76	Confident	74.3	Confident	6 Å²	6	54.7 Å²	54.7	3%	0.031	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	131.6	-175.3	-60.9	159.4	0	0	0	110.1	I204 M206 C208 P215 S219 C222 F223	I204-I217 VanDerWaalsContact CG2-N 3.27Å; I204-I217 WeakPolarHBondContact CG2-O 3.27Å; M206-I217 CarbonylContact C-O 3.56Å; M206-I217 WeakPolarHBondContact CB-O 3.47Å; M206-I217 PolarHBondContact N-O 2.9Å; M206-I217 PolarHBondContact O-N 2.94Å; C208-I217 HydrophobicContact CB-CD1 4.31Å; P215-I217 HydrophobicContact CG-CD1 4.38Å; P215-I217 WeakPolarHBondContact O-CG1 3.38Å; P215-I217 PolarHBondContact O-N 2.96Å; I217-S219 WeakPolarHBondContact CG2-O 3.37Å; I217-S219 PolarHBondContact O-N 3.26Å; I217-C222 HydrophobicContact CG2-CB 3.54Å; I217-F223 HydrophobicContact CD1-CB 3.97Å; I217-F223 HydrophobicContact CD1-CD2 3.67Å; I217-F223 HydrophobicContact CD1-CG 4.32Å; I217-F223 HydrophobicContact CG2-CB 4.03Å; I217-F223 VanDerWaalsContact CG2-N 3.31Å
218	C	76.9	Confident	73.9	Confident	21 Å²	21	57.6 Å²	57.6	14%	0.142	32%	0.323	C	S	.	.	S	Bend	trans	-71.7	-25.5	-177.1	76.3	0	0	0	0	114.3	C189 C192 M202 C222	C189-C218 HydrophobicContact CB-CB 3.86Å; C192-C218 HydrophobicContact CB-CB 4.32Å; C192-C218 WeakPolarHBondContact CB-SG 3.49Å; C192-C218 WeakPolarHBondContact SG-CB 3.38Å; C192-C218 CovalentContact SG-SG 2.04Å; C192-C218 PolarHBondContact SG-SG 3.35Å; M202-C218 HydrophobicContact CB-CB 4.21Å; C218-C222 VanDerWaalsContact SG-SG 3.64Å
219	S	74.5	Confident	73.4	Confident	35 Å²	35	60.9 Å²	60.9	25%	0.245	34%	0.343	C	S	.	.	S	Bend	trans	-158.7	162.8	-174.5	63.7	0	0	0	0	113.6	I217 Q221 C222 F223	I217-S219 WeakPolarHBondContact CG2-O 3.37Å; I217-S219 PolarHBondContact O-N 3.26Å; S219-Q221 PolarHBondContact O-N 2.93Å; S219-C222 PolarHBondContact O-N 3.48Å; S219-C222 PolarHBondContact OG-N 3.49Å; S219-C222 PolarHBondContact OG-SG 3.42Å; S219-F223 PolarHBondContact O-N 3Å; S219-F223 VanDerWaalsContact O-N 3.12Å
220	A	74.9	Confident	73.1	Confident	61 Å²	61	63.5 Å²	63.5	50%	0.504	35%	0.348	S	S	.	.	H	α-helix	trans	-59.3	-29.2	175.2	0	0	0	0	0	113.8	L163 R224	L163-A220 HydrophobicContact CD1-CB 3.87Å; A220-R224 WeakPolarHBondContact O-CG 3.37Å; A220-R224 PolarHBondContact O-N 3.39Å; A220-R224 VanDerWaalsContact O-N 3.08Å
221	Q	73.4	Confident	72.7	Confident	113 Å²	113	65.3 Å²	65.3	53%	0.528	35%	0.35	S	S	.	.	H	α-helix	trans	-70.5	-36.2	176.4	-170.4	172.3	1.1	0	0	112	S219 R224 W225	S219-Q221 PolarHBondContact O-N 2.93Å; Q221-R224 PolarHBondContact O-N 3.18Å; Q221-W225 PolarHBondContact O-N 3.15Å
222	C	76.8	Confident	71.4	Confident	8 Å²	8	69 Å²	69	5%	0.054	38%	0.375	C	S	.	.	H	α-helix	trans	-72.8	-32.9	177.8	-65.8	0	0	0	0	111.5	C192 I217 C218 S219 W225 W226	C192-C222 PolarHBondContact SG-SG 3.02Å; I217-C222 HydrophobicContact CG2-CB 3.54Å; C218-C222 VanDerWaalsContact SG-SG 3.64Å; S219-C222 PolarHBondContact O-N 3.48Å; S219-C222 PolarHBondContact OG-N 3.49Å; S219-C222 PolarHBondContact OG-SG 3.42Å; C222-W225 PolarHBondContact O-N 2.87Å; C222-W226 WeakPolarHBondContact O-CB 3.44Å; C222-W226 PolarHBondContact O-N 2.91Å
223	F	79.4	Confident	70.2	Confident	26 Å²	26	65.1 Å²	65.1	11%	0.114	36%	0.356	C	S	.	.	H	α-helix	trans	-62.7	-50.6	170.4	171.7	-96	0	0	0	112	H161 L163 C208 I217 S219 W225 W226 H227	H161-F223 HydrophobicContact CB-CE2 4.02Å; H161-F223 HydrophobicContact CB-CZ 3.6Å; H161-F223 WeakPolarHBondContact O-CZ 3.4Å; L163-F223 HydrophobicContact CD1-CB 3.59Å; L163-F223 HydrophobicContact CD1-CD1 3.5Å; L163-F223 VanDerWaalsContact CD1-CD1 3.5Å; L163-F223 HydrophobicContact CD1-CD2 4.06Å; L163-F223 HydrophobicContact CD1-CE1 4.16Å; L163-F223 HydrophobicContact CD1-CG 3.45Å; L163-F223 VanDerWaalsContact CD1-CG 3.45Å; L163-F223 HydrophobicContact CD2-CB 3.87Å; L163-F223 HydrophobicContact CD2-CD2 3.92Å; L163-F223 HydrophobicContact CD2-CG 3.98Å; L163-F223 HydrophobicContact CG-CB 3.88Å; L163-F223 HydrophobicContact CG-CD1 3.94Å; L163-F223 HydrophobicContact CG-CD2 3.59Å; L163-F223 HydrophobicContact CG-CE1 4.37Å; L163-F223 HydrophobicContact CG-CE2 4.04Å; L163-F223 HydrophobicContact CG-CG 3.53Å; L163-F223 HydrophobicContact CG-CZ 4.41Å; C208-F223 HydrophobicContact CB-CD2 4.1Å; C208-F223 HydrophobicContact CB-CE2 3.75Å; I217-F223 HydrophobicContact CD1-CB 3.97Å; I217-F223 HydrophobicContact CD1-CD2 3.67Å; I217-F223 HydrophobicContact CD1-CG 4.32Å; I217-F223 HydrophobicContact CG2-CB 4.03Å; I217-F223 VanDerWaalsContact CG2-N 3.31Å; S219-F223 PolarHBondContact O-N 3Å; S219-F223 VanDerWaalsContact O-N 3.12Å; F223-W225 PolarHBondContact O-N 3.43Å; F223-W226 PolarHBondContact O-N 3.48Å; F223-H227 AromaticContact CD2-CD2 3.56Å; F223-H227 AromaticContact CD2-NE2 3.57Å; F223-H227 AromaticContact CE1-CD2 3.79Å; F223-H227 AromaticContact CE2-CD2 3.31Å; F223-H227 WeakPolarHBondContact CE2-CD2 3.48Å; F223-H227 AromaticContact CE2-NE2 3.05Å; F223-H227 WeakPolarHBondContact CE2-NE2 3.47Å; F223-H227 AromaticContact CG-CD2 3.91Å; F223-H227 AromaticContact CZ-CD2 3.42Å; F223-H227 VanDerWaalsContact CZ-CD2 3.42Å; F223-H227 WeakPolarHBondContact CZ-CD2 3.2Å; F223-H227 AromaticContact CZ-NE2 3.49Å; F223-H227 WeakPolarHBondContact CZ-NE2 3.27Å; F223-H227 PolarHBondContact O-CD2 3.01Å; F223-H227 VanDerWaalsContact O-CD2 3.23Å; F223-H227 PolarHBondContact O-N 2.97Å
