G4LYV3_SCHMA Loading...

Nuclear migration protein nudC

AlphaFold DB , UniProt , Accession G4LYV3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 325 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	63.1	Low	86.8	Confident	195 Å²	195	103.7 Å²	103.7	96%	0.961	54%	0.538	S	S	*	.				0	59.2	0	-85.5	-146.7	-81.7	0	0	110	Y3 D4	M1-Y3 VanDerWaalsContact C-N 3.35Å; M1-Y3 PolarHBondContact O-N 2.73Å; M1-D4 WeakPolarHBondContact CA-OD2 3.45Å; M1-D4 HydrophobicContact CB-CB 3.97Å; M1-D4 WeakPolarHBondContact CB-OD2 3.41Å; M1-D4 HydrophobicContact CG-CB 4.16Å; M1-D4 WeakPolarHBondContact CG-OD2 3.43Å; M1-D4 HydrophobicContact SD-CB 3.71Å
2	E	80.4	Confident	87.2	Confident	162 Å²	162	107.4 Å²	107.4	76%	0.757	55%	0.551	S	S	*	*			trans	-71.5	-29.6	-170	-171.2	178.2	175.5	0	0	112.8
3	Y	88	Confident	87.4	Confident	135 Å²	135	106.5 Å²	106.5	53%	0.529	56%	0.56	S	S	.	*	S	Bend	trans	-116.2	3.7	-176.3	-60.8	-75.3	0	0	0	113.5	M1 N5 V6 F7	M1-Y3 VanDerWaalsContact C-N 3.35Å; M1-Y3 PolarHBondContact O-N 2.73Å; Y3-N5 VanDerWaalsContact C-N 3.28Å; Y3-N5 PolarHBondContact O-N 3.5Å; Y3-V6 WeakPolarHBondContact O-CA 3.21Å; Y3-V6 WeakPolarHBondContact O-CB 3.38Å; Y3-V6 PolarHBondContact O-N 3.18Å; Y3-F7 HydrophobicContact CG-CE2 4.5Å; Y3-F7 VanDerWaalsContact O-CD2 3.26Å; Y3-F7 WeakPolarHBondContact O-CD2 3.38Å; Y3-F7 PolarHBondContact O-N 2.89Å
4	D	90	Very high	87.4	Confident	68 Å²	68	100.8 Å²	100.8	36%	0.364	53%	0.533	S	S	.	.	H	α-helix	trans	-63.9	-33.8	-173.3	-65.9	-85.3	0	0	0	112.7	M1 V6 F7 L8	M1-D4 WeakPolarHBondContact CA-OD2 3.45Å; M1-D4 HydrophobicContact CB-CB 3.97Å; M1-D4 WeakPolarHBondContact CB-OD2 3.41Å; M1-D4 HydrophobicContact CG-CB 4.16Å; M1-D4 WeakPolarHBondContact CG-OD2 3.43Å; M1-D4 HydrophobicContact SD-CB 3.71Å; D4-V6 VanDerWaalsContact C-N 3.31Å; D4-V6 PolarHBondContact O-N 3.27Å; D4-F7 PolarHBondContact O-N 3.23Å; D4-L8 WeakPolarHBondContact O-CB 3.39Å; D4-L8 PolarHBondContact O-N 3.07Å
5	N	91.7	Very high	87.4	Confident	135 Å²	135	103.9 Å²	103.9	72%	0.722	55%	0.55	S	S	*	.	H	α-helix	trans	-63.8	-37.8	172.6	-68.7	-40.2	0	0	0	112.1	Y3 S9	Y3-N5 VanDerWaalsContact C-N 3.28Å; Y3-N5 PolarHBondContact O-N 3.5Å; N5-S9 WeakPolarHBondContact O-CB 3.46Å; N5-S9 PolarHBondContact O-N 3.02Å
6	V	91.1	Very high	87.4	Confident	89 Å²	89	104.9 Å²	104.9	54%	0.539	56%	0.556	S	S	.	*	H	α-helix	trans	-69.6	-48.2	177.3	-177.7	0	0	0	0	109.7	Y3 D4 L8 S9 V10	Y3-V6 WeakPolarHBondContact O-CA 3.21Å; Y3-V6 WeakPolarHBondContact O-CB 3.38Å; Y3-V6 PolarHBondContact O-N 3.18Å; D4-V6 VanDerWaalsContact C-N 3.31Å; D4-V6 PolarHBondContact O-N 3.27Å; V6-L8 VanDerWaalsContact C-N 3.32Å; V6-L8 PolarHBondContact O-N 2.91Å; V6-S9 PolarHBondContact O-N 2.72Å; V6-V10 WeakPolarHBondContact O-CG2 3.16Å; V6-V10 PolarHBondContact O-N 2.63Å
7	F	90.3	Very high	87.4	Confident	103 Å²	103	101.2 Å²	101.2	45%	0.452	55%	0.548	S	S	.	.	H	α-helix	trans	-63.6	-36.6	177.5	-74.7	-62.3	0	0	0	112.6	Y3 D4 V10 A11	Y3-F7 HydrophobicContact CG-CE2 4.5Å; Y3-F7 VanDerWaalsContact O-CD2 3.26Å; Y3-F7 WeakPolarHBondContact O-CD2 3.38Å; Y3-F7 PolarHBondContact O-N 2.89Å; D4-F7 PolarHBondContact O-N 3.23Å; F7-V10 PolarHBondContact O-N 2.93Å; F7-A11 VanDerWaalsContact O-CB 3.23Å; F7-A11 WeakPolarHBondContact O-CB 3.28Å; F7-A11 PolarHBondContact O-N 3Å
8	L	90	Very high	87.5	Confident	96 Å²	96	101.6 Å²	101.6	50%	0.503	55%	0.554	S	S	.	*	H	α-helix	trans	-64.7	-44.6	174.8	-176.2	64.2	0	0	0	111	D4 V6 V10 A11 Q12	D4-L8 WeakPolarHBondContact O-CB 3.39Å; D4-L8 PolarHBondContact O-N 3.07Å; V6-L8 VanDerWaalsContact C-N 3.32Å; V6-L8 PolarHBondContact O-N 2.91Å; L8-V10 VanDerWaalsContact C-N 3.34Å; L8-V10 PolarHBondContact O-N 3.17Å; L8-A11 PolarHBondContact O-N 3.16Å; L8-Q12 WeakPolarHBondContact O-CB 3.29Å; L8-Q12 VanDerWaalsContact O-CG 3.28Å; L8-Q12 WeakPolarHBondContact O-CG 3.4Å; L8-Q12 PolarHBondContact O-N 2.86Å
9	S	90.7	Very high	87.7	Confident	66 Å²	66	103.4 Å²	103.4	46%	0.462	56%	0.558	S	S	.	*	H	α-helix	trans	-61.6	-41.8	176.1	177.3	0	0	0	0	112.1	N5 V6 Q12 S13	N5-S9 WeakPolarHBondContact O-CB 3.46Å; N5-S9 PolarHBondContact O-N 3.02Å; V6-S9 PolarHBondContact O-N 2.72Å; S9-Q12 PolarHBondContact O-N 2.64Å; S9-S13 PolarHBondContact O-N 3.46Å; S9-S13 PolarHBondContact O-OG 3.14Å
10	V	89.8	Confident	88	Confident	57 Å²	57	99 Å²	99	35%	0.345	54%	0.538	S	S	.	.	H	α-helix	trans	-64.7	-47.1	174	177.6	0	0	0	0	110.5	V6 F7 L8 Q12 S13 C14 L21	V6-V10 WeakPolarHBondContact O-CG2 3.16Å; V6-V10 PolarHBondContact O-N 2.63Å; F7-V10 PolarHBondContact O-N 2.93Å; L8-V10 VanDerWaalsContact C-N 3.34Å; L8-V10 PolarHBondContact O-N 3.17Å; V10-Q12 VanDerWaalsContact C-N 3.26Å; V10-Q12 PolarHBondContact O-N 3.01Å; V10-S13 CarbonylContact O-C 3.58Å; V10-S13 WeakPolarHBondContact O-CA 3.42Å; V10-S13 PolarHBondContact O-N 3.33Å; V10-C14 PolarHBondContact O-N 3.29Å; V10-C14 PolarHBondContact O-SG 3.29Å; V10-L21 HydrophobicContact CB-CD1 4.1Å; V10-L21 HydrophobicContact CG1-CD1 3.58Å
11	A	89.7	Confident	88.2	Confident	35 Å²	35	96.1 Å²	96.1	29%	0.289	52%	0.522	S	S	.	.	H	α-helix	trans	-61	-33.6	180	0	0	0	0	0	113	F7 L8 S13 L21	F7-A11 VanDerWaalsContact O-CB 3.23Å; F7-A11 WeakPolarHBondContact O-CB 3.28Å; F7-A11 PolarHBondContact O-N 3Å; L8-A11 PolarHBondContact O-N 3.16Å; A11-S13 VanDerWaalsContact C-N 3.32Å; A11-L21 HydrophobicContact CB-CD1 4.32Å; A11-L21 HydrophobicContact CB-CD2 4.15Å
12	Q	91.2	Very high	89.7	Confident	148 Å²	148	91 Å²	91	69%	0.692	50%	0.498	S	S	*	.	H	α-helix	trans	-72.2	-24.9	173.7	-73.8	173.6	-14.5	0	0	113.2	L8 S9 V10	L8-Q12 WeakPolarHBondContact O-CB 3.29Å; L8-Q12 VanDerWaalsContact O-CG 3.28Å; L8-Q12 WeakPolarHBondContact O-CG 3.4Å; L8-Q12 PolarHBondContact O-N 2.86Å; S9-Q12 PolarHBondContact O-N 2.64Å; V10-Q12 VanDerWaalsContact C-N 3.26Å; V10-Q12 PolarHBondContact O-N 3.01Å
13	S	90	Very high	90.2	Very high	95 Å²	95	89.1 Å²	89.1	66%	0.664	49%	0.493	S	S	*	.	H	α-helix	trans	-91.8	-20.4	-179.4	-54	0	0	0	0	113	S9 V10 A11	S9-S13 PolarHBondContact O-N 3.46Å; S9-S13 PolarHBondContact O-OG 3.14Å; V10-S13 CarbonylContact O-C 3.58Å; V10-S13 WeakPolarHBondContact O-CA 3.42Å; V10-S13 PolarHBondContact O-N 3.33Å; A11-S13 VanDerWaalsContact C-N 3.32Å
14	C	88.2	Confident	90.4	Very high	27 Å²	27	84.4 Å²	84.4	18%	0.182	48%	0.482	C	S	.	.	S	Bend	trans	-80.2	128.4	178.2	-70.6	0	0	0	0	111.1	V10	V10-C14 PolarHBondContact O-N 3.29Å; V10-C14 PolarHBondContact O-SG 3.29Å
15	D	86.2	Confident	90.6	Very high	147 Å²	147	85.3 Å²	85.3	79%	0.786	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	151.7	165.9	-64.6	-41.8	0	0	0	110.1	G17 G20	D15-G17 VanDerWaalsContact C-N 3.33Å; D15-G17 PolarHBondContact O-N 3.43Å; D15-G20 VanDerWaalsContact O-CA 3.29Å; D15-G20 WeakPolarHBondContact O-CA 3.3Å
16	N	87.6	Confident	90.7	Very high	121 Å²	121	81.9 Å²	81.9	65%	0.647	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.3	26.7	173.9	-156.2	30.4	0	0	0	115.5	V18 Q19	N16-V18 PolarHBondContact O-N 3.01Å; N16-Q19 PolarHBondContact ND2-OE1 3.47Å; N16-Q19 PolarHBondContact O-N 2.98Å
17	G	87.7	Confident	90.8	Very high	41 Å²	41	78.5 Å²	78.5	42%	0.423	45%	0.445	S	S	.	.	H	α-helix	trans	60.5	-131.2	167.4	0	0	0	0	0	114.1	D15 Q19 G20 L21	D15-G17 VanDerWaalsContact C-N 3.33Å; D15-G17 PolarHBondContact O-N 3.43Å; G17-Q19 PolarHBondContact O-N 3.33Å; G17-G20 PolarHBondContact O-N 3.31Å; G17-L21 PolarHBondContact O-N 3.02Å
18	V	89.8	Confident	91	Very high	108 Å²	108	78.3 Å²	78.3	66%	0.655	44%	0.444	S	S	*	.	H	α-helix	trans	-60.6	-33.3	-177.6	179.7	0	0	0	0	112.1	N16 L21 L22	N16-V18 PolarHBondContact O-N 3.01Å; V18-L21 PolarHBondContact O-N 2.85Å; V18-L22 HydrophobicContact CG1-CD1 4.08Å; V18-L22 HydrophobicContact CG1-CG 4.27Å; V18-L22 WeakPolarHBondContact O-CB 3.4Å; V18-L22 VanDerWaalsContact O-CG 3.31Å; V18-L22 WeakPolarHBondContact O-CG 3.4Å; V18-L22 PolarHBondContact O-N 3.2Å
19	Q	91.2	Very high	91.2	Very high	136 Å²	136	74.8 Å²	74.8	64%	0.636	43%	0.426	S	S	*	.	H	α-helix	trans	-64.9	-45.7	178.3	-68.5	-176	-14.9	0	0	111.2	N16 G17 L22 D23	N16-Q19 PolarHBondContact ND2-OE1 3.47Å; N16-Q19 PolarHBondContact O-N 2.98Å; G17-Q19 PolarHBondContact O-N 3.33Å; Q19-L22 PolarHBondContact O-N 3.41Å; Q19-D23 PolarHBondContact O-N 3.02Å
20	G	92.4	Very high	91.2	Very high	15 Å²	15	74.4 Å²	74.4	16%	0.155	42%	0.423	C	S	.	.	H	α-helix	trans	-66.6	-36.5	176	0	0	0	0	0	113	D15 G17 D23 A24	D15-G20 VanDerWaalsContact O-CA 3.29Å; D15-G20 WeakPolarHBondContact O-CA 3.3Å; G17-G20 PolarHBondContact O-N 3.31Å; G20-D23 PolarHBondContact O-N 2.63Å; G20-A24 VanDerWaalsContact O-CB 3.3Å; G20-A24 WeakPolarHBondContact O-CB 3.5Å; G20-A24 PolarHBondContact O-N 3.45Å
21	L	93.3	Very high	91.4	Very high	39 Å²	39	80.4 Å²	80.4	20%	0.204	44%	0.439	C	S	.	.	H	α-helix	trans	-61.1	-45.3	173.8	179.5	64.7	0	0	0	111.6	V10 A11 G17 V18 A24 F25	V10-L21 HydrophobicContact CB-CD1 4.1Å; V10-L21 HydrophobicContact CG1-CD1 3.58Å; A11-L21 HydrophobicContact CB-CD1 4.32Å; A11-L21 HydrophobicContact CB-CD2 4.15Å; G17-L21 PolarHBondContact O-N 3.02Å; V18-L21 PolarHBondContact O-N 2.85Å; L21-A24 PolarHBondContact O-N 3.5Å; L21-F25 WeakPolarHBondContact O-CB 3.44Å; L21-F25 PolarHBondContact O-N 2.91Å
22	L	93.5	Very high	91.6	Very high	87 Å²	87	88.2 Å²	88.2	46%	0.455	46%	0.462	S	S	.	.	H	α-helix	trans	-66	-43.2	177.3	-70.7	175.7	0	0	0	111.5	V18 Q19 F25 F26	V18-L22 HydrophobicContact CG1-CD1 4.08Å; V18-L22 HydrophobicContact CG1-CG 4.27Å; V18-L22 WeakPolarHBondContact O-CB 3.4Å; V18-L22 VanDerWaalsContact O-CG 3.31Å; V18-L22 WeakPolarHBondContact O-CG 3.4Å; V18-L22 PolarHBondContact O-N 3.2Å; Q19-L22 PolarHBondContact O-N 3.41Å; L22-F25 PolarHBondContact O-N 3.46Å; L22-F26 HydrophobicContact CB-CD2 4.39Å; L22-F26 HydrophobicContact CB-CE2 4.31Å; L22-F26 HydrophobicContact CD2-CE2 4.35Å; L22-F26 WeakPolarHBondContact O-CD2 3.31Å; L22-F26 PolarHBondContact O-N 2.98Å
23	D	92.9	Very high	91.6	Very high	123 Å²	123	83.5 Å²	83.5	66%	0.658	44%	0.443	S	S	*	.	H	α-helix	trans	-60.2	-45.5	175.6	-175.4	66.3	0	0	0	111.8	Q19 G20 F25 F26 G27	Q19-D23 PolarHBondContact O-N 3.02Å; G20-D23 PolarHBondContact O-N 2.63Å; D23-F25 VanDerWaalsContact C-N 3.33Å; D23-F25 PolarHBondContact O-N 3.43Å; D23-F26 PolarHBondContact O-N 3.4Å; D23-G27 PolarHBondContact O-N 2.8Å
24	A	92.3	Very high	91.7	Very high	36 Å²	36	84.5 Å²	84.5	30%	0.298	44%	0.441	S	S	.	.	H	α-helix	trans	-60.6	-41.4	175.6	0	0	0	0	0	112.1	G20 L21 F28	G20-A24 VanDerWaalsContact O-CB 3.3Å; G20-A24 WeakPolarHBondContact O-CB 3.5Å; G20-A24 PolarHBondContact O-N 3.45Å; L21-A24 PolarHBondContact O-N 3.5Å; A24-F28 WeakPolarHBondContact O-CB 3.26Å; A24-F28 PolarHBondContact O-N 3.12Å
25	F	93.6	Very high	91.8	Very high	87 Å²	87	85 Å²	85	38%	0.382	44%	0.44	S	S	.	.	H	α-helix	trans	-66	-50.5	178	178.9	-105.3	0	0	0	112.3	L21 L22 D23 G27 F28 L29	L21-F25 WeakPolarHBondContact O-CB 3.44Å; L21-F25 PolarHBondContact O-N 2.91Å; L22-F25 PolarHBondContact O-N 3.46Å; D23-F25 VanDerWaalsContact C-N 3.33Å; D23-F25 PolarHBondContact O-N 3.43Å; F25-G27 VanDerWaalsContact C-N 3.3Å; F25-G27 PolarHBondContact O-N 3.25Å; F25-F28 WeakPolarHBondContact O-CB 3.39Å; F25-F28 PolarHBondContact O-N 3Å; F25-F28 VanDerWaalsContact O-N 3.16Å; F25-L29 HydrophobicContact CD1-CD1 4.27Å; F25-L29 HydrophobicContact CE1-CD1 3.72Å; F25-L29 HydrophobicContact CE1-CG 4.36Å; F25-L29 HydrophobicContact CZ-CD1 4.05Å; F25-L29 HydrophobicContact CZ-CD2 4.46Å; F25-L29 HydrophobicContact CZ-CG 4.38Å; F25-L29 PolarHBondContact O-N 2.85Å
26	F	93.8	Very high	91.9	Very high	64 Å²	64	82.8 Å²	82.8	28%	0.281	42%	0.421	S	S	.	.	H	α-helix	trans	-66.1	-34.5	177.1	-71.3	-61.1	0	0	0	111.9	L22 D23 L29 S30 Y36 V48	L22-F26 HydrophobicContact CB-CD2 4.39Å; L22-F26 HydrophobicContact CB-CE2 4.31Å; L22-F26 HydrophobicContact CD2-CE2 4.35Å; L22-F26 WeakPolarHBondContact O-CD2 3.31Å; L22-F26 PolarHBondContact O-N 2.98Å; D23-F26 PolarHBondContact O-N 3.4Å; F26-L29 HydrophobicContact CD1-CD1 4.14Å; F26-L29 PolarHBondContact O-N 3.12Å; F26-S30 PolarHBondContact O-N 3.28Å; F26-Y36 PolarHBondContact O-OH 3.45Å; F26-V48 HydrophobicContact CE1-CG1 4.38Å; F26-V48 HydrophobicContact CE1-CG2 3.96Å; F26-V48 HydrophobicContact CZ-CG1 4.02Å; F26-V48 HydrophobicContact CZ-CG2 4.43Å
27	G	93.1	Very high	91.9	Very high	17 Å²	17	86.5 Å²	86.5	18%	0.175	43%	0.428	C	S	.	.	H	α-helix	trans	-64.6	-36.9	171.2	0	0	0	0	0	113.2	D23 F25 S30 R31	D23-G27 PolarHBondContact O-N 2.8Å; F25-G27 VanDerWaalsContact C-N 3.3Å; F25-G27 PolarHBondContact O-N 3.25Å; G27-S30 PolarHBondContact O-N 3.44Å; G27-R31 WeakPolarHBondContact O-CG 3.33Å; G27-R31 PolarHBondContact O-N 3.27Å; G27-R31 PolarHBondContact O-NH1 3.5Å
28	F	93.6	Very high	91.8	Very high	99 Å²	99	87.3 Å²	87.3	43%	0.434	44%	0.436	S	S	.	.	H	α-helix	trans	-62.9	-48.2	171.5	162.7	-94.8	0	0	0	111.2	A24 F25 S30 R31 R32 T33	A24-F28 WeakPolarHBondContact O-CB 3.26Å; A24-F28 PolarHBondContact O-N 3.12Å; F25-F28 WeakPolarHBondContact O-CB 3.39Å; F25-F28 PolarHBondContact O-N 3Å; F25-F28 VanDerWaalsContact O-N 3.16Å; F28-S30 PolarHBondContact O-N 3.48Å; F28-R31 PolarHBondContact O-N 3.42Å; F28-R31 VanDerWaalsContact O-N 3.14Å; F28-R32 HydrophobicContact CD2-CB 3.93Å; F28-R32 HydrophobicContact CD2-CG 3.84Å; F28-R32 HydrophobicContact CE2-CB 3.61Å; F28-R32 HydrophobicContact CE2-CG 3.79Å; F28-R32 HydrophobicContact CZ-CB 4.07Å; F28-R32 WeakPolarHBondContact O-CB 3.45Å; F28-R32 PolarHBondContact O-N 2.92Å; F28-T33 HydrophobicContact CE1-CG2 4.18Å
29	L	94.1	Very high	91.3	Very high	22 Å²	22	84.3 Å²	84.3	12%	0.115	42%	0.423	C	S	.	.	H	α-helix	trans	-56.4	-40.9	176.9	-67	-179.6	0	0	0	111.1	F25 F26 R31 T33 F35 Y36	F25-L29 HydrophobicContact CD1-CD1 4.27Å; F25-L29 HydrophobicContact CE1-CD1 3.72Å; F25-L29 HydrophobicContact CE1-CG 4.36Å; F25-L29 HydrophobicContact CZ-CD1 4.05Å; F25-L29 HydrophobicContact CZ-CD2 4.46Å; F25-L29 HydrophobicContact CZ-CG 4.38Å; F25-L29 PolarHBondContact O-N 2.85Å; F26-L29 HydrophobicContact CD1-CD1 4.14Å; F26-L29 PolarHBondContact O-N 3.12Å; L29-R31 PolarHBondContact O-N 2.85Å; L29-T33 WeakPolarHBondContact CA-OG1 3.39Å; L29-T33 HydrophobicContact CD2-CG2 3.93Å; L29-T33 PolarHBondContact O-N 3.07Å; L29-T33 PolarHBondContact O-OG1 2.86Å; L29-F35 HydrophobicContact CB-CB 4.28Å; L29-F35 HydrophobicContact CB-CD1 4.29Å; L29-F35 HydrophobicContact CB-CG 4.47Å; L29-F35 HydrophobicContact CD1-CD1 4Å; L29-F35 HydrophobicContact CD1-CE1 4.2Å; L29-F35 HydrophobicContact CD1-CG 4.24Å; L29-Y36 HydrophobicContact CB-CE2 3.93Å
30	S	92.1	Very high	91.1	Very high	59 Å²	59	81.7 Å²	81.7	41%	0.413	42%	0.416	S	S	.	.	H	α-helix	trans	-64.2	-38.3	178.7	179.1	0	0	0	0	113.5	F26 G27 F28	F26-S30 PolarHBondContact O-N 3.28Å; G27-S30 PolarHBondContact O-N 3.44Å; F28-S30 PolarHBondContact O-N 3.48Å
31	R	93.4	Very high	91.1	Very high	182 Å²	182	87.5 Å²	87.5	69%	0.687	44%	0.439	S	S	*	.	H	α-helix	trans	-90.5	-27.7	-175	-67.9	-171.8	-60.9	-87.5	0.9	114.7	G27 F28 L29	G27-R31 WeakPolarHBondContact O-CG 3.33Å; G27-R31 PolarHBondContact O-N 3.27Å; G27-R31 PolarHBondContact O-NH1 3.5Å; F28-R31 PolarHBondContact O-N 3.42Å; F28-R31 VanDerWaalsContact O-N 3.14Å; L29-R31 PolarHBondContact O-N 2.85Å
32	R	93.6	Very high	91	Very high	200 Å²	200	93.8 Å²	93.8	76%	0.755	47%	0.465	S	S	*	.	H	α-helix	trans	-122.8	-4.3	-165.5	-63.5	-63.8	-170.2	154.4	0.8	114.2	F28	F28-R32 HydrophobicContact CD2-CB 3.93Å; F28-R32 HydrophobicContact CD2-CG 3.84Å; F28-R32 HydrophobicContact CE2-CB 3.61Å; F28-R32 HydrophobicContact CE2-CG 3.79Å; F28-R32 HydrophobicContact CZ-CB 4.07Å; F28-R32 WeakPolarHBondContact O-CB 3.45Å; F28-R32 PolarHBondContact O-N 2.92Å
33	T	91.9	Very high	90.9	Very high	49 Å²	49	92.2 Å²	92.2	30%	0.301	46%	0.457	S	S	.	.	S	Bend	trans	-133.1	164.3	179.8	76.8	0	0	0	0	110.2	F28 L29 F35	F28-T33 HydrophobicContact CE1-CG2 4.18Å; L29-T33 WeakPolarHBondContact CA-OG1 3.39Å; L29-T33 HydrophobicContact CD2-CG2 3.93Å; L29-T33 PolarHBondContact O-N 3.07Å; L29-T33 PolarHBondContact O-OG1 2.86Å; T33-F35 PolarHBondContact O-N 3.48Å; T33-F35 WeakPolarHBondContact OG1-CB 3.23Å; T33-F35 PolarHBondContact OG1-N 2.96Å
34	D	91.4	Very high	90.8	Very high	116 Å²	116	86.9 Å²	86.9	62%	0.62	43%	0.43	S	S	*	.	S	Bend	trans	-85.4	11	171.3	62.9	-23.4	0	0	0	112.5	Y36 Y37 G38	D34-Y36 PolarHBondContact O-N 3.27Å; D34-Y37 CarbonylContact O-C 3.53Å; D34-Y37 PolarHBondContact O-N 3.03Å; D34-G38 PolarHBondContact O-N 3.42Å
35	F	91	Very high	90.8	Very high	36 Å²	36	90.8 Å²	90.8	16%	0.158	44%	0.44	C	S	.	.	H	α-helix	trans	-49.7	-37.8	-172.3	-179.2	-105.1	0	0	0	114.9	L29 T33 A44 L47 V48	L29-F35 HydrophobicContact CB-CB 4.28Å; L29-F35 HydrophobicContact CB-CD1 4.29Å; L29-F35 HydrophobicContact CB-CG 4.47Å; L29-F35 HydrophobicContact CD1-CD1 4Å; L29-F35 HydrophobicContact CD1-CE1 4.2Å; L29-F35 HydrophobicContact CD1-CG 4.24Å; T33-F35 PolarHBondContact O-N 3.48Å; T33-F35 WeakPolarHBondContact OG1-CB 3.23Å; T33-F35 PolarHBondContact OG1-N 2.96Å; F35-A44 HydrophobicContact CE1-CB 3.97Å; F35-A44 HydrophobicContact CE2-CB 4.11Å; F35-A44 HydrophobicContact CZ-CB 3.65Å; F35-L47 HydrophobicContact CE2-CD2 4.12Å; F35-V48 HydrophobicContact CZ-CG2 3.95Å
36	Y	88.5	Confident	90.8	Very high	102 Å²	102	92.7 Å²	92.7	40%	0.4	45%	0.445	S	S	.	.	H	α-helix	trans	-90.9	-7.6	-179.3	-62.6	-80	0	0	0	114.7	F26 L29 D34	F26-Y36 PolarHBondContact O-OH 3.45Å; L29-Y36 HydrophobicContact CB-CE2 3.93Å; D34-Y36 PolarHBondContact O-N 3.27Å
37	Y	87.3	Confident	90.8	Very high	198 Å²	198	93.8 Å²	93.8	78%	0.776	45%	0.453	S	S	*	.	H	α-helix	trans	-120.4	-22.8	-177.2	-57.3	-73.4	0	0	0	113.3	D34	D34-Y37 CarbonylContact O-C 3.53Å; D34-Y37 PolarHBondContact O-N 3.03Å
38	G	84.1	Confident	90.8	Very high	58 Å²	58	95.5 Å²	95.5	60%	0.598	46%	0.46	S	S	*	.	H	α-helix	trans	-91.5	-23.5	-176.3	0	0	0	0	0	114.5	D34	D34-G38 PolarHBondContact O-N 3.42Å
39	A	79.6	Confident	90.8	Very high	46 Å²	46	95.9 Å²	95.9	38%	0.38	47%	0.466	S	S	.	.	S	Bend	trans	-119	157	176.6	0	0	0	0	0	110.9	D43	A39-D43 HydrophobicContact CB-CB 4.11Å
40	T	88.7	Confident	90.9	Very high	81 Å²	81	99.8 Å²	99.8	50%	0.497	48%	0.484	S	S	.	.			trans	-65.6	151.5	170.6	73.3	0	0	0	0	109.8	K42 D43 A44	T40-K42 PolarHBondContact O-N 2.81Å; T40-K42 VanDerWaalsContact O-N 3.07Å; T40-D43 PolarHBondContact O-N 3.43Å; T40-D43 PolarHBondContact OG1-N 3.42Å; T40-D43 PolarHBondContact OG1-OD2 3.24Å; T40-A44 PolarHBondContact O-N 2.96Å
41	E	90.6	Very high	91	Very high	137 Å²	137	100.5 Å²	100.5	64%	0.64	48%	0.483	S	S	*	.	H	α-helix	trans	-52.4	-35.4	176.2	-171.4	-169.4	156.3	0	0	111.8	K45	E41-K45 HydrophobicContact CG-CD 4.32Å; E41-K45 WeakPolarHBondContact O-CB 3.34Å; E41-K45 WeakPolarHBondContact O-CG 3.08Å; E41-K45 PolarHBondContact O-N 3.36Å; E41-K45 VanDerWaalsContact OE1-CE 3.29Å; E41-K45 WeakPolarHBondContact OE1-CE 3.5Å; E41-K45 IonicContact OE1-NZ 3.56Å; E41-K45 PolarHBondContact OE1-NZ 3.49Å
42	K	91.9	Very high	91	Very high	170 Å²	170	97.9 Å²	97.9	74%	0.739	48%	0.477	S	S	*	.	H	α-helix	trans	-64.5	-43.4	176.6	-171.8	179.6	179.4	-177.9	0	112.1	T40 R46	T40-K42 PolarHBondContact O-N 2.81Å; T40-K42 VanDerWaalsContact O-N 3.07Å; K42-R46 WeakPolarHBondContact O-CB 3.49Å; K42-R46 PolarHBondContact O-N 2.94Å
43	D	91.5	Very high	91.1	Very high	54 Å²	54	91.7 Å²	91.7	29%	0.289	46%	0.461	S	S	.	.	H	α-helix	trans	-69.6	-41.4	179.1	-63.7	-48.8	0	0	0	111.6	A39 T40 R46 L47	A39-D43 HydrophobicContact CB-CB 4.11Å; T40-D43 PolarHBondContact O-N 3.43Å; T40-D43 PolarHBondContact OG1-N 3.42Å; T40-D43 PolarHBondContact OG1-OD2 3.24Å; D43-R46 PolarHBondContact O-N 2.95Å; D43-R46 IonicContact OD1-CZ 3.82Å; D43-R46 IonicContact OD1-NH1 3.38Å; D43-R46 IonicContact OD1-NH2 2.72Å; D43-R46 PolarHBondContact OD1-NH2 2.83Å; D43-L47 PolarHBondContact O-N 3.22Å
44	A	90.7	Very high	91.3	Very high	11 Å²	11	96 Å²	96	9%	0.091	48%	0.476	C	S	.	.	H	α-helix	trans	-61	-47.1	176.3	0	0	0	0	0	111.8	F35 T40 R46 L47 V48	F35-A44 HydrophobicContact CE1-CB 3.97Å; F35-A44 HydrophobicContact CE2-CB 4.11Å; F35-A44 HydrophobicContact CZ-CB 3.65Å; T40-A44 PolarHBondContact O-N 2.96Å; A44-R46 PolarHBondContact O-N 3.4Å; A44-L47 PolarHBondContact O-N 3.29Å; A44-V48 PolarHBondContact O-N 2.94Å
45	K	92.7	Very high	91.4	Very high	119 Å²	119	96.1 Å²	96.1	52%	0.517	47%	0.473	S	S	.	.	H	α-helix	trans	-61.6	-43	175.3	-78.1	176.4	172.2	171.8	0	112	E41 L47 V48 L49	E41-K45 HydrophobicContact CG-CD 4.32Å; E41-K45 WeakPolarHBondContact O-CB 3.34Å; E41-K45 WeakPolarHBondContact O-CG 3.08Å; E41-K45 PolarHBondContact O-N 3.36Å; E41-K45 VanDerWaalsContact OE1-CE 3.29Å; E41-K45 WeakPolarHBondContact OE1-CE 3.5Å; E41-K45 IonicContact OE1-NZ 3.56Å; E41-K45 PolarHBondContact OE1-NZ 3.49Å; K45-L47 VanDerWaalsContact C-N 3.34Å; K45-L47 PolarHBondContact O-N 3.28Å; K45-V48 PolarHBondContact O-N 2.95Å; K45-L49 WeakPolarHBondContact O-CB 3.37Å; K45-L49 WeakPolarHBondContact O-CG 3.42Å; K45-L49 PolarHBondContact O-N 3.29Å
46	R	93.5	Very high	91.6	Very high	127 Å²	127	98.2 Å²	98.2	48%	0.479	48%	0.482	S	S	.	.	H	α-helix	trans	-58	-47.2	176.6	-178.2	-179.8	64.6	-143.9	-15	110.8	K42 D43 A44 V48 L49 E50	K42-R46 WeakPolarHBondContact O-CB 3.49Å; K42-R46 PolarHBondContact O-N 2.94Å; D43-R46 PolarHBondContact O-N 2.95Å; D43-R46 IonicContact OD1-CZ 3.82Å; D43-R46 IonicContact OD1-NH1 3.38Å; D43-R46 IonicContact OD1-NH2 2.72Å; D43-R46 PolarHBondContact OD1-NH2 2.83Å; A44-R46 PolarHBondContact O-N 3.4Å; R46-V48 PolarHBondContact O-N 3.48Å; R46-L49 PolarHBondContact O-N 3.49Å; R46-E50 VanDerWaalsContact CD-OE1 3.28Å; R46-E50 WeakPolarHBondContact CD-OE1 3.13Å; R46-E50 HydrophobicContact CG-CG 4.13Å; R46-E50 WeakPolarHBondContact CG-OE1 2.77Å; R46-E50 IonicContact NE-OE1 3.57Å; R46-E50 WeakPolarHBondContact O-CB 2.92Å; R46-E50 VanDerWaalsContact O-CG 3.31Å; R46-E50 WeakPolarHBondContact O-CG 3.13Å; R46-E50 PolarHBondContact O-N 3.36Å
47	L	92.7	Very high	92	Very high	86 Å²	86	97.5 Å²	97.5	45%	0.45	49%	0.486	S	S	.	.	H	α-helix	trans	-61.6	-42.6	-178.5	-172.8	67.2	0	0	0	112.8	F35 D43 A44 K45 N51	F35-L47 HydrophobicContact CE2-CD2 4.12Å; D43-L47 PolarHBondContact O-N 3.22Å; A44-L47 PolarHBondContact O-N 3.29Å; K45-L47 VanDerWaalsContact C-N 3.34Å; K45-L47 PolarHBondContact O-N 3.28Å; L47-N51 PolarHBondContact O-N 3.47Å; L47-N51 VanDerWaalsContact O-N 3.12Å; L47-N51 PolarHBondContact O-ND2 3.23Å
48	V	93.5	Very high	92.3	Very high	54 Å²	54	90.6 Å²	90.6	33%	0.327	47%	0.469	S	S	.	.	H	α-helix	trans	-63.3	-46.5	177.3	173.1	0	0	0	0	110.7	F26 F35 A44 K45 R46 N51 F52	F26-V48 HydrophobicContact CE1-CG1 4.38Å; F26-V48 HydrophobicContact CE1-CG2 3.96Å; F26-V48 HydrophobicContact CZ-CG1 4.02Å; F26-V48 HydrophobicContact CZ-CG2 4.43Å; F35-V48 HydrophobicContact CZ-CG2 3.95Å; A44-V48 PolarHBondContact O-N 2.94Å; K45-V48 PolarHBondContact O-N 2.95Å; R46-V48 PolarHBondContact O-N 3.48Å; V48-N51 PolarHBondContact O-N 3.42Å; V48-F52 WeakPolarHBondContact O-CB 3.29Å; V48-F52 PolarHBondContact O-N 2.78Å
49	L	95	Very high	92.8	Very high	107 Å²	107	89.8 Å²	89.8	56%	0.56	46%	0.457	S	S	*	.	H	α-helix	trans	-68.1	-39.7	-178.8	-68.6	169.7	0	0	0	112	K45 R46 N51 F52 T53	K45-L49 WeakPolarHBondContact O-CB 3.37Å; K45-L49 WeakPolarHBondContact O-CG 3.42Å; K45-L49 PolarHBondContact O-N 3.29Å; R46-L49 PolarHBondContact O-N 3.49Å; L49-N51 PolarHBondContact O-N 2.92Å; L49-F52 PolarHBondContact O-N 2.87Å; L49-T53 PolarHBondContact O-N 3.03Å; L49-T53 PolarHBondContact O-OG1 3.22Å; L49-T53 VanDerWaalsContact O-OG1 3.12Å
50	E	95.1	Very high	93.6	Very high	104 Å²	104	91.8 Å²	91.8	49%	0.486	46%	0.461	S	S	.	.	H	α-helix	trans	-60.7	-45	175.1	-77.2	173.3	177.8	0	0	111.8	R46 T53 K54	R46-E50 VanDerWaalsContact CD-OE1 3.28Å; R46-E50 WeakPolarHBondContact CD-OE1 3.13Å; R46-E50 HydrophobicContact CG-CG 4.13Å; R46-E50 WeakPolarHBondContact CG-OE1 2.77Å; R46-E50 IonicContact NE-OE1 3.57Å; R46-E50 WeakPolarHBondContact O-CB 2.92Å; R46-E50 VanDerWaalsContact O-CG 3.31Å; R46-E50 WeakPolarHBondContact O-CG 3.13Å; R46-E50 PolarHBondContact O-N 3.36Å; E50-T53 PolarHBondContact O-N 3.09Å; E50-K54 WeakPolarHBondContact O-CB 2.7Å; E50-K54 PolarHBondContact O-N 3.25Å
51	N	93.4	Very high	94	Very high	73 Å²	73	90.5 Å²	90.5	39%	0.39	46%	0.459	S	S	.	.	H	α-helix	trans	-66.2	-40.7	175.7	-80	-77.7	0	0	0	111.8	L47 V48 L49 K54 H55	L47-N51 PolarHBondContact O-N 3.47Å; L47-N51 VanDerWaalsContact O-N 3.12Å; L47-N51 PolarHBondContact O-ND2 3.23Å; V48-N51 PolarHBondContact O-N 3.42Å; L49-N51 PolarHBondContact O-N 2.92Å; N51-K54 PolarHBondContact O-N 3.22Å; N51-H55 PolarHBondContact O-CD2 3.33Å; N51-H55 VanDerWaalsContact O-CD2 3.23Å; N51-H55 PolarHBondContact O-N 3.46Å; N51-H55 VanDerWaalsContact O-N 3.09Å
52	F	95.1	Very high	94.2	Very high	128 Å²	128	90.7 Å²	90.7	56%	0.561	45%	0.454	S	S	*	.	H	α-helix	trans	-58.3	-52.5	174.1	172.2	-95.7	0	0	0	111.2	V48 L49 K54 H55 H56	V48-F52 WeakPolarHBondContact O-CB 3.29Å; V48-F52 PolarHBondContact O-N 2.78Å; L49-F52 PolarHBondContact O-N 2.87Å; F52-K54 PolarHBondContact O-N 3.27Å; F52-H55 PolarHBondContact O-N 3.36Å; F52-H56 HydrophobicContact CE1-CB 4.27Å; F52-H56 HydrophobicContact CZ-CB 4.33Å; F52-H56 WeakPolarHBondContact O-CB 3.31Å; F52-H56 PolarHBondContact O-N 3.44Å
53	T	95.9	Very high	94.3	Very high	69 Å²	69	89.9 Å²	89.9	42%	0.423	45%	0.446	S	S	.	.	H	α-helix	trans	-58	-47	179.5	-62.8	0	0	0	0	111.2	L49 E50 H55 H56 D57	L49-T53 PolarHBondContact O-N 3.03Å; L49-T53 PolarHBondContact O-OG1 3.22Å; L49-T53 VanDerWaalsContact O-OG1 3.12Å; E50-T53 PolarHBondContact O-N 3.09Å; T53-H55 PolarHBondContact O-N 2.79Å; T53-H56 PolarHBondContact O-N 3.4Å; T53-D57 WeakPolarHBondContact CG2-OD2 3.38Å; T53-D57 WeakPolarHBondContact O-CB 3.28Å; T53-D57 PolarHBondContact O-N 2.92Å
54	K	95.2	Very high	94.6	Very high	141 Å²	141	92.4 Å²	92.4	61%	0.613	46%	0.456	S	S	*	.	H	α-helix	trans	-54	-49.6	176.7	178	-174.8	175.9	-175.3	0	112.5	E50 N51 F52 A58	E50-K54 WeakPolarHBondContact O-CB 2.7Å; E50-K54 PolarHBondContact O-N 3.25Å; N51-K54 PolarHBondContact O-N 3.22Å; F52-K54 PolarHBondContact O-N 3.27Å; K54-A58 WeakPolarHBondContact O-CB 3.47Å; K54-A58 PolarHBondContact O-N 3.33Å
55	H	94.2	Very high	94.8	Very high	118 Å²	118	98.2 Å²	98.2	55%	0.546	48%	0.481	S	S	.	.	H	α-helix	trans	-77.1	-32.8	-177.1	-76.7	-71.9	0	0	0	112.9	N51 F52 T53 A59	N51-H55 PolarHBondContact O-CD2 3.33Å; N51-H55 VanDerWaalsContact O-CD2 3.23Å; N51-H55 PolarHBondContact O-N 3.46Å; N51-H55 VanDerWaalsContact O-N 3.09Å; F52-H55 PolarHBondContact O-N 3.36Å; T53-H55 PolarHBondContact O-N 2.79Å; H55-A59 VanDerWaalsContact O-CB 3.24Å; H55-A59 WeakPolarHBondContact O-CB 3.24Å; H55-A59 PolarHBondContact O-N 3.37Å
56	H	95	Very high	94.9	Very high	79 Å²	79	97.7 Å²	97.7	37%	0.366	48%	0.481	S	S	.	.	H	α-helix	trans	-60.9	-51.5	173.5	171	-89.2	0	0	0	111.1	F52 T53 A58 A59 L60	F52-H56 HydrophobicContact CE1-CB 4.27Å; F52-H56 HydrophobicContact CZ-CB 4.33Å; F52-H56 WeakPolarHBondContact O-CB 3.31Å; F52-H56 PolarHBondContact O-N 3.44Å; T53-H56 PolarHBondContact O-N 3.4Å; H56-A58 PolarHBondContact O-N 3.48Å; H56-A59 PolarHBondContact O-N 2.92Å; H56-L60 WeakPolarHBondContact CE1-CD1 3.42Å; H56-L60 PolarHBondContact O-N 2.95Å
57	D	95.6	Very high	95	Very high	87 Å²	87	97.7 Å²	97.7	47%	0.465	48%	0.484	S	S	.	.	H	α-helix	trans	-66.5	-41.1	-177.3	-64.4	-11	0	0	0	110.9	T53 A59 L60 A61	T53-D57 WeakPolarHBondContact CG2-OD2 3.38Å; T53-D57 WeakPolarHBondContact O-CB 3.28Å; T53-D57 PolarHBondContact O-N 2.92Å; D57-A59 VanDerWaalsContact C-N 3.33Å; D57-A59 PolarHBondContact O-N 2.8Å; D57-L60 PolarHBondContact O-N 3.17Å; D57-A61 VanDerWaalsContact O-CB 3.29Å; D57-A61 WeakPolarHBondContact O-CB 3.42Å; D57-A61 PolarHBondContact O-N 3Å
58	A	95.2	Very high	95.2	Very high	53 Å²	53	99 Å²	99	44%	0.438	49%	0.486	S	S	.	.	H	α-helix	trans	-62.2	-38.6	173.4	0	0	0	0	0	112.7	K54 H56 R62	K54-A58 WeakPolarHBondContact O-CB 3.47Å; K54-A58 PolarHBondContact O-N 3.33Å; H56-A58 PolarHBondContact O-N 3.48Å; A58-R62 WeakPolarHBondContact O-CB 3.23Å; A58-R62 PolarHBondContact O-N 2.88Å
59	A	94.7	Very high	95.3	Very high	41 Å²	41	102.8 Å²	102.8	34%	0.339	50%	0.5	S	S	.	.	H	α-helix	trans	-69.5	-39.9	177.8	0	0	0	0	0	112.3	H55 H56 D57 R63	H55-A59 VanDerWaalsContact O-CB 3.24Å; H55-A59 WeakPolarHBondContact O-CB 3.24Å; H55-A59 PolarHBondContact O-N 3.37Å; H56-A59 PolarHBondContact O-N 2.92Å; D57-A59 VanDerWaalsContact C-N 3.33Å; D57-A59 PolarHBondContact O-N 2.8Å; A59-R63 WeakPolarHBondContact O-CB 3.41Å; A59-R63 PolarHBondContact O-N 2.9Å; A59-R63 VanDerWaalsContact O-N 3.07Å
60	L	95.6	Very high	95.4	Very high	89 Å²	89	102.4 Å²	102.4	47%	0.466	50%	0.498	S	S	.	.	H	α-helix	trans	-66.4	-45.1	174.3	-72.7	-174.5	0	0	0	111.8	H56 D57 R62 R63 E64	H56-L60 WeakPolarHBondContact CE1-CD1 3.42Å; H56-L60 PolarHBondContact O-N 2.95Å; D57-L60 PolarHBondContact O-N 3.17Å; L60-R62 PolarHBondContact O-N 3.43Å; L60-R63 PolarHBondContact O-N 3.19Å; L60-E64 WeakPolarHBondContact O-CB 3.29Å; L60-E64 PolarHBondContact O-N 2.89Å
61	A	96.4	Very high	95.4	Very high	54 Å²	54	102.5 Å²	102.5	45%	0.446	50%	0.498	S	S	.	.	H	α-helix	trans	-59	-47.6	177	0	0	0	0	0	111.6	D57 R63 E64 E65	D57-A61 VanDerWaalsContact O-CB 3.29Å; D57-A61 WeakPolarHBondContact O-CB 3.42Å; D57-A61 PolarHBondContact O-N 3Å; A61-R63 PolarHBondContact O-N 2.91Å; A61-E64 PolarHBondContact O-N 3.35Å; A61-E65 WeakPolarHBondContact O-CB 3.29Å; A61-E65 PolarHBondContact O-N 3.43Å
62	R	95.1	Very high	95.5	Very high	141 Å²	141	104.3 Å²	104.3	53%	0.532	51%	0.505	S	S	.	.	H	α-helix	trans	-59.9	-43.7	176.1	-175	177.2	64.5	-121.8	-0.5	112.1	A58 L60 E64 E65 E66	A58-R62 WeakPolarHBondContact O-CB 3.23Å; A58-R62 PolarHBondContact O-N 2.88Å; L60-R62 PolarHBondContact O-N 3.43Å; R62-E64 VanDerWaalsContact C-N 3.31Å; R62-E64 PolarHBondContact O-N 3.25Å; R62-E65 PolarHBondContact O-N 3.07Å; R62-E66 HydrophobicContact CG-CG 4.42Å; R62-E66 WeakPolarHBondContact CG-OE1 3.5Å; R62-E66 IonicContact NE-OE1 2.86Å; R62-E66 WeakPolarHBondContact O-CB 3.44Å; R62-E66 VanDerWaalsContact O-CG 3.29Å; R62-E66 WeakPolarHBondContact O-CG 3.45Å; R62-E66 PolarHBondContact O-N 3.5Å
63	R	95.4	Very high	95.6	Very high	152 Å²	152	105.4 Å²	105.4	57%	0.574	51%	0.505	S	S	*	.	H	α-helix	trans	-64.8	-35	177.5	-174.5	-179.7	-176.8	-173.8	1.2	112.4	A59 L60 A61 K67	A59-R63 WeakPolarHBondContact O-CB 3.41Å; A59-R63 PolarHBondContact O-N 2.9Å; A59-R63 VanDerWaalsContact O-N 3.07Å; L60-R63 PolarHBondContact O-N 3.19Å; A61-R63 PolarHBondContact O-N 2.91Å; R63-K67 VanDerWaalsContact O-CG 3.32Å; R63-K67 WeakPolarHBondContact O-CG 3.2Å; R63-K67 PolarHBondContact O-N 3.26Å
64	E	95.9	Very high	95.6	Very high	107 Å²	107	107.3 Å²	107.3	50%	0.5	51%	0.509	S	S	.	.	H	α-helix	trans	-70.8	-42.6	176	-168.1	-175.6	158.5	0	0	111.3	L60 A61 R62 K67 K68	L60-E64 WeakPolarHBondContact O-CB 3.29Å; L60-E64 PolarHBondContact O-N 2.89Å; A61-E64 PolarHBondContact O-N 3.35Å; R62-E64 VanDerWaalsContact C-N 3.31Å; R62-E64 PolarHBondContact O-N 3.25Å; E64-K67 PolarHBondContact O-N 2.85Å; E64-K68 WeakPolarHBondContact O-CG 3.46Å; E64-K68 PolarHBondContact O-N 2.69Å; E64-K68 WeakPolarHBondContact OE1-CE 3.48Å; E64-K68 IonicContact OE1-NZ 2.63Å; E64-K68 PolarHBondContact OE1-NZ 2.86Å
65	E	96.1	Very high	95.7	Very high	134 Å²	134	104.3 Å²	104.3	63%	0.626	50%	0.497	S	S	*	.	H	α-helix	trans	-61.1	-49	174.9	-172.6	172.3	-160.6	0	0	111.8	A61 R62 K67 K68 E69	A61-E65 WeakPolarHBondContact O-CB 3.29Å; A61-E65 PolarHBondContact O-N 3.43Å; R62-E65 PolarHBondContact O-N 3.07Å; E65-K67 VanDerWaalsContact C-N 3.28Å; E65-K67 PolarHBondContact O-N 3.1Å; E65-K68 PolarHBondContact O-N 3.28Å; E65-K68 VanDerWaalsContact O-N 3.1Å; E65-E69 PolarHBondContact O-N 3.35Å
66	E	94.9	Very high	95.8	Very high	108 Å²	108	106.5 Å²	106.5	51%	0.505	50%	0.501	S	S	.	.	H	α-helix	trans	-56.9	-39.7	175.8	-75	169.5	-171.6	0	0	112.3	R62 L70	R62-E66 HydrophobicContact CG-CG 4.42Å; R62-E66 WeakPolarHBondContact CG-OE1 3.5Å; R62-E66 IonicContact NE-OE1 2.86Å; R62-E66 WeakPolarHBondContact O-CB 3.44Å; R62-E66 VanDerWaalsContact O-CG 3.29Å; R62-E66 WeakPolarHBondContact O-CG 3.45Å; R62-E66 PolarHBondContact O-N 3.5Å; E66-L70 WeakPolarHBondContact O-CB 3.32Å; E66-L70 PolarHBondContact O-N 2.87Å
67	K	95.6	Very high	95.8	Very high	127 Å²	127	106.4 Å²	106.4	55%	0.552	50%	0.5	S	S	*	.	H	α-helix	trans	-68.4	-41	176.1	-78.2	179.3	179.8	-175.1	0	112.5	R63 E64 E65 H71	R63-K67 VanDerWaalsContact O-CG 3.32Å; R63-K67 WeakPolarHBondContact O-CG 3.2Å; R63-K67 PolarHBondContact O-N 3.26Å; E64-K67 PolarHBondContact O-N 2.85Å; E65-K67 VanDerWaalsContact C-N 3.28Å; E65-K67 PolarHBondContact O-N 3.1Å; K67-H71 WeakPolarHBondContact O-CB 3.05Å; K67-H71 PolarHBondContact O-N 3.23Å
68	K	96.6	Very high	95.8	Very high	112 Å²	112	108.6 Å²	108.6	49%	0.487	50%	0.502	S	S	.	.	H	α-helix	trans	-64.1	-46.4	176.3	-74.4	174.1	-176.4	166.6	0	110.3	E64 E65 L70 H71 E72	E64-K68 WeakPolarHBondContact O-CG 3.46Å; E64-K68 PolarHBondContact O-N 2.69Å; E64-K68 WeakPolarHBondContact OE1-CE 3.48Å; E64-K68 IonicContact OE1-NZ 2.63Å; E64-K68 PolarHBondContact OE1-NZ 2.86Å; E65-K68 PolarHBondContact O-N 3.28Å; E65-K68 VanDerWaalsContact O-N 3.1Å; K68-L70 PolarHBondContact O-N 2.99Å; K68-H71 PolarHBondContact O-N 2.72Å; K68-E72 WeakPolarHBondContact O-CB 3.4Å; K68-E72 WeakPolarHBondContact O-CG 3.29Å; K68-E72 PolarHBondContact O-N 2.92Å
69	E	96.1	Very high	95.9	Very high	135 Å²	135	112.3 Å²	112.3	63%	0.631	51%	0.508	S	S	*	.	H	α-helix	trans	-61.5	-43.4	177.8	-169.8	-175.7	173.3	0	0	111.9	E65 E72 R73	E65-E69 PolarHBondContact O-N 3.35Å; E69-E72 PolarHBondContact O-N 3.46Å; E69-R73 VanDerWaalsContact O-CB 3.29Å; E69-R73 WeakPolarHBondContact O-CB 3.42Å; E69-R73 PolarHBondContact O-N 3.17Å
70	L	95.5	Very high	95.9	Very high	98 Å²	98	117.9 Å²	117.9	51%	0.513	52%	0.521	S	S	.	.	H	α-helix	trans	-59.8	-47.2	174.8	-179.3	65.6	0	0	0	111.4	E66 K68 R73 E74	E66-L70 WeakPolarHBondContact O-CB 3.32Å; E66-L70 PolarHBondContact O-N 2.87Å; K68-L70 PolarHBondContact O-N 2.99Å; L70-R73 PolarHBondContact O-N 2.9Å; L70-E74 WeakPolarHBondContact O-CG 3.37Å; L70-E74 PolarHBondContact O-N 3.23Å
71	H	95.9	Very high	95.8	Very high	106 Å²	106	122 Å²	122	49%	0.491	53%	0.53	S	S	.	.	H	α-helix	trans	-62.3	-47.4	178.6	-173.1	56.2	0	0	0	111.8	K67 K68 R73 E74 E75	K67-H71 WeakPolarHBondContact O-CB 3.05Å; K67-H71 PolarHBondContact O-N 3.23Å; K68-H71 PolarHBondContact O-N 2.72Å; H71-R73 VanDerWaalsContact C-N 3.3Å; H71-R73 PolarHBondContact O-N 3.02Å; H71-E74 PolarHBondContact O-N 3.03Å; H71-E75 WeakPolarHBondContact O-CG 3.33Å; H71-E75 PolarHBondContact O-N 3.03Å
72	E	96.5	Very high	95.7	Very high	112 Å²	112	124.2 Å²	124.2	52%	0.523	53%	0.531	S	S	.	.	H	α-helix	trans	-60.8	-38.4	176.9	-74	-179.9	-170.8	0	0	112.4	K68 E69 R76	K68-E72 WeakPolarHBondContact O-CB 3.4Å; K68-E72 WeakPolarHBondContact O-CG 3.29Å; K68-E72 PolarHBondContact O-N 2.92Å; E69-E72 PolarHBondContact O-N 3.46Å; E72-R76 VanDerWaalsContact O-CB 3.3Å; E72-R76 WeakPolarHBondContact O-CB 3.46Å; E72-R76 PolarHBondContact O-N 2.85Å
73	R	96.1	Very high	95.7	Very high	150 Å²	150	122.3 Å²	122.3	57%	0.566	53%	0.528	S	S	*	.	H	α-helix	trans	-64.4	-47.4	174.8	-179.3	-179.6	171.4	175	-1.2	111.5	E69 L70 H71 E75 R76 E77	E69-R73 VanDerWaalsContact O-CB 3.29Å; E69-R73 WeakPolarHBondContact O-CB 3.42Å; E69-R73 PolarHBondContact O-N 3.17Å; L70-R73 PolarHBondContact O-N 2.9Å; H71-R73 VanDerWaalsContact C-N 3.3Å; H71-R73 PolarHBondContact O-N 3.02Å; R73-E75 VanDerWaalsContact C-N 3.33Å; R73-E75 PolarHBondContact O-N 3.42Å; R73-R76 PolarHBondContact O-N 3.44Å; R73-E77 IonicContact CZ-OE1 3.86Å; R73-E77 IonicContact NE-OE1 3.96Å; R73-E77 PolarHBondContact NE-OE1 3.36Å; R73-E77 IonicContact NH2-OE1 2.69Å; R73-E77 WeakPolarHBondContact O-CG 3.44Å; R73-E77 PolarHBondContact O-N 2.98Å
74	E	96.1	Very high	95.5	Very high	110 Å²	110	120.6 Å²	120.6	51%	0.514	53%	0.525	S	S	.	.	H	α-helix	trans	-61	-41.8	177.1	-73.7	178.7	170.4	0	0	111.8	L70 H71 E77 R78	L70-E74 WeakPolarHBondContact O-CG 3.37Å; L70-E74 PolarHBondContact O-N 3.23Å; H71-E74 PolarHBondContact O-N 3.03Å; E74-E77 PolarHBondContact O-N 3.34Å; E74-R78 WeakPolarHBondContact O-CB 3.19Å; E74-R78 PolarHBondContact O-N 3.03Å
75	E	96.5	Very high	95.4	Very high	77 Å²	77	120.7 Å²	120.7	36%	0.36	52%	0.524	S	S	.	.	H	α-helix	trans	-65.1	-42.2	176.2	-69.6	-147.9	118.2	0	0	112.5	H71 R73 R78 K79	H71-E75 WeakPolarHBondContact O-CG 3.33Å; H71-E75 PolarHBondContact O-N 3.03Å; R73-E75 VanDerWaalsContact C-N 3.33Å; R73-E75 PolarHBondContact O-N 3.42Å; E75-R78 PolarHBondContact O-N 3.04Å; E75-R78 IonicContact OE1-CZ 3.23Å; E75-R78 IonicContact OE1-NH1 3.52Å; E75-R78 IonicContact OE1-NH2 3.36Å; E75-R78 PolarHBondContact OE1-NH2 3.49Å; E75-K79 WeakPolarHBondContact O-CB 3.24Å; E75-K79 PolarHBondContact O-N 3.32Å
76	R	96.7	Very high	95.2	Very high	165 Å²	165	121.2 Å²	121.2	62%	0.623	52%	0.524	S	S	*	.	H	α-helix	trans	-62.8	-43	175.6	-170	-176.4	-60.2	134.3	5.1	111.4	E72 R73 R80	E72-R76 VanDerWaalsContact O-CB 3.3Å; E72-R76 WeakPolarHBondContact O-CB 3.46Å; E72-R76 PolarHBondContact O-N 2.85Å; R73-R76 PolarHBondContact O-N 3.44Å; R76-R80 WeakPolarHBondContact O-CB 3.29Å; R76-R80 PolarHBondContact O-N 3.36Å
77	E	95.4	Very high	95.1	Very high	77 Å²	77	122.2 Å²	122.2	36%	0.36	53%	0.528	S	S	.	.	H	α-helix	trans	-65.9	-41.2	176	-74.6	-173.2	-163.8	0	0	112	R73 E74 R80 R81	R73-E77 IonicContact CZ-OE1 3.86Å; R73-E77 IonicContact NE-OE1 3.96Å; R73-E77 PolarHBondContact NE-OE1 3.36Å; R73-E77 IonicContact NH2-OE1 2.69Å; R73-E77 WeakPolarHBondContact O-CG 3.44Å; R73-E77 PolarHBondContact O-N 2.98Å; E74-E77 PolarHBondContact O-N 3.34Å; E77-R80 PolarHBondContact O-N 3.44Å; E77-R81 WeakPolarHBondContact O-CG 3.3Å; E77-R81 PolarHBondContact O-N 2.9Å; E77-R81 IonicContact OE2-NH2 3.78Å
78	R	96	Very high	94.9	Very high	133 Å²	133	117.4 Å²	117.4	50%	0.502	51%	0.512	S	S	.	.	H	α-helix	trans	-59.1	-50.5	174.2	-177.3	-177.5	67.7	-154.8	-7	111.1	E74 E75 R80 R81 E82	E74-R78 WeakPolarHBondContact O-CB 3.19Å; E74-R78 PolarHBondContact O-N 3.03Å; E75-R78 PolarHBondContact O-N 3.04Å; E75-R78 IonicContact OE1-CZ 3.23Å; E75-R78 IonicContact OE1-NH1 3.52Å; E75-R78 IonicContact OE1-NH2 3.36Å; E75-R78 PolarHBondContact OE1-NH2 3.49Å; R78-R80 PolarHBondContact O-N 3.12Å; R78-R81 PolarHBondContact O-N 3.26Å; R78-E82 WeakPolarHBondContact O-CG 3.3Å; R78-E82 PolarHBondContact O-N 3.42Å
79	K	96.4	Very high	94.8	Very high	130 Å²	130	113.5 Å²	113.5	57%	0.565	50%	0.496	S	S	*	.	H	α-helix	trans	-59	-45.8	178.7	-172.4	179.3	177.3	-174.9	0	111.7	E75 R81 E82 E83	E75-K79 WeakPolarHBondContact O-CB 3.24Å; E75-K79 PolarHBondContact O-N 3.32Å; K79-R81 VanDerWaalsContact C-N 3.34Å; K79-R81 PolarHBondContact O-N 2.88Å; K79-E82 PolarHBondContact O-N 3.17Å; K79-E83 WeakPolarHBondContact CE-OE1 3.39Å; K79-E83 WeakPolarHBondContact O-CG 3.38Å; K79-E83 PolarHBondContact O-N 3.32Å
80	R	95.9	Very high	94.6	Very high	159 Å²	159	113.4 Å²	113.4	60%	0.6	50%	0.498	S	S	*	.	H	α-helix	trans	-60.7	-39.9	176.6	-173.3	-177.4	179.8	-158.7	0.8	112.5	R76 E77 R78 K84	R76-R80 WeakPolarHBondContact O-CB 3.29Å; R76-R80 PolarHBondContact O-N 3.36Å; E77-R80 PolarHBondContact O-N 3.44Å; R78-R80 PolarHBondContact O-N 3.12Å; R80-K84 WeakPolarHBondContact O-CB 3.44Å; R80-K84 WeakPolarHBondContact O-CG 3.46Å; R80-K84 PolarHBondContact O-N 3.33Å; R80-K84 VanDerWaalsContact O-N 3.08Å
81	R	93.5	Very high	94.4	Very high	176 Å²	176	111.9 Å²	111.9	66%	0.664	50%	0.499	S	S	*	.	H	α-helix	trans	-66.4	-41.2	176.5	-74.1	177.5	-172.3	172.9	7.6	111.7	E77 R78 K79 K85	E77-R81 WeakPolarHBondContact O-CG 3.3Å; E77-R81 PolarHBondContact O-N 2.9Å; E77-R81 IonicContact OE2-NH2 3.78Å; R78-R81 PolarHBondContact O-N 3.26Å; K79-R81 VanDerWaalsContact C-N 3.34Å; K79-R81 PolarHBondContact O-N 2.88Å; R81-K85 WeakPolarHBondContact O-CB 3.42Å; R81-K85 PolarHBondContact O-N 3Å
82	E	93.4	Very high	94.1	Very high	100 Å²	100	107.2 Å²	107.2	47%	0.467	48%	0.478	S	S	.	.	H	α-helix	trans	-66	-42.7	176.9	-72.5	176.4	-171.6	0	0	112.5	R78 K79 K85 K86	R78-E82 WeakPolarHBondContact O-CG 3.3Å; R78-E82 PolarHBondContact O-N 3.42Å; K79-E82 PolarHBondContact O-N 3.17Å; E82-K85 PolarHBondContact O-N 3.39Å; E82-K86 WeakPolarHBondContact O-CG 3.34Å; E82-K86 PolarHBondContact O-N 3.48Å
83	E	94.3	Very high	93.8	Very high	101 Å²	101	105.9 Å²	105.9	47%	0.472	47%	0.474	S	S	.	.	H	α-helix	trans	-61.2	-49.7	175.7	-75.2	171	176.1	0	0	111.4	K79 K85 K86 E87	K79-E83 WeakPolarHBondContact CE-OE1 3.39Å; K79-E83 WeakPolarHBondContact O-CG 3.38Å; K79-E83 PolarHBondContact O-N 3.32Å; E83-K85 VanDerWaalsContact C-N 3.3Å; E83-K85 PolarHBondContact O-N 2.94Å; E83-K86 WeakPolarHBondContact O-CB 3.44Å; E83-K86 PolarHBondContact O-N 2.9Å; E83-K86 VanDerWaalsContact O-N 3.12Å; E83-E87 PolarHBondContact O-N 3.22Å
84	K	93.1	Very high	93.3	Very high	115 Å²	115	101 Å²	101	50%	0.5	47%	0.465	S	S	.	.	H	α-helix	trans	-56.8	-43	174.6	-76.3	-175.3	174.9	-164.1	0	112.3	R80 K86 E87 A88	R80-K84 WeakPolarHBondContact O-CB 3.44Å; R80-K84 WeakPolarHBondContact O-CG 3.46Å; R80-K84 PolarHBondContact O-N 3.33Å; R80-K84 VanDerWaalsContact O-N 3.08Å; K84-K86 VanDerWaalsContact C-N 3.35Å; K84-K86 PolarHBondContact O-N 2.95Å; K84-E87 PolarHBondContact O-N 2.93Å; K84-A88 WeakPolarHBondContact O-CB 3.47Å; K84-A88 PolarHBondContact O-N 2.8Å