224	R	77	Confident	69.1	Low	162 Å²	162	67.2 Å²	67.2	61%	0.611	36%	0.359	S	S	*	.	H	α-helix	trans	-55.9	-40.9	176.4	-78.1	177.9	141	-159.5	-8.6	111.9	A220 Q221 S228	A220-R224 WeakPolarHBondContact O-CG 3.37Å; A220-R224 PolarHBondContact O-N 3.39Å; A220-R224 VanDerWaalsContact O-N 3.08Å; Q221-R224 PolarHBondContact O-N 3.18Å; R224-S228 WeakPolarHBondContact O-CB 3.49Å; R224-S228 PolarHBondContact O-N 3.27Å
225	W	74.8	Confident	67.7	Low	51 Å²	51	68.1 Å²	68.1	19%	0.193	37%	0.373	C	S	.	.	H	α-helix	trans	-66.3	-49.6	175.6	175.3	67.4	0	0	0	112.7	A191 Q221 C222 F223 H227 S228 V229	A191-W225 HydrophobicContact CB-CE3 4.11Å; A191-W225 HydrophobicContact CB-CH2 4.48Å; A191-W225 HydrophobicContact CB-CZ3 3.57Å; Q221-W225 PolarHBondContact O-N 3.15Å; C222-W225 PolarHBondContact O-N 2.87Å; F223-W225 PolarHBondContact O-N 3.43Å; W225-H227 VanDerWaalsContact C-N 3.25Å; W225-H227 PolarHBondContact O-N 3.13Å; W225-S228 WeakPolarHBondContact CA-OG 3.36Å; W225-S228 WeakPolarHBondContact O-CA 3.5Å; W225-S228 WeakPolarHBondContact O-CB 3.44Å; W225-S228 PolarHBondContact O-N 2.94Å; W225-S228 PolarHBondContact O-OG 3.42Å; W225-V229 HydrophobicContact CD2-CG2 4.2Å; W225-V229 HydrophobicContact CG-CG2 4.48Å; W225-V229 HydrophobicContact CZ2-CG2 3.74Å; W225-V229 VanDerWaalsContact NE1-CG2 3.33Å; W225-V229 PolarHBondContact O-N 2.93Å
226	W	76.1	Confident	65.9	Low	83 Å²	83	73.9 Å²	73.9	31%	0.314	40%	0.402	S	S	.	.	H	α-helix	trans	-53.3	-47.3	179.2	-175.4	-99.3	0	0	0	110.7	C222 F223 S228 V229 H230	C222-W226 WeakPolarHBondContact O-CB 3.44Å; C222-W226 PolarHBondContact O-N 2.91Å; F223-W226 PolarHBondContact O-N 3.48Å; W226-S228 PolarHBondContact O-N 3.29Å; W226-V229 PolarHBondContact O-N 3.08Å; W226-H230 AromaticContact CD2-CD2 3.35Å; W226-H230 AromaticContact CD2-NE2 3.89Å; W226-H230 AromaticContact CE2-CD2 3.41Å; W226-H230 VanDerWaalsContact CE2-CD2 3.41Å; W226-H230 AromaticContact CE2-CG 3.97Å; W226-H230 AromaticContact CE2-NE2 3.95Å; W226-H230 AromaticContact CE3-CD2 3.46Å; W226-H230 VanDerWaalsContact CE3-CD2 3.46Å; W226-H230 AromaticContact CE3-NE2 3.51Å; W226-H230 AromaticContact CG-CD2 3.99Å; W226-H230 AromaticContact CH2-CD2 3.7Å; W226-H230 AromaticContact CH2-CE1 3.85Å; W226-H230 AromaticContact CH2-NE2 3.31Å; W226-H230 VanDerWaalsContact CH2-NE2 3.31Å; W226-H230 WeakPolarHBondContact CH2-NE2 3.42Å; W226-H230 AromaticContact CZ2-CD2 3.6Å; W226-H230 AromaticContact CZ2-NE2 3.69Å; W226-H230 AromaticContact CZ3-CD2 3.63Å; W226-H230 AromaticContact CZ3-NE2 3.21Å; W226-H230 WeakPolarHBondContact CZ3-NE2 3.42Å; W226-H230 WeakPolarHBondContact O-CB 3.39Å; W226-H230 PolarHBondContact O-CD2 2.88Å; W226-H230 PolarHBondContact O-N 2.99Å
227	H	73.9	Confident	63.9	Low	23 Å²	23	76.4 Å²	76.4	11%	0.106	42%	0.416	C	S	.	.	H	α-helix	trans	-64.7	-37.7	174.4	-76	-68.6	0	0	0	113	H161 F223 W225 V229 L231	H161-H227 AromaticContact CD2-CE1 3.55Å; H161-H227 AromaticContact CD2-ND1 3.74Å; H161-H227 AromaticContact CE1-CE1 3.48Å; H161-H227 PolarHBondContact CE1-CE1 3.39Å; H161-H227 VanDerWaalsContact CE1-CE1 3.48Å; H161-H227 AromaticContact CG-CE1 3.11Å; H161-H227 AromaticContact CG-ND1 3.72Å; H161-H227 AromaticContact CG-NE2 3.71Å; H161-H227 AromaticContact ND1-CE1 3.07Å; H161-H227 PolarHBondContact ND1-CE1 2.67Å; H161-H227 AromaticContact ND1-ND1 3.99Å; H161-H227 AromaticContact ND1-NE2 3.73Å; H161-H227 AromaticContact NE2-CE1 3.73Å; F223-H227 AromaticContact CD2-CD2 3.56Å; F223-H227 AromaticContact CD2-NE2 3.57Å; F223-H227 AromaticContact CE1-CD2 3.79Å; F223-H227 AromaticContact CE2-CD2 3.31Å; F223-H227 WeakPolarHBondContact CE2-CD2 3.48Å; F223-H227 AromaticContact CE2-NE2 3.05Å; F223-H227 WeakPolarHBondContact CE2-NE2 3.47Å; F223-H227 AromaticContact CG-CD2 3.91Å; F223-H227 AromaticContact CZ-CD2 3.42Å; F223-H227 VanDerWaalsContact CZ-CD2 3.42Å; F223-H227 WeakPolarHBondContact CZ-CD2 3.2Å; F223-H227 AromaticContact CZ-NE2 3.49Å; F223-H227 WeakPolarHBondContact CZ-NE2 3.27Å; F223-H227 PolarHBondContact O-CD2 3.01Å; F223-H227 VanDerWaalsContact O-CD2 3.23Å; F223-H227 PolarHBondContact O-N 2.97Å; W225-H227 VanDerWaalsContact C-N 3.25Å; W225-H227 PolarHBondContact O-N 3.13Å; H227-V229 VanDerWaalsContact C-N 3.25Å; H227-V229 PolarHBondContact O-N 3.2Å; H227-L231 WeakPolarHBondContact ND1-CD1 3.43Å; H227-L231 WeakPolarHBondContact O-CA 3.49Å; H227-L231 VanDerWaalsContact O-CB 3.23Å; H227-L231 WeakPolarHBondContact O-CB 3.44Å; H227-L231 PolarHBondContact O-N 3.01Å
228	S	72.4	Confident	61.7	Low	66 Å²	66	84.5 Å²	84.5	46%	0.462	45%	0.454	S	S	.	.	H	α-helix	trans	-63.5	-30.7	175.6	72.8	0	0	0	0	113.6	R224 W225 W226 S232	R224-S228 WeakPolarHBondContact O-CB 3.49Å; R224-S228 PolarHBondContact O-N 3.27Å; W225-S228 WeakPolarHBondContact CA-OG 3.36Å; W225-S228 WeakPolarHBondContact O-CA 3.5Å; W225-S228 WeakPolarHBondContact O-CB 3.44Å; W225-S228 PolarHBondContact O-N 2.94Å; W225-S228 PolarHBondContact O-OG 3.42Å; W226-S228 PolarHBondContact O-N 3.29Å; S228-S232 PolarHBondContact O-OG 3.05Å
229	V	70.2	Confident	59.6	Low	69 Å²	69	88 Å²	88	42%	0.418	48%	0.478	S	S	.	.	H	α-helix	trans	-87.5	-43.7	-179.6	175.7	0	0	0	0	111.5	W225 W226 H227	W225-V229 HydrophobicContact CD2-CG2 4.2Å; W225-V229 HydrophobicContact CG-CG2 4.48Å; W225-V229 HydrophobicContact CZ2-CG2 3.74Å; W225-V229 VanDerWaalsContact NE1-CG2 3.33Å; W225-V229 PolarHBondContact O-N 2.93Å; W226-V229 PolarHBondContact O-N 3.08Å; H227-V229 VanDerWaalsContact C-N 3.25Å; H227-V229 PolarHBondContact O-N 3.2Å