85	K	91.9	Very high	92.2	Very high	109 Å²	109	101.1 Å²	101.1	47%	0.474	48%	0.476	S	S	.	.	H	α-helix	trans	-62.9	-41.1	177.5	-173.5	-179.9	-178.7	-178.9	0	111.7	R81 E82 E83 I89 T186	R81-K85 WeakPolarHBondContact O-CB 3.42Å; R81-K85 PolarHBondContact O-N 3Å; E82-K85 PolarHBondContact O-N 3.39Å; E83-K85 VanDerWaalsContact C-N 3.3Å; E83-K85 PolarHBondContact O-N 2.94Å; K85-I89 HydrophobicContact CG-CD1 4.23Å; K85-I89 VanDerWaalsContact O-CG1 3.31Å; K85-I89 WeakPolarHBondContact O-CG1 3.47Å; K85-I89 PolarHBondContact O-N 3.44Å; K85-T186 HydrophobicContact CG-CG2 4.44Å
86	K	92.6	Very high	90.8	Very high	146 Å²	146	100.5 Å²	100.5	64%	0.635	48%	0.479	S	S	*	.	H	α-helix	trans	-65.2	-44.3	176	-73.9	176	-178.5	177.1	0	111.6	E82 E83 K84 I89 M90	E82-K86 WeakPolarHBondContact O-CG 3.34Å; E82-K86 PolarHBondContact O-N 3.48Å; E83-K86 WeakPolarHBondContact O-CB 3.44Å; E83-K86 PolarHBondContact O-N 2.9Å; E83-K86 VanDerWaalsContact O-N 3.12Å; K84-K86 VanDerWaalsContact C-N 3.35Å; K84-K86 PolarHBondContact O-N 2.95Å; K86-I89 PolarHBondContact O-N 3.09Å; K86-M90 WeakPolarHBondContact O-CB 3.31Å; K86-M90 PolarHBondContact O-N 3.4Å
87	E	93	Very high	89.2	Confident	128 Å²	128	101.6 Å²	101.6	60%	0.598	49%	0.488	S	S	*	.	H	α-helix	trans	-60.3	-44.8	176.1	-172.8	-178.1	176.6	0	0	111.4	E83 K84 I89 M90 A91	E83-E87 PolarHBondContact O-N 3.22Å; K84-E87 PolarHBondContact O-N 2.93Å; E87-I89 PolarHBondContact O-N 3.33Å; E87-M90 PolarHBondContact O-N 3.37Å; E87-A91 WeakPolarHBondContact O-CB 3.38Å; E87-A91 PolarHBondContact O-N 3.45Å
88	A	92.3	Very high	87.1	Confident	26 Å²	26	104.5 Å²	104.5	22%	0.215	51%	0.506	C	S	.	.	H	α-helix	trans	-60.9	-43.5	176.1	0	0	0	0	0	112.3	K84 A91 N92 I233	K84-A88 WeakPolarHBondContact O-CB 3.47Å; K84-A88 PolarHBondContact O-N 2.8Å; A88-A91 PolarHBondContact O-N 3.44Å; A88-N92 WeakPolarHBondContact O-CB 3.25Å; A88-N92 PolarHBondContact O-N 2.91Å; A88-I233 HydrophobicContact CB-CD1 3.53Å; A88-I233 VanDerWaalsContact O-CD1 3.28Å; A88-I233 WeakPolarHBondContact O-CD1 3.43Å
89	I	93.1	Very high	84.9	Confident	30 Å²	30	104.4 Å²	104.4	15%	0.154	52%	0.515	C	S	.	.	H	α-helix	trans	-64.3	-41.3	175.9	-69.5	167.2	0	0	0	111	K85 K86 E87 N92 L93 P184 T186 I233	K85-I89 HydrophobicContact CG-CD1 4.23Å; K85-I89 VanDerWaalsContact O-CG1 3.31Å; K85-I89 WeakPolarHBondContact O-CG1 3.47Å; K85-I89 PolarHBondContact O-N 3.44Å; K86-I89 PolarHBondContact O-N 3.09Å; E87-I89 PolarHBondContact O-N 3.33Å; I89-N92 WeakPolarHBondContact O-CB 3.45Å; I89-N92 PolarHBondContact O-N 3.47Å; I89-L93 HydrophobicContact CG2-CD1 4.43Å; I89-L93 PolarHBondContact O-N 3.02Å; I89-P184 WeakPolarHBondContact CG2-O 3.35Å; I89-T186 HydrophobicContact CD1-CG2 4.37Å; I89-I233 HydrophobicContact CG1-CG2 4.24Å
90	M	92.3	Very high	82.1	Confident	134 Å²	134	101.7 Å²	101.7	66%	0.66	51%	0.512	S	S	*	.	H	α-helix	trans	-64.1	-43.9	177.8	-173.3	176	67.1	0	0	111.5	K86 E87 N92 L93 A94	K86-M90 WeakPolarHBondContact O-CB 3.31Å; K86-M90 PolarHBondContact O-N 3.4Å; E87-M90 PolarHBondContact O-N 3.37Å; M90-N92 VanDerWaalsContact C-N 3.33Å; M90-N92 PolarHBondContact O-N 3.47Å; M90-L93 PolarHBondContact O-N 3.17Å; M90-A94 PolarHBondContact O-N 3.07Å
91	A	91.1	Very high	79.1	Confident	66 Å²	66	103.5 Å²	103.5	55%	0.545	52%	0.524	S	S	.	.	H	α-helix	trans	-63.7	-37.1	174.7	0	0	0	0	0	112.4	E87 A88 L93 A94	E87-A91 WeakPolarHBondContact O-CB 3.38Å; E87-A91 PolarHBondContact O-N 3.45Å; A88-A91 PolarHBondContact O-N 3.44Å; A91-L93 PolarHBondContact O-N 2.99Å; A91-A94 WeakPolarHBondContact O-CB 3.13Å; A91-A94 PolarHBondContact O-N 3.33Å
92	N	90.7	Very high	76.3	Confident	7 Å²	7	102.3 Å²	102.3	4%	0.037	54%	0.537	C	S	.	.	H	α-helix	trans	-61.5	-32.8	175.5	-172.6	44.4	0	0	0	112.7	A88 I89 M90 P180 T181 R182 L183 I233	A88-N92 WeakPolarHBondContact O-CB 3.25Å; A88-N92 PolarHBondContact O-N 2.91Å; I89-N92 WeakPolarHBondContact O-CB 3.45Å; I89-N92 PolarHBondContact O-N 3.47Å; M90-N92 VanDerWaalsContact C-N 3.33Å; M90-N92 PolarHBondContact O-N 3.47Å; N92-P180 VanDerWaalsContact OD1-CB 3.24Å; N92-P180 WeakPolarHBondContact OD1-CB 3.49Å; N92-T181 PolarHBondContact ND2-OG1 2.96Å; N92-T181 PolarHBondContact OD1-N 3.23Å; N92-R182 PolarHBondContact ND2-N 2.87Å; N92-R182 WeakPolarHBondContact O-CD 3.37Å; N92-R182 PolarHBondContact O-NH1 3.19Å; N92-R182 PolarHBondContact OD1-N 2.83Å; N92-L183 PolarHBondContact ND2-N 3.4Å; N92-L183 PolarHBondContact ND2-O 3.39Å; N92-L183 VanDerWaalsContact ND2-O 3.17Å; N92-I233 HydrophobicContact CB-CB 4.22Å; N92-I233 HydrophobicContact CB-CD1 4.18Å; N92-I233 PolarHBondContact OD1-O 3.2Å; N92-I233 VanDerWaalsContact OD1-O 3.09Å
93	L	89.1	Confident	73.6	Confident	84 Å²	84	104.6 Å²	104.6	44%	0.44	55%	0.552	S	S	.	*	H	α-helix	trans	-85.8	-15.6	178.9	-69	172.5	0	0	0	113.9	I89 M90 A91 P184	I89-L93 HydrophobicContact CG2-CD1 4.43Å; I89-L93 PolarHBondContact O-N 3.02Å; M90-L93 PolarHBondContact O-N 3.17Å; A91-L93 PolarHBondContact O-N 2.99Å; L93-P184 HydrophobicContact CD1-CB 4.06Å
94	A	85.7	Confident	70.8	Confident	47 Å²	47	106.7 Å²	106.7	39%	0.388	57%	0.567	S	S	.	*	S	Bend	trans	-62	133.7	-177	0	0	0	0	0	111.1	M90 A91 R182	M90-A94 PolarHBondContact O-N 3.07Å; A91-A94 WeakPolarHBondContact O-CB 3.13Å; A91-A94 PolarHBondContact O-N 3.33Å; A94-R182 PolarHBondContact O-NH1 2.91Å
95	P	74.2	Confident	68.2	Low	113 Å²	113	109.4 Å²	109.4	73%	0.734	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-58.4	150.5	-179	22.9	-31.8	0	0	0	111.3	K97	P95-K97 PolarHBondContact O-N 3.38Å
96	P	66.9	Low	65.6	Low	64 Å²	64	112 Å²	112	42%	0.416	60%	0.604	S	S	.	*	P	Polyproline II helix	trans	-51.9	131.4	169	-17.6	28.9	0	0	0	108.6	D98 P164	P96-D98 PolarHBondContact O-N 3.24Å; P96-D98 VanDerWaalsContact O-N 3.1Å; P96-P164 HydrophobicContact CG-CB 4.35Å; P96-P164 VanDerWaalsContact CG-O 3.26Å; P96-P164 WeakPolarHBondContact CG-O 3.43Å
97	K	63.3	Low	62.7	Low	189 Å²	189	108 Å²	108	82%	0.822	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-58.2	120.5	167.5	-75.6	179.4	177.7	178.9	0	106.2	P95 L99	P95-K97 PolarHBondContact O-N 3.38Å; K97-L99 PolarHBondContact O-N 2.85Å
98	D	50.9	Low	60	Low	138 Å²	138	108.3 Å²	108.3	74%	0.738	62%	0.616	S	S	*	*			trans	-63.5	99.7	177	-163.6	-17.2	0	0	0	107.8	P96 S100	P96-D98 PolarHBondContact O-N 3.24Å; P96-D98 VanDerWaalsContact O-N 3.1Å; D98-S100 PolarHBondContact O-N 2.86Å; D98-S100 PolarHBondContact OD1-OG 3.43Å
99	L	50	Low	57.1	Low	131 Å²	131	112.5 Å²	112.5	69%	0.686	64%	0.644	S	S	*	*			trans	-82.3	58.5	175.6	-73.7	162.1	0	0	0	108.4	K97 D162	K97-L99 PolarHBondContact O-N 2.85Å; L99-D162 HydrophobicContact CD1-CB 3.52Å
100	S	36.2	Very low	54.5	Low	73 Å²	73	120 Å²	120	51%	0.51	68%	0.678	S	S	.	*	S	Bend	trans	-139.2	113.8	167.6	69.2	0	0	0	0	109.1	D98	D98-S100 PolarHBondContact O-N 2.86Å; D98-S100 PolarHBondContact OD1-OG 3.43Å
101	K	34.2	Very low	51.8	Low	197 Å²	197	122.6 Å²	122.6	86%	0.857	69%	0.689	S	S	*	*			trans	75	100.3	179.1	-58.2	172.2	176.1	174.3	0	116.9
102	T	34.1	Very low	49.5	Very low	150 Å²	150	128.1 Å²	128.1	92%	0.92	71%	0.708	S	S	*	*			trans	-153.7	83.9	132.4	31.4	0	0	0	0	109.4
103	D	37.3	Very low	46.8	Very low	148 Å²	148	132.3 Å²	132.3	79%	0.791	74%	0.738	S	S	*	*			trans	-77.3	141.9	150.4	-79.5	-44.7	0	0	0	109
104	N	34.7	Very low	44.6	Very low	146 Å²	146	135.3 Å²	135.3	78%	0.781	75%	0.754	S	S	*	*			trans	68.4	119	157.6	-66.4	-35.6	0	0	0	119.4
105	L	38.5	Very low	42.1	Very low	171 Å²	171	138.2 Å²	138.2	90%	0.895	77%	0.767	S	S	*	*			trans	157.2	86.8	136.1	-81.6	154.3	0	0	0	107.3
106	N	37.2	Very low	40.6	Very low	163 Å²	163	139.1 Å²	139.1	87%	0.872	78%	0.776	S	S	*	*				41.1	110.4	89.6	-149.9	32.3	0	0	0	115.3
107	G	32.8	Very low	38.9	Very low	63 Å²	63	141.7 Å²	141.7	65%	0.649	79%	0.791	S	S	*	*			trans	74.4	111.4	148.8	0	0	0	0	0	117.9
108	T	35.2	Very low	38	Very low	134 Å²	134	140.5 Å²	140.5	82%	0.822	79%	0.793	S	S	*	*				168.6	121.5	104.1	-62.4	0	0	0	0	109
109	S	32	Very low	37.4	Very low	114 Å²	114	138.4 Å²	138.4	80%	0.797	79%	0.787	S	S	*	*			trans	-71.3	130.7	170.4	7.8	0	0	0	0	110.6
110	E	39.2	Very low	36.6	Very low	188 Å²	188	140.6 Å²	140.6	88%	0.879	79%	0.794	S	S	*	*			trans	-136.7	122	152.1	-76.6	-169	159.1	0	0	109.5
111	E	34.2	Very low	36.5	Very low	189 Å²	189	144.4 Å²	144.4	88%	0.883	81%	0.814	S	S	*	*			trans	-68.8	144.4	176.3	-64.1	170	121.5	0	0	111.6
112	L	42.4	Very low	36.6	Very low	181 Å²	181	143.8 Å²	143.8	95%	0.948	81%	0.814	S	S	*	*			trans	-146.1	129.1	142.5	-84.1	-178.4	0	0	0	111
113	S	34.7	Very low	36.6	Very low	96 Å²	96	143.7 Å²	143.7	67%	0.671	81%	0.814	S	S	*	*			trans	-81.9	149.6	-175.1	49.9	0	0	0	0	114.6
114	D	42.8	Very low	36.6	Very low	146 Å²	146	146.4 Å²	146.4	78%	0.781	82%	0.818	S	S	*	*				175.9	105.8	123.1	-108.9	-26.5	0	0	0	111.1
115	T	34.1	Very low	36.4	Very low	108 Å²	108	145.3 Å²	145.3	66%	0.663	82%	0.819	S	S	*	*				63.3	105.4	88.7	-38	0	0	0	0	115.8
116	S	41.8	Very low	36.3	Very low	132 Å²	132	145.7 Å²	145.7	92%	0.923	82%	0.821	S	S	*	*			trans	-162.9	115.3	141.4	-83.5	0	0	0	0	112.2
117	T	32.5	Very low	36.2	Very low	118 Å²	118	146.5 Å²	146.5	72%	0.724	82%	0.819	S	S	*	*			trans	-81.5	154.6	-174	-44.4	0	0	0	0	112.8
118	L	43.7	Very low	36.3	Very low	165 Å²	165	152.7 Å²	152.7	86%	0.864	83%	0.829	S	S	*	*			trans	175.2	152.7	134.4	-89.6	165.2	0	0	0	110.5
119	P	37.7	Very low	36.4	Very low	93 Å²	93	150.9 Å²	150.9	60%	0.604	82%	0.821	S	S	*	*				-127.7	159.4	-122.8	32.4	-12.7	0	0	0	117.8
120	Q	34.1	Very low	36.7	Very low	178 Å²	178	152.9 Å²	152.9	83%	0.832	82%	0.823	S	S	*	*			trans	57.5	114.1	140.6	-65.7	174	8.4	0	0	121.4
121	T	33.2	Very low	36.5	Very low	153 Å²	153	152.1 Å²	152.1	94%	0.939	82%	0.824	S	S	*	*			trans	-141.6	133.6	134	5.5	0	0	0	0	110.4
122	E	35.7	Very low	37	Very low	184 Å²	184	148 Å²	148	86%	0.86	81%	0.814	S	S	*	*			trans	-73.7	138.2	-166	-60.1	166.6	137.5	0	0	113.6
123	T	34.7	Very low	37	Very low	148 Å²	148	148.4 Å²	148.4	91%	0.908	81%	0.808	S	S	*	*			trans	-156.3	144.1	136.8	31.1	0	0	0	0	109.9
124	K	37.5	Very low	37.3	Very low	205 Å²	205	149 Å²	149	89%	0.891	81%	0.81	S	S	*	*			trans	-67.6	155.3	-157.9	-74.5	162	168.4	174.3	0	115.5
125	P	31.4	Very low	37.2	Very low	123 Å²	123	146.6 Å²	146.6	80%	0.799	80%	0.796	S	S	*	*			trans	-93.2	147.4	-175.2	22.8	-6.6	0	0	0	113.5
126	L	34.7	Very low	37.3	Very low	179 Å²	179	149.2 Å²	149.2	94%	0.937	80%	0.798	S	S	*	*			trans	-118.7	115.8	162.5	-108.7	132	0	0	0	108.6
127	E	35.1	Very low	37.1	Very low	179 Å²	179	149.1 Å²	149.1	84%	0.836	79%	0.792	S	S	*	*			trans	-62.9	141.8	170.5	-65.7	173	133.4	0	0	111.7
128	K	34.9	Very low	37.1	Very low	193 Å²	193	146.8 Å²	146.8	84%	0.839	79%	0.791	S	S	*	*			trans	164	92.3	141.6	-91	167.8	-173.2	-176.1	0	107.5
129	S	39.1	Very low	36.6	Very low	96 Å²	96	142 Å²	142	67%	0.671	77%	0.771	S	S	*	*				63.3	108.4	88.5	71.2	0	0	0	0	112.9
130	D	36.5	Very low	36.6	Very low	156 Å²	156	142.1 Å²	142.1	83%	0.834	77%	0.774	S	S	*	*			trans	59.1	85.1	153.5	-56.3	-40	0	0	0	118.1
131	L	36	Very low	36.7	Very low	172 Å²	172	139.6 Å²	139.6	90%	0.901	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-71	123.4	151.2	-81.4	115.1	0	0	0	108.8
132	P	45.2	Very low	37.2	Very low	104 Å²	104	138.1 Å²	138.1	68%	0.675	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-69	135.9	171.3	15.8	-7.8	0	0	0	109
133	K	42.7	Very low	38	Very low	189 Å²	189	136.5 Å²	136.5	82%	0.822	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-49	144.8	167.3	-72.5	172.2	178	174.7	0	109.4	I135	K133-I135 PolarHBondContact O-N 3.3Å; K133-I135 VanDerWaalsContact O-N 3.16Å
134	P	41	Very low	38.8	Very low	108 Å²	108	137.2 Å²	137.2	70%	0.701	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-54.7	127.4	175.3	24	-32.4	0	0	0	108.8	K136	P134-K136 PolarHBondContact O-N 2.83Å
135	I	39.3	Very low	39.7	Very low	95 Å²	95	132.7 Å²	132.7	49%	0.487	73%	0.732	S	S	.	*			trans	-56.8	114.4	175.7	-66.1	162.9	0	0	0	106.9	K133 V137	K133-I135 PolarHBondContact O-N 3.3Å; K133-I135 VanDerWaalsContact O-N 3.16Å; I135-V137 HydrophobicContact CB-CG2 4.47Å; I135-V137 HydrophobicContact CG2-CG2 3.7Å; I135-V137 PolarHBondContact O-N 3.42Å
136	K	36.3	Very low	41.3	Very low	164 Å²	164	132.2 Å²	132.2	71%	0.713	72%	0.719	S	S	*	*			trans	-66.2	84.5	166.8	-130.1	179	-177.4	-153.1	0	106.9	P134 G138 S139	P134-K136 PolarHBondContact O-N 2.83Å; K136-G138 PolarHBondContact O-N 2.86Å; K136-G138 VanDerWaalsContact O-N 3.17Å; K136-S139 WeakPolarHBondContact CD-OG 3.46Å; K136-S139 WeakPolarHBondContact CE-OG 3.35Å; K136-S139 PolarHBondContact NZ-OG 3.49Å
137	V	38	Very low	42.9	Very low	130 Å²	130	130.6 Å²	130.6	79%	0.788	71%	0.707	S	S	*	*	S	Bend	trans	-76.9	97.4	167.4	-173.7	0	0	0	0	105.8	I135	I135-V137 HydrophobicContact CB-CG2 4.47Å; I135-V137 HydrophobicContact CG2-CG2 3.7Å; I135-V137 PolarHBondContact O-N 3.42Å
138	G	32.6	Very low	44.6	Very low	68 Å²	68	128.3 Å²	128.3	70%	0.701	70%	0.696	S	S	*	*			trans	98.4	64.1	177.7	0	0	0	0	0	115	K136	K136-G138 PolarHBondContact O-N 2.86Å; K136-G138 VanDerWaalsContact O-N 3.17Å
139	S	33.5	Very low	46.7	Very low	65 Å²	65	120 Å²	120	46%	0.455	66%	0.66	S	S	.	*			trans	-123.7	83.9	146	-70.7	0	0	0	0	107.6	K136	K136-S139 WeakPolarHBondContact CD-OG 3.46Å; K136-S139 WeakPolarHBondContact CE-OG 3.35Å; K136-S139 PolarHBondContact NZ-OG 3.49Å
140	S	36.8	Very low	48.6	Very low	96 Å²	96	120.7 Å²	120.7	67%	0.671	65%	0.651	S	S	*	*			trans	-65.5	131	150.8	-61.2	0	0	0	0	107.1	D142	S140-D142 PolarHBondContact O-N 3.03Å
141	P	35.8	Very low	50.8	Low	124 Å²	124	117 Å²	117	81%	0.805	65%	0.651	S	S	*	*			trans	-78.6	75.5	164.8	33	-28.4	0	0	0	107.7
142	D	44.8	Very low	53.4	Low	122 Å²	122	111.9 Å²	111.9	65%	0.652	62%	0.621	S	S	*	*			trans	-130	82.6	166.8	-78.4	-37.4	0	0	0	107.2	S140 E144	S140-D142 PolarHBondContact O-N 3.03Å; D142-E144 PolarHBondContact O-N 3.17Å
143	D	51.6	Low	55.6	Low	151 Å²	151	109.9 Å²	109.9	81%	0.807	60%	0.604	S	S	*	*			trans	-72.7	54.4	158.9	-80.8	-43	0	0	0	109.1	E145	D143-E145 PolarHBondContact O-N 2.89Å
144	E	52.8	Low	58	Low	163 Å²	163	109 Å²	109	76%	0.762	60%	0.601	S	S	*	*			trans	-87.3	89.2	152.5	-69.3	-167.7	179.7	0	0	105.4	D142 E146	D142-E144 PolarHBondContact O-N 3.17Å; E144-E146 VanDerWaalsContact C-N 3.3Å; E144-E146 PolarHBondContact O-N 2.94Å
145	E	55.4	Low	60.5	Low	110 Å²	110	104.7 Å²	104.7	51%	0.514	57%	0.573	S	S	.	*			trans	-57.9	100.1	166.7	-71.3	-167.9	157.8	0	0	107.8	D143 E147	D143-E145 PolarHBondContact O-N 2.89Å; E145-E147 PolarHBondContact O-N 3.37Å
146	E	64.7	Low	63.2	Low	113 Å²	113	101.5 Å²	101.5	53%	0.528	56%	0.556	S	S	.	*			trans	-49.5	138.2	170	-68	-178.8	-171.8	0	0	108.3	E144 E148 D149 R261	E144-E146 VanDerWaalsContact C-N 3.3Å; E144-E146 PolarHBondContact O-N 2.94Å; E146-E148 PolarHBondContact O-N 3.47Å; E146-D149 PolarHBondContact O-N 2.97Å; E146-R261 IonicContact OE2-CZ 3.37Å; E146-R261 IonicContact OE2-NH1 3.97Å; E146-R261 PolarHBondContact OE2-NH1 3.09Å; E146-R261 IonicContact OE2-NH2 3.11Å
147	E	67.8	Low	65.9	Low	145 Å²	145	103.6 Å²	103.6	68%	0.678	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.1	-25.8	-176.8	-69.5	-70	152.5	0	0	113.1	E145 D149 K150	E145-E147 PolarHBondContact O-N 3.37Å; E147-D149 VanDerWaalsContact C-N 3.33Å; E147-D149 PolarHBondContact O-N 3.44Å; E147-K150 IonicContact OE1-NZ 2.57Å; E147-K150 PolarHBondContact OE1-NZ 3.05Å; E147-K150 WeakPolarHBondContact OE2-CD 3.35Å; E147-K150 WeakPolarHBondContact OE2-CE 3.37Å; E147-K150 IonicContact OE2-NZ 3.81Å; E147-K150 PolarHBondContact OE2-NZ 3.02Å
148	E	72.1	Confident	68.5	Low	130 Å²	130	98.5 Å²	98.5	61%	0.607	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-19.8	178	-60.7	-174.7	168.6	0	0	114.8	E146 K152 R261	E146-E148 PolarHBondContact O-N 3.47Å; E148-K152 WeakPolarHBondContact O-CE 3.33Å; E148-K152 PolarHBondContact O-NZ 2.92Å; E148-R261 IonicContact OE2-CZ 3.95Å; E148-R261 IonicContact OE2-NH1 3.87Å; E148-R261 IonicContact OE2-NH2 2.77Å; E148-R261 PolarHBondContact OE2-NH2 3.33Å
149	D	78.9	Confident	71.5	Confident	18 Å²	18	95.8 Å²	95.8	10%	0.096	51%	0.512	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-7.7	-176.7	-74.7	-19.8	0	0	0	113.5	E146 E147 G151 K152 N259 R261	E146-D149 PolarHBondContact O-N 2.97Å; E147-D149 VanDerWaalsContact C-N 3.33Å; E147-D149 PolarHBondContact O-N 3.44Å; D149-G151 PolarHBondContact O-N 3.44Å; D149-K152 PolarHBondContact O-N 3.44Å; D149-K152 VanDerWaalsContact O-N 3.16Å; D149-K152 IonicContact OD1-NZ 3.48Å; D149-K152 PolarHBondContact OD1-NZ 3.35Å; D149-N259 WeakPolarHBondContact CB-ND2 3.43Å; D149-N259 PolarHBondContact OD1-ND2 2.89Å; D149-N259 PolarHBondContact OD2-ND2 3Å; D149-R261 IonicContact OD1-NH1 2.8Å; D149-R261 IonicContact OD2-NH1 2.76Å
150	K	77.8	Confident	74.5	Confident	111 Å²	111	92.7 Å²	92.7	48%	0.483	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	122.6	176.4	-70	-175.7	-178.2	173.1	0	110.8	E147	E147-K150 IonicContact OE1-NZ 2.57Å; E147-K150 PolarHBondContact OE1-NZ 3.05Å; E147-K150 WeakPolarHBondContact OE2-CD 3.35Å; E147-K150 WeakPolarHBondContact OE2-CE 3.37Å; E147-K150 IonicContact OE2-NZ 3.81Å; E147-K150 PolarHBondContact OE2-NZ 3.02Å
151	G	83.3	Confident	77.3	Confident	80 Å²	80	88.2 Å²	88.2	83%	0.825	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.9	-3.2	177.9	0	0	0	0	0	115.2	D149	D149-G151 PolarHBondContact O-N 3.44Å
152	K	90.7	Very high	80.1	Confident	64 Å²	64	86 Å²	86	28%	0.278	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-79.3	145.4	171.2	-63.9	-178.2	-167.4	153.7	0	111.1	E148 D149 E257 N259	E148-K152 WeakPolarHBondContact O-CE 3.33Å; E148-K152 PolarHBondContact O-NZ 2.92Å; D149-K152 PolarHBondContact O-N 3.44Å; D149-K152 VanDerWaalsContact O-N 3.16Å; D149-K152 IonicContact OD1-NZ 3.48Å; D149-K152 PolarHBondContact OD1-NZ 3.35Å; K152-E257 CarbonylContact C-O 3.55Å; K152-E257 WeakPolarHBondContact CA-O 3.48Å; K152-E257 WeakPolarHBondContact CB-O 3.41Å; K152-E257 HydrophobicContact CG-CB 4.45Å; K152-N259 HydrophobicContact CB-CB 3.93Å; K152-N259 HydrophobicContact CD-CB 4.18Å
153	L	92	Very high	82.5	Confident	61 Å²	61	81.3 Å²	81.3	32%	0.319	42%	0.416	S	S	.	.	B	Isolated β-bridge	trans	-71.1	141.6	175.9	-60.9	178.1	0	0	0	110.9	A161 L163 P256 E257 M258 N259	L153-A161 HydrophobicContact CD1-CB 3.94Å; L153-L163 HydrophobicContact CD1-CD2 3.84Å; L153-P256 HydrophobicContact CD1-CB 3.74Å; L153-P256 HydrophobicContact CG-CB 4.14Å; L153-E257 PolarHBondContact N-O 2.77Å; L153-M258 HydrophobicContact CB-CB 4.5Å; L153-M258 CarbonylContact O-C 3.6Å; L153-M258 VanDerWaalsContact O-CA 3.31Å; L153-M258 WeakPolarHBondContact O-CA 3.34Å; L153-M258 WeakPolarHBondContact O-CG 3.44Å; L153-N259 PolarHBondContact O-N 3.16Å
154	K	92.9	Very high	84.4	Confident	172 Å²	172	78.2 Å²	78.2	75%	0.748	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-70.5	133.5	167.3	-175.7	178.9	176.5	179.3	0	108.9
155	P	94.3	Very high	86.3	Confident	17 Å²	17	75 Å²	75	11%	0.11	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-55.7	142.6	174.8	-21.9	29.2	0	0	0	112.7	G160 M258 N259 K262 V263	P155-G160 CarbonylContact C-O 3.54Å; P155-G160 VanDerWaalsContact CA-O 3.32Å; P155-G160 WeakPolarHBondContact CA-O 3.43Å; P155-M258 VanDerWaalsContact CA-SD 3.55Å; P155-M258 HydrophobicContact CB-CE 4.5Å; P155-M258 HydrophobicContact CB-CG 4.06Å; P155-M258 HydrophobicContact CB-SD 3.45Å; P155-M258 WeakPolarHBondContact CB-SD 3.27Å; P155-M258 HydrophobicContact CG-CE 4.24Å; P155-M258 HydrophobicContact CG-CG 3.66Å; P155-M258 HydrophobicContact CG-SD 3.56Å; P155-M258 VanDerWaalsContact CG-SD 3.56Å; P155-N259 WeakPolarHBondContact CG-O 3.39Å; P155-K262 HydrophobicContact CG-CB 4.04Å; P155-V263 HydrophobicContact CG-CG2 4.08Å
156	N	94.9	Very high	88.3	Confident	27 Å²	27	70.1 Å²	70.1	14%	0.144	37%	0.369	C	S	.	.			trans	-74.6	178.5	166.7	66.1	19.2	0	0	0	110.8	G158 N159 G160 D162 W168	N156-G158 PolarHBondContact O-N 3.42Å; N156-G158 VanDerWaalsContact O-N 3.09Å; N156-G158 PolarHBondContact OD1-N 2.88Å; N156-G158 VanDerWaalsContact OD1-N 3.14Å; N156-N159 PolarHBondContact O-N 2.92Å; N156-N159 PolarHBondContact OD1-N 2.86Å; N156-G160 PolarHBondContact N-O 2.99Å; N156-G160 PolarHBondContact OD1-N 3.31Å; N156-G160 PolarHBondContact OD1-O 2.87Å; N156-D162 PolarHBondContact ND2-OD1 2.85Å; N156-W168 PolarHBondContact ND2-O 2.73Å