230	H	66.8	Low	57.3	Low	94 Å²	94	94.5 Å²	94.5	44%	0.435	50%	0.502	S	S	.	.	H	α-helix	trans	-99.5	-22.5	-170.1	-66.1	-76.3	0	0	0	114.8	W226 S232	W226-H230 AromaticContact CD2-CD2 3.35Å; W226-H230 AromaticContact CD2-NE2 3.89Å; W226-H230 AromaticContact CE2-CD2 3.41Å; W226-H230 VanDerWaalsContact CE2-CD2 3.41Å; W226-H230 AromaticContact CE2-CG 3.97Å; W226-H230 AromaticContact CE2-NE2 3.95Å; W226-H230 AromaticContact CE3-CD2 3.46Å; W226-H230 VanDerWaalsContact CE3-CD2 3.46Å; W226-H230 AromaticContact CE3-NE2 3.51Å; W226-H230 AromaticContact CG-CD2 3.99Å; W226-H230 AromaticContact CH2-CD2 3.7Å; W226-H230 AromaticContact CH2-CE1 3.85Å; W226-H230 AromaticContact CH2-NE2 3.31Å; W226-H230 VanDerWaalsContact CH2-NE2 3.31Å; W226-H230 WeakPolarHBondContact CH2-NE2 3.42Å; W226-H230 AromaticContact CZ2-CD2 3.6Å; W226-H230 AromaticContact CZ2-NE2 3.69Å; W226-H230 AromaticContact CZ3-CD2 3.63Å; W226-H230 AromaticContact CZ3-NE2 3.21Å; W226-H230 WeakPolarHBondContact CZ3-NE2 3.42Å; W226-H230 WeakPolarHBondContact O-CB 3.39Å; W226-H230 PolarHBondContact O-CD2 2.88Å; W226-H230 PolarHBondContact O-N 2.99Å; H230-S232 VanDerWaalsContact C-N 3.33Å
231	L	67	Low	55	Low	91 Å²	91	96.5 Å²	96.5	48%	0.476	51%	0.512	S	S	.	.	S	Bend	trans	-87.4	-3.6	170.8	-97.6	67.2	0	0	0	113	H227 A233	H227-L231 WeakPolarHBondContact ND1-CD1 3.43Å; H227-L231 WeakPolarHBondContact O-CA 3.49Å; H227-L231 VanDerWaalsContact O-CB 3.23Å; H227-L231 WeakPolarHBondContact O-CB 3.44Å; H227-L231 PolarHBondContact O-N 3.01Å; L231-A233 PolarHBondContact O-N 3.13Å
232	S	46.5	Very low	53	Low	92 Å²	92	99.3 Å²	99.3	64%	0.643	53%	0.529	S	S	*	.			trans	-79.6	44.4	169.6	-60.4	0	0	0	0	111.6	S228 H230	S228-S232 PolarHBondContact O-OG 3.05Å; H230-S232 VanDerWaalsContact C-N 3.33Å
233	A	40.6	Very low	50.8	Low	69 Å²	69	106.6 Å²	106.6	57%	0.57	56%	0.563	S	S	*	*	S	Bend	trans	-108.7	108.7	159	0	0	0	0	0	106	L231 V235	L231-A233 PolarHBondContact O-N 3.13Å; A233-V235 PolarHBondContact O-N 3.46Å
234	P	41.2	Very low	48.8	Very low	103 Å²	103	113.3 Å²	113.3	67%	0.669	60%	0.595	S	S	*	*			trans	-55.4	129.6	169.5	24.7	-30.7	0	0	0	106.8	D236	P234-D236 PolarHBondContact O-N 3.12Å
235	V	37.5	Very low	47.1	Very low	119 Å²	119	113 Å²	113	72%	0.721	61%	0.605	S	S	*	*			trans	-65.6	80.9	164.7	177.2	0	0	0	0	105.8	A233 K237	A233-V235 PolarHBondContact O-N 3.46Å; V235-K237 HydrophobicContact CG1-CB 3.63Å; V235-K237 HydrophobicContact CG1-CD 3.83Å; V235-K237 HydrophobicContact CG1-CG 3.6Å; V235-K237 PolarHBondContact O-N 3.29Å
236	D	32.1	Very low	45.2	Very low	144 Å²	144	119 Å²	119	77%	0.77	63%	0.632	S	S	*	*			trans	-70.5	65.1	153.5	-74.2	-31.2	0	0	0	106.2	P234 E238	P234-D236 PolarHBondContact O-N 3.12Å; D236-E238 PolarHBondContact O-N 3.09Å
237	K	33.9	Very low	43.5	Very low	169 Å²	169	120.9 Å²	120.9	74%	0.735	65%	0.647	S	S	*	*			trans	-87.4	77.6	157.3	-78.9	-178.3	-180	-176.3	0	106.9	V235 S239	V235-K237 HydrophobicContact CG1-CB 3.63Å; V235-K237 HydrophobicContact CG1-CD 3.83Å; V235-K237 HydrophobicContact CG1-CG 3.6Å; V235-K237 PolarHBondContact O-N 3.29Å; K237-S239 PolarHBondContact O-N 3.42Å
238	E	31.2	Very low	41.6	Very low	176 Å²	176	129.1 Å²	129.1	82%	0.822	68%	0.679	S	S	*	*			trans	-59.5	75.9	142.8	-160.3	178.4	-165.9	0	0	107.9	D236	D236-E238 PolarHBondContact O-N 3.09Å
239	S	31	Very low	40.1	Very low	93 Å²	93	130.8 Å²	130.8	65%	0.65	69%	0.687	S	S	*	*			trans	-117.4	94.1	163.9	50.4	0	0	0	0	107.7	K237	K237-S239 PolarHBondContact O-N 3.42Å
240	K	26.3	Very low	38.9	Very low	172 Å²	172	133.7 Å²	133.7	75%	0.748	70%	0.698	S	S	*	*			trans	-40.8	141.1	165.7	-70.5	163.7	173.7	167.2	0	111.9
241	S	28.1	Very low	37.7	Very low	103 Å²	103	135.3 Å²	135.3	72%	0.72	71%	0.706	S	S	*	*			trans	41.2	94.1	143.8	63.9	0	0	0	0	117.3
242	I	31.4	Very low	36.5	Very low	172 Å²	172	136.9 Å²	136.9	88%	0.882	72%	0.715	S	S	*	*			trans	-121.9	115.2	134.4	-63.1	177.8	0	0	0	105.9
243	E	29.2	Very low	36.3	Very low	162 Å²	162	138.9 Å²	138.9	76%	0.757	72%	0.718	S	S	*	*			trans	-52.1	143.5	-177.7	-77.1	156.3	126.5	0	0	113.4	D245	E243-D245 PolarHBondContact O-N 2.84Å
244	Q	38.3	Very low	36.1	Very low	167 Å²	167	139.3 Å²	139.3	78%	0.78	72%	0.716	S	S	*	*	S	Bend	trans	17.3	91.3	135.4	-67.5	168.8	-15.6	0	0	116.5
245	D	40.1	Very low	35.9	Very low	156 Å²	156	144.8 Å²	144.8	83%	0.834	72%	0.724	S	S	*	*	S	Bend	trans	-158.7	15.2	146.8	-116.6	-10.7	0	0	0	117	E243	E243-D245 PolarHBondContact O-N 2.84Å
246	K	35.4	Very low	35.7	Very low	175 Å²	175	143.8 Å²	143.8	76%	0.761	72%	0.722	S	S	*	*	S	Bend	trans	-123.6	7.4	176.5	-77.3	-174.8	178.6	178.6	0	115.8	Y248	K246-Y248 VanDerWaalsContact C-N 3.28Å; K246-Y248 PolarHBondContact O-N 2.81Å
247	I	40.1	Very low	35.7	Very low	123 Å²	123	143.8 Å²	143.8	63%	0.631	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	-21.3	178.6	-63.1	176.8	0	0	0	111.7	T249	I247-T249 PolarHBondContact O-N 2.88Å
248	Y	35	Very low	35.4	Very low	196 Å²	196	140.8 Å²	140.8	77%	0.769	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	-6.9	-175.5	-83.2	-75	0	0	0	117	K246	K246-Y248 VanDerWaalsContact C-N 3.28Å; K246-Y248 PolarHBondContact O-N 2.81Å
249	T	40.5	Very low	35.4	Very low	102 Å²	102	138.1 Å²	138.1	63%	0.626	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.1	-16.9	-178.7	-14.9	0	0	0	0	114.5	I247	I247-T249 PolarHBondContact O-N 2.88Å
250	I	45.3	Very low	35.6	Very low	129 Å²	129	138.9 Å²	138.9	66%	0.662	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	-26.4	-176.3	-60.2	175.7	0	0	0	112.3	N252 L253 S254	I250-N252 VanDerWaalsContact C-N 3.29Å; I250-N252 PolarHBondContact O-N 3.33Å; I250-L253 PolarHBondContact O-N 2.85Å; I250-S254 PolarHBondContact O-OG 3.3Å
251	E	41.1	Very low	35.6	Very low	129 Å²	129	137.2 Å²	137.2	60%	0.603	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	-25.9	178.1	-89.9	-169.5	145.3	0	0	113.6
252	N	42.2	Very low	35.8	Very low	124 Å²	124	140.9 Å²	140.9	66%	0.663	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	-24.9	179.8	-79.4	-25.8	0	0	0	114	I250	I250-N252 VanDerWaalsContact C-N 3.29Å; I250-N252 PolarHBondContact O-N 3.33Å
253	L	41.1	Very low	35.6	Very low	134 Å²	134	141.9 Å²	141.9	70%	0.702	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-22.6	176.5	-101.2	100.6	0	0	0	113.6	I250	I250-L253 PolarHBondContact O-N 2.85Å
254	S	38.1	Very low	35.7	Very low	77 Å²	77	141.5 Å²	141.5	54%	0.538	72%	0.723	S	S	.	*	S	Bend	trans	-87.8	-8.9	-178.8	37.2	0	0	0	0	113.5	I250	I250-S254 PolarHBondContact O-OG 3.3Å
255	R	36.8	Very low	35.3	Very low	219 Å²	219	138.5 Å²	138.5	83%	0.826	72%	0.72	S	S	*	*	S	Bend	trans	-85	-21.4	176.3	-112.2	-179.3	-165.9	179.6	6.6	114.9
256	S	33.8	Very low	34.7	Very low	97 Å²	97	142.7 Å²	142.7	68%	0.678	72%	0.724	S	S	*	*	S	Bend	trans	-92.2	3.6	-173.4	76.6	0	0	0	0	115.3
257	L	30.9	Very low	34.4	Very low	144 Å²	144	145.2 Å²	145.2	75%	0.754	73%	0.729	S	S	*	*	S	Bend	trans	-124.5	15.8	-173.1	-80	163.1	0	0	0	115	P259	L257-P259 WeakPolarHBondContact O-CD 3.43Å
258	C	26.8	Very low	34	Very low	107 Å²	107	145.9 Å²	145.9	72%	0.723	74%	0.739	S	S	*	*			trans	-109	103.3	172.1	-77.9	0	0	0	0	110.3
259	P	31.4	Very low	34.1	Very low	120 Å²	120	145.2 Å²	145.2	78%	0.779	74%	0.74	S	S	*	*			trans	-61.9	130.7	165.2	-10.9	25.3	0	0	0	108.6	L257	L257-P259 WeakPolarHBondContact O-CD 3.43Å
260	P	35.4	Very low	33.8	Very low	108 Å²	108	147.4 Å²	147.4	70%	0.701	74%	0.743	S	S	*	*			trans	-72.1	166.9	168.9	33.2	-30.8	0	0	0	108.9
261	D	27.7	Very low	33.2	Very low	137 Å²	137	152.2 Å²	152.2	73%	0.733	76%	0.755	S	S	*	*			trans	85.2	58.2	172.9	-49.2	-31	0	0	0	117.2
262	F	30.9	Very low	32.8	Very low	180 Å²	180	154 Å²	154	79%	0.789	76%	0.76	S	S	*	*			trans	-130.2	83.5	135.8	-108.6	-90	0	0	0	109.8	Q264	F262-Q264 HydrophobicContact CD1-CG 4.18Å; F262-Q264 PolarHBondContact O-N 2.83Å
263	Q	27.1	Very low	32.3	Very low	193 Å²	193	151.9 Å²	151.9	90%	0.902	76%	0.76	S	S	*	*			trans	-65.1	80.7	162.4	-74.6	-169.9	2.6	0	0	109.5
264	Q	31.5	Very low	31.8	Very low	154 Å²	154	152.3 Å²	152.3	72%	0.72	76%	0.758	S	S	*	*			trans	-102.2	96.7	163.6	-89.6	-179.1	2.7	0	0	110	F262	F262-Q264 HydrophobicContact CD1-CG 4.18Å; F262-Q264 PolarHBondContact O-N 2.83Å
265	S	29.6	Very low	31.4	Very low	104 Å²	104	154.4 Å²	154.4	73%	0.727	77%	0.768	S	S	*	*			trans	8.7	113.3	154.3	61	0	0	0	0	116.8	R267	S265-R267 PolarHBondContact O-N 2.87Å
266	R	27.9	Very low	31.2	Very low	245 Å²	245	153.5 Å²	153.5	93%	0.925	77%	0.765	S	S	*	*			trans	-46.1	100.3	162.4	-67.7	179.4	175.5	-160.8	-0.9	111.1
267	R	30.2	Very low	31.2	Very low	227 Å²	227	153.6 Å²	153.6	86%	0.857	77%	0.766	S	S	*	*			trans	-131.7	84.9	152.5	-77.2	-169.5	175	174.4	-0.2	108.8	S265 K269	S265-R267 PolarHBondContact O-N 2.87Å; R267-K269 VanDerWaalsContact C-N 3.27Å; R267-K269 PolarHBondContact O-N 2.81Å
268	T	29.9	Very low	31.2	Very low	137 Å²	137	154 Å²	154	84%	0.84	77%	0.768	S	S	*	*			trans	-56.7	88.3	160.2	41.3	0	0	0	0	109.4
269	K	37.1	Very low	31.4	Very low	182 Å²	182	153.9 Å²	153.9	79%	0.791	77%	0.766	S	S	*	*			trans	-107.4	93.2	153	-78.6	-173.1	178.3	-177.9	0	106.3	R267 Y271	R267-K269 VanDerWaalsContact C-N 3.27Å; R267-K269 PolarHBondContact O-N 2.81Å; K269-Y271 PolarHBondContact O-N 3.14Å
270	E	35.3	Very low	31.4	Very low	149 Å²	149	156.2 Å²	156.2	70%	0.696	77%	0.77	S	S	*	*			trans	-47.1	102.3	166.6	-66.7	176.5	173.8	0	0	108.8	K272	E270-K272 HydrophobicContact CB-CG 4.5Å; E270-K272 PolarHBondContact O-N 3.26Å; E270-K272 VanDerWaalsContact OE2-CE 3.26Å; E270-K272 WeakPolarHBondContact OE2-CE 3.46Å; E270-K272 IonicContact OE2-NZ 3.46Å; E270-K272 PolarHBondContact OE2-NZ 3.18Å
271	Y	32.9	Very low	31.3	Very low	229 Å²	229	158.7 Å²	158.7	90%	0.898	78%	0.777	S	S	*	*			trans	-71.8	81	163.7	-112.5	-91.8	0	0	0	106.5	K269 A273	K269-Y271 PolarHBondContact O-N 3.14Å; Y271-A273 PolarHBondContact O-N 3.39Å
272	K	31.6	Very low	31.2	Very low	166 Å²	166	157.2 Å²	157.2	72%	0.722	78%	0.778	S	S	*	*			trans	-65.4	105.8	164.9	-78.3	179.4	179.8	166.8	0	106.5	E270 H274	E270-K272 HydrophobicContact CB-CG 4.5Å; E270-K272 PolarHBondContact O-N 3.26Å; E270-K272 VanDerWaalsContact OE2-CE 3.26Å; E270-K272 WeakPolarHBondContact OE2-CE 3.46Å; E270-K272 IonicContact OE2-NZ 3.46Å; E270-K272 PolarHBondContact OE2-NZ 3.18Å; K272-H274 PolarHBondContact O-N 3.41Å; K272-H274 VanDerWaalsContact O-N 3.16Å
273	A	32.1	Very low	31.4	Very low	80 Å²	80	153.8 Å²	153.8	66%	0.661	78%	0.783	S	S	*	*			trans	-48.5	125.4	166.5	0	0	0	0	0	107.2	Y271 T275	Y271-A273 PolarHBondContact O-N 3.39Å; A273-T275 PolarHBondContact O-N 3.29Å