157	E	92.3	Very high	89.8	Confident	208 Å²	208	66.1 Å²	66.1	97%	0.972	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-24.7	-178.4	-66.8	-176.5	166.3	0	0	113.6
158	G	93.8	Very high	91.2	Very high	23 Å²	23	59.4 Å²	59.4	24%	0.237	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	24.8	176.4	0	0	0	0	0	113.6	N156 G160 T169 Q170	N156-G158 PolarHBondContact O-N 3.42Å; N156-G158 VanDerWaalsContact O-N 3.09Å; N156-G158 PolarHBondContact OD1-N 2.88Å; N156-G158 VanDerWaalsContact OD1-N 3.14Å; G158-G160 PolarHBondContact O-N 2.67Å; G158-T169 CarbonylContact O-C 3.58Å; G158-T169 VanDerWaalsContact O-CA 3.26Å; G158-T169 WeakPolarHBondContact O-CA 3.43Å; G158-T169 VanDerWaalsContact O-CB 3.32Å; G158-T169 WeakPolarHBondContact O-CB 3.35Å; G158-Q170 PolarHBondContact O-N 3.31Å
159	N	95.7	Very high	92.4	Very high	11 Å²	11	55.8 Å²	55.8	6%	0.059	31%	0.309	C	S	.	.	S	Bend	trans	57.6	21.1	176.3	-61.8	-51.3	0	0	0	115.7	N156 Q170 W247 M258 V263 Q264	N156-N159 PolarHBondContact O-N 2.92Å; N156-N159 PolarHBondContact OD1-N 2.86Å; N159-Q170 HydrophobicContact CB-CG 4.31Å; N159-Q170 WeakPolarHBondContact O-CG 3.31Å; N159-Q170 PolarHBondContact O-NE2 3.38Å; N159-W247 HydrophobicContact CB-CE3 4.45Å; N159-W247 HydrophobicContact CB-CH2 4.37Å; N159-W247 HydrophobicContact CB-CZ3 3.84Å; N159-M258 VanDerWaalsContact O-CE 3.28Å; N159-M258 WeakPolarHBondContact O-CE 2.92Å; N159-M258 VanDerWaalsContact O-SD 3.36Å; N159-V263 HydrophobicContact CB-CG1 3.92Å; N159-V263 HydrophobicContact CB-CG2 4.23Å; N159-Q264 PolarHBondContact ND2-O 3.18Å; N159-Q264 PolarHBondContact OD1-N 3.15Å; N159-Q264 PolarHBondContact OD1-O 3.08Å
160	G	95.8	Very high	93.3	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.306	C	S	.	.	S	Bend	trans	-116.8	-148.4	169.9	0	0	0	0	0	110.6	P155 N156 G158 W168 M258	P155-G160 CarbonylContact C-O 3.54Å; P155-G160 VanDerWaalsContact CA-O 3.32Å; P155-G160 WeakPolarHBondContact CA-O 3.43Å; N156-G160 PolarHBondContact N-O 2.99Å; N156-G160 PolarHBondContact OD1-N 3.31Å; N156-G160 PolarHBondContact OD1-O 2.87Å; G158-G160 PolarHBondContact O-N 2.67Å; G160-W168 CarbonylContact C-O 3.34Å; G160-W168 VanDerWaalsContact CA-O 3.24Å; G160-W168 WeakPolarHBondContact CA-O 3.43Å; G160-M258 VanDerWaalsContact C-SD 3.52Å
161	A	96.5	Very high	94.1	Very high	3 Å²	3	51.9 Å²	51.9	3%	0.025	29%	0.294	C	S	.	.			trans	-134.8	152.6	-178.9	0	0	0	0	0	112.8	L153 S167 W168	L153-A161 HydrophobicContact CD1-CB 3.94Å; A161-S167 WeakPolarHBondContact O-CA 3.11Å; A161-W168 HydrophobicContact CB-CZ2 4.18Å; A161-W168 PolarHBondContact N-O 2.97Å; A161-W168 VanDerWaalsContact N-O 3.14Å; A161-W168 VanDerWaalsContact O-CD1 3.24Å; A161-W168 PolarHBondContact O-N 3.42Å
162	D	95	Very high	94.6	Very high	78 Å²	78	51.4 Å²	51.4	42%	0.417	27%	0.272	S	S	.	.	B	Isolated β-bridge	trans	-100.7	115.8	172.6	-62.2	-31.7	0	0	0	108.8	L99 N156 S167	L99-D162 HydrophobicContact CD1-CB 3.52Å; N156-D162 PolarHBondContact ND2-OD1 2.85Å; D162-S167 WeakPolarHBondContact OD1-CB 3.44Å
163	L	93.9	Very high	94.7	Very high	23 Å²	23	50.1 Å²	50.1	12%	0.12	27%	0.271	C	S	.	.			trans	-114.6	164.8	-179.1	-63.2	164.4	0	0	0	110	L153 N165 Y166 E255 P256	L153-L163 HydrophobicContact CD1-CD2 3.84Å; L163-N165 VanDerWaalsContact C-N 3.27Å; L163-N165 PolarHBondContact O-N 2.91Å; L163-Y166 CarbonylContact C-O 3.57Å; L163-Y166 VanDerWaalsContact CA-O 3.28Å; L163-Y166 WeakPolarHBondContact CA-O 3.42Å; L163-Y166 HydrophobicContact CB-CE1 4.43Å; L163-Y166 VanDerWaalsContact CB-O 3.27Å; L163-Y166 WeakPolarHBondContact CB-O 3.4Å; L163-Y166 HydrophobicContact CD1-CD2 4.42Å; L163-Y166 HydrophobicContact CD1-CE1 3.75Å; L163-Y166 HydrophobicContact CD1-CE2 3.68Å; L163-Y166 WeakPolarHBondContact CD1-OH 3.3Å; L163-Y166 PolarHBondContact N-O 3.3Å; L163-E255 WeakPolarHBondContact CD1-OE2 3.35Å; L163-P256 HydrophobicContact CD2-CB 4.36Å; L163-P256 HydrophobicContact CD2-CG 3.93Å
164	P	92.1	Very high	95	Very high	85 Å²	85	48.4 Å²	48.4	55%	0.552	26%	0.262	S	S	*	.	S	Bend	trans	-58.6	-36.7	-175.7	-28.2	36.3	0	0	0	114.4	P96	P96-P164 HydrophobicContact CG-CB 4.35Å; P96-P164 VanDerWaalsContact CG-O 3.26Å; P96-P164 WeakPolarHBondContact CG-O 3.43Å
165	N	93.3	Very high	95.2	Very high	95 Å²	95	40.2 Å²	40.2	51%	0.508	23%	0.227	S	C	.	.	S	Bend	trans	-101.8	-19.6	-173	-67.2	-27.5	0	0	0	113.9	L163 I211	L163-N165 VanDerWaalsContact C-N 3.27Å; L163-N165 PolarHBondContact O-N 2.91Å; N165-I211 HydrophobicContact CB-CG2 3.87Å
166	Y	95.7	Very high	95.4	Very high	8 Å²	8	42.6 Å²	42.6	3%	0.031	24%	0.239	C	C	.	.			trans	-158.7	164.6	-179.5	67.6	-83.2	0	0	0	110.5	L163 W168 I177 K178 L212 I251 E255	L163-Y166 CarbonylContact C-O 3.57Å; L163-Y166 VanDerWaalsContact CA-O 3.28Å; L163-Y166 WeakPolarHBondContact CA-O 3.42Å; L163-Y166 HydrophobicContact CB-CE1 4.43Å; L163-Y166 VanDerWaalsContact CB-O 3.27Å; L163-Y166 WeakPolarHBondContact CB-O 3.4Å; L163-Y166 HydrophobicContact CD1-CD2 4.42Å; L163-Y166 HydrophobicContact CD1-CE1 3.75Å; L163-Y166 HydrophobicContact CD1-CE2 3.68Å; L163-Y166 WeakPolarHBondContact CD1-OH 3.3Å; L163-Y166 PolarHBondContact N-O 3.3Å; Y166-W168 AromaticContact CE2-CD1 3.75Å; Y166-W168 HydrophobicContact CE2-CG 4.5Å; Y166-I177 HydrophobicContact CD2-CG2 3.77Å; Y166-I177 HydrophobicContact CE2-CG2 4.43Å; Y166-I177 HydrophobicContact CG-CG2 4.42Å; Y166-K178 CarbonylContact C-O 3.48Å; Y166-K178 WeakPolarHBondContact CA-O 3.49Å; Y166-K178 WeakPolarHBondContact CB-O 3.31Å; Y166-L212 HydrophobicContact CE1-CD1 4.06Å; Y166-L212 HydrophobicContact CE2-CD2 4.39Å; Y166-I251 HydrophobicContact CE2-CG1 3.98Å; Y166-E255 VanDerWaalsContact OH-CD 3.24Å; Y166-E255 PolarHBondContact OH-OE2 3.03Å
167	S	96.8	Very high	95.6	Very high	30 Å²	30	41.5 Å²	41.5	21%	0.21	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	156.6	169.8	49.3	0	0	0	0	107.9	A161 D162 K178	A161-S167 WeakPolarHBondContact O-CA 3.11Å; D162-S167 WeakPolarHBondContact OD1-CB 3.44Å; S167-K178 PolarHBondContact N-O 3.12Å; S167-K178 PolarHBondContact O-N 3.08Å
168	W	98.2	Very high	95.9	Very high	4 Å²	4	36.9 Å²	36.9	2%	0.015	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	153.7	174.1	62	-78.6	0	0	0	111	N156 G160 A161 Y166 Q170 V175 D176 I177 W248 I251 M258	N156-W168 PolarHBondContact ND2-O 2.73Å; G160-W168 CarbonylContact C-O 3.34Å; G160-W168 VanDerWaalsContact CA-O 3.24Å; G160-W168 WeakPolarHBondContact CA-O 3.43Å; A161-W168 HydrophobicContact CB-CZ2 4.18Å; A161-W168 PolarHBondContact N-O 2.97Å; A161-W168 VanDerWaalsContact N-O 3.14Å; A161-W168 VanDerWaalsContact O-CD1 3.24Å; A161-W168 PolarHBondContact O-N 3.42Å; Y166-W168 AromaticContact CE2-CD1 3.75Å; Y166-W168 HydrophobicContact CE2-CG 4.5Å; W168-Q170 HydrophobicContact CE3-CB 4.41Å; W168-Q170 HydrophobicContact CE3-CG 4.28Å; W168-Q170 HydrophobicContact CZ3-CB 4.16Å; W168-Q170 VanDerWaalsContact CZ3-CD 3.45Å; W168-Q170 HydrophobicContact CZ3-CG 3.71Å; W168-Q170 VanDerWaalsContact CZ3-NE2 3.3Å; W168-V175 HydrophobicContact CB-CG1 4.45Å; W168-V175 HydrophobicContact CE3-CG1 3.85Å; W168-D176 CarbonylContact C-O 3.55Å; W168-D176 WeakPolarHBondContact CA-O 3.27Å; W168-D176 WeakPolarHBondContact CB-O 3.44Å; W168-I177 HydrophobicContact CB-CG1 4.16Å; W168-W248 HydrophobicContact CH2-CB 4.5Å; W168-W248 WeakPolarHBondContact CH2-O 3.26Å; W168-W248 HydrophobicContact CZ3-CB 4.5Å; W168-I251 HydrophobicContact CB-CD1 4.02Å; W168-I251 HydrophobicContact CB-CG1 4.23Å; W168-I251 HydrophobicContact CD2-CD1 3.39Å; W168-I251 HydrophobicContact CD2-CG1 3.72Å; W168-I251 HydrophobicContact CE3-CD1 3.5Å; W168-I251 VanDerWaalsContact CE3-CD1 3.5Å; W168-I251 HydrophobicContact CE3-CG1 4.32Å; W168-I251 HydrophobicContact CG-CD1 3.62Å; W168-I251 HydrophobicContact CG-CG1 3.64Å; W168-I251 HydrophobicContact CZ3-CD1 4.06Å; W168-M258 HydrophobicContact CH2-CE 4.4Å
169	T	97.7	Very high	96	Very high	54 Å²	54	35.8 Å²	35.8	33%	0.331	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	161.2	175.6	55.1	0	0	0	0	108.1	G158 V175 D176	G158-T169 CarbonylContact O-C 3.58Å; G158-T169 VanDerWaalsContact O-CA 3.26Å; G158-T169 WeakPolarHBondContact O-CA 3.43Å; G158-T169 VanDerWaalsContact O-CB 3.32Å; G158-T169 WeakPolarHBondContact O-CB 3.35Å; T169-V175 CarbonylContact O-C 3.49Å; T169-V175 WeakPolarHBondContact O-CA 3.33Å; T169-V175 WeakPolarHBondContact O-CG1 3.11Å; T169-D176 PolarHBondContact N-O 2.73Å; T169-D176 PolarHBondContact O-N 3.47Å
170	Q	97	Very high	96.1	Very high	7 Å²	7	36.4 Å²	36.4	3%	0.033	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	156.8	-179.9	55	169.2	-24.3	0	0	111.9	G158 N159 W168 D174 V175 W247 W248	G158-Q170 PolarHBondContact O-N 3.31Å; N159-Q170 HydrophobicContact CB-CG 4.31Å; N159-Q170 WeakPolarHBondContact O-CG 3.31Å; N159-Q170 PolarHBondContact O-NE2 3.38Å; W168-Q170 HydrophobicContact CE3-CB 4.41Å; W168-Q170 HydrophobicContact CE3-CG 4.28Å; W168-Q170 HydrophobicContact CZ3-CB 4.16Å; W168-Q170 VanDerWaalsContact CZ3-CD 3.45Å; W168-Q170 HydrophobicContact CZ3-CG 3.71Å; W168-Q170 VanDerWaalsContact CZ3-NE2 3.3Å; Q170-D174 WeakPolarHBondContact CA-O 3.36Å; Q170-D174 VanDerWaalsContact CB-O 3.26Å; Q170-D174 WeakPolarHBondContact CB-O 3.49Å; Q170-V175 HydrophobicContact CB-CB 4.48Å; Q170-V175 HydrophobicContact CB-CG2 4.02Å; Q170-W247 HydrophobicContact CG-CE3 3.87Å; Q170-W247 HydrophobicContact CG-CZ3 3.86Å; Q170-W247 WeakPolarHBondContact O-CZ3 3.41Å; Q170-W248 PolarHBondContact NE2-O 3.25Å
171	T	94.9	Very high	96	Very high	39 Å²	39	36.7 Å²	36.7	24%	0.239	21%	0.205	C	C	.	.			trans	-110.8	-171.4	160.4	69.4	0	0	0	0	108.9	S173 D174 K241 W247	T171-S173 PolarHBondContact O-N 3.34Å; T171-S173 PolarHBondContact OG1-N 3.44Å; T171-S173 VanDerWaalsContact OG1-N 3.15Å; T171-S173 PolarHBondContact OG1-OG 3.34Å; T171-D174 WeakPolarHBondContact CG2-OD1 3.47Å; T171-D174 PolarHBondContact N-O 2.96Å; T171-D174 PolarHBondContact OG1-N 2.93Å; T171-D174 PolarHBondContact OG1-OD1 2.82Å; T171-D174 PolarHBondContact OG1-OD2 2.77Å; T171-K241 PolarHBondContact O-NZ 2.85Å; T171-W247 VanDerWaalsContact C-CZ3 3.48Å
172	L	92.5	Very high	95.8	Very high	71 Å²	71	40.5 Å²	40.5	37%	0.372	22%	0.218	S	C	.	.	S	Bend	trans	-66	-27.9	169.7	-78.1	173.7	0	0	0	112.7	K241 K244 W247	L172-K241 WeakPolarHBondContact O-CD 3.33Å; L172-K244 CarbonylContact C-O 3.6Å; L172-K244 WeakPolarHBondContact CB-O 3.38Å; L172-K244 CarbonylContact O-C 3.48Å; L172-K244 WeakPolarHBondContact O-CA 3.31Å; L172-W247 HydrophobicContact CD2-CD2 3.99Å; L172-W247 VanDerWaalsContact CD2-CE2 3.48Å; L172-W247 HydrophobicContact CD2-CG 4.17Å; L172-W247 HydrophobicContact CD2-CZ2 3.93Å; L172-W247 HydrophobicContact CG-CH2 4.44Å; L172-W247 HydrophobicContact CG-CZ2 3.78Å
173	S	94.5	Very high	95.8	Very high	36 Å²	36	37.3 Å²	37.3	25%	0.252	20%	0.201	S	C	.	.	S	Bend	trans	-95.3	-26	-173.9	42.8	0	0	0	0	114.8	T171 K241	T171-S173 PolarHBondContact O-N 3.34Å; T171-S173 PolarHBondContact OG1-N 3.44Å; T171-S173 VanDerWaalsContact OG1-N 3.15Å; T171-S173 PolarHBondContact OG1-OG 3.34Å; S173-K241 WeakPolarHBondContact O-CB 3.42Å; S173-K241 WeakPolarHBondContact O-CG 3.45Å; S173-K241 PolarHBondContact O-N 2.97Å
174	D	97.3	Very high	95.8	Very high	25 Å²	25	40.4 Å²	40.4	13%	0.134	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	169.1	-166.2	49.8	62.7	0	0	0	112.7	Q170 T171 H238 L239 K241	Q170-D174 WeakPolarHBondContact CA-O 3.36Å; Q170-D174 VanDerWaalsContact CB-O 3.26Å; Q170-D174 WeakPolarHBondContact CB-O 3.49Å; T171-D174 WeakPolarHBondContact CG2-OD1 3.47Å; T171-D174 PolarHBondContact N-O 2.96Å; T171-D174 PolarHBondContact OG1-N 2.93Å; T171-D174 PolarHBondContact OG1-OD1 2.82Å; T171-D174 PolarHBondContact OG1-OD2 2.77Å; D174-H238 VanDerWaalsContact CB-CE1 3.48Å; D174-H238 WeakPolarHBondContact CB-CE1 3.43Å; D174-L239 CarbonylContact C-O 3.45Å; D174-L239 VanDerWaalsContact CA-O 3.25Å; D174-L239 WeakPolarHBondContact CA-O 3.24Å; D174-L239 WeakPolarHBondContact CB-O 3.44Å; D174-K241 WeakPolarHBondContact O-CE 3.48Å
175	V	98.3	Very high	95.9	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	131.5	176.1	-178.2	0	0	0	0	109.2	W168 T169 Q170 I177 L239 K241 W248 I251	W168-V175 HydrophobicContact CB-CG1 4.45Å; W168-V175 HydrophobicContact CE3-CG1 3.85Å; T169-V175 CarbonylContact O-C 3.49Å; T169-V175 WeakPolarHBondContact O-CA 3.33Å; T169-V175 WeakPolarHBondContact O-CG1 3.11Å; Q170-V175 HydrophobicContact CB-CB 4.48Å; Q170-V175 HydrophobicContact CB-CG2 4.02Å; V175-I177 HydrophobicContact CG1-CG1 4.14Å; V175-L239 HydrophobicContact CB-CB 4.25Å; V175-L239 PolarHBondContact N-O 3.14Å; V175-L239 PolarHBondContact O-N 3.09Å; V175-K241 HydrophobicContact CG2-CG 4.48Å; V175-W248 HydrophobicContact CG2-CD2 4.16Å; V175-W248 HydrophobicContact CG2-CE3 4.03Å; V175-W248 HydrophobicContact CG2-CZ3 4.44Å; V175-I251 HydrophobicContact CG1-CD1 3.47Å; V175-I251 VanDerWaalsContact CG1-CD1 3.47Å
176	D	98.5	Very high	96	Very high	68 Å²	68	38.4 Å²	38.4	36%	0.364	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	124.7	171.4	-71.9	-57.4	0	0	0	110.3	W168 T169 V237 H238	W168-D176 CarbonylContact C-O 3.55Å; W168-D176 WeakPolarHBondContact CA-O 3.27Å; W168-D176 WeakPolarHBondContact CB-O 3.44Å; T169-D176 PolarHBondContact N-O 2.73Å; T169-D176 PolarHBondContact O-N 3.47Å; D176-V237 CarbonylContact C-O 3.59Å; D176-V237 WeakPolarHBondContact CA-O 3.24Å; D176-H238 WeakPolarHBondContact OD1-CB 3.38Å; D176-H238 IonicContact OD1-CE1 3.86Å; D176-H238 IonicContact OD1-CG 3.75Å; D176-H238 IonicContact OD1-ND1 3.05Å; D176-H238 PolarHBondContact OD1-ND1 2.81Å; D176-H238 IonicContact OD2-ND1 2.67Å
177	I	98.4	Very high	96	Very high	3 Å²	3	38.7 Å²	38.7	2%	0.015	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	129.7	179.8	-53.7	171.8	0	0	0	108.8	Y166 W168 V175 I179 I201 L212 L236 V237 L239 I251	Y166-I177 HydrophobicContact CD2-CG2 3.77Å; Y166-I177 HydrophobicContact CE2-CG2 4.43Å; Y166-I177 HydrophobicContact CG-CG2 4.42Å; W168-I177 HydrophobicContact CB-CG1 4.16Å; V175-I177 HydrophobicContact CG1-CG1 4.14Å; I177-I179 HydrophobicContact CG2-CD1 4.15Å; I177-I179 HydrophobicContact CG2-CG1 3.83Å; I177-I201 HydrophobicContact CD1-CD1 4.04Å; I177-L212 HydrophobicContact CD1-CD2 4.08Å; I177-L212 HydrophobicContact CG2-CD2 4.46Å; I177-L236 CarbonylContact O-C 3.59Å; I177-L236 WeakPolarHBondContact O-CA 3.14Å; I177-V237 HydrophobicContact CB-CB 4.28Å; I177-V237 PolarHBondContact N-O 2.97Å; I177-V237 PolarHBondContact O-N 3.38Å; I177-L239 HydrophobicContact CD1-CD1 3.74Å; I177-L239 HydrophobicContact CD1-CG 4.37Å; I177-I251 HydrophobicContact CD1-CD1 4.29Å; I177-I251 HydrophobicContact CD1-CG1 4.46Å; I177-I251 HydrophobicContact CD1-CG2 3.8Å; I177-I251 HydrophobicContact CG1-CD1 4.24Å
178	K	97.9	Very high	96	Very high	112 Å²	112	43.9 Å²	43.9	49%	0.487	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	113.6	178.8	178.9	178.6	-178.5	-177.2	0	110.8	Y166 S167 T234 L236	Y166-K178 CarbonylContact C-O 3.48Å; Y166-K178 WeakPolarHBondContact CA-O 3.49Å; Y166-K178 WeakPolarHBondContact CB-O 3.31Å; S167-K178 PolarHBondContact N-O 3.12Å; S167-K178 PolarHBondContact O-N 3.08Å; K178-T234 HydrophobicContact CD-CG2 4.36Å; K178-T234 HydrophobicContact CG-CG2 3.6Å; K178-L236 HydrophobicContact CB-CD2 3.79Å; K178-L236 HydrophobicContact CD-CD2 4.29Å; K178-L236 HydrophobicContact CG-CD2 3.68Å
179	I	96.9	Very high	96	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	105	-176.9	-47.3	-172.6	0	0	0	110.1	I177 I203 I211 T234 I235	I177-I179 HydrophobicContact CG2-CD1 4.15Å; I177-I179 HydrophobicContact CG2-CG1 3.83Å; I179-I203 HydrophobicContact CD1-CB 3.95Å; I179-I203 HydrophobicContact CD1-CD1 3.93Å; I179-I203 HydrophobicContact CD1-CG2 3.55Å; I179-I211 HydrophobicContact CG2-CB 4.24Å; I179-I211 HydrophobicContact CG2-CD1 3.68Å; I179-I211 HydrophobicContact CG2-CG2 3.66Å; I179-T234 WeakPolarHBondContact O-CA 3.42Å; I179-I235 HydrophobicContact CB-CB 4.24Å; I179-I235 PolarHBondContact N-O 2.92Å; I179-I235 PolarHBondContact O-N 3.21Å
180	P	96.1	Very high	95.9	Very high	23 Å²	23	53.3 Å²	53.3	15%	0.149	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	136.2	169	27.3	-33	0	0	0	110.4	N92 R182	N92-P180 VanDerWaalsContact OD1-CB 3.24Å; N92-P180 WeakPolarHBondContact OD1-CB 3.49Å; P180-R182 PolarHBondContact O-N 3.01Å
181	T	94.7	Very high	95.9	Very high	7 Å²	7	55.7 Å²	55.7	4%	0.043	28%	0.279	C	S	.	.			trans	-71.8	-18.2	-177.7	61.1	0	0	0	0	113	N92 L183 I187 L205 L229 I233 I235	N92-T181 PolarHBondContact ND2-OG1 2.96Å; N92-T181 PolarHBondContact OD1-N 3.23Å; T181-L183 PolarHBondContact O-N 3.05Å; T181-I187 HydrophobicContact CG2-CD1 3.7Å; T181-I187 HydrophobicContact CG2-CG1 4.21Å; T181-L205 HydrophobicContact CG2-CD2 4.46Å; T181-L229 HydrophobicContact CG2-CD1 4.45Å; T181-I233 WeakPolarHBondContact CG2-O 3.48Å; T181-I233 PolarHBondContact N-O 3.4Å; T181-I233 PolarHBondContact OG1-O 2.99Å; T181-I235 HydrophobicContact CG2-CG1 4.37Å
182	R	93	Very high	96.1	Very high	83 Å²	83	54.1 Å²	54.1	31%	0.313	27%	0.27	S	S	.	.			trans	54.4	32.9	-175.4	-53	-56.1	-167.2	173.9	6.5	113.3	N92 A94 P180	N92-R182 PolarHBondContact ND2-N 2.87Å; N92-R182 WeakPolarHBondContact O-CD 3.37Å; N92-R182 PolarHBondContact O-NH1 3.19Å; N92-R182 PolarHBondContact OD1-N 2.83Å; A94-R182 PolarHBondContact O-NH1 2.91Å; P180-R182 PolarHBondContact O-N 3.01Å
183	L	93.7	Very high	96.3	Very high	11 Å²	11	55.2 Å²	55.2	6%	0.058	27%	0.269	C	S	.	.			trans	-106.8	145.5	177.3	-65.4	177	0	0	0	111.5	N92 T181 H185 I187 L205	N92-L183 PolarHBondContact ND2-N 3.4Å; N92-L183 PolarHBondContact ND2-O 3.39Å; N92-L183 VanDerWaalsContact ND2-O 3.17Å; T181-L183 PolarHBondContact O-N 3.05Å; L183-H185 PolarHBondContact O-N 3.22Å; L183-H185 VanDerWaalsContact O-N 3.15Å; L183-I187 HydrophobicContact CD1-CG2 3.39Å; L183-L205 HydrophobicContact CD1-CD1 3.83Å; L183-L205 HydrophobicContact CD2-CD1 4.4Å; L183-L205 HydrophobicContact CG-CD1 4.23Å
184	P	93.7	Very high	96.4	Very high	87 Å²	87	54.8 Å²	54.8	57%	0.565	27%	0.265	S	S	*	.	S	Bend	trans	-78.1	11.1	176.9	34.3	-36.6	0	0	0	113.2	I89 L93	I89-P184 WeakPolarHBondContact CG2-O 3.35Å; L93-P184 HydrophobicContact CD1-CB 4.06Å
185	H	94.2	Very high	96.5	Very high	94 Å²	94	57.3 Å²	57.3	44%	0.435	28%	0.276	S	S	.	.	S	Bend	trans	-149.4	158.8	-179.5	60.7	75.6	0	0	0	110.4	L183	L183-H185 PolarHBondContact O-N 3.22Å; L183-H185 VanDerWaalsContact O-N 3.15Å
186	T	95.5	Very high	96.5	Very high	44 Å²	44	59 Å²	59	27%	0.27	29%	0.285	S	S	.	.			trans	-74.3	138.3	174	56	0	0	0	0	111	K85 I89 D231 G232 I233	K85-T186 HydrophobicContact CG-CG2 4.44Å; I89-T186 HydrophobicContact CD1-CG2 4.37Å; T186-D231 WeakPolarHBondContact CG2-O 3.33Å; T186-G232 CarbonylContact C-O 3.5Å; T186-G232 WeakPolarHBondContact CA-O 3.38Å; T186-I233 HydrophobicContact CG2-CG2 4.14Å
187	I	96.3	Very high	96.4	Very high	14 Å²	14	57.5 Å²	57.5	7%	0.072	28%	0.282	C	S	.	.			trans	-105.9	174.2	172.2	59.9	169.6	0	0	0	111.3	T181 L183 D191 V192 L205 L229 G232	T181-I187 HydrophobicContact CG2-CD1 3.7Å; T181-I187 HydrophobicContact CG2-CG1 4.21Å; L183-I187 HydrophobicContact CD1-CG2 3.39Å; I187-D191 HydrophobicContact CB-CB 4.2Å; I187-D191 HydrophobicContact CD1-CB 4.5Å; I187-V192 HydrophobicContact CD1-CG2 3.59Å; I187-L205 HydrophobicContact CD1-CD2 3.39Å; I187-L229 HydrophobicContact CD1-CD1 4.43Å; I187-L229 HydrophobicContact CG1-CD1 4.26Å; I187-L229 HydrophobicContact CG1-CD2 4Å; I187-G232 VanDerWaalsContact CG1-O 3.31Å; I187-G232 WeakPolarHBondContact CG1-O 3.45Å; I187-G232 PolarHBondContact N-O 3.22Å; I187-G232 WeakPolarHBondContact O-CA 3.48Å
188	K	97.4	Very high	96.4	Very high	140 Å²	140	62.7 Å²	62.7	61%	0.609	30%	0.304	S	S	*	.			trans	-110.5	160.6	173	-63.5	-61.7	-174.1	179.4	0	110	R190 D191 L229	K188-R190 HydrophobicContact CB-CG 4.12Å; K188-R190 PolarHBondContact O-N 3.11Å; K188-D191 PolarHBondContact N-OD2 3.27Å; K188-D191 WeakPolarHBondContact O-CB 3.03Å; K188-D191 PolarHBondContact O-N 2.91Å; K188-L229 VanDerWaalsContact C-CD2 3.45Å
189	S	96.9	Very high	96.4	Very high	67 Å²	67	62.2 Å²	62.2	47%	0.469	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-55.9	-28.9	179.5	-47	0	0	0	0	112.9	D191 V192	S189-D191 PolarHBondContact O-N 2.96Å; S189-V192 PolarHBondContact O-N 3.04Å
190	R	96.8	Very high	96.5	Very high	188 Å²	188	64.9 Å²	64.9	71%	0.709	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-64.3	-19.2	175.3	75	-178.8	-179.1	-174.1	-1.2	114.1	K188 K206	K188-R190 HydrophobicContact CB-CG 4.12Å; K188-R190 PolarHBondContact O-N 3.11Å; R190-K206 WeakPolarHBondContact O-CD 3.43Å; R190-K206 WeakPolarHBondContact O-CE 3.16Å; R190-K206 PolarHBondContact O-NZ 3.28Å