274	H	30.4	Very low	31.6	Very low	144 Å²	144	149.6 Å²	149.6	67%	0.667	77%	0.774	S	S	*	*			trans	-69.2	84.4	-179.7	-159.1	-21.7	0	0	0	107.6	K272 R276	K272-H274 PolarHBondContact O-N 3.41Å; K272-H274 VanDerWaalsContact O-N 3.16Å; H274-R276 PolarHBondContact O-N 3.43Å
275	T	30.9	Very low	31.8	Very low	121 Å²	121	145.3 Å²	145.3	74%	0.742	77%	0.771	S	S	*	*			trans	-71.1	72.3	170.7	50.7	0	0	0	0	107.7	A273 S277	A273-T275 PolarHBondContact O-N 3.29Å; T275-S277 PolarHBondContact O-N 2.95Å
276	R	33.1	Very low	32	Very low	199 Å²	199	149.6 Å²	149.6	75%	0.751	78%	0.78	S	S	*	*			trans	-71.1	78.8	153.9	-87.6	178.5	166.4	140.2	-0.3	106.2	H274 L278	H274-R276 PolarHBondContact O-N 3.43Å; R276-L278 PolarHBondContact O-N 3.46Å
277	S	32.7	Very low	32.3	Very low	100 Å²	100	145.2 Å²	145.2	70%	0.699	77%	0.774	S	S	*	*			trans	-54.3	108.5	156.7	50.7	0	0	0	0	106.2	T275 P279	T275-S277 PolarHBondContact O-N 2.95Å; S277-P279 WeakPolarHBondContact O-CD 3.41Å
278	L	30.5	Very low	32.7	Very low	152 Å²	152	141.2 Å²	141.2	80%	0.796	76%	0.763	S	S	*	*			trans	-55.6	122.3	164.2	-75.7	162.4	0	0	0	105.8	R276 L280	R276-L278 PolarHBondContact O-N 3.46Å; L278-L280 PolarHBondContact O-N 2.73Å
279	P	31.3	Very low	33.6	Very low	105 Å²	105	140.7 Å²	140.7	68%	0.682	77%	0.765	S	S	*	*			trans	-57.5	113.9	175.4	-19.4	30.5	0	0	0	107.6	S277 L281	S277-P279 WeakPolarHBondContact O-CD 3.41Å; P279-L281 PolarHBondContact O-N 2.8Å
280	L	31.8	Very low	34.2	Very low	168 Å²	168	138.9 Å²	138.9	88%	0.88	76%	0.764	S	S	*	*			trans	-66.5	87.7	165.8	-69.6	170.5	0	0	0	105.6	L278 S282	L278-L280 PolarHBondContact O-N 2.73Å; L280-S282 PolarHBondContact O-N 3.16Å
281	L	32.2	Very low	34.5	Very low	160 Å²	160	134.6 Å²	134.6	84%	0.838	76%	0.76	S	S	*	*			trans	-66.2	99.6	176	-86.2	151.3	0	0	0	107.8	P279 A283	P279-L281 PolarHBondContact O-N 2.8Å; L281-A283 PolarHBondContact O-N 2.92Å
282	S	27.1	Very low	34.8	Very low	107 Å²	107	134.4 Å²	134.4	75%	0.748	76%	0.758	S	S	*	*			trans	-46.2	123.3	173.2	-56.8	0	0	0	0	110.2	L280 S284	L280-S282 PolarHBondContact O-N 3.16Å; S282-S284 PolarHBondContact O-N 3.48Å
283	A	35.1	Very low	35.1	Very low	108 Å²	108	136.4 Å²	136.4	89%	0.893	77%	0.767	S	S	*	*			trans	-78.5	50.3	-178.5	0	0	0	0	0	111.9	L281 G285	L281-A283 PolarHBondContact O-N 2.92Å; A283-G285 PolarHBondContact O-N 2.88Å
284	S	31.3	Very low	35.5	Very low	104 Å²	104	142.4 Å²	142.4	73%	0.727	77%	0.772	S	S	*	*			trans	-93.4	74.7	166.5	65.3	0	0	0	0	108.8	S282 E286	S282-S284 PolarHBondContact O-N 3.48Å; S284-E286 PolarHBondContact O-N 3.33Å
285	G	34.1	Very low	36.1	Very low	64 Å²	64	145.3 Å²	145.3	66%	0.66	78%	0.783	S	S	*	*			trans	-77.7	104.2	169.5	0	0	0	0	0	109.3	A283 L287	A283-G285 PolarHBondContact O-N 2.88Å; G285-L287 PolarHBondContact O-N 3.27Å; G285-L287 VanDerWaalsContact O-N 3.09Å
286	E	34.3	Very low	36.8	Very low	194 Å²	194	150.5 Å²	150.5	91%	0.907	79%	0.789	S	S	*	*			trans	-53.5	114.4	168.5	-72.8	178.2	161.3	0	0	109.7	S284	S284-E286 PolarHBondContact O-N 3.33Å
287	L	34	Very low	37.2	Very low	154 Å²	154	150.9 Å²	150.9	81%	0.806	80%	0.796	S	S	*	*			trans	-67.9	128.6	168	-86.2	95.2	0	0	0	108.2	G285	G285-L287 PolarHBondContact O-N 3.27Å; G285-L287 VanDerWaalsContact O-N 3.09Å
288	K	38.5	Very low	37.3	Very low	142 Å²	142	153.1 Å²	153.1	62%	0.617	80%	0.8	S	S	*	*			trans	-75.9	149.2	159.9	-70.9	-160.9	169.6	-155.9	0	109.3	D290 G291	K288-D290 PolarHBondContact O-N 3.26Å; K288-G291 PolarHBondContact O-N 3.48Å
289	S	50.3	Low	37.5	Very low	126 Å²	126	154.5 Å²	154.5	88%	0.881	80%	0.802	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.5	-14	-172.7	28.3	0	0	0	0	116.3
290	D	48.4	Very low	37.5	Very low	144 Å²	144	158.9 Å²	158.9	77%	0.77	81%	0.81	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.8	18	178.4	-73	-31.5	0	0	0	114.9	K288 R292	K288-D290 PolarHBondContact O-N 3.26Å; D290-R292 PolarHBondContact O-N 2.89Å
291	G	41.4	Very low	37.7	Very low	60 Å²	60	160.3 Å²	160.3	62%	0.619	81%	0.81	S	S	*	*			trans	65.3	-3.9	167.9	0	0	0	0	0	116.7	K288	K288-G291 PolarHBondContact O-N 3.48Å
292	R	39.9	Very low	37.6	Very low	225 Å²	225	159 Å²	159	85%	0.849	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-91.1	120.2	179.2	-68.3	-175.3	-171.2	-172.3	3.3	111.1	D290 R294	D290-R292 PolarHBondContact O-N 2.89Å; R292-R294 PolarHBondContact O-N 2.85Å
293	K	38.9	Very low	37.7	Very low	208 Å²	208	164.8 Å²	164.8	90%	0.904	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-56.7	118.6	172	-69.3	-175.7	178.4	178	0	109.9	K295	K293-K295 PolarHBondContact O-N 2.84Å; K293-K295 VanDerWaalsContact O-N 3.15Å
294	R	39.5	Very low	37.4	Very low	205 Å²	205	166.9 Å²	166.9	77%	0.774	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-58.6	118.3	177.1	-146.9	175.7	-176.4	-177.9	-0.7	108.6	R292 R296	R292-R294 PolarHBondContact O-N 2.85Å; R294-R296 PolarHBondContact O-N 3.38Å
295	K	42.2	Very low	37.2	Very low	206 Å²	206	169.5 Å²	169.5	90%	0.896	81%	0.807	S	S	*	*			trans	-56.3	111.2	174.1	-87.9	-177.4	176.2	175.6	0	108.4	K293 K297	K293-K295 PolarHBondContact O-N 2.84Å; K293-K295 VanDerWaalsContact O-N 3.15Å; K295-K297 PolarHBondContact O-N 3.22Å
296	R	45.5	Very low	37.1	Very low	229 Å²	229	177 Å²	177	86%	0.864	82%	0.815	S	S	*	*			trans	-59.9	130.3	179.4	-71.2	178.8	164.8	176.4	-6	109.2	R294 N298	R294-R296 PolarHBondContact O-N 3.38Å; R296-N298 PolarHBondContact O-N 2.79Å