191	D	97	Very high	96.6	Very high	58 Å²	58	63.8 Å²	63.8	31%	0.31	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-92.1	-6.4	-179.6	-49.6	-46.6	0	0	0	111.7	I187 K188 S189 K206	I187-D191 HydrophobicContact CB-CB 4.2Å; I187-D191 HydrophobicContact CD1-CB 4.5Å; K188-D191 PolarHBondContact N-OD2 3.27Å; K188-D191 WeakPolarHBondContact O-CB 3.03Å; K188-D191 PolarHBondContact O-N 2.91Å; S189-D191 PolarHBondContact O-N 2.96Å; D191-K206 PolarHBondContact O-N 2.82Å
192	V	97.9	Very high	96.7	Very high	6 Å²	6	66.8 Å²	66.8	4%	0.036	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	145	179.3	-178.6	0	0	0	0	109.5	I187 S189 V194 L205 K206 W227 L229 I235	I187-V192 HydrophobicContact CD1-CG2 3.59Å; S189-V192 PolarHBondContact O-N 3.04Å; V192-V194 HydrophobicContact CG1-CG2 3.9Å; V192-L205 HydrophobicContact CG2-CD2 4.4Å; V192-K206 WeakPolarHBondContact O-CE 3.45Å; V192-W227 HydrophobicContact CB-CH2 4.19Å; V192-W227 HydrophobicContact CB-CZ3 4.16Å; V192-W227 HydrophobicContact CG1-CH2 4.28Å; V192-W227 HydrophobicContact CG1-CZ3 3.97Å; V192-L229 HydrophobicContact CG2-CD1 4.39Å; V192-L229 HydrophobicContact CG2-CD2 4.32Å; V192-I235 HydrophobicContact CG1-CD1 3.62Å; V192-I235 HydrophobicContact CG1-CG1 4.03Å; V192-I235 HydrophobicContact CG1-CG2 4.4Å; V192-I235 HydrophobicContact CG2-CD1 4.11Å; V192-I235 HydrophobicContact CG2-CG1 4.18Å
193	Y	97	Very high	97	Very high	93 Å²	93	62.8 Å²	62.8	37%	0.365	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	124.5	169.8	178.1	-96.5	0	0	0	108.8	E195 K202 I203 G204	Y193-E195 HydrophobicContact CE1-CB 3.91Å; Y193-E195 PolarHBondContact OH-OE2 3.31Å; Y193-K202 HydrophobicContact CD1-CG 4.29Å; Y193-K202 HydrophobicContact CE1-CB 4.24Å; Y193-K202 HydrophobicContact CE1-CD 3.83Å; Y193-K202 HydrophobicContact CE1-CG 3.84Å; Y193-I203 CarbonylContact O-C 3.57Å; Y193-I203 WeakPolarHBondContact O-CA 3.45Å; Y193-G204 PolarHBondContact N-O 3.18Å; Y193-G204 PolarHBondContact O-N 3.14Å
194	V	97.7	Very high	97.1	Very high	28 Å²	28	62.4 Å²	62.4	17%	0.17	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	120.4	175.2	175.9	0	0	0	0	107.4	V192 I196 K202 I203 W227 I235	V192-V194 HydrophobicContact CG1-CG2 3.9Å; V194-I196 HydrophobicContact CG1-CD1 3.95Å; V194-I196 HydrophobicContact CG1-CG1 3.82Å; V194-K202 CarbonylContact C-O 3.47Å; V194-K202 WeakPolarHBondContact CA-O 3.39Å; V194-I203 HydrophobicContact CG1-CG1 4.2Å; V194-I203 HydrophobicContact CG2-CG1 4.32Å; V194-I203 HydrophobicContact CG2-CG2 4.01Å; V194-W227 HydrophobicContact CB-CD2 4.12Å; V194-W227 HydrophobicContact CB-CG 4.04Å; V194-W227 HydrophobicContact CG1-CB 4.2Å; V194-W227 HydrophobicContact CG1-CD2 4.5Å; V194-W227 HydrophobicContact CG1-CG 3.9Å; V194-W227 HydrophobicContact CG2-CB 4.41Å; V194-W227 HydrophobicContact CG2-CD2 3.74Å; V194-W227 HydrophobicContact CG2-CE3 3.98Å; V194-W227 HydrophobicContact CG2-CG 3.93Å; V194-I235 HydrophobicContact CG2-CG2 4.36Å
195	E	97.7	Very high	97.2	Very high	77 Å²	77	59 Å²	59	36%	0.36	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	124.1	170.8	-177.8	-173.6	176.8	0	0	107.9	Y193 I201 K202	Y193-E195 HydrophobicContact CE1-CB 3.91Å; Y193-E195 PolarHBondContact OH-OE2 3.31Å; E195-I201 CarbonylContact O-C 3.59Å; E195-I201 WeakPolarHBondContact O-CA 3.42Å; E195-K202 HydrophobicContact CB-CB 4.26Å; E195-K202 PolarHBondContact N-O 3.29Å; E195-K202 PolarHBondContact O-N 3.02Å
196	I	98.3	Very high	97.3	Very high	37 Å²	37	59.4 Å²	59.4	19%	0.19	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	115.5	177.3	-53.1	170.5	0	0	0	106.5	V194 I201 V220 C225 V237 L239	V194-I196 HydrophobicContact CG1-CD1 3.95Å; V194-I196 HydrophobicContact CG1-CG1 3.82Å; I196-I201 HydrophobicContact CG1-CG1 4.39Å; I196-V220 HydrophobicContact CG2-CG2 4.11Å; I196-C225 HydrophobicContact CD1-CB 3.96Å; I196-C225 HydrophobicContact CG2-CB 4.09Å; I196-V237 HydrophobicContact CD1-CG1 3.74Å; I196-L239 HydrophobicContact CD1-CD2 4.08Å; I196-L239 HydrophobicContact CG1-CD2 4.44Å; I196-L239 HydrophobicContact CG2-CD2 3.85Å
197	A	98.1	Very high	97.1	Very high	35 Å²	35	65.6 Å²	65.6	29%	0.289	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	168.3	173.4	0	0	0	0	0	109.4	K199 H200 T222	A197-K199 PolarHBondContact O-N 3.49Å; A197-H200 HydrophobicContact CB-CB 4.25Å; A197-H200 PolarHBondContact N-O 3.16Å; A197-H200 PolarHBondContact O-N 3.47Å; A197-H200 VanDerWaalsContact O-O 3.1Å; A197-T222 VanDerWaalsContact C-CG2 3.43Å
198	K	98	Very high	97	Very high	112 Å²	112	72.2 Å²	72.2	49%	0.487	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.7	-37.9	-172.7	-166	-175.9	-171.4	-145	0	113.9	E219 V220	K198-E219 WeakPolarHBondContact CE-OE1 3.37Å; K198-E219 WeakPolarHBondContact CE-OE2 3.48Å; K198-E219 HydrophobicContact CG-CB 4.23Å; K198-E219 HydrophobicContact CG-CG 4.29Å; K198-E219 IonicContact NZ-OE1 2.63Å; K198-E219 PolarHBondContact NZ-OE1 3.17Å; K198-E219 IonicContact NZ-OE2 2.78Å; K198-E219 PolarHBondContact NZ-OE2 3.26Å; K198-E219 CarbonylContact O-C 3.55Å; K198-E219 WeakPolarHBondContact O-CA 3.32Å; K198-V220 PolarHBondContact O-N 2.89Å
199	K	97.8	Very high	96.8	Very high	103 Å²	103	73.8 Å²	73.8	45%	0.448	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.5	26.8	179.6	-156.1	178.1	177.8	174.2	0	112.7	A197 N215 L216 E219	A197-K199 PolarHBondContact O-N 3.49Å; K199-N215 CarbonylContact O-C 3.55Å; K199-N215 VanDerWaalsContact O-CA 3.26Å; K199-N215 WeakPolarHBondContact O-CA 3.32Å; K199-L216 PolarHBondContact O-N 3.07Å; K199-E219 HydrophobicContact CB-CG 4.48Å; K199-E219 HydrophobicContact CD-CG 4.37Å; K199-E219 HydrophobicContact CG-CG 4.47Å
200	H	98.4	Very high	96.7	Very high	56 Å²	56	72.8 Å²	72.8	26%	0.259	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	145.1	-177.7	178.3	-86.4	0	0	0	110.4	A197 G214	A197-H200 HydrophobicContact CB-CB 4.25Å; A197-H200 PolarHBondContact N-O 3.16Å; A197-H200 PolarHBondContact O-N 3.47Å; A197-H200 VanDerWaalsContact O-O 3.1Å; H200-G214 WeakPolarHBondContact CA-O 3.28Å; H200-G214 VanDerWaalsContact CD2-C 3.44Å; H200-G214 PolarHBondContact CD2-O 2.95Å
201	I	98.2	Very high	96.6	Very high	0 Å²	0	66 Å²	66	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	145.9	177.8	-163.6	166.3	0	0	0	110.3	I177 E195 I196 I203 L212 S213 G214 L216 V237 L239 C252	I177-I201 HydrophobicContact CD1-CD1 4.04Å; E195-I201 CarbonylContact O-C 3.59Å; E195-I201 WeakPolarHBondContact O-CA 3.42Å; I196-I201 HydrophobicContact CG1-CG1 4.39Å; I201-I203 HydrophobicContact CD1-CD1 3.49Å; I201-I203 VanDerWaalsContact CD1-CD1 3.49Å; I201-I203 HydrophobicContact CD1-CG1 4.22Å; I201-I203 HydrophobicContact CG1-CD1 3.77Å; I201-I203 HydrophobicContact CG1-CG1 3.94Å; I201-L212 HydrophobicContact CG2-CD2 4.24Å; I201-L212 HydrophobicContact CG2-CG 4.17Å; I201-S213 VanDerWaalsContact O-CA 3.28Å; I201-S213 WeakPolarHBondContact O-CA 3.18Å; I201-G214 PolarHBondContact N-O 2.77Å; I201-G214 PolarHBondContact O-N 3.49Å; I201-L216 HydrophobicContact CB-CD1 4.45Å; I201-L216 HydrophobicContact CB-CD2 3.82Å; I201-L216 HydrophobicContact CB-CG 4.15Å; I201-L216 HydrophobicContact CD1-CD2 4.35Å; I201-L216 HydrophobicContact CG2-CD2 3.55Å; I201-L216 HydrophobicContact CG2-CG 4.19Å; I201-V237 HydrophobicContact CD1-CG1 4.39Å; I201-L239 HydrophobicContact CD1-CD1 3.99Å; I201-L239 HydrophobicContact CD1-CD2 3.99Å; I201-L239 HydrophobicContact CD1-CG 4.49Å; I201-C252 WeakPolarHBondContact CG2-SG 3.39Å
202	K	97.8	Very high	96.6	Very high	69 Å²	69	63.3 Å²	63.3	30%	0.3	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	114.1	172	-175.8	173.5	175.3	-176.2	0	110.1	Y193 V194 E195 P210 L212	Y193-K202 HydrophobicContact CD1-CG 4.29Å; Y193-K202 HydrophobicContact CE1-CB 4.24Å; Y193-K202 HydrophobicContact CE1-CD 3.83Å; Y193-K202 HydrophobicContact CE1-CG 3.84Å; V194-K202 CarbonylContact C-O 3.47Å; V194-K202 WeakPolarHBondContact CA-O 3.39Å; E195-K202 HydrophobicContact CB-CB 4.26Å; E195-K202 PolarHBondContact N-O 3.29Å; E195-K202 PolarHBondContact O-N 3.02Å; K202-P210 HydrophobicContact CD-CG 4.27Å; K202-P210 VanDerWaalsContact CE-CG 3.43Å; K202-P210 HydrophobicContact CG-CB 4.04Å; K202-P210 HydrophobicContact CG-CG 4.01Å; K202-L212 CarbonylContact C-O 3.56Å; K202-L212 VanDerWaalsContact CA-O 3.3Å; K202-L212 WeakPolarHBondContact CA-O 3.43Å
203	I	98	Very high	96.5	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	134.2	-176.6	-57.5	157.2	0	0	0	109.4	I179 Y193 V194 I201 P210 I211 L212 I235 V237	I179-I203 HydrophobicContact CD1-CB 3.95Å; I179-I203 HydrophobicContact CD1-CD1 3.93Å; I179-I203 HydrophobicContact CD1-CG2 3.55Å; Y193-I203 CarbonylContact O-C 3.57Å; Y193-I203 WeakPolarHBondContact O-CA 3.45Å; V194-I203 HydrophobicContact CG1-CG1 4.2Å; V194-I203 HydrophobicContact CG2-CG1 4.32Å; V194-I203 HydrophobicContact CG2-CG2 4.01Å; I201-I203 HydrophobicContact CD1-CD1 3.49Å; I201-I203 VanDerWaalsContact CD1-CD1 3.49Å; I201-I203 HydrophobicContact CD1-CG1 4.22Å; I201-I203 HydrophobicContact CG1-CD1 3.77Å; I201-I203 HydrophobicContact CG1-CG1 3.94Å; I203-P210 CarbonylContact O-C 3.59Å; I203-I211 PolarHBondContact O-N 2.89Å; I203-L212 HydrophobicContact CD1-CD2 4.27Å; I203-L212 PolarHBondContact N-O 3.12Å; I203-L212 PolarHBondContact O-N 3.38Å; I203-L212 VanDerWaalsContact O-N 3.15Å; I203-I235 HydrophobicContact CG2-CD1 4.31Å; I203-I235 HydrophobicContact CG2-CG2 4.21Å; I203-V237 HydrophobicContact CD1-CB 4.23Å; I203-V237 HydrophobicContact CD1-CG1 4.35Å; I203-V237 HydrophobicContact CD1-CG2 3.62Å; I203-V237 HydrophobicContact CG1-CG2 4.31Å
204	G	96.4	Very high	96.5	Very high	3 Å²	3	62.4 Å²	62.4	3%	0.031	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.1	-169.6	173.9	0	0	0	0	0	113.3	Y193	Y193-G204 PolarHBondContact N-O 3.18Å; Y193-G204 PolarHBondContact O-N 3.14Å
205	L	96.3	Very high	96.5	Very high	15 Å²	15	65.1 Å²	65.1	8%	0.079	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	140.9	172.1	-59.2	178	0	0	0	109.2	T181 L183 I187 V192 N207 R208	T181-L205 HydrophobicContact CG2-CD2 4.46Å; L183-L205 HydrophobicContact CD1-CD1 3.83Å; L183-L205 HydrophobicContact CD2-CD1 4.4Å; L183-L205 HydrophobicContact CG-CD1 4.23Å; I187-L205 HydrophobicContact CD1-CD2 3.39Å; V192-L205 HydrophobicContact CG2-CD2 4.4Å; L205-N207 PolarHBondContact O-N 3Å; L205-R208 HydrophobicContact CB-CB 4.3Å; L205-R208 HydrophobicContact CB-CG 4.21Å; L205-R208 PolarHBondContact O-N 2.92Å
206	K	95	Very high	96.6	Very high	103 Å²	103	61.5 Å²	61.5	45%	0.448	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	141.7	175.7	-70.4	-171	-175.1	172.2	0	110.2	R190 D191 V192 R208	R190-K206 WeakPolarHBondContact O-CD 3.43Å; R190-K206 WeakPolarHBondContact O-CE 3.16Å; R190-K206 PolarHBondContact O-NZ 3.28Å; D191-K206 PolarHBondContact O-N 2.82Å; V192-K206 WeakPolarHBondContact O-CE 3.45Å; K206-R208 PolarHBondContact O-N 3.03Å
207	N	91.9	Very high	96.6	Very high	173 Å²	173	63.1 Å²	63.1	93%	0.925	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.1	23.9	-178.6	-45	-43.3	0	0	0	114.2	L205	L205-N207 PolarHBondContact O-N 3Å
208	R	93.4	Very high	96.5	Very high	153 Å²	153	63.5 Å²	63.5	58%	0.577	31%	0.309	S	S	*	.	S	Bend	trans	-131.4	169.1	170.9	-57.8	-166.6	-171.4	-167.5	0.4	110.1	L205 K206	L205-R208 HydrophobicContact CB-CB 4.3Å; L205-R208 HydrophobicContact CB-CG 4.21Å; L205-R208 PolarHBondContact O-N 2.92Å; K206-R208 PolarHBondContact O-N 3.03Å
209	E	93.9	Very high	96.6	Very high	173 Å²	173	61 Å²	61	81%	0.808	30%	0.299	S	S	*	.			trans	-60.1	137.9	169.4	-166.8	174.1	-176.5	0	0	110.1
210	P	95.2	Very high	96.6	Very high	47 Å²	47	56.2 Å²	56.2	31%	0.305	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	140.5	172.8	-22.5	33.3	0	0	0	111.1	K202 I203	K202-P210 HydrophobicContact CD-CG 4.27Å; K202-P210 VanDerWaalsContact CE-CG 3.43Å; K202-P210 HydrophobicContact CG-CB 4.04Å; K202-P210 HydrophobicContact CG-CG 4.01Å; I203-P210 CarbonylContact O-C 3.59Å
211	I	94.9	Very high	96.6	Very high	45 Å²	45	56.9 Å²	56.9	23%	0.231	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	-36	176.2	-60.5	170.4	0	0	0	110.4	N165 I179 I203	N165-I211 HydrophobicContact CB-CG2 3.87Å; I179-I211 HydrophobicContact CG2-CB 4.24Å; I179-I211 HydrophobicContact CG2-CD1 3.68Å; I179-I211 HydrophobicContact CG2-CG2 3.66Å; I203-I211 PolarHBondContact O-N 2.89Å
212	L	96.1	Very high	96.6	Very high	2 Å²	2	59.7 Å²	59.7	1%	0.01	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	123.4	175.9	175.3	61.8	0	0	0	107.8	Y166 I177 I201 K202 I203 I251 C252	Y166-L212 HydrophobicContact CE1-CD1 4.06Å; Y166-L212 HydrophobicContact CE2-CD2 4.39Å; I177-L212 HydrophobicContact CD1-CD2 4.08Å; I177-L212 HydrophobicContact CG2-CD2 4.46Å; I201-L212 HydrophobicContact CG2-CD2 4.24Å; I201-L212 HydrophobicContact CG2-CG 4.17Å; K202-L212 CarbonylContact C-O 3.56Å; K202-L212 VanDerWaalsContact CA-O 3.3Å; K202-L212 WeakPolarHBondContact CA-O 3.43Å; I203-L212 HydrophobicContact CD1-CD2 4.27Å; I203-L212 PolarHBondContact N-O 3.12Å; I203-L212 PolarHBondContact O-N 3.38Å; I203-L212 VanDerWaalsContact O-N 3.15Å; L212-I251 HydrophobicContact CD2-CG2 3.8Å; L212-C252 HydrophobicContact CD1-CB 4.2Å
213	S	96.7	Very high	96.5	Very high	64 Å²	64	65 Å²	65	45%	0.448	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	124.6	177.4	-170.1	0	0	0	0	110.4	I201	I201-S213 VanDerWaalsContact O-CA 3.28Å; I201-S213 WeakPolarHBondContact O-CA 3.18Å
214	G	97.1	Very high	96.5	Very high	15 Å²	15	69.3 Å²	69.3	16%	0.155	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	167.4	176.9	177.6	0	0	0	0	0	113.6	H200 I201	H200-G214 WeakPolarHBondContact CA-O 3.28Å; H200-G214 VanDerWaalsContact CD2-C 3.44Å; H200-G214 PolarHBondContact CD2-O 2.95Å; I201-G214 PolarHBondContact N-O 2.77Å; I201-G214 PolarHBondContact O-N 3.49Å
215	N	98.3	Very high	96.6	Very high	86 Å²	86	70 Å²	70	46%	0.46	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	133.9	169.9	-63.6	-35.5	0	0	0	109	K199 C252 D253	K199-N215 CarbonylContact O-C 3.55Å; K199-N215 VanDerWaalsContact O-CA 3.26Å; K199-N215 WeakPolarHBondContact O-CA 3.32Å; N215-C252 CarbonylContact O-C 3.51Å; N215-C252 WeakPolarHBondContact O-CA 3.45Å; N215-C252 WeakPolarHBondContact O-CB 3.37Å; N215-D253 WeakPolarHBondContact CB-OD2 3.43Å; N215-D253 PolarHBondContact O-N 3.03Å
216	L	98.5	Very high	96.7	Very high	0 Å²	0	73.6 Å²	73.6	0%	0	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-70.6	151.2	175.2	-69	169.3	0	0	0	110.4	K199 I201 N218 V220 L239 W248 I251	K199-L216 PolarHBondContact O-N 3.07Å; I201-L216 HydrophobicContact CB-CD1 4.45Å; I201-L216 HydrophobicContact CB-CD2 3.82Å; I201-L216 HydrophobicContact CB-CG 4.15Å; I201-L216 HydrophobicContact CD1-CD2 4.35Å; I201-L216 HydrophobicContact CG2-CD2 3.55Å; I201-L216 HydrophobicContact CG2-CG 4.19Å; L216-N218 WeakPolarHBondContact CB-O 3.26Å; L216-N218 PolarHBondContact O-N 3.34Å; L216-V220 HydrophobicContact CD1-CB 4.45Å; L216-V220 HydrophobicContact CD1-CG1 3.86Å; L216-V220 HydrophobicContact CD1-CG2 3.71Å; L216-L239 HydrophobicContact CD2-CD1 3.97Å; L216-W248 HydrophobicContact CB-CH2 4.01Å; L216-W248 HydrophobicContact CB-CZ3 4.25Å; L216-W248 HydrophobicContact CD2-CH2 4.37Å; L216-W248 HydrophobicContact CD2-CZ3 4.09Å; L216-I251 CarbonylContact C-O 3.48Å; L216-I251 WeakPolarHBondContact CA-O 3.37Å; L216-I251 HydrophobicContact CD2-CG2 4.11Å
217	Y	97.8	Very high	96.9	Very high	71 Å²	71	73.3 Å²	73.3	28%	0.278	37%	0.366	S	S	.	.	S	Bend	trans	-51.1	-44.9	175.8	178.8	-88.2	0	0	0	112	E246 W248 S249 R250 I251	Y217-E246 HydrophobicContact CE1-CG 4.43Å; Y217-W248 HydrophobicContact CD1-CB 3.97Å; Y217-W248 AromaticContact CD1-CD1 3.52Å; Y217-W248 AromaticContact CD1-CD2 3.86Å; Y217-W248 HydrophobicContact CD1-CD2 3.86Å; Y217-W248 AromaticContact CD1-CG 3.52Å; Y217-W248 HydrophobicContact CD1-CG 3.52Å; Y217-W248 AromaticContact CD1-NE1 3.83Å; Y217-W248 HydrophobicContact CE1-CB 4.47Å; Y217-W248 AromaticContact CE1-CD1 3.96Å; Y217-W248 HydrophobicContact CE1-CG 4.23Å; Y217-W248 HydrophobicContact CG-CB 4.19Å; Y217-W248 HydrophobicContact CG-CD2 4.17Å; Y217-W248 HydrophobicContact CG-CG 4.04Å; Y217-S249 WeakPolarHBondContact CE2-OG 3.47Å; Y217-R250 VanDerWaalsContact CB-O 3.3Å; Y217-R250 WeakPolarHBondContact CB-O 3.15Å; Y217-R250 HydrophobicContact CD2-CG 3.85Å; Y217-I251 PolarHBondContact N-O 2.97Å
218	N	97.6	Very high	97.2	Very high	43 Å²	43	67.8 Å²	67.8	23%	0.23	34%	0.341	C	S	.	.	S	Bend	trans	-145	179.8	171.8	-150.3	-12	0	0	0	112.4	L216 E246 W248	L216-N218 WeakPolarHBondContact CB-O 3.26Å; L216-N218 PolarHBondContact O-N 3.34Å; N218-E246 PolarHBondContact ND2-OE2 3.19Å; N218-W248 HydrophobicContact CB-CZ2 3.91Å; N218-W248 WeakPolarHBondContact O-CH2 3.47Å; N218-W248 WeakPolarHBondContact O-CZ2 3.32Å
219	E	98.2	Very high	97.4	Very high	61 Å²	61	62 Å²	62	29%	0.285	32%	0.321	S	S	.	.			trans	-70.9	139.1	-176.5	-60.9	-170.3	149.8	0	0	112.9	K198 K199 T242	K198-E219 WeakPolarHBondContact CE-OE1 3.37Å; K198-E219 WeakPolarHBondContact CE-OE2 3.48Å; K198-E219 HydrophobicContact CG-CB 4.23Å; K198-E219 HydrophobicContact CG-CG 4.29Å; K198-E219 IonicContact NZ-OE1 2.63Å; K198-E219 PolarHBondContact NZ-OE1 3.17Å; K198-E219 IonicContact NZ-OE2 2.78Å; K198-E219 PolarHBondContact NZ-OE2 3.26Å; K198-E219 CarbonylContact O-C 3.55Å; K198-E219 WeakPolarHBondContact O-CA 3.32Å; K199-E219 HydrophobicContact CB-CG 4.48Å; K199-E219 HydrophobicContact CD-CG 4.37Å; K199-E219 HydrophobicContact CG-CG 4.47Å; E219-T242 VanDerWaalsContact O-CB 3.28Å; E219-T242 WeakPolarHBondContact O-CB 3.47Å; E219-T242 PolarHBondContact O-N 3.46Å; E219-T242 PolarHBondContact O-OG1 3.32Å; E219-T242 VanDerWaalsContact O-OG1 3.07Å
220	V	98.6	Very high	97.5	Very high	2 Å²	2	56.4 Å²	56.4	1%	0.012	30%	0.299	C	S	.	.	B	Isolated β-bridge	trans	-114.5	152.4	174.7	-61	0	0	0	0	110.8	I196 K198 L216 T222 L239 E240 W248	I196-V220 HydrophobicContact CG2-CG2 4.11Å; K198-V220 PolarHBondContact O-N 2.89Å; L216-V220 HydrophobicContact CD1-CB 4.45Å; L216-V220 HydrophobicContact CD1-CG1 3.86Å; L216-V220 HydrophobicContact CD1-CG2 3.71Å; V220-T222 HydrophobicContact CG2-CG2 4.47Å; V220-T222 PolarHBondContact O-N 3.47Å; V220-L239 HydrophobicContact CG1-CB 4.06Å; V220-E240 CarbonylContact C-O 3.49Å; V220-E240 WeakPolarHBondContact CA-O 3.28Å; V220-E240 VanDerWaalsContact CB-O 3.28Å; V220-E240 WeakPolarHBondContact CB-O 3.14Å; V220-W248 HydrophobicContact CG1-CH2 3.71Å; V220-W248 HydrophobicContact CG1-CZ2 4.11Å
221	K	98.3	Very high	97.4	Very high	69 Å²	69	60 Å²	60	30%	0.3	32%	0.316	S	S	.	.			trans	-83.4	94.5	171.1	-63	-173.1	-175.4	176.3	0	109.2	E223 E224 C225 E240	K221-E223 PolarHBondContact O-N 3.39Å; K221-E223 VanDerWaalsContact O-N 3.1Å; K221-E224 HydrophobicContact CB-CB 4.22Å; K221-E224 HydrophobicContact CB-CG 4.48Å; K221-E224 HydrophobicContact CD-CG 4.46Å; K221-E224 WeakPolarHBondContact CD-OE1 3.49Å; K221-E224 IonicContact NZ-OE1 2.77Å; K221-E224 PolarHBondContact NZ-OE1 2.62Å; K221-E224 IonicContact NZ-OE2 2.71Å; K221-E224 PolarHBondContact O-N 2.93Å; K221-C225 PolarHBondContact O-N 3.24Å; K221-C225 PolarHBondContact O-SG 3.44Å; K221-E240 HydrophobicContact CB-CB 4.29Å; K221-E240 HydrophobicContact CB-CG 4.18Å; K221-E240 HydrophobicContact CD-CG 4.04Å; K221-E240 HydrophobicContact CG-CG 4.4Å; K221-E240 PolarHBondContact N-O 2.82Å
222	T	97.7	Very high	97.5	Very high	59 Å²	59	58.3 Å²	58.3	36%	0.362	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-54.5	-34	-173.9	51.2	0	0	0	0	114.1	A197 V220 E224 C225	A197-T222 VanDerWaalsContact C-CG2 3.43Å; V220-T222 HydrophobicContact CG2-CG2 4.47Å; V220-T222 PolarHBondContact O-N 3.47Å; T222-E224 VanDerWaalsContact C-N 3.29Å; T222-E224 PolarHBondContact O-N 3.3Å; T222-C225 PolarHBondContact O-N 3.34Å
223	E	97.4	Very high	97.5	Very high	181 Å²	181	58.7 Å²	58.7	85%	0.846	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-70.7	-21.9	179.2	-56.2	-66.3	176.4	0	0	113.6	K221	K221-E223 PolarHBondContact O-N 3.39Å; K221-E223 VanDerWaalsContact O-N 3.1Å
224	E	98	Very high	97.5	Very high	91 Å²	91	56.6 Å²	56.6	43%	0.425	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-100	-4.9	177.7	-65.8	178.4	-133.9	0	0	111.4	K221 T222 E240	K221-E224 HydrophobicContact CB-CB 4.22Å; K221-E224 HydrophobicContact CB-CG 4.48Å; K221-E224 HydrophobicContact CD-CG 4.46Å; K221-E224 WeakPolarHBondContact CD-OE1 3.49Å; K221-E224 IonicContact NZ-OE1 2.77Å; K221-E224 PolarHBondContact NZ-OE1 2.62Å; K221-E224 IonicContact NZ-OE2 2.71Å; K221-E224 PolarHBondContact O-N 2.93Å; T222-E224 VanDerWaalsContact C-N 3.29Å; T222-E224 PolarHBondContact O-N 3.3Å; E224-E240 HydrophobicContact CB-CB 3.61Å; E224-E240 HydrophobicContact CB-CG 3.76Å; E224-E240 HydrophobicContact CG-CG 4.48Å; E224-E240 WeakPolarHBondContact OE2-CG 3.37Å
225	C	98.2	Very high	97.5	Very high	16 Å²	16	55.9 Å²	55.9	11%	0.108	29%	0.288	C	S	.	.			trans	-81.5	137.2	175.8	-60.3	0	0	0	0	110.8	I196 K221 T222 H238 L239	I196-C225 HydrophobicContact CD1-CB 3.96Å; I196-C225 HydrophobicContact CG2-CB 4.09Å; K221-C225 PolarHBondContact O-N 3.24Å; K221-C225 PolarHBondContact O-SG 3.44Å; T222-C225 PolarHBondContact O-N 3.34Å; C225-H238 VanDerWaalsContact CA-O 3.27Å; C225-H238 WeakPolarHBondContact CA-O 3.39Å; C225-H238 WeakPolarHBondContact CB-O 3.45Å; C225-L239 HydrophobicContact CB-CD2 4.36Å
226	V	98.3	Very high	97.5	Very high	92 Å²	92	54.9 Å²	54.9	56%	0.558	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.2	153.1	179.9	-65.6	0	0	0	0	111.3	H238	V226-H238 HydrophobicContact CG2-CB 3.69Å; V226-H238 PolarHBondContact N-O 3.05Å; V226-H238 PolarHBondContact O-N 3.3Å
227	W	98.3	Very high	97.5	Very high	97 Å²	97	54.9 Å²	54.9	37%	0.367	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	153.4	171.2	75.1	-86.9	0	0	0	111.4	V192 V194 L229 I235 L236 V237	V192-W227 HydrophobicContact CB-CH2 4.19Å; V192-W227 HydrophobicContact CB-CZ3 4.16Å; V192-W227 HydrophobicContact CG1-CH2 4.28Å; V192-W227 HydrophobicContact CG1-CZ3 3.97Å; V194-W227 HydrophobicContact CB-CD2 4.12Å; V194-W227 HydrophobicContact CB-CG 4.04Å; V194-W227 HydrophobicContact CG1-CB 4.2Å; V194-W227 HydrophobicContact CG1-CD2 4.5Å; V194-W227 HydrophobicContact CG1-CG 3.9Å; V194-W227 HydrophobicContact CG2-CB 4.41Å; V194-W227 HydrophobicContact CG2-CD2 3.74Å; V194-W227 HydrophobicContact CG2-CE3 3.98Å; V194-W227 HydrophobicContact CG2-CG 3.93Å; W227-L229 HydrophobicContact CZ3-CB 4.4Å; W227-I235 HydrophobicContact CE3-CG2 4.37Å; W227-L236 CarbonylContact C-O 3.57Å; W227-L236 WeakPolarHBondContact CA-O 3.32Å; W227-L236 WeakPolarHBondContact CB-O 3.36Å; W227-V237 HydrophobicContact CB-CB 4.47Å; W227-V237 HydrophobicContact CB-CG1 4.47Å; W227-V237 HydrophobicContact CB-CG2 3.95Å
228	S	98.1	Very high	97.5	Very high	56 Å²	56	53.7 Å²	53.7	39%	0.392	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	160.3	176.3	67.2	0	0	0	0	111.7	I235 L236	S228-I235 WeakPolarHBondContact O-CA 3.47Å; S228-L236 PolarHBondContact N-O 2.83Å; S228-L236 PolarHBondContact O-N 3.31Å
229	L	98.1	Very high	97.6	Very high	31 Å²	31	51.6 Å²	51.6	16%	0.162	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	106.1	174	176.3	67.5	0	0	0	108.6	T181 I187 K188 V192 W227 T234 I235	T181-L229 HydrophobicContact CG2-CD1 4.45Å; I187-L229 HydrophobicContact CD1-CD1 4.43Å; I187-L229 HydrophobicContact CG1-CD1 4.26Å; I187-L229 HydrophobicContact CG1-CD2 4Å; K188-L229 VanDerWaalsContact C-CD2 3.45Å; V192-L229 HydrophobicContact CG2-CD1 4.39Å; V192-L229 HydrophobicContact CG2-CD2 4.32Å; W227-L229 HydrophobicContact CZ3-CB 4.4Å; L229-T234 CarbonylContact C-O 3.42Å; L229-T234 WeakPolarHBondContact CA-O 2.97Å; L229-I235 HydrophobicContact CD1-CG1 4.07Å
230	V	96	Very high	97.6	Very high	57 Å²	57	49.5 Å²	49.5	35%	0.345	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	128.1	-178.5	-177.4	0	0	0	0	109.7	G232 I233 T234 L236	V230-G232 PolarHBondContact O-N 2.87Å; V230-I233 PolarHBondContact O-N 3.2Å; V230-T234 PolarHBondContact N-O 2.91Å; V230-T234 PolarHBondContact O-N 3.23Å; V230-T234 VanDerWaalsContact O-N 3.13Å; V230-L236 HydrophobicContact CG2-CD1 3.51Å; V230-L236 HydrophobicContact CG2-CG 3.95Å
231	D	93.7	Very high	97.6	Very high	122 Å²	122	49.4 Å²	49.4	65%	0.652	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	13.8	180	-61.5	-39.8	0	0	0	115.7	T186 I233	T186-D231 WeakPolarHBondContact CG2-O 3.33Å; D231-I233 VanDerWaalsContact C-N 3.26Å; D231-I233 HydrophobicContact CB-CD1 4.47Å; D231-I233 HydrophobicContact CB-CG1 3.96Å; D231-I233 PolarHBondContact O-N 3.46Å
232	G	95.9	Very high	97.5	Very high	9 Å²	9	49.1 Å²	49.1	9%	0.093	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.4	13.1	-173.7	0	0	0	0	0	114.5	T186 I187 V230	T186-G232 CarbonylContact C-O 3.5Å; T186-G232 WeakPolarHBondContact CA-O 3.38Å; I187-G232 VanDerWaalsContact CG1-O 3.31Å; I187-G232 WeakPolarHBondContact CG1-O 3.45Å; I187-G232 PolarHBondContact N-O 3.22Å; I187-G232 WeakPolarHBondContact O-CA 3.48Å; V230-G232 PolarHBondContact O-N 2.87Å
233	I	96.1	Very high	97.4	Very high	10 Å²	10	49.6 Å²	49.6	5%	0.051	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.3	-14.1	-173.5	55.4	160.5	0	0	0	114.6	A88 I89 N92 T181 T186 V230 D231	A88-I233 HydrophobicContact CB-CD1 3.53Å; A88-I233 VanDerWaalsContact O-CD1 3.28Å; A88-I233 WeakPolarHBondContact O-CD1 3.43Å; I89-I233 HydrophobicContact CG1-CG2 4.24Å; N92-I233 HydrophobicContact CB-CB 4.22Å; N92-I233 HydrophobicContact CB-CD1 4.18Å; N92-I233 PolarHBondContact OD1-O 3.2Å; N92-I233 VanDerWaalsContact OD1-O 3.09Å; T181-I233 WeakPolarHBondContact CG2-O 3.48Å; T181-I233 PolarHBondContact N-O 3.4Å; T181-I233 PolarHBondContact OG1-O 2.99Å; T186-I233 HydrophobicContact CG2-CG2 4.14Å; V230-I233 PolarHBondContact O-N 3.2Å; D231-I233 VanDerWaalsContact C-N 3.26Å; D231-I233 HydrophobicContact CB-CD1 4.47Å; D231-I233 HydrophobicContact CB-CG1 3.96Å; D231-I233 PolarHBondContact O-N 3.46Å
234	T	96.4	Very high	97.2	Very high	21 Å²	21	45.4 Å²	45.4	13%	0.129	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	123.3	-179.8	-60.2	0	0	0	0	109.8	K178 I179 L229 V230 L236	K178-T234 HydrophobicContact CD-CG2 4.36Å; K178-T234 HydrophobicContact CG-CG2 3.6Å; I179-T234 WeakPolarHBondContact O-CA 3.42Å; L229-T234 CarbonylContact C-O 3.42Å; L229-T234 WeakPolarHBondContact CA-O 2.97Å; V230-T234 PolarHBondContact N-O 2.91Å; V230-T234 PolarHBondContact O-N 3.23Å; V230-T234 VanDerWaalsContact O-N 3.13Å; T234-L236 HydrophobicContact CG2-CD2 3.89Å; T234-L236 HydrophobicContact CG2-CG 4.41Å
235	I	98.1	Very high	96.8	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	122.4	172.4	-54.1	161.7	0	0	0	106.8	I179 T181 V192 V194 I203 W227 S228 L229 V237	I179-I235 HydrophobicContact CB-CB 4.24Å; I179-I235 PolarHBondContact N-O 2.92Å; I179-I235 PolarHBondContact O-N 3.21Å; T181-I235 HydrophobicContact CG2-CG1 4.37Å; V192-I235 HydrophobicContact CG1-CD1 3.62Å; V192-I235 HydrophobicContact CG1-CG1 4.03Å; V192-I235 HydrophobicContact CG1-CG2 4.4Å; V192-I235 HydrophobicContact CG2-CD1 4.11Å; V192-I235 HydrophobicContact CG2-CG1 4.18Å; V194-I235 HydrophobicContact CG2-CG2 4.36Å; I203-I235 HydrophobicContact CG2-CD1 4.31Å; I203-I235 HydrophobicContact CG2-CG2 4.21Å; W227-I235 HydrophobicContact CE3-CG2 4.37Å; S228-I235 WeakPolarHBondContact O-CA 3.47Å; L229-I235 HydrophobicContact CD1-CG1 4.07Å; I235-V237 HydrophobicContact CG2-CG2 4.02Å
236	L	98.3	Very high	96.5	Very high	64 Å²	64	50.2 Å²	50.2	34%	0.335	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	132.7	171.8	-62.4	-177.1	0	0	0	108.7	I177 K178 W227 S228 V230 T234	I177-L236 CarbonylContact O-C 3.59Å; I177-L236 WeakPolarHBondContact O-CA 3.14Å; K178-L236 HydrophobicContact CB-CD2 3.79Å; K178-L236 HydrophobicContact CD-CD2 4.29Å; K178-L236 HydrophobicContact CG-CD2 3.68Å; W227-L236 CarbonylContact C-O 3.57Å; W227-L236 WeakPolarHBondContact CA-O 3.32Å; W227-L236 WeakPolarHBondContact CB-O 3.36Å; S228-L236 PolarHBondContact N-O 2.83Å; S228-L236 PolarHBondContact O-N 3.31Å; V230-L236 HydrophobicContact CG2-CD1 3.51Å; V230-L236 HydrophobicContact CG2-CG 3.95Å; T234-L236 HydrophobicContact CG2-CD2 3.89Å; T234-L236 HydrophobicContact CG2-CG 4.41Å
237	V	98.6	Very high	96.4	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.006	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	122.6	177	-175.3	0	0	0	0	108.9	D176 I177 I196 I201 I203 W227 I235 L239	D176-V237 CarbonylContact C-O 3.59Å; D176-V237 WeakPolarHBondContact CA-O 3.24Å; I177-V237 HydrophobicContact CB-CB 4.28Å; I177-V237 PolarHBondContact N-O 2.97Å; I177-V237 PolarHBondContact O-N 3.38Å; I196-V237 HydrophobicContact CD1-CG1 3.74Å; I201-V237 HydrophobicContact CD1-CG1 4.39Å; I203-V237 HydrophobicContact CD1-CB 4.23Å; I203-V237 HydrophobicContact CD1-CG1 4.35Å; I203-V237 HydrophobicContact CD1-CG2 3.62Å; I203-V237 HydrophobicContact CG1-CG2 4.31Å; W227-V237 HydrophobicContact CB-CB 4.47Å; W227-V237 HydrophobicContact CB-CG1 4.47Å; W227-V237 HydrophobicContact CB-CG2 3.95Å; I235-V237 HydrophobicContact CG2-CG2 4.02Å; V237-L239 HydrophobicContact CG1-CD2 3.9Å; V237-L239 HydrophobicContact CG1-CG 4.36Å
238	H	98.6	Very high	96.3	Very high	45 Å²	45	44 Å²	44	21%	0.208	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	128.2	173.8	-179.8	78.4	0	0	0	109.1	D174 D176 C225 V226 E240	D174-H238 VanDerWaalsContact CB-CE1 3.48Å; D174-H238 WeakPolarHBondContact CB-CE1 3.43Å; D176-H238 WeakPolarHBondContact OD1-CB 3.38Å; D176-H238 IonicContact OD1-CE1 3.86Å; D176-H238 IonicContact OD1-CG 3.75Å; D176-H238 IonicContact OD1-ND1 3.05Å; D176-H238 PolarHBondContact OD1-ND1 2.81Å; D176-H238 IonicContact OD2-ND1 2.67Å; C225-H238 VanDerWaalsContact CA-O 3.27Å; C225-H238 WeakPolarHBondContact CA-O 3.39Å; C225-H238 WeakPolarHBondContact CB-O 3.45Å; V226-H238 HydrophobicContact CG2-CB 3.69Å; V226-H238 PolarHBondContact N-O 3.05Å; V226-H238 PolarHBondContact O-N 3.3Å; H238-E240 IonicContact NE2-OE2 3.85Å
239	L	98.6	Very high	96.2	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	117.7	178.2	-57.8	179.5	0	0	0	109.7	D174 V175 I177 I196 I201 L216 V220 C225 V237	D174-L239 CarbonylContact C-O 3.45Å; D174-L239 VanDerWaalsContact CA-O 3.25Å; D174-L239 WeakPolarHBondContact CA-O 3.24Å; D174-L239 WeakPolarHBondContact CB-O 3.44Å; V175-L239 HydrophobicContact CB-CB 4.25Å; V175-L239 PolarHBondContact N-O 3.14Å; V175-L239 PolarHBondContact O-N 3.09Å; I177-L239 HydrophobicContact CD1-CD1 3.74Å; I177-L239 HydrophobicContact CD1-CG 4.37Å; I196-L239 HydrophobicContact CD1-CD2 4.08Å; I196-L239 HydrophobicContact CG1-CD2 4.44Å; I196-L239 HydrophobicContact CG2-CD2 3.85Å; I201-L239 HydrophobicContact CD1-CD1 3.99Å; I201-L239 HydrophobicContact CD1-CD2 3.99Å; I201-L239 HydrophobicContact CD1-CG 4.49Å; L216-L239 HydrophobicContact CD2-CD1 3.97Å; V220-L239 HydrophobicContact CG1-CB 4.06Å; C225-L239 HydrophobicContact CB-CD2 4.36Å; V237-L239 HydrophobicContact CG1-CD2 3.9Å; V237-L239 HydrophobicContact CG1-CG 4.36Å
240	E	98.4	Very high	96.2	Very high	16 Å²	16	42.9 Å²	42.9	8%	0.075	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	119.6	173.6	-178.5	71.3	-170.3	0	0	109.8	V220 K221 E224 H238 K244	V220-E240 CarbonylContact C-O 3.49Å; V220-E240 WeakPolarHBondContact CA-O 3.28Å; V220-E240 VanDerWaalsContact CB-O 3.28Å; V220-E240 WeakPolarHBondContact CB-O 3.14Å; K221-E240 HydrophobicContact CB-CB 4.29Å; K221-E240 HydrophobicContact CB-CG 4.18Å; K221-E240 HydrophobicContact CD-CG 4.04Å; K221-E240 HydrophobicContact CG-CG 4.4Å; K221-E240 PolarHBondContact N-O 2.82Å; E224-E240 HydrophobicContact CB-CB 3.61Å; E224-E240 HydrophobicContact CB-CG 3.76Å; E224-E240 HydrophobicContact CG-CG 4.48Å; E224-E240 WeakPolarHBondContact OE2-CG 3.37Å; H238-E240 IonicContact NE2-OE2 3.85Å; E240-K244 WeakPolarHBondContact OE1-CE 3.11Å; E240-K244 IonicContact OE1-NZ 2.85Å; E240-K244 PolarHBondContact OE1-NZ 3.13Å
241	K	98.3	Very high	96.3	Very high	1 Å²	1	40.2 Å²	40.2	0%	0.004	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-71.1	142	179.9	-59.1	169.3	-179	175.1	0	110.2	T171 L172 S173 D174 V175 N243 E246 W248	T171-K241 PolarHBondContact O-NZ 2.85Å; L172-K241 WeakPolarHBondContact O-CD 3.33Å; S173-K241 WeakPolarHBondContact O-CB 3.42Å; S173-K241 WeakPolarHBondContact O-CG 3.45Å; S173-K241 PolarHBondContact O-N 2.97Å; D174-K241 WeakPolarHBondContact O-CE 3.48Å; V175-K241 HydrophobicContact CG2-CG 4.48Å; K241-N243 VanDerWaalsContact CB-O 3.29Å; K241-N243 WeakPolarHBondContact CB-O 3.35Å; K241-E246 PolarHBondContact NZ-O 3.03Å; K241-W248 HydrophobicContact CG-CZ2 4.17Å
242	T	97.5	Very high	96.4	Very high	63 Å²	63	34.5 Å²	34.5	39%	0.387	17%	0.17	S	C	.	.	S	Bend	trans	-69.6	-42	168	-57.9	0	0	0	0	110.2	E219	E219-T242 VanDerWaalsContact O-CB 3.28Å; E219-T242 WeakPolarHBondContact O-CB 3.47Å; E219-T242 PolarHBondContact O-N 3.46Å; E219-T242 PolarHBondContact O-OG1 3.32Å; E219-T242 VanDerWaalsContact O-OG1 3.07Å
243	N	95.3	Very high	96.4	Very high	69 Å²	69	38.5 Å²	38.5	37%	0.369	19%	0.189	S	C	.	.	S	Bend	trans	-91.2	103.6	171.8	-175.2	4	0	0	0	110.2	K241 M245 E246	K241-N243 VanDerWaalsContact CB-O 3.29Å; K241-N243 WeakPolarHBondContact CB-O 3.35Å; N243-M245 PolarHBondContact O-N 3.15Å; N243-M245 PolarHBondContact OD1-N 3.46Å; N243-E246 HydrophobicContact CB-CB 4.41Å; N243-E246 WeakPolarHBondContact ND2-CB 3.38Å; N243-E246 PolarHBondContact ND2-OE2 2.78Å
244	K	91.9	Very high	96.2	Very high	92 Å²	92	41.6 Å²	41.6	40%	0.4	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	14.5	-176.8	-59.1	-164.6	177.8	-148	0	114.8	L172 E240	L172-K244 CarbonylContact C-O 3.6Å; L172-K244 WeakPolarHBondContact CB-O 3.38Å; L172-K244 CarbonylContact O-C 3.48Å; L172-K244 WeakPolarHBondContact O-CA 3.31Å; E240-K244 WeakPolarHBondContact OE1-CE 3.11Å; E240-K244 IonicContact OE1-NZ 2.85Å; E240-K244 PolarHBondContact OE1-NZ 3.13Å
245	M	90.2	Very high	96	Very high	164 Å²	164	43.3 Å²	43.3	81%	0.808	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-132.8	36	-178.5	-60.3	-173.7	-166.7	0	0	111	N243	N243-M245 PolarHBondContact O-N 3.15Å; N243-M245 PolarHBondContact OD1-N 3.46Å
246	E	93	Very high	95.7	Very high	45 Å²	45	46.4 Å²	46.4	21%	0.21	25%	0.251	C	S	.	.			trans	-138	126.7	-174.6	-174.9	171.7	-154.1	0	0	112.8	Y217 N218 K241 N243	Y217-E246 HydrophobicContact CE1-CG 4.43Å; N218-E246 PolarHBondContact ND2-OE2 3.19Å; K241-E246 PolarHBondContact NZ-O 3.03Å; N243-E246 HydrophobicContact CB-CB 4.41Å; N243-E246 WeakPolarHBondContact ND2-CB 3.38Å; N243-E246 PolarHBondContact ND2-OE2 2.78Å
247	W	94.9	Very high	95.5	Very high	56 Å²	56	46.6 Å²	46.6	21%	0.212	25%	0.25	C	C	.	.			trans	-83.2	122.6	169.1	-65.9	112.9	0	0	0	109.7	N159 Q170 T171 L172 T260 V263 P265	N159-W247 HydrophobicContact CB-CE3 4.45Å; N159-W247 HydrophobicContact CB-CH2 4.37Å; N159-W247 HydrophobicContact CB-CZ3 3.84Å; Q170-W247 HydrophobicContact CG-CE3 3.87Å; Q170-W247 HydrophobicContact CG-CZ3 3.86Å; Q170-W247 WeakPolarHBondContact O-CZ3 3.41Å; T171-W247 VanDerWaalsContact C-CZ3 3.48Å; L172-W247 HydrophobicContact CD2-CD2 3.99Å; L172-W247 VanDerWaalsContact CD2-CE2 3.48Å; L172-W247 HydrophobicContact CD2-CG 4.17Å; L172-W247 HydrophobicContact CD2-CZ2 3.93Å; L172-W247 HydrophobicContact CG-CH2 4.44Å; L172-W247 HydrophobicContact CG-CZ2 3.78Å; W247-T260 HydrophobicContact CB-CG2 4.24Å; W247-V263 HydrophobicContact CD2-CG1 3.63Å; W247-V263 HydrophobicContact CE3-CG1 3.84Å; W247-V263 HydrophobicContact CG-CG1 4.23Å; W247-V263 HydrophobicContact CH2-CG1 3.87Å; W247-V263 HydrophobicContact CZ2-CG1 3.65Å; W247-V263 HydrophobicContact CZ3-CG1 3.95Å; W247-P265 HydrophobicContact CZ2-CB 4.03Å
248	W	97.2	Very high	95.3	Very high	1 Å²	1	46.6 Å²	46.6	0%	0.004	25%	0.25	C	C	.	.			trans	-80.2	137	175.5	-71	17.7	0	0	0	108.9	W168 Q170 V175 L216 Y217 N218 V220 K241	W168-W248 HydrophobicContact CH2-CB 4.5Å; W168-W248 WeakPolarHBondContact CH2-O 3.26Å; W168-W248 HydrophobicContact CZ3-CB 4.5Å; Q170-W248 PolarHBondContact NE2-O 3.25Å; V175-W248 HydrophobicContact CG2-CD2 4.16Å; V175-W248 HydrophobicContact CG2-CE3 4.03Å; V175-W248 HydrophobicContact CG2-CZ3 4.44Å; L216-W248 HydrophobicContact CB-CH2 4.01Å; L216-W248 HydrophobicContact CB-CZ3 4.25Å; L216-W248 HydrophobicContact CD2-CH2 4.37Å; L216-W248 HydrophobicContact CD2-CZ3 4.09Å; Y217-W248 HydrophobicContact CD1-CB 3.97Å; Y217-W248 AromaticContact CD1-CD1 3.52Å; Y217-W248 AromaticContact CD1-CD2 3.86Å; Y217-W248 HydrophobicContact CD1-CD2 3.86Å; Y217-W248 AromaticContact CD1-CG 3.52Å; Y217-W248 HydrophobicContact CD1-CG 3.52Å; Y217-W248 AromaticContact CD1-NE1 3.83Å; Y217-W248 HydrophobicContact CE1-CB 4.47Å; Y217-W248 AromaticContact CE1-CD1 3.96Å; Y217-W248 HydrophobicContact CE1-CG 4.23Å; Y217-W248 HydrophobicContact CG-CB 4.19Å; Y217-W248 HydrophobicContact CG-CD2 4.17Å; Y217-W248 HydrophobicContact CG-CG 4.04Å; N218-W248 HydrophobicContact CB-CZ2 3.91Å; N218-W248 WeakPolarHBondContact O-CH2 3.47Å; N218-W248 WeakPolarHBondContact O-CZ2 3.32Å; V220-W248 HydrophobicContact CG1-CH2 3.71Å; V220-W248 HydrophobicContact CG1-CZ2 4.11Å; K241-W248 HydrophobicContact CG-CZ2 4.17Å
249	S	96.2	Very high	94.9	Very high	7 Å²	7	44.7 Å²	44.7	5%	0.049	24%	0.241	C	C	.	.	S	Bend	trans	-83.8	-18.6	172.3	64.3	0	0	0	0	112.3	Y217 E257 M258	Y217-S249 WeakPolarHBondContact CE2-OG 3.47Å; S249-E257 CarbonylContact O-C 3.57Å; S249-E257 WeakPolarHBondContact O-CA 3.39Å; S249-E257 PolarHBondContact OG-OE2 2.66Å; S249-M258 WeakPolarHBondContact O-CB 3.42Å; S249-M258 PolarHBondContact O-N 2.9Å
250	R	97	Very high	94.6	Very high	58 Å²	58	47.2 Å²	47.2	22%	0.219	26%	0.257	C	S	.	.			trans	-156.9	168.3	-179.4	57.3	-176.4	158.9	-137.2	-20.9	110.4	Y217 C252 E255 E257	Y217-R250 VanDerWaalsContact CB-O 3.3Å; Y217-R250 WeakPolarHBondContact CB-O 3.15Å; Y217-R250 HydrophobicContact CD2-CG 3.85Å; R250-C252 VanDerWaalsContact CD-O 3.32Å; R250-C252 WeakPolarHBondContact CD-O 3.42Å; R250-E255 HydrophobicContact CB-CB 4.37Å; R250-E257 IonicContact CZ-OE1 2.96Å; R250-E257 VanDerWaalsContact NH1-CG 3.32Å; R250-E257 IonicContact NH1-OE1 2.7Å; R250-E257 PolarHBondContact NH1-OE1 3.06Å; R250-E257 IonicContact NH2-OE1 2.73Å; R250-E257 PolarHBondContact NH2-OE1 2.98Å
251	I	97.7	Very high	94.1	Very high	1 Å²	1	53 Å²	53	1%	0.005	28%	0.278	C	S	.	.	S	Bend	trans	-83.5	-54.6	175	-60.8	-56.3	0	0	0	111.8	Y166 W168 V175 I177 L212 L216 Y217	Y166-I251 HydrophobicContact CE2-CG1 3.98Å; W168-I251 HydrophobicContact CB-CD1 4.02Å; W168-I251 HydrophobicContact CB-CG1 4.23Å; W168-I251 HydrophobicContact CD2-CD1 3.39Å; W168-I251 HydrophobicContact CD2-CG1 3.72Å; W168-I251 HydrophobicContact CE3-CD1 3.5Å; W168-I251 VanDerWaalsContact CE3-CD1 3.5Å; W168-I251 HydrophobicContact CE3-CG1 4.32Å; W168-I251 HydrophobicContact CG-CD1 3.62Å; W168-I251 HydrophobicContact CG-CG1 3.64Å; W168-I251 HydrophobicContact CZ3-CD1 4.06Å; V175-I251 HydrophobicContact CG1-CD1 3.47Å; V175-I251 VanDerWaalsContact CG1-CD1 3.47Å; I177-I251 HydrophobicContact CD1-CD1 4.29Å; I177-I251 HydrophobicContact CD1-CG1 4.46Å; I177-I251 HydrophobicContact CD1-CG2 3.8Å; I177-I251 HydrophobicContact CG1-CD1 4.24Å; L212-I251 HydrophobicContact CD2-CG2 3.8Å; L216-I251 CarbonylContact C-O 3.48Å; L216-I251 WeakPolarHBondContact CA-O 3.37Å; L216-I251 HydrophobicContact CD2-CG2 4.11Å; Y217-I251 PolarHBondContact N-O 2.97Å
252	C	96.7	Very high	93.7	Very high	2 Å²	2	57.2 Å²	57.2	1%	0.014	30%	0.296	C	S	.	.	B	Isolated β-bridge	trans	-123.2	155.4	-178	-73.3	0	0	0	0	112.1	I201 L212 N215 R250 G254 E255	I201-C252 WeakPolarHBondContact CG2-SG 3.39Å; L212-C252 HydrophobicContact CD1-CB 4.2Å; N215-C252 CarbonylContact O-C 3.51Å; N215-C252 WeakPolarHBondContact O-CA 3.45Å; N215-C252 WeakPolarHBondContact O-CB 3.37Å; R250-C252 VanDerWaalsContact CD-O 3.32Å; R250-C252 WeakPolarHBondContact CD-O 3.42Å; C252-G254 PolarHBondContact O-N 2.77Å; C252-E255 HydrophobicContact CB-CG 4.1Å; C252-E255 WeakPolarHBondContact O-CB 3.25Å; C252-E255 PolarHBondContact O-N 2.8Å
253	D	95	Very high	93.2	Very high	92 Å²	92	55 Å²	55	49%	0.492	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	136.4	169.3	-67.6	-21.4	0	0	0	111.1	N215 E255	N215-D253 WeakPolarHBondContact CB-OD2 3.43Å; N215-D253 PolarHBondContact O-N 3.03Å; D253-E255 VanDerWaalsContact C-N 3.32Å; D253-E255 PolarHBondContact O-N 2.57Å
254	G	92	Very high	92.8	Very high	75 Å²	75	59.2 Å²	59.2	77%	0.773	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.7	-14.2	179.9	0	0	0	0	0	115.5	C252	C252-G254 PolarHBondContact O-N 2.77Å
255	E	92.7	Very high	92.3	Very high	58 Å²	58	58.5 Å²	58.5	27%	0.271	31%	0.305	S	S	.	.	S	Bend	trans	-74.3	154.9	173.2	-63.9	-76.2	135.2	0	0	111.4	L163 Y166 R250 C252 D253 E257	L163-E255 WeakPolarHBondContact CD1-OE2 3.35Å; Y166-E255 VanDerWaalsContact OH-CD 3.24Å; Y166-E255 PolarHBondContact OH-OE2 3.03Å; R250-E255 HydrophobicContact CB-CB 4.37Å; C252-E255 HydrophobicContact CB-CG 4.1Å; C252-E255 WeakPolarHBondContact O-CB 3.25Å; C252-E255 PolarHBondContact O-N 2.8Å; D253-E255 VanDerWaalsContact C-N 3.32Å; D253-E255 PolarHBondContact O-N 2.57Å; E255-E257 PolarHBondContact O-N 3.28Å