297	K	41.2	Very low	36.7	Very low	207 Å²	207	175.6 Å²	175.6	90%	0.9	81%	0.808	S	S	*	*			trans	-65.7	105.2	162.5	-85.1	-177.8	176.9	178.2	0	106.2	K295 H299	K295-K297 PolarHBondContact O-N 3.22Å; K297-H299 PolarHBondContact O-N 3.33Å
298	N	36.7	Very low	36.8	Very low	148 Å²	148	175.2 Å²	175.2	79%	0.791	81%	0.807	S	S	*	*			trans	-57.9	114.2	177.6	-69.6	-22.7	0	0	0	109	R296 K300	R296-N298 PolarHBondContact O-N 2.79Å; N298-K300 PolarHBondContact O-N 2.87Å; N298-K300 VanDerWaalsContact O-N 3.13Å
299	H	33.9	Very low	36.6	Very low	180 Å²	180	174 Å²	174	83%	0.833	81%	0.813	S	S	*	*			trans	-59.6	116.4	168.7	-112.5	-77.7	0	0	0	107.8	K297 F301	K297-H299 PolarHBondContact O-N 3.33Å; H299-F301 PolarHBondContact O-N 3.01Å
300	K	32.1	Very low	35.7	Very low	197 Å²	197	176.3 Å²	176.3	86%	0.857	81%	0.81	S	S	*	*			trans	-60.1	108.1	168	-91.3	178.6	174.4	174.9	0	107.1	N298 T302	N298-K300 PolarHBondContact O-N 2.87Å; N298-K300 VanDerWaalsContact O-N 3.13Å; K300-T302 PolarHBondContact O-N 3.34Å
301	F	34.9	Very low	35.2	Very low	199 Å²	199	172.2 Å²	172.2	87%	0.873	80%	0.801	S	S	*	*			trans	-55.4	113.7	160	-75.8	-88.6	0	0	0	107.2	H299 R303	H299-F301 PolarHBondContact O-N 3.01Å; F301-R303 PolarHBondContact O-N 2.83Å
302	T	30.3	Very low	34.8	Very low	132 Å²	132	173.7 Å²	173.7	81%	0.81	80%	0.799	S	S	*	*			trans	-61.8	94	165.1	25.2	0	0	0	0	106.7	K300 I304	K300-T302 PolarHBondContact O-N 3.34Å; T302-I304 PolarHBondContact O-N 3.15Å
303	R	28.9	Very low	34.4	Very low	228 Å²	228	166 Å²	166	86%	0.86	78%	0.78	S	S	*	*			trans	-60.5	100.6	175.6	-151.3	-176.2	-148.2	-149.1	4.6	106.6	F301 K305	F301-R303 PolarHBondContact O-N 2.83Å; R303-K305 VanDerWaalsContact C-N 3.28Å; R303-K305 PolarHBondContact O-N 2.85Å
304	I	29.6	Very low	34	Very low	153 Å²	153	161.8 Å²	161.8	79%	0.785	77%	0.766	S	S	*	*			trans	-61.5	99.9	168.3	-62.1	173.5	0	0	0	105.1	T302 R306	T302-I304 PolarHBondContact O-N 3.15Å; I304-R306 PolarHBondContact O-N 3.4Å
305	K	27.7	Very low	33.6	Very low	158 Å²	158	163 Å²	163	69%	0.687	77%	0.77	S	S	*	*			trans	-68.1	83.5	172.8	-74.8	-178.9	178	177.5	0	107.1	R303 H307	R303-K305 VanDerWaalsContact C-N 3.28Å; R303-K305 PolarHBondContact O-N 2.85Å; K305-H307 PolarHBondContact O-N 2.75Å; K305-H307 VanDerWaalsContact O-N 3.15Å
306	R	30.9	Very low	33	Very low	221 Å²	221	158 Å²	158	83%	0.834	76%	0.757	S	S	*	*			trans	-62.3	112.4	147.2	-76.4	-174.4	176.7	166.9	-1.2	104.8	I304 L308	I304-R306 PolarHBondContact O-N 3.4Å; R306-L308 PolarHBondContact O-N 3.35Å
307	H	26.7	Very low	32.2	Very low	165 Å²	165	156.3 Å²	156.3	76%	0.764	76%	0.756	S	S	*	*			trans	-60	82.1	173.7	-101.1	-100.7	0	0	0	108.5	K305	K305-H307 PolarHBondContact O-N 2.75Å; K305-H307 VanDerWaalsContact O-N 3.15Å
308	L	35	Very low	31.6	Very low	147 Å²	147	153.9 Å²	153.9	77%	0.77	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-84.3	134.6	147.7	-116.4	79.3	0	0	0	106	R306 Q310	R306-L308 PolarHBondContact O-N 3.35Å; L308-Q310 PolarHBondContact O-N 2.88Å
309	P	33.9	Very low	31.2	Very low	115 Å²	115	151.2 Å²	151.2	75%	0.747	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-53.3	127.7	-176.2	19.3	-29.2	0	0	0	109.9	G311	P309-G311 PolarHBondContact O-N 3.03Å
310	Q	33.1	Very low	31.1	Very low	175 Å²	175	149.3 Å²	149.3	82%	0.818	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.5	121.3	-176.2	-64.6	173.4	-3.1	0	0	109.8	L308	L308-Q310 PolarHBondContact O-N 2.88Å
311	G	36.4	Very low	31	Very low	58 Å²	58	147.7 Å²	147.7	60%	0.598	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	145.7	-16.9	151.2	0	0	0	0	0	119.3	P309 S313	P309-G311 PolarHBondContact O-N 3.03Å; G311-S313 PolarHBondContact O-N 2.96Å
312	T	34.3	Very low	30.9	Very low	91 Å²	91	145.3 Å²	145.3	56%	0.558	73%	0.732	S	S	*	*			trans	-95.3	98.1	-172.2	46.6	0	0	0	0	112.1	V339	T312-V339 HydrophobicContact CG2-CB 4.16Å; T312-V339 HydrophobicContact CG2-CG1 4.25Å; T312-V339 HydrophobicContact CG2-CG2 4.17Å
313	S	31.9	Very low	30.8	Very low	65 Å²	65	146 Å²	146	46%	0.455	73%	0.731	S	S	.	*			trans	-85.5	103.7	155.3	52.4	0	0	0	0	107.2	G311 W315	G311-S313 PolarHBondContact O-N 2.96Å; S313-W315 PolarHBondContact O-N 3.44Å
314	I	30.5	Very low	30.8	Very low	119 Å²	119	140.8 Å²	140.8	61%	0.61	73%	0.727	S	S	*	*			trans	-73	107.6	176	-59.2	168.9	0	0	0	106.8	V316 I341	I314-V316 HydrophobicContact CG2-CG2 4.37Å; I314-I341 HydrophobicContact CD1-CD1 4.2Å
315	W	30.7	Very low	30.9	Very low	229 Å²	229	140.6 Å²	140.6	87%	0.867	73%	0.726	S	S	*	*			trans	-97.3	109.5	166.8	-72.8	87	0	0	0	107.3	S313 K317	S313-W315 PolarHBondContact O-N 3.44Å; W315-K317 PolarHBondContact O-N 3.41Å
316	V	29.5	Very low	30.9	Very low	102 Å²	102	140.4 Å²	140.4	62%	0.618	73%	0.732	S	S	*	*			trans	-69	109.9	170.7	179.8	0	0	0	0	106.9	I314 Q318	I314-V316 HydrophobicContact CG2-CG2 4.37Å; V316-Q318 HydrophobicContact CG1-CG 4.3Å; V316-Q318 PolarHBondContact O-N 3.43Å
317	K	28	Very low	31.2	Very low	194 Å²	194	135.4 Å²	135.4	84%	0.843	73%	0.726	S	S	*	*			trans	-84.7	84.3	176.3	-155.3	-177.8	-173.9	-170.5	0	107.8	W315 S319	W315-K317 PolarHBondContact O-N 3.41Å; K317-S319 PolarHBondContact O-N 3.27Å
318	Q	28.6	Very low	31.4	Very low	156 Å²	156	136.1 Å²	136.1	73%	0.729	73%	0.73	S	S	*	*			trans	-75.2	94.6	161.7	-84.6	177.7	-19.3	0	0	107.7	V316	V316-Q318 HydrophobicContact CG1-CG 4.3Å; V316-Q318 PolarHBondContact O-N 3.43Å
319	S	29.2	Very low	31.4	Very low	92 Å²	92	139.6 Å²	139.6	64%	0.643	73%	0.732	S	S	*	*			trans	-68.5	125.1	152.9	49.9	0	0	0	0	106.4	K317	K317-S319 PolarHBondContact O-N 3.27Å
320	N	30.3	Very low	31.5	Very low	139 Å²	139	143.5 Å²	143.5	74%	0.743	74%	0.738	S	S	*	*	S	Bend		-145.8	142.8	55.1	-66.5	-37.5	0	0	0	111.4
321	N	31.4	Very low	31.8	Very low	164 Å²	164	140.3 Å²	140.3	88%	0.877	74%	0.741	S	S	*	*			trans	70.9	40.6	164.1	-62.3	-12.4	0	0	0	120.2
322	I	32.1	Very low	32.1	Very low	149 Å²	149	141.3 Å²	141.3	76%	0.764	75%	0.751	S	S	*	*			trans	-106	112.8	156.7	-56.6	173.8	0	0	0	108.1
323	N	28.3	Very low	32.7	Very low	145 Å²	145	147.6 Å²	147.6	78%	0.775	77%	0.765	S	S	*	*			trans	-44.8	122.6	175.9	-74.7	-34.6	0	0	0	110.4	I325	N323-I325 PolarHBondContact O-N 3.03Å
324	P	29.7	Very low	33.3	Very low	119 Å²	119	150.1 Å²	150.1	77%	0.773	78%	0.78	S	S	*	*			trans	-65.2	110.6	-177.2	24.8	-31.9	0	0	0	109.4	N326	P324-N326 PolarHBondContact O-N 2.97Å
325	I	30.8	Very low	34.2	Very low	150 Å²	150	155.2 Å²	155.2	77%	0.769	79%	0.791	S	S	*	*			trans	-62.6	106.1	170.4	-61.1	173	0	0	0	106.9	N323 V327	N323-I325 PolarHBondContact O-N 3.03Å; I325-V327 VanDerWaalsContact C-N 3.3Å; I325-V327 HydrophobicContact CG2-CG2 4.13Å; I325-V327 PolarHBondContact O-N 3.46Å
326	N	28.1	Very low	35.6	Very low	153 Å²	153	151.4 Å²	151.4	82%	0.818	78%	0.781	S	S	*	*			trans	-74.2	84.3	-178.6	-151.1	-5.6	0	0	0	108.6	P324 Q328	P324-N326 PolarHBondContact O-N 2.97Å; N326-Q328 PolarHBondContact O-N 2.94Å; N326-Q328 VanDerWaalsContact O-N 3.09Å
327	V	37.4	Very low	36.8	Very low	116 Å²	116	155.1 Å²	155.1	70%	0.703	79%	0.789	S	S	*	*			trans	-71.4	105.7	175	-177.5	0	0	0	0	108	I325 R329	I325-V327 VanDerWaalsContact C-N 3.3Å; I325-V327 HydrophobicContact CG2-CG2 4.13Å; I325-V327 PolarHBondContact O-N 3.46Å; V327-R329 PolarHBondContact O-N 2.99Å
328	Q	30.9	Very low	38.4	Very low	180 Å²	180	152.5 Å²	152.5	84%	0.841	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-50.9	126.8	174.9	-77.7	-172.3	-12.7	0	0	110.9	N326 K330	N326-Q328 PolarHBondContact O-N 2.94Å; N326-Q328 VanDerWaalsContact O-N 3.09Å; Q328-K330 PolarHBondContact O-N 3.46Å
329	R	34.5	Very low	39.6	Very low	220 Å²	220	148.1 Å²	148.1	83%	0.83	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-69.6	120.4	-175.6	-69.2	-178.4	179.2	174.3	4.5	110.4	V327 A331	V327-R329 PolarHBondContact O-N 2.99Å; R329-A331 PolarHBondContact O-N 2.9Å
330	K	35.3	Very low	41.2	Very low	198 Å²	198	147.8 Å²	147.8	86%	0.861	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-70.8	120.2	158.1	-76.9	-174.6	175.7	-178.1	0	108.7	Q328	Q328-K330 PolarHBondContact O-N 3.46Å
331	A	40.9	Very low	42.6	Very low	107 Å²	107	143.7 Å²	143.7	88%	0.884	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.7	139.6	175.7	0	0	0	0	0	111	R329	R329-A331 PolarHBondContact O-N 2.9Å
332	G	42.5	Very low	43.9	Very low	79 Å²	79	139.1 Å²	139.1	81%	0.814	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	107.2	6.9	166.8	0	0	0	0	0	117.8
333	R	45.4	Very low	45.1	Very low	223 Å²	223	139.2 Å²	139.2	84%	0.842	70%	0.697	S	S	*	*			trans	-100.2	123.1	166.8	-75.2	-169.1	178.6	-171.8	0.4	111.1	R335	R333-R335 PolarHBondContact O-N 2.95Å
334	P	44.2	Very low	46.6	Very low	119 Å²	119	141.4 Å²	141.4	77%	0.773	70%	0.7	S	S	*	*			trans	-58.3	139.2	175.3	21.9	-30.1	0	0	0	110	K336	P334-K336 PolarHBondContact O-N 3.22Å
335	R	51.3	Low	47.9	Very low	225 Å²	225	137.7 Å²	137.7	85%	0.849	67%	0.673	S	S	*	*			trans	-49.1	113.2	179.6	-83.2	177.6	154.7	160.9	-7.1	109.3	R333 K337	R333-R335 PolarHBondContact O-N 2.95Å; R335-K337 PolarHBondContact O-N 3.27Å
336	K	59.3	Low	49	Very low	149 Å²	149	135 Å²	135	65%	0.648	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-65.5	120.3	168.3	-72.9	-173.7	175.3	-172.6	0	107.8	P334 Q338	P334-K336 PolarHBondContact O-N 3.22Å; K336-Q338 PolarHBondContact O-N 2.97Å
337	K	55.3	Low	50.8	Low	181 Å²	181	135.3 Å²	135.3	79%	0.787	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-60.4	126	171.1	-70.2	-174.6	177.8	-176.3	0	108.1	R335 V339	R335-K337 PolarHBondContact O-N 3.27Å; K337-V339 PolarHBondContact O-N 3.27Å
338	Q	60.9	Low	51.8	Low	139 Å²	139	135.2 Å²	135.2	65%	0.65	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-71	118.5	174.7	-77.4	173.3	-22.1	0	0	108.1	K336 Y340	K336-Q338 PolarHBondContact O-N 2.97Å; Q338-Y340 HydrophobicContact CB-CD2 4.47Å; Q338-Y340 HydrophobicContact CB-CE2 3.64Å; Q338-Y340 PolarHBondContact OE1-OH 3.13Å
339	V	54.7	Low	53.4	Low	63 Å²	63	129.9 Å²	129.9	38%	0.382	63%	0.628	S	S	.	*	P	Polyproline II helix	trans	-96.2	129.6	174	178.4	0	0	0	0	107.2	T312 K337 P350	T312-V339 HydrophobicContact CG2-CB 4.16Å; T312-V339 HydrophobicContact CG2-CG1 4.25Å; T312-V339 HydrophobicContact CG2-CG2 4.17Å; K337-V339 PolarHBondContact O-N 3.27Å; V339-P350 HydrophobicContact CG1-CB 3.45Å; V339-P350 VanDerWaalsContact CG1-CB 3.45Å
340	Y	61.9	Low	54.7	Low	85 Å²	85	123.4 Å²	123.4	33%	0.333	62%	0.615	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.3	151.2	-179.6	-63.6	-89.8	0	0	0	109.2	Q338 Y351 K353	Q338-Y340 HydrophobicContact CB-CD2 4.47Å; Q338-Y340 HydrophobicContact CB-CE2 3.64Å; Q338-Y340 PolarHBondContact OE1-OH 3.13Å; Y340-Y351 PolarHBondContact N-O 3.28Å; Y340-Y351 WeakPolarHBondContact O-CD1 3.41Å; Y340-Y351 PolarHBondContact O-N 3.22Å; Y340-K353 HydrophobicContact CD2-CG 4.2Å; Y340-K353 HydrophobicContact CE2-CD 4.47Å; Y340-K353 HydrophobicContact CE2-CG 4.48Å