256	P	92.7	Very high	91.4	Very high	65 Å²	65	58.3 Å²	58.3	42%	0.422	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-56	136.6	174.4	-24.6	34.5	0	0	0	112.1	L153 L163	L153-P256 HydrophobicContact CD1-CB 3.74Å; L153-P256 HydrophobicContact CG-CB 4.14Å; L163-P256 HydrophobicContact CD2-CB 4.36Å; L163-P256 HydrophobicContact CD2-CG 3.93Å
257	E	93.9	Very high	89.9	Confident	68 Å²	68	62.9 Å²	62.9	32%	0.318	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-85.3	139.4	176.4	-67.3	-171.2	-150.2	0	0	111.1	K152 L153 S249 R250 E255	K152-E257 CarbonylContact C-O 3.55Å; K152-E257 WeakPolarHBondContact CA-O 3.48Å; K152-E257 WeakPolarHBondContact CB-O 3.41Å; K152-E257 HydrophobicContact CG-CB 4.45Å; L153-E257 PolarHBondContact N-O 2.77Å; S249-E257 CarbonylContact O-C 3.57Å; S249-E257 WeakPolarHBondContact O-CA 3.39Å; S249-E257 PolarHBondContact OG-OE2 2.66Å; R250-E257 IonicContact CZ-OE1 2.96Å; R250-E257 VanDerWaalsContact NH1-CG 3.32Å; R250-E257 IonicContact NH1-OE1 2.7Å; R250-E257 PolarHBondContact NH1-OE1 3.06Å; R250-E257 IonicContact NH2-OE1 2.73Å; R250-E257 PolarHBondContact NH2-OE1 2.98Å; E255-E257 PolarHBondContact O-N 3.28Å
258	M	92.7	Very high	88.1	Confident	1 Å²	1	64 Å²	64	1%	0.005	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-90.2	146.2	169.9	-178.8	-163	68.6	0	0	110.2	L153 P155 N159 G160 W168 S249 T260 V263	L153-M258 HydrophobicContact CB-CB 4.5Å; L153-M258 CarbonylContact O-C 3.6Å; L153-M258 VanDerWaalsContact O-CA 3.31Å; L153-M258 WeakPolarHBondContact O-CA 3.34Å; L153-M258 WeakPolarHBondContact O-CG 3.44Å; P155-M258 VanDerWaalsContact CA-SD 3.55Å; P155-M258 HydrophobicContact CB-CE 4.5Å; P155-M258 HydrophobicContact CB-CG 4.06Å; P155-M258 HydrophobicContact CB-SD 3.45Å; P155-M258 WeakPolarHBondContact CB-SD 3.27Å; P155-M258 HydrophobicContact CG-CE 4.24Å; P155-M258 HydrophobicContact CG-CG 3.66Å; P155-M258 HydrophobicContact CG-SD 3.56Å; P155-M258 VanDerWaalsContact CG-SD 3.56Å; N159-M258 VanDerWaalsContact O-CE 3.28Å; N159-M258 WeakPolarHBondContact O-CE 2.92Å; N159-M258 VanDerWaalsContact O-SD 3.36Å; G160-M258 VanDerWaalsContact C-SD 3.52Å; W168-M258 HydrophobicContact CH2-CE 4.4Å; S249-M258 WeakPolarHBondContact O-CB 3.42Å; S249-M258 PolarHBondContact O-N 2.9Å; M258-T260 HydrophobicContact CE-CG2 4.1Å; M258-T260 PolarHBondContact O-N 3.2Å; M258-T260 VanDerWaalsContact O-N 3.09Å; M258-V263 HydrophobicContact CE-CG2 3.63Å
259	N	91.8	Very high	86.4	Confident	4 Å²	4	71 Å²	71	2%	0.021	37%	0.374	C	S	.	.			trans	-74.6	98.5	174.3	-171.9	-15.9	0	0	0	110.8	D149 K152 L153 P155 R261 K262	D149-N259 WeakPolarHBondContact CB-ND2 3.43Å; D149-N259 PolarHBondContact OD1-ND2 2.89Å; D149-N259 PolarHBondContact OD2-ND2 3Å; K152-N259 HydrophobicContact CB-CB 3.93Å; K152-N259 HydrophobicContact CD-CB 4.18Å; L153-N259 PolarHBondContact O-N 3.16Å; P155-N259 WeakPolarHBondContact CG-O 3.39Å; N259-R261 PolarHBondContact O-N 2.87Å; N259-R261 VanDerWaalsContact OD1-CB 3.28Å; N259-R261 WeakPolarHBondContact OD1-CB 3.29Å; N259-R261 PolarHBondContact OD1-N 3.37Å; N259-K262 HydrophobicContact CB-CG 4.46Å; N259-K262 PolarHBondContact O-N 3.26Å; N259-K262 VanDerWaalsContact O-N 3.13Å
260	T	91.5	Very high	84.9	Confident	54 Å²	54	73.3 Å²	73.3	33%	0.331	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-65.6	-17.9	179.2	53.2	0	0	0	0	113.7	W247 M258 K262 V263	W247-T260 HydrophobicContact CB-CG2 4.24Å; M258-T260 HydrophobicContact CE-CG2 4.1Å; M258-T260 PolarHBondContact O-N 3.2Å; M258-T260 VanDerWaalsContact O-N 3.09Å; T260-K262 PolarHBondContact O-N 3.17Å; T260-V263 WeakPolarHBondContact O-CB 3.39Å; T260-V263 PolarHBondContact O-N 2.97Å
261	R	88.1	Confident	83.7	Confident	137 Å²	137	74.5 Å²	74.5	52%	0.517	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-70.8	-20.8	174.1	-59.4	176.8	174.5	162.6	-3.5	112.6	E146 E148 D149 N259	E146-R261 IonicContact OE2-CZ 3.37Å; E146-R261 IonicContact OE2-NH1 3.97Å; E146-R261 PolarHBondContact OE2-NH1 3.09Å; E146-R261 IonicContact OE2-NH2 3.11Å; E148-R261 IonicContact OE2-CZ 3.95Å; E148-R261 IonicContact OE2-NH1 3.87Å; E148-R261 IonicContact OE2-NH2 2.77Å; E148-R261 PolarHBondContact OE2-NH2 3.33Å; D149-R261 IonicContact OD1-NH1 2.8Å; D149-R261 IonicContact OD2-NH1 2.76Å; N259-R261 PolarHBondContact O-N 2.87Å; N259-R261 VanDerWaalsContact OD1-CB 3.28Å; N259-R261 WeakPolarHBondContact OD1-CB 3.29Å; N259-R261 PolarHBondContact OD1-N 3.37Å
262	K	88.9	Confident	82.4	Confident	90 Å²	90	79.6 Å²	79.6	39%	0.391	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-94.6	4.3	178.6	-64.2	-173.3	180	-177.4	0	113.2	P155 N259 T260	P155-K262 HydrophobicContact CG-CB 4.04Å; N259-K262 HydrophobicContact CB-CG 4.46Å; N259-K262 PolarHBondContact O-N 3.26Å; N259-K262 VanDerWaalsContact O-N 3.13Å; T260-K262 PolarHBondContact O-N 3.17Å
263	V	88.8	Confident	81.3	Confident	17 Å²	17	81.6 Å²	81.6	10%	0.103	44%	0.441	C	S	.	.			trans	-66.8	134.9	176.2	162.8	0	0	0	0	110.1	P155 N159 W247 M258 T260 P265	P155-V263 HydrophobicContact CG-CG2 4.08Å; N159-V263 HydrophobicContact CB-CG1 3.92Å; N159-V263 HydrophobicContact CB-CG2 4.23Å; W247-V263 HydrophobicContact CD2-CG1 3.63Å; W247-V263 HydrophobicContact CE3-CG1 3.84Å; W247-V263 HydrophobicContact CG-CG1 4.23Å; W247-V263 HydrophobicContact CH2-CG1 3.87Å; W247-V263 HydrophobicContact CZ2-CG1 3.65Å; W247-V263 HydrophobicContact CZ3-CG1 3.95Å; M258-V263 HydrophobicContact CE-CG2 3.63Å; T260-V263 WeakPolarHBondContact O-CB 3.39Å; T260-V263 PolarHBondContact O-N 2.97Å; V263-P265 VanDerWaalsContact O-CD 3.32Å; V263-P265 WeakPolarHBondContact O-CD 3.18Å
264	Q	86.2	Confident	80.5	Confident	157 Å²	157	81.5 Å²	81.5	73%	0.734	44%	0.44	S	S	*	.			trans	-106.7	93.3	176.3	-66.8	-176.1	-3.4	0	0	108.6	N159	N159-Q264 PolarHBondContact ND2-O 3.18Å; N159-Q264 PolarHBondContact OD1-N 3.15Å; N159-Q264 PolarHBondContact OD1-O 3.08Å
265	P	80.2	Confident	80	Confident	77 Å²	77	80.8 Å²	80.8	50%	0.5	43%	0.433	S	S	.	.			trans	-55.8	145.8	177.8	22.9	-31.9	0	0	0	110.1	W247 V263 N267	W247-P265 HydrophobicContact CZ2-CB 4.03Å; V263-P265 VanDerWaalsContact O-CD 3.32Å; V263-P265 WeakPolarHBondContact O-CD 3.18Å; P265-N267 PolarHBondContact O-N 3.4Å
266	E	71.4	Confident	79.6	Confident	159 Å²	159	85.9 Å²	85.9	74%	0.743	46%	0.457	S	S	*	.			trans	-55.4	131.3	175.1	-64.3	-163.8	163.5	0	0	109.6	S268	E266-S268 PolarHBondContact O-N 3.13Å
267	N	61.6	Low	78.9	Confident	141 Å²	141	85.8 Å²	85.8	75%	0.754	46%	0.455	S	S	*	.			trans	-59.1	107.4	176	-79.7	20.1	0	0	0	108.5	P265 K269	P265-N267 PolarHBondContact O-N 3.4Å; N267-K269 PolarHBondContact O-N 3.37Å
268	S	57.6	Low	78.4	Confident	79 Å²	79	87.7 Å²	87.7	55%	0.552	46%	0.459	S	S	*	.			trans	-53.9	128.1	171.8	-51.6	0	0	0	0	108.3	E266	E266-S268 PolarHBondContact O-N 3.13Å
269	K	61.7	Low	77.9	Confident	148 Å²	148	91 Å²	91	64%	0.643	48%	0.483	S	S	*	.			trans	-65.1	146.2	169.5	-62.5	173.5	-175.2	168.5	0	106.4	N267 S271 D272	N267-K269 PolarHBondContact O-N 3.37Å; K269-S271 WeakPolarHBondContact CB-OG 3.4Å; K269-S271 PolarHBondContact O-N 3.33Å; K269-D272 WeakPolarHBondContact CB-OD2 3.17Å; K269-D272 PolarHBondContact N-OD2 2.87Å; K269-D272 WeakPolarHBondContact O-CB 3.28Å; K269-D272 PolarHBondContact O-N 2.92Å
270	L	64.2	Low	77.6	Confident	57 Å²	57	96 Å²	96	30%	0.298	51%	0.508	S	S	.	.	G	3₁₀ helix	trans	-50.4	-28.4	175.1	-91.6	154.8	0	0	0	113.2	D272 R278 V281 E282 M285	L270-D272 VanDerWaalsContact C-N 3.27Å; L270-D272 PolarHBondContact O-N 2.82Å; L270-R278 HydrophobicContact CD2-CG 4.18Å; L270-R278 WeakPolarHBondContact O-CD 3.31Å; L270-R278 WeakPolarHBondContact O-CG 3.39Å; L270-V281 HydrophobicContact CD2-CB 4.21Å; L270-V281 HydrophobicContact CD2-CG1 3.91Å; L270-E282 HydrophobicContact CD2-CG 3.62Å; L270-M285 HydrophobicContact CD1-CE 4.33Å; L270-M285 HydrophobicContact CD1-SD 3.73Å
271	S	73.2	Confident	77.1	Confident	82 Å²	82	95.5 Å²	95.5	57%	0.573	50%	0.504	S	S	*	.	G	3₁₀ helix	trans	-66.2	-24.2	175.5	51.8	0	0	0	0	114.7	K269	K269-S271 WeakPolarHBondContact CB-OG 3.4Å; K269-S271 PolarHBondContact O-N 3.33Å
272	D	70	Confident	77.1	Confident	109 Å²	109	92.8 Å²	92.8	58%	0.583	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-93.7	-11.9	-170.8	-50.1	-20.1	0	0	0	111.4	K269 L270	K269-D272 WeakPolarHBondContact CB-OD2 3.17Å; K269-D272 PolarHBondContact N-OD2 2.87Å; K269-D272 WeakPolarHBondContact O-CB 3.28Å; K269-D272 PolarHBondContact O-N 2.92Å; L270-D272 VanDerWaalsContact C-N 3.27Å; L270-D272 PolarHBondContact O-N 2.82Å
273	L	72.4	Confident	77	Confident	43 Å²	43	91.3 Å²	91.3	23%	0.225	49%	0.491	C	S	.	.	S	Bend	trans	-79.4	143.4	175.2	-59.6	176.2	0	0	0	110.4	T277 R278 V281	L273-T277 HydrophobicContact CB-CG2 4.43Å; L273-T277 HydrophobicContact CD1-CG2 4.35Å; L273-T277 HydrophobicContact CD2-CG2 4.16Å; L273-R278 HydrophobicContact CB-CB 3.94Å; L273-V281 HydrophobicContact CD1-CB 4.09Å; L273-V281 HydrophobicContact CD1-CG1 4.41Å; L273-V281 HydrophobicContact CD1-CG2 3.76Å
274	D	79.3	Confident	76.9	Confident	90 Å²	90	95.8 Å²	95.8	48%	0.481	51%	0.512	S	S	.	.			trans	-61.8	162	172.4	70.7	-88.7	0	0	0	111.3	E276 T277 R278	D274-E276 VanDerWaalsContact C-N 3.27Å; D274-E276 PolarHBondContact O-N 3.14Å; D274-E276 WeakPolarHBondContact OD2-CB 3.12Å; D274-E276 PolarHBondContact OD2-N 2.95Å; D274-T277 PolarHBondContact O-N 2.91Å; D274-T277 WeakPolarHBondContact OD1-CB 3.26Å; D274-T277 PolarHBondContact OD1-OG1 2.84Å; D274-T277 PolarHBondContact OD2-N 2.83Å; D274-T277 PolarHBondContact OD2-OG1 2.84Å; D274-R278 WeakPolarHBondContact O-CB 3.44Å; D274-R278 PolarHBondContact O-N 2.84Å
275	G	81.7	Confident	76.8	Confident	61 Å²	61	92.7 Å²	92.7	63%	0.629	50%	0.499	S	S	*	.	H	α-helix	trans	-58.3	-33.9	-172	0	0	0	0	0	114.9	S279	G275-S279 VanDerWaalsContact O-CB 3.27Å; G275-S279 WeakPolarHBondContact O-CB 3.27Å; G275-S279 PolarHBondContact O-N 2.85Å; G275-S279 VanDerWaalsContact O-N 3.16Å
276	E	84.4	Confident	77.2	Confident	165 Å²	165	93.3 Å²	93.3	77%	0.771	49%	0.492	S	S	*	.	H	α-helix	trans	-75.3	-49.7	179.3	-172.9	173.3	-172.6	0	0	110.5	D274 R278 S279 M280	D274-E276 VanDerWaalsContact C-N 3.27Å; D274-E276 PolarHBondContact O-N 3.14Å; D274-E276 WeakPolarHBondContact OD2-CB 3.12Å; D274-E276 PolarHBondContact OD2-N 2.95Å; E276-R278 PolarHBondContact O-N 2.95Å; E276-S279 PolarHBondContact O-N 2.77Å; E276-M280 PolarHBondContact O-N 2.87Å
277	T	78.1	Confident	78.2	Confident	63 Å²	63	86.8 Å²	86.8	39%	0.387	46%	0.462	S	S	.	.	H	α-helix	trans	-63.8	-42.8	178.2	-54.6	0	0	0	0	111.7	L273 D274 S279 M280 V281	L273-T277 HydrophobicContact CB-CG2 4.43Å; L273-T277 HydrophobicContact CD1-CG2 4.35Å; L273-T277 HydrophobicContact CD2-CG2 4.16Å; D274-T277 PolarHBondContact O-N 2.91Å; D274-T277 WeakPolarHBondContact OD1-CB 3.26Å; D274-T277 PolarHBondContact OD1-OG1 2.84Å; D274-T277 PolarHBondContact OD2-N 2.83Å; D274-T277 PolarHBondContact OD2-OG1 2.84Å; T277-S279 PolarHBondContact O-N 2.85Å; T277-M280 PolarHBondContact O-N 2.89Å; T277-M280 VanDerWaalsContact O-N 3.14Å; T277-V281 HydrophobicContact CG2-CG2 4.46Å; T277-V281 WeakPolarHBondContact O-CG2 3.28Å; T277-V281 PolarHBondContact O-N 2.87Å
278	R	82	Confident	79.2	Confident	107 Å²	107	83.3 Å²	83.3	40%	0.404	44%	0.441	S	S	.	.	H	α-helix	trans	-57.8	-48.5	175.3	-178.9	-178.8	164.8	175.1	-4.3	111.1	L270 L273 D274 E276 M280 V281 E282	L270-R278 HydrophobicContact CD2-CG 4.18Å; L270-R278 WeakPolarHBondContact O-CD 3.31Å; L270-R278 WeakPolarHBondContact O-CG 3.39Å; L273-R278 HydrophobicContact CB-CB 3.94Å; D274-R278 WeakPolarHBondContact O-CB 3.44Å; D274-R278 PolarHBondContact O-N 2.84Å; E276-R278 PolarHBondContact O-N 2.95Å; R278-M280 PolarHBondContact O-N 2.83Å; R278-V281 PolarHBondContact O-N 3.05Å; R278-E282 HydrophobicContact CG-CG 4.29Å; R278-E282 IonicContact CZ-OE1 2.9Å; R278-E282 IonicContact NE-OE1 3.75Å; R278-E282 PolarHBondContact NE-OE1 2.72Å; R278-E282 IonicContact NH2-OE1 3.74Å; R278-E282 PolarHBondContact NH2-OE1 2.76Å; R278-E282 WeakPolarHBondContact O-CB 3.28Å; R278-E282 VanDerWaalsContact O-CG 3.3Å; R278-E282 WeakPolarHBondContact O-CG 3.44Å; R278-E282 PolarHBondContact O-N 2.81Å
279	S	84	Confident	80.6	Confident	72 Å²	72	87.1 Å²	87.1	50%	0.503	44%	0.443	S	S	.	.	H	α-helix	trans	-58.9	-38.3	177.1	-178.2	0	0	0	0	111.6	G275 E276 T277 K283	G275-S279 VanDerWaalsContact O-CB 3.27Å; G275-S279 WeakPolarHBondContact O-CB 3.27Å; G275-S279 PolarHBondContact O-N 2.85Å; G275-S279 VanDerWaalsContact O-N 3.16Å; E276-S279 PolarHBondContact O-N 2.77Å; T277-S279 PolarHBondContact O-N 2.85Å; S279-K283 WeakPolarHBondContact O-CB 3.44Å; S279-K283 PolarHBondContact O-N 2.9Å
280	M	84.3	Confident	82	Confident	109 Å²	109	81.1 Å²	81.1	54%	0.537	42%	0.418	S	S	.	.	H	α-helix	trans	-68.7	-45	177.1	-173.4	82.4	-47.6	0	0	113.3	E276 T277 R278 K283 M284	E276-M280 PolarHBondContact O-N 2.87Å; T277-M280 PolarHBondContact O-N 2.89Å; T277-M280 VanDerWaalsContact O-N 3.14Å; R278-M280 PolarHBondContact O-N 2.83Å; M280-K283 HydrophobicContact CE-CB 4.01Å; M280-K283 HydrophobicContact CE-CD 3.47Å; M280-K283 VanDerWaalsContact CE-CD 3.47Å; M280-K283 HydrophobicContact CE-CG 4.34Å; M280-K283 PolarHBondContact O-N 2.78Å; M280-M284 PolarHBondContact O-N 3.05Å
281	V	82	Confident	83.2	Confident	42 Å²	42	85.4 Å²	85.4	26%	0.255	43%	0.434	S	S	.	.	H	α-helix	trans	-65.4	-40.2	176.3	177	0	0	0	0	110.8	L270 L273 T277 R278 M284 M285	L270-V281 HydrophobicContact CD2-CB 4.21Å; L270-V281 HydrophobicContact CD2-CG1 3.91Å; L273-V281 HydrophobicContact CD1-CB 4.09Å; L273-V281 HydrophobicContact CD1-CG1 4.41Å; L273-V281 HydrophobicContact CD1-CG2 3.76Å; T277-V281 HydrophobicContact CG2-CG2 4.46Å; T277-V281 WeakPolarHBondContact O-CG2 3.28Å; T277-V281 PolarHBondContact O-N 2.87Å; R278-V281 PolarHBondContact O-N 3.05Å; V281-M284 PolarHBondContact O-N 2.77Å; V281-M285 HydrophobicContact CG1-CE 4.49Å; V281-M285 HydrophobicContact CG1-CG 4.4Å; V281-M285 HydrophobicContact CG1-SD 4.48Å; V281-M285 WeakPolarHBondContact O-CB 3.47Å; V281-M285 WeakPolarHBondContact O-CG 3.17Å; V281-M285 PolarHBondContact O-N 3.27Å
282	E	86.5	Confident	83.9	Confident	80 Å²	80	87.7 Å²	87.7	37%	0.374	44%	0.436	S	S	.	.	H	α-helix	trans	-61.2	-44.3	174	-75	-179.2	175.3	0	0	111.6	L270 R278 M284 M285 Y286	L270-E282 HydrophobicContact CD2-CG 3.62Å; R278-E282 HydrophobicContact CG-CG 4.29Å; R278-E282 IonicContact CZ-OE1 2.9Å; R278-E282 IonicContact NE-OE1 3.75Å; R278-E282 PolarHBondContact NE-OE1 2.72Å; R278-E282 IonicContact NH2-OE1 3.74Å; R278-E282 PolarHBondContact NH2-OE1 2.76Å; R278-E282 WeakPolarHBondContact O-CB 3.28Å; R278-E282 VanDerWaalsContact O-CG 3.3Å; R278-E282 WeakPolarHBondContact O-CG 3.44Å; R278-E282 PolarHBondContact O-N 2.81Å; E282-M284 VanDerWaalsContact C-N 3.34Å; E282-M284 PolarHBondContact O-N 3.27Å; E282-M285 PolarHBondContact O-N 2.85Å; E282-Y286 VanDerWaalsContact O-CB 3.31Å; E282-Y286 WeakPolarHBondContact O-CB 3.44Å; E282-Y286 PolarHBondContact O-N 2.81Å
283	K	88	Confident	84.8	Confident	59 Å²	59	88 Å²	88	26%	0.257	44%	0.436	S	S	.	.	H	α-helix	trans	-59.1	-45.8	173.7	-173.7	-161.2	173.2	-162.2	0	110.7	S279 M280 Y286 D287 S298 E299	S279-K283 WeakPolarHBondContact O-CB 3.44Å; S279-K283 PolarHBondContact O-N 2.9Å; M280-K283 HydrophobicContact CE-CB 4.01Å; M280-K283 HydrophobicContact CE-CD 3.47Å; M280-K283 VanDerWaalsContact CE-CD 3.47Å; M280-K283 HydrophobicContact CE-CG 4.34Å; M280-K283 PolarHBondContact O-N 2.78Å; K283-Y286 PolarHBondContact O-N 3.13Å; K283-D287 WeakPolarHBondContact O-CB 3.36Å; K283-D287 VanDerWaalsContact O-CG 3.27Å; K283-D287 PolarHBondContact O-N 2.86Å; K283-S298 WeakPolarHBondContact CE-OG 3.32Å; K283-S298 WeakPolarHBondContact CG-OG 3.38Å; K283-E299 IonicContact NZ-OE1 3.85Å; K283-E299 PolarHBondContact NZ-OE1 3.07Å; K283-E299 VanDerWaalsContact NZ-OE1 3.11Å
284	M	85.4	Confident	85.6	Confident	112 Å²	112	89.2 Å²	89.2	55%	0.552	46%	0.459	S	S	*	.	H	α-helix	trans	-65.7	-42.9	-178.8	-162.1	178.5	82.7	0	0	111.8	M280 V281 E282 D287 Q288	M280-M284 PolarHBondContact O-N 3.05Å; V281-M284 PolarHBondContact O-N 2.77Å; E282-M284 VanDerWaalsContact C-N 3.34Å; E282-M284 PolarHBondContact O-N 3.27Å; M284-D287 PolarHBondContact O-N 2.95Å; M284-Q288 WeakPolarHBondContact O-CB 3.16Å; M284-Q288 PolarHBondContact O-N 3.43Å
285	M	85	Confident	86.2	Confident	92 Å²	92	89 Å²	89	45%	0.453	46%	0.458	S	S	.	.	H	α-helix	trans	-63	-40.4	174.3	-76.9	-169.2	161.9	0	0	112.3	L270 V281 E282 R289	L270-M285 HydrophobicContact CD1-CE 4.33Å; L270-M285 HydrophobicContact CD1-SD 3.73Å; V281-M285 HydrophobicContact CG1-CE 4.49Å; V281-M285 HydrophobicContact CG1-CG 4.4Å; V281-M285 HydrophobicContact CG1-SD 4.48Å; V281-M285 WeakPolarHBondContact O-CB 3.47Å; V281-M285 WeakPolarHBondContact O-CG 3.17Å; V281-M285 PolarHBondContact O-N 3.27Å; E282-M285 PolarHBondContact O-N 2.85Å; M285-R289 WeakPolarHBondContact O-CB 3.45Å; M285-R289 PolarHBondContact O-N 3.1Å; M285-R289 VanDerWaalsContact O-N 3.08Å
286	Y	89	Confident	86.4	Confident	89 Å²	89	88.1 Å²	88.1	35%	0.349	44%	0.441	S	S	.	.	H	α-helix	trans	-62	-51	174.4	178.8	-95.4	0	0	0	111	E282 K283 Q288 R289 Q290 Q301	E282-Y286 VanDerWaalsContact O-CB 3.31Å; E282-Y286 WeakPolarHBondContact O-CB 3.44Å; E282-Y286 PolarHBondContact O-N 2.81Å; K283-Y286 PolarHBondContact O-N 3.13Å; Y286-Q288 VanDerWaalsContact C-N 3.3Å; Y286-Q288 PolarHBondContact O-N 3.23Å; Y286-R289 PolarHBondContact O-N 3.32Å; Y286-Q290 HydrophobicContact CD1-CG 3.82Å; Y286-Q290 HydrophobicContact CE1-CG 3.42Å; Y286-Q290 VanDerWaalsContact CE1-CG 3.42Å; Y286-Q290 HydrophobicContact CE2-CG 4.21Å; Y286-Q290 HydrophobicContact CG-CG 4.37Å; Y286-Q290 WeakPolarHBondContact O-CG 3.41Å; Y286-Q290 PolarHBondContact O-N 2.73Å; Y286-Q301 PolarHBondContact OH-NE2 3.16Å; Y286-Q301 PolarHBondContact OH-OE1 2.9Å
287	D	91.5	Very high	86.7	Confident	22 Å²	22	80.9 Å²	80.9	12%	0.118	41%	0.408	C	S	.	.	H	α-helix	trans	-61.8	-38.9	-179.1	-72.9	-11.7	0	0	0	111.9	K283 M284 Q290 K291 T297 S298	K283-D287 WeakPolarHBondContact O-CB 3.36Å; K283-D287 VanDerWaalsContact O-CG 3.27Å; K283-D287 PolarHBondContact O-N 2.86Å; M284-D287 PolarHBondContact O-N 2.95Å; D287-Q290 PolarHBondContact O-N 2.9Å; D287-K291 WeakPolarHBondContact O-CB 3.36Å; D287-K291 WeakPolarHBondContact O-CG 3.46Å; D287-K291 PolarHBondContact O-N 3.1Å; D287-T297 HydrophobicContact CB-CG2 4.29Å; D287-S298 VanDerWaalsContact CG-OG 3.24Å; D287-S298 WeakPolarHBondContact OD1-CB 3.2Å; D287-S298 PolarHBondContact OD1-N 3.23Å; D287-S298 PolarHBondContact OD1-OG 3Å; D287-S298 PolarHBondContact OD2-OG 2.74Å
288	Q	83.8	Confident	87.2	Confident	68 Å²	68	78.7 Å²	78.7	32%	0.318	40%	0.396	S	S	.	.	H	α-helix	trans	-65.3	-44.1	176.7	-170.2	147.8	5.3	0	0	111.5	M284 Y286 K291 E292	M284-Q288 WeakPolarHBondContact O-CB 3.16Å; M284-Q288 PolarHBondContact O-N 3.43Å; Y286-Q288 VanDerWaalsContact C-N 3.3Å; Y286-Q288 PolarHBondContact O-N 3.23Å; Q288-K291 PolarHBondContact O-N 3.46Å; Q288-E292 WeakPolarHBondContact O-CG 3.03Å; Q288-E292 PolarHBondContact O-N 2.83Å
289	R	86.9	Confident	87.5	Confident	159 Å²	159	78.4 Å²	78.4	60%	0.6	40%	0.399	S	S	*	.	H	α-helix	trans	-64.6	-40	174.1	-169.9	-175.8	-63	163.2	2.1	112.4	M285 Y286 E292 L293	M285-R289 WeakPolarHBondContact O-CB 3.45Å; M285-R289 PolarHBondContact O-N 3.1Å; M285-R289 VanDerWaalsContact O-N 3.08Å; Y286-R289 PolarHBondContact O-N 3.32Å; R289-E292 PolarHBondContact O-N 2.82Å; R289-L293 HydrophobicContact CG-CD1 4.07Å; R289-L293 WeakPolarHBondContact O-CB 3.32Å; R289-L293 VanDerWaalsContact O-CG 3.3Å; R289-L293 WeakPolarHBondContact O-CG 3.28Å; R289-L293 PolarHBondContact O-N 2.82Å
290	Q	90.6	Very high	87.7	Confident	22 Å²	22	77.8 Å²	77.8	10%	0.103	39%	0.39	C	S	.	.	H	α-helix	trans	-61.1	-46.6	175	-68.9	-57.8	-64.4	0	0	110.4	Y286 D287 E292 L293 G294 L295 P296	Y286-Q290 HydrophobicContact CD1-CG 3.82Å; Y286-Q290 HydrophobicContact CE1-CG 3.42Å; Y286-Q290 VanDerWaalsContact CE1-CG 3.42Å; Y286-Q290 HydrophobicContact CE2-CG 4.21Å; Y286-Q290 HydrophobicContact CG-CG 4.37Å; Y286-Q290 WeakPolarHBondContact O-CG 3.41Å; Y286-Q290 PolarHBondContact O-N 2.73Å; D287-Q290 PolarHBondContact O-N 2.9Å; Q290-E292 PolarHBondContact O-N 3.4Å; Q290-L293 CarbonylContact O-C 3.1Å; Q290-L293 PolarHBondContact O-N 2.8Å; Q290-L293 VanDerWaalsContact O-N 3.17Å; Q290-G294 PolarHBondContact O-N 3.29Å; Q290-L295 CarbonylContact C-O 3.47Å; Q290-L295 HydrophobicContact CB-CB 4.24Å; Q290-L295 PolarHBondContact O-N 2.97Å; Q290-P296 WeakPolarHBondContact CG-O 3.48Å; Q290-P296 PolarHBondContact OE1-O 3.24Å