341	I	59.7	Low	55.9	Low	54 Å²	54	118.8 Å²	118.8	28%	0.277	59%	0.593	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.4	131.8	174.4	-56.4	170.7	0	0	0	106.8	I314 W348	I314-I341 HydrophobicContact CD1-CD1 4.2Å; I341-W348 HydrophobicContact CG2-CB 4.17Å; I341-W348 HydrophobicContact CG2-CD2 4.47Å; I341-W348 HydrophobicContact CG2-CE3 3.76Å
342	N	58.8	Low	56.7	Low	68 Å²	68	116.8 Å²	116.8	36%	0.364	57%	0.57	S	S	.	*			trans	-85.5	114.7	176	-175.8	0.5	0	0	0	108.7	K344 D345 Y351	N342-K344 PolarHBondContact O-N 2.67Å; N342-K344 WeakPolarHBondContact OD1-CB 3.28Å; N342-K344 PolarHBondContact OD1-N 3.22Å; N342-D345 HydrophobicContact CB-CB 3.96Å; N342-D345 WeakPolarHBondContact O-CB 3.44Å; N342-D345 PolarHBondContact O-N 3.36Å; N342-Y351 HydrophobicContact CB-CE1 3.81Å
343	F	56.5	Low	57.3	Low	150 Å²	150	119.7 Å²	119.7	66%	0.658	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	-17.7	178.3	-66.8	-80.3	0	0	0	113.7	W348	F343-W348 AromaticContact CD1-CH2 3.73Å; F343-W348 HydrophobicContact CD1-CH2 3.73Å; F343-W348 AromaticContact CD1-CZ3 3.61Å; F343-W348 HydrophobicContact CD1-CZ3 3.61Å; F343-W348 HydrophobicContact CE1-CH2 4.23Å; F343-W348 AromaticContact CE1-CZ3 3.84Å; F343-W348 HydrophobicContact CE1-CZ3 3.84Å
344	K	61.5	Low	57.5	Low	192 Å²	192	121 Å²	121	84%	0.835	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	-10.9	174.8	-62.1	-172.7	177.3	-173	0	112.8	N342 P346	N342-K344 PolarHBondContact O-N 2.67Å; N342-K344 WeakPolarHBondContact OD1-CB 3.28Å; N342-K344 PolarHBondContact OD1-N 3.22Å; K344-P346 WeakPolarHBondContact O-CD 3.32Å
345	D	55.2	Low	58.2	Low	40 Å²	40	121.1 Å²	121.1	21%	0.214	57%	0.565	C	S	.	*			trans	-84.5	114.2	175.9	-178.9	6.3	0	0	0	109.3	N342 E347 W348 T349	N342-D345 HydrophobicContact CB-CB 3.96Å; N342-D345 WeakPolarHBondContact O-CB 3.44Å; N342-D345 PolarHBondContact O-N 3.36Å; D345-E347 PolarHBondContact O-N 3.47Å; D345-E347 PolarHBondContact OD1-N 2.77Å; D345-W348 PolarHBondContact O-N 2.91Å; D345-W348 VanDerWaalsContact O-N 3.13Å; D345-T349 WeakPolarHBondContact OD2-CB 3.26Å; D345-T349 PolarHBondContact OD2-N 2.88Å; D345-T349 PolarHBondContact OD2-OG1 3.15Å
346	P	54.6	Low	58.5	Low	93 Å²	93	115.6 Å²	115.6	60%	0.604	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	-19	178.6	26.6	-33.6	0	0	0	113.2	K344 W348	K344-P346 WeakPolarHBondContact O-CD 3.32Å; P346-W348 VanDerWaalsContact O-CD1 3.26Å
347	E	65.3	Low	58.5	Low	160 Å²	160	113.8 Å²	113.8	75%	0.748	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-9.2	177.3	-60.8	-168.6	170.5	0	0	113.3	D345 T349	D345-E347 PolarHBondContact O-N 3.47Å; D345-E347 PolarHBondContact OD1-N 2.77Å; E347-T349 PolarHBondContact O-N 2.88Å
348	W	60.1	Low	58.7	Low	115 Å²	115	109.8 Å²	109.8	44%	0.436	53%	0.531	S	S	.	.			trans	52.7	34.9	-179.9	-61.6	73	0	0	0	113.1	I341 F343 D345 P346 P350	I341-W348 HydrophobicContact CG2-CB 4.17Å; I341-W348 HydrophobicContact CG2-CD2 4.47Å; I341-W348 HydrophobicContact CG2-CE3 3.76Å; F343-W348 AromaticContact CD1-CH2 3.73Å; F343-W348 HydrophobicContact CD1-CH2 3.73Å; F343-W348 AromaticContact CD1-CZ3 3.61Å; F343-W348 HydrophobicContact CD1-CZ3 3.61Å; F343-W348 HydrophobicContact CE1-CH2 4.23Å; F343-W348 AromaticContact CE1-CZ3 3.84Å; F343-W348 HydrophobicContact CE1-CZ3 3.84Å; D345-W348 PolarHBondContact O-N 2.91Å; D345-W348 VanDerWaalsContact O-N 3.13Å; P346-W348 VanDerWaalsContact O-CD1 3.26Å; W348-P350 WeakPolarHBondContact O-CD 3.41Å
349	T	64	Low	58.5	Low	67 Å²	67	108 Å²	108	41%	0.411	52%	0.523	S	S	.	.			trans	-66.5	121.3	-174.7	-19.8	0	0	0	0	109.7	D345 E347 Y351	D345-T349 WeakPolarHBondContact OD2-CB 3.26Å; D345-T349 PolarHBondContact OD2-N 2.88Å; D345-T349 PolarHBondContact OD2-OG1 3.15Å; E347-T349 PolarHBondContact O-N 2.88Å; T349-Y351 PolarHBondContact O-N 2.87Å
350	P	61.5	Low	58.8	Low	85 Å²	85	111 Å²	111	55%	0.552	53%	0.533	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.9	128.9	176.2	24.8	-29.9	0	0	0	109.6	V339 W348	V339-P350 HydrophobicContact CG1-CB 3.45Å; V339-P350 VanDerWaalsContact CG1-CB 3.45Å; W348-P350 WeakPolarHBondContact O-CD 3.41Å
351	Y	60.4	Low	58.6	Low	100 Å²	100	112.9 Å²	112.9	39%	0.392	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	152.6	175.6	70.6	-78.6	0	0	0	111.4	Y340 N342 T349 K353	Y340-Y351 PolarHBondContact N-O 3.28Å; Y340-Y351 WeakPolarHBondContact O-CD1 3.41Å; Y340-Y351 PolarHBondContact O-N 3.22Å; N342-Y351 HydrophobicContact CB-CE1 3.81Å; T349-Y351 PolarHBondContact O-N 2.87Å; Y351-K353 HydrophobicContact CE2-CG 4.07Å
352	T	58.2	Low	58.5	Low	65 Å²	65	117.4 Å²	117.4	40%	0.399	57%	0.568	S	S	.	*			trans	-93.3	127.8	169.7	44.7	0	0	0	0	108.7	H354	T352-H354 PolarHBondContact O-N 3.22Å
353	K	55	Low	58.5	Low	141 Å²	141	121.5 Å²	121.5	61%	0.613	59%	0.585	S	S	*	*			trans	-65.8	121.8	163.5	-78	-172.3	175.2	-173.1	0	107.7	Y340 Y351	Y340-K353 HydrophobicContact CD2-CG 4.2Å; Y340-K353 HydrophobicContact CE2-CD 4.47Å; Y340-K353 HydrophobicContact CE2-CG 4.48Å; Y351-K353 HydrophobicContact CE2-CG 4.07Å
354	H	49.6	Very low	58.7	Low	250 Å²	250	118.9 Å²	118.9	100%	1.157	58%	0.578	S	S	*	*			trans	-70.5	0	167.9	-77.1	-66.7	0	0	0	110.4	T352	T352-H354 PolarHBondContact O-N 3.22Å

Retrieved 354 of 354 residues in 373.7 ms (Link to these results)

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