291	K	90.1	Very high	87.9	Confident	148 Å²	148	75.5 Å²	75.5	64%	0.643	38%	0.378	S	S	*	.	H	α-helix	trans	-59.9	-44	177	-75.4	177.9	-175.7	179.9	0	112.6	D287 Q288 L293 G294 T297	D287-K291 WeakPolarHBondContact O-CB 3.36Å; D287-K291 WeakPolarHBondContact O-CG 3.46Å; D287-K291 PolarHBondContact O-N 3.1Å; Q288-K291 PolarHBondContact O-N 3.46Å; K291-L293 VanDerWaalsContact C-N 3.27Å; K291-L293 PolarHBondContact O-N 2.87Å; K291-G294 PolarHBondContact O-N 3.22Å; K291-G294 VanDerWaalsContact O-N 3.09Å; K291-T297 HydrophobicContact CD-CG2 4.29Å; K291-T297 HydrophobicContact CG-CG2 3.79Å
292	E	86.2	Confident	88.3	Confident	130 Å²	130	79.5 Å²	79.5	61%	0.607	39%	0.392	S	S	*	.	H	α-helix	trans	-62.3	-35	176.7	-75	172.7	-177.3	0	0	112.5	Q288 R289 Q290 G294	Q288-E292 WeakPolarHBondContact O-CG 3.03Å; Q288-E292 PolarHBondContact O-N 2.83Å; R289-E292 PolarHBondContact O-N 2.82Å; Q290-E292 PolarHBondContact O-N 3.4Å; E292-G294 VanDerWaalsContact C-N 3.31Å
293	L	90.1	Very high	88.4	Confident	114 Å²	114	81.8 Å²	81.8	60%	0.597	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-1.1	176.1	-65.3	172.3	0	0	0	113.6	R289 Q290 K291 L295	R289-L293 HydrophobicContact CG-CD1 4.07Å; R289-L293 WeakPolarHBondContact O-CB 3.32Å; R289-L293 VanDerWaalsContact O-CG 3.3Å; R289-L293 WeakPolarHBondContact O-CG 3.28Å; R289-L293 PolarHBondContact O-N 2.82Å; Q290-L293 CarbonylContact O-C 3.1Å; Q290-L293 PolarHBondContact O-N 2.8Å; Q290-L293 VanDerWaalsContact O-N 3.17Å; K291-L293 VanDerWaalsContact C-N 3.27Å; K291-L293 PolarHBondContact O-N 2.87Å; L293-L295 HydrophobicContact CB-CD1 3.87Å; L293-L295 HydrophobicContact CB-CG 3.93Å; L293-L295 HydrophobicContact CD1-CD1 4.06Å; L293-L295 PolarHBondContact O-N 3.22Å
294	G	89.1	Confident	88.3	Confident	69 Å²	69	84.2 Å²	84.2	71%	0.711	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.8	20.2	-174.3	0	0	0	0	0	114.3	Q290 K291 E292	Q290-G294 PolarHBondContact O-N 3.29Å; K291-G294 PolarHBondContact O-N 3.22Å; K291-G294 VanDerWaalsContact O-N 3.09Å; E292-G294 VanDerWaalsContact C-N 3.31Å
295	L	90.7	Very high	88.6	Confident	85 Å²	85	84.5 Å²	84.5	45%	0.445	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-94.2	156.6	180	-63.1	172.9	0	0	0	111.5	Q290 L293 T297	Q290-L295 CarbonylContact C-O 3.47Å; Q290-L295 HydrophobicContact CB-CB 4.24Å; Q290-L295 PolarHBondContact O-N 2.97Å; L293-L295 HydrophobicContact CB-CD1 3.87Å; L293-L295 HydrophobicContact CB-CG 3.93Å; L293-L295 HydrophobicContact CD1-CD1 4.06Å; L293-L295 PolarHBondContact O-N 3.22Å; L295-T297 PolarHBondContact O-N 2.75Å
296	P	87.7	Confident	88.7	Confident	44 Å²	44	86.2 Å²	86.2	29%	0.286	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-59.6	133.8	178	-23	34	0	0	0	112.5	Q290 D300 Q301	Q290-P296 WeakPolarHBondContact CG-O 3.48Å; Q290-P296 PolarHBondContact OE1-O 3.24Å; P296-D300 HydrophobicContact CB-CB 3.67Å; P296-Q301 HydrophobicContact CB-CG 3.99Å; P296-Q301 PolarHBondContact O-NE2 3.09Å
297	T	90.3	Very high	88.6	Confident	13 Å²	13	84.3 Å²	84.3	8%	0.08	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-66.1	168.3	173.3	63.4	0	0	0	0	111.5	D287 K291 L295 E299 D300 Q301	D287-T297 HydrophobicContact CB-CG2 4.29Å; K291-T297 HydrophobicContact CD-CG2 4.29Å; K291-T297 HydrophobicContact CG-CG2 3.79Å; L295-T297 PolarHBondContact O-N 2.75Å; T297-E299 PolarHBondContact O-N 2.92Å; T297-E299 VanDerWaalsContact O-N 3.17Å; T297-D300 WeakPolarHBondContact CB-OD2 3.36Å; T297-D300 PolarHBondContact N-OD2 2.85Å; T297-D300 PolarHBondContact O-N 3.17Å; T297-D300 PolarHBondContact OG1-N 2.86Å; T297-D300 PolarHBondContact OG1-OD2 3.41Å; T297-Q301 WeakPolarHBondContact O-CG 3.33Å; T297-Q301 PolarHBondContact O-N 3.24Å
298	S	88	Confident	88.4	Confident	17 Å²	17	90.9 Å²	90.9	12%	0.119	44%	0.444	C	S	.	.	H	α-helix	trans	-55.4	-31.1	174.1	63.8	0	0	0	0	112.9	K283 D287 K302	K283-S298 WeakPolarHBondContact CE-OG 3.32Å; K283-S298 WeakPolarHBondContact CG-OG 3.38Å; D287-S298 VanDerWaalsContact CG-OG 3.24Å; D287-S298 WeakPolarHBondContact OD1-CB 3.2Å; D287-S298 PolarHBondContact OD1-N 3.23Å; D287-S298 PolarHBondContact OD1-OG 3Å; D287-S298 PolarHBondContact OD2-OG 2.74Å; S298-K302 VanDerWaalsContact O-CG 3.31Å; S298-K302 WeakPolarHBondContact O-CG 3.06Å; S298-K302 PolarHBondContact O-N 2.75Å; S298-K302 VanDerWaalsContact O-N 3.12Å
299	E	88.2	Confident	88.6	Confident	101 Å²	101	94.9 Å²	94.9	47%	0.472	46%	0.461	S	S	.	.	H	α-helix	trans	-73.9	-41.2	173.4	-69.4	-170.8	178.9	0	0	112.6	K283 T297 Q301 K302 K303	K283-E299 IonicContact NZ-OE1 3.85Å; K283-E299 PolarHBondContact NZ-OE1 3.07Å; K283-E299 VanDerWaalsContact NZ-OE1 3.11Å; T297-E299 PolarHBondContact O-N 2.92Å; T297-E299 VanDerWaalsContact O-N 3.17Å; E299-Q301 VanDerWaalsContact C-N 3.32Å; E299-Q301 PolarHBondContact O-N 2.86Å; E299-K302 PolarHBondContact O-N 2.86Å; E299-K303 WeakPolarHBondContact O-CG 3.3Å; E299-K303 PolarHBondContact O-N 2.83Å
300	D	88.9	Confident	88.7	Confident	58 Å²	58	92 Å²	92	31%	0.31	45%	0.452	S	S	.	.	H	α-helix	trans	-64.4	-40.3	176.6	-58.3	-41.7	0	0	0	111	P296 T297 K303 Q304	P296-D300 HydrophobicContact CB-CB 3.67Å; T297-D300 WeakPolarHBondContact CB-OD2 3.36Å; T297-D300 PolarHBondContact N-OD2 2.85Å; T297-D300 PolarHBondContact O-N 3.17Å; T297-D300 PolarHBondContact OG1-N 2.86Å; T297-D300 PolarHBondContact OG1-OD2 3.41Å; D300-K303 PolarHBondContact O-N 3.26Å; D300-Q304 WeakPolarHBondContact O-CB 3.35Å; D300-Q304 VanDerWaalsContact O-CG 3.25Å; D300-Q304 WeakPolarHBondContact O-CG 3.48Å; D300-Q304 PolarHBondContact O-N 2.88Å
301	Q	89	Confident	88.6	Confident	62 Å²	62	94.6 Å²	94.6	29%	0.29	47%	0.466	S	S	.	.	H	α-helix	trans	-62.7	-45.2	174.5	-68.2	175.8	34	0	0	111.3	Y286 P296 T297 E299 K303 Q304 E305	Y286-Q301 PolarHBondContact OH-NE2 3.16Å; Y286-Q301 PolarHBondContact OH-OE1 2.9Å; P296-Q301 HydrophobicContact CB-CG 3.99Å; P296-Q301 PolarHBondContact O-NE2 3.09Å; T297-Q301 WeakPolarHBondContact O-CG 3.33Å; T297-Q301 PolarHBondContact O-N 3.24Å; E299-Q301 VanDerWaalsContact C-N 3.32Å; E299-Q301 PolarHBondContact O-N 2.86Å; Q301-K303 VanDerWaalsContact C-N 3.34Å; Q301-K303 PolarHBondContact O-N 2.84Å; Q301-Q304 PolarHBondContact O-N 3.45Å; Q301-E305 WeakPolarHBondContact O-CG 3.12Å; Q301-E305 PolarHBondContact O-N 3.47Å
302	K	89.4	Confident	88.5	Confident	125 Å²	125	91.3 Å²	91.3	54%	0.543	47%	0.466	S	S	.	.	H	α-helix	trans	-60.6	-41.2	174.6	-77.9	178.8	-175.8	-177	0	112.4	S298 E299 E305 M306	S298-K302 VanDerWaalsContact O-CG 3.31Å; S298-K302 WeakPolarHBondContact O-CG 3.06Å; S298-K302 PolarHBondContact O-N 2.75Å; S298-K302 VanDerWaalsContact O-N 3.12Å; E299-K302 PolarHBondContact O-N 2.86Å; K302-E305 PolarHBondContact O-N 3.47Å; K302-M306 PolarHBondContact O-N 2.67Å
303	K	88.6	Confident	88.7	Confident	128 Å²	128	88.3 Å²	88.3	56%	0.557	46%	0.463	S	S	*	.	H	α-helix	trans	-62.8	-45.9	175	-72.9	174	-173.8	171.3	0	111.1	E299 D300 Q301 E305 M306 L307	E299-K303 WeakPolarHBondContact O-CG 3.3Å; E299-K303 PolarHBondContact O-N 2.83Å; D300-K303 PolarHBondContact O-N 3.26Å; Q301-K303 VanDerWaalsContact C-N 3.34Å; Q301-K303 PolarHBondContact O-N 2.84Å; K303-E305 VanDerWaalsContact C-N 3.35Å; K303-E305 PolarHBondContact O-N 2.67Å; K303-M306 PolarHBondContact O-N 2.85Å; K303-L307 WeakPolarHBondContact O-CB 3.42Å; K303-L307 PolarHBondContact O-N 2.77Å
304	Q	87	Confident	88.5	Confident	111 Å²	111	85.8 Å²	85.8	52%	0.519	45%	0.449	S	S	.	.	H	α-helix	trans	-62.3	-40	177.1	-72.9	173.8	13.7	0	0	112	D300 Q301 K308	D300-Q304 WeakPolarHBondContact O-CB 3.35Å; D300-Q304 VanDerWaalsContact O-CG 3.25Å; D300-Q304 WeakPolarHBondContact O-CG 3.48Å; D300-Q304 PolarHBondContact O-N 2.88Å; Q301-Q304 PolarHBondContact O-N 3.45Å; Q304-K308 VanDerWaalsContact O-CB 3.29Å; Q304-K308 WeakPolarHBondContact O-CB 3.16Å; Q304-K308 PolarHBondContact O-N 3.46Å
305	E	90.2	Very high	88.2	Confident	118 Å²	118	87.5 Å²	87.5	55%	0.551	45%	0.447	S	S	*	.	H	α-helix	trans	-66.9	-43.4	175.6	-77	-172.4	170.2	0	0	113	Q301 K302 K303 L307 K308 K309	Q301-E305 WeakPolarHBondContact O-CG 3.12Å; Q301-E305 PolarHBondContact O-N 3.47Å; K302-E305 PolarHBondContact O-N 3.47Å; K303-E305 VanDerWaalsContact C-N 3.35Å; K303-E305 PolarHBondContact O-N 2.67Å; E305-L307 VanDerWaalsContact C-N 3.34Å; E305-K308 PolarHBondContact O-N 2.96Å; E305-K309 WeakPolarHBondContact O-CG 3.3Å; E305-K309 PolarHBondContact O-N 3.25Å
306	M	87.8	Confident	87.9	Confident	128 Å²	128	90.3 Å²	90.3	63%	0.631	46%	0.458	S	S	*	.	H	α-helix	trans	-61.4	-45	175.1	-89	-169.1	-76.6	0	0	111.2	K302 K303 K308 K309 F310	K302-M306 PolarHBondContact O-N 2.67Å; K303-M306 PolarHBondContact O-N 2.85Å; M306-K308 VanDerWaalsContact C-N 3.35Å; M306-K308 PolarHBondContact O-N 2.79Å; M306-K309 PolarHBondContact O-N 2.9Å; M306-F310 WeakPolarHBondContact O-CB 3.41Å; M306-F310 PolarHBondContact O-N 3.15Å
307	L	85.9	Confident	87.5	Confident	48 Å²	48	92.1 Å²	92.1	25%	0.251	46%	0.463	S	S	.	.	H	α-helix	trans	-61.3	-44.6	176.1	-179.6	63	0	0	0	111.1	K303 E305 K309 F310 M311 F324	K303-L307 WeakPolarHBondContact O-CB 3.42Å; K303-L307 PolarHBondContact O-N 2.77Å; E305-L307 VanDerWaalsContact C-N 3.34Å; L307-K309 PolarHBondContact O-N 2.97Å; L307-F310 WeakPolarHBondContact O-CB 3.4Å; L307-F310 PolarHBondContact O-N 3.33Å; L307-M311 HydrophobicContact CD1-CG 4.31Å; L307-M311 HydrophobicContact CD1-SD 4.37Å; L307-M311 HydrophobicContact CG-CG 4.43Å; L307-M311 HydrophobicContact CG-SD 4.05Å; L307-M311 VanDerWaalsContact O-CG 3.24Å; L307-M311 WeakPolarHBondContact O-CG 3.34Å; L307-M311 PolarHBondContact O-N 2.84Å; L307-F324 HydrophobicContact CD1-CD1 4.23Å; L307-F324 HydrophobicContact CD1-CE1 3.42Å; L307-F324 VanDerWaalsContact CD1-CE1 3.42Å; L307-F324 HydrophobicContact CD1-CZ 3.84Å; L307-F324 HydrophobicContact CD2-CD1 3.55Å; L307-F324 HydrophobicContact CD2-CD2 4.08Å; L307-F324 HydrophobicContact CD2-CE1 3.36Å; L307-F324 HydrophobicContact CD2-CE2 3.91Å; L307-F324 HydrophobicContact CD2-CG 3.92Å; L307-F324 HydrophobicContact CD2-CZ 3.55Å; L307-F324 HydrophobicContact CG-CE1 4.01Å; L307-F324 HydrophobicContact CG-CZ 4.21Å
308	K	87.8	Confident	87	Confident	161 Å²	161	97 Å²	97	70%	0.7	49%	0.489	S	S	*	.	H	α-helix	trans	-62.6	-40.9	177.8	-170.7	176	-178.8	179.2	0	112.4	Q304 E305 M306 A312	Q304-K308 VanDerWaalsContact O-CB 3.29Å; Q304-K308 WeakPolarHBondContact O-CB 3.16Å; Q304-K308 PolarHBondContact O-N 3.46Å; E305-K308 PolarHBondContact O-N 2.96Å; M306-K308 VanDerWaalsContact C-N 3.35Å; M306-K308 PolarHBondContact O-N 2.79Å; K308-A312 WeakPolarHBondContact O-CB 3.01Å; K308-A312 PolarHBondContact O-N 3.48Å
309	K	89.2	Confident	86.5	Confident	151 Å²	151	97.6 Å²	97.6	66%	0.657	49%	0.49	S	S	*	.	H	α-helix	trans	-63.9	-41.2	173.4	-76.7	179.1	-177.7	171.6	0	111.7	E305 M306 L307 A312 A313	E305-K309 WeakPolarHBondContact O-CG 3.3Å; E305-K309 PolarHBondContact O-N 3.25Å; M306-K309 PolarHBondContact O-N 2.9Å; L307-K309 PolarHBondContact O-N 2.97Å; K309-A312 PolarHBondContact O-N 2.81Å; K309-A313 WeakPolarHBondContact O-CB 3.4Å; K309-A313 PolarHBondContact O-N 3.25Å
310	F	88.3	Confident	86	Confident	98 Å²	98	97.2 Å²	97.2	43%	0.43	50%	0.498	S	S	.	.	H	α-helix	trans	-63.7	-45.9	177	-173.5	-101.7	0	0	0	112	M306 L307 A312 A313 H314 M317 F319	M306-F310 WeakPolarHBondContact O-CB 3.41Å; M306-F310 PolarHBondContact O-N 3.15Å; L307-F310 WeakPolarHBondContact O-CB 3.4Å; L307-F310 PolarHBondContact O-N 3.33Å; F310-A312 VanDerWaalsContact C-N 3.32Å; F310-A312 PolarHBondContact O-N 2.83Å; F310-A313 PolarHBondContact O-N 2.95Å; F310-H314 AromaticContact CD2-CD2 3.75Å; F310-H314 AromaticContact CE2-CD2 3.55Å; F310-H314 AromaticContact CE2-NE2 3.65Å; F310-H314 AromaticContact CZ-CD2 3.81Å; F310-H314 PolarHBondContact O-CD2 2.88Å; F310-H314 VanDerWaalsContact O-CD2 3.32Å; F310-H314 PolarHBondContact O-N 2.71Å; F310-H314 VanDerWaalsContact O-N 3.12Å; F310-M317 HydrophobicContact CE1-CE 3.61Å; F310-M317 HydrophobicContact CZ-CE 3.63Å; F310-F319 AromaticContact CD1-CE1 3.91Å; F310-F319 HydrophobicContact CD1-CE1 3.91Å; F310-F319 AromaticContact CD1-CZ 3.62Å; F310-F319 HydrophobicContact CD1-CZ 3.62Å; F310-F319 AromaticContact CE1-CE1 3.85Å; F310-F319 HydrophobicContact CE1-CE1 3.85Å; F310-F319 AromaticContact CE1-CZ 3.61Å; F310-F319 HydrophobicContact CE1-CZ 3.61Å
311	M	87.3	Confident	85.4	Confident	78 Å²	78	103.3 Å²	103.3	38%	0.384	52%	0.522	S	S	.	.	H	α-helix	trans	-62.4	-38.1	176	-66.1	176.2	69.4	0	0	112.3	L307 H314 F319	L307-M311 HydrophobicContact CD1-CG 4.31Å; L307-M311 HydrophobicContact CD1-SD 4.37Å; L307-M311 HydrophobicContact CG-CG 4.43Å; L307-M311 HydrophobicContact CG-SD 4.05Å; L307-M311 VanDerWaalsContact O-CG 3.24Å; L307-M311 WeakPolarHBondContact O-CG 3.34Å; L307-M311 PolarHBondContact O-N 2.84Å; M311-H314 CarbonylContact O-C 3.55Å; M311-H314 PolarHBondContact O-N 2.76Å; M311-F319 HydrophobicContact CB-CD2 4.23Å; M311-F319 HydrophobicContact CB-CE2 4.07Å; M311-F319 HydrophobicContact CE-CB 3.7Å; M311-F319 HydrophobicContact CE-CD2 3.88Å; M311-F319 HydrophobicContact CE-CG 3.92Å; M311-F319 HydrophobicContact CG-CD1 4.19Å; M311-F319 HydrophobicContact CG-CD2 3.63Å; M311-F319 HydrophobicContact CG-CE1 4.22Å; M311-F319 HydrophobicContact CG-CE2 3.67Å; M311-F319 HydrophobicContact CG-CG 3.9Å; M311-F319 HydrophobicContact CG-CZ 3.97Å; M311-F319 HydrophobicContact SD-CB 4.45Å; M311-F319 HydrophobicContact SD-CD2 4.43Å; M311-F319 HydrophobicContact SD-CG 4.3Å
312	A	89	Confident	84.6	Confident	79 Å²	79	103.5 Å²	103.5	65%	0.653	53%	0.53	S	S	*	.	H	α-helix	trans	-71.2	-31.5	177.3	0	0	0	0	0	113.3	K308 K309 F310 H314	K308-A312 WeakPolarHBondContact O-CB 3.01Å; K308-A312 PolarHBondContact O-N 3.48Å; K309-A312 PolarHBondContact O-N 2.81Å; F310-A312 VanDerWaalsContact C-N 3.32Å; F310-A312 PolarHBondContact O-N 2.83Å; A312-H314 VanDerWaalsContact C-N 3.33Å
313	A	89.6	Confident	83.4	Confident	66 Å²	66	107.2 Å²	107.2	55%	0.545	55%	0.546	S	S	.	.	H	α-helix	trans	-77.1	-20.1	176.4	0	0	0	0	0	113.1	K309 F310 P315	K309-A313 WeakPolarHBondContact O-CB 3.4Å; K309-A313 PolarHBondContact O-N 3.25Å; F310-A313 PolarHBondContact O-N 2.95Å; A313-P315 VanDerWaalsContact C-CD 3.43Å; A313-P315 WeakPolarHBondContact O-CD 3.49Å
314	H	85.9	Confident	82.3	Confident	62 Å²	62	107 Å²	107	29%	0.287	55%	0.545	S	S	.	.			trans	-126.5	65.2	-178.1	-63.7	-68.3	0	0	0	112	F310 M311 A312 E316 M317	F310-H314 AromaticContact CD2-CD2 3.75Å; F310-H314 AromaticContact CE2-CD2 3.55Å; F310-H314 AromaticContact CE2-NE2 3.65Å; F310-H314 AromaticContact CZ-CD2 3.81Å; F310-H314 PolarHBondContact O-CD2 2.88Å; F310-H314 VanDerWaalsContact O-CD2 3.32Å; F310-H314 PolarHBondContact O-N 2.71Å; F310-H314 VanDerWaalsContact O-N 3.12Å; M311-H314 CarbonylContact O-C 3.55Å; M311-H314 PolarHBondContact O-N 2.76Å; A312-H314 VanDerWaalsContact C-N 3.33Å; H314-E316 IonicContact ND1-OE1 3.54Å; H314-E316 PolarHBondContact ND1-OE1 2.63Å; H314-E316 PolarHBondContact O-N 2.78Å; H314-M317 HydrophobicContact CB-CB 4.38Å; H314-M317 HydrophobicContact CB-CE 3.24Å; H314-M317 HydrophobicContact CB-CG 4.43Å; H314-M317 PolarHBondContact O-N 2.73Å
315	P	83.4	Confident	81	Confident	105 Å²	105	110.8 Å²	110.8	68%	0.682	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	-19.5	-179.6	27	-33.9	0	0	0	113.1	A313 M317	A313-P315 VanDerWaalsContact C-CD 3.43Å; A313-P315 WeakPolarHBondContact O-CD 3.49Å; P315-M317 VanDerWaalsContact C-N 3.3Å
316	E	84.8	Confident	80.6	Confident	144 Å²	144	110.5 Å²	110.5	67%	0.673	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	-17.4	172.6	61.4	-82	174.4	0	0	114.8	H314	H314-E316 IonicContact ND1-OE1 3.54Å; H314-E316 PolarHBondContact ND1-OE1 2.63Å; H314-E316 PolarHBondContact O-N 2.78Å
317	M	79.8	Confident	80.2	Confident	81 Å²	81	109.5 Å²	109.5	40%	0.399	58%	0.583	S	S	.	*	S	Bend	trans	-89.9	124.1	179.1	-78.9	-164.9	-77.5	0	0	111.7	F310 H314 P315 F319	F310-M317 HydrophobicContact CE1-CE 3.61Å; F310-M317 HydrophobicContact CZ-CE 3.63Å; H314-M317 HydrophobicContact CB-CB 4.38Å; H314-M317 HydrophobicContact CB-CE 3.24Å; H314-M317 HydrophobicContact CB-CG 4.43Å; H314-M317 PolarHBondContact O-N 2.73Å; P315-M317 VanDerWaalsContact C-N 3.3Å; M317-F319 HydrophobicContact CB-CD2 4.24Å; M317-F319 HydrophobicContact CB-CE2 3.55Å; M317-F319 HydrophobicContact CB-CZ 3.85Å; M317-F319 HydrophobicContact CE-CZ 4.03Å; M317-F319 WeakPolarHBondContact O-CD2 3.28Å; M317-F319 WeakPolarHBondContact O-CE2 3.36Å; M317-F319 PolarHBondContact O-N 3.48Å; M317-F319 HydrophobicContact SD-CZ 4.37Å
318	D	79.2	Confident	79.9	Confident	117 Å²	117	112.9 Å²	112.9	63%	0.626	60%	0.602	S	S	*	*			trans	-83.3	106.5	172.4	179.2	17.7	0	0	0	111	S320	D318-S320 WeakPolarHBondContact OD1-CB 3.26Å; D318-S320 PolarHBondContact OD1-N 2.7Å; D318-S320 PolarHBondContact OD1-OG 3.25Å; D318-S320 PolarHBondContact OD2-OG 3.21Å
319	F	77	Confident	79.4	Confident	28 Å²	28	110.1 Å²	110.1	12%	0.123	60%	0.596	C	S	.	*			trans	-89.4	3.8	175.7	-63.2	-90.3	0	0	0	113.4	F310 M311 M317 K321 C322 F324	F310-F319 AromaticContact CD1-CE1 3.91Å; F310-F319 HydrophobicContact CD1-CE1 3.91Å; F310-F319 AromaticContact CD1-CZ 3.62Å; F310-F319 HydrophobicContact CD1-CZ 3.62Å; F310-F319 AromaticContact CE1-CE1 3.85Å; F310-F319 HydrophobicContact CE1-CE1 3.85Å; F310-F319 AromaticContact CE1-CZ 3.61Å; F310-F319 HydrophobicContact CE1-CZ 3.61Å; M311-F319 HydrophobicContact CB-CD2 4.23Å; M311-F319 HydrophobicContact CB-CE2 4.07Å; M311-F319 HydrophobicContact CE-CB 3.7Å; M311-F319 HydrophobicContact CE-CD2 3.88Å; M311-F319 HydrophobicContact CE-CG 3.92Å; M311-F319 HydrophobicContact CG-CD1 4.19Å; M311-F319 HydrophobicContact CG-CD2 3.63Å; M311-F319 HydrophobicContact CG-CE1 4.22Å; M311-F319 HydrophobicContact CG-CE2 3.67Å; M311-F319 HydrophobicContact CG-CG 3.9Å; M311-F319 HydrophobicContact CG-CZ 3.97Å; M311-F319 HydrophobicContact SD-CB 4.45Å; M311-F319 HydrophobicContact SD-CD2 4.43Å; M311-F319 HydrophobicContact SD-CG 4.3Å; M317-F319 HydrophobicContact CB-CD2 4.24Å; M317-F319 HydrophobicContact CB-CE2 3.55Å; M317-F319 HydrophobicContact CB-CZ 3.85Å; M317-F319 HydrophobicContact CE-CZ 4.03Å; M317-F319 WeakPolarHBondContact O-CD2 3.28Å; M317-F319 WeakPolarHBondContact O-CE2 3.36Å; M317-F319 PolarHBondContact O-N 3.48Å; M317-F319 HydrophobicContact SD-CZ 4.37Å; F319-K321 PolarHBondContact O-N 3.01Å; F319-C322 PolarHBondContact O-N 2.99Å; F319-F324 HydrophobicContact CD1-CZ 4.37Å
320	S	78.3	Confident	78.8	Confident	94 Å²	94	107.6 Å²	107.6	66%	0.657	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	-19.7	-177.2	69.1	0	0	0	0	113.7	D318	D318-S320 WeakPolarHBondContact OD1-CB 3.26Å; D318-S320 PolarHBondContact OD1-N 2.7Å; D318-S320 PolarHBondContact OD1-OG 3.25Å; D318-S320 PolarHBondContact OD2-OG 3.21Å
321	K	75.5	Confident	78.2	Confident	186 Å²	186	108.2 Å²	108.2	81%	0.809	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.7	1.6	178.3	-61.2	-176.1	-176.1	175.7	0	114.3	F319 K323	F319-K321 PolarHBondContact O-N 3.01Å; K321-K323 PolarHBondContact O-N 3.2Å
322	C	71.7	Confident	77.5	Confident	66 Å²	66	110.4 Å²	110.4	45%	0.446	62%	0.619	S	S	.	*			trans	-76.5	122.3	177.5	-84.5	0	0	0	0	110.8	F319 F324	F319-C322 PolarHBondContact O-N 2.99Å; C322-F324 HydrophobicContact CB-CE1 3.95Å; C322-F324 HydrophobicContact CB-CE2 3.9Å; C322-F324 HydrophobicContact CB-CZ 3.51Å
323	K	66.1	Low	76.7	Confident	202 Å²	202	112.8 Å²	112.8	88%	0.878	62%	0.616	S	S	*	*			trans	-86.6	114.2	163.6	-73.1	-172.6	178	-176.7	0	108.4	K321	K321-K323 PolarHBondContact O-N 3.2Å
324	F	64.9	Low	75.6	Confident	123 Å²	123	116.7 Å²	116.7	54%	0.539	62%	0.622	S	S	.	*			trans	-88.4	118.3	170.3	-54.6	-72.8	0	0	0	107.5	L307 F319 C322	L307-F324 HydrophobicContact CD1-CD1 4.23Å; L307-F324 HydrophobicContact CD1-CE1 3.42Å; L307-F324 VanDerWaalsContact CD1-CE1 3.42Å; L307-F324 HydrophobicContact CD1-CZ 3.84Å; L307-F324 HydrophobicContact CD2-CD1 3.55Å; L307-F324 HydrophobicContact CD2-CD2 4.08Å; L307-F324 HydrophobicContact CD2-CE1 3.36Å; L307-F324 HydrophobicContact CD2-CE2 3.91Å; L307-F324 HydrophobicContact CD2-CG 3.92Å; L307-F324 HydrophobicContact CD2-CZ 3.55Å; L307-F324 HydrophobicContact CG-CE1 4.01Å; L307-F324 HydrophobicContact CG-CZ 4.21Å; F319-F324 HydrophobicContact CD1-CZ 4.37Å; C322-F324 HydrophobicContact CB-CE1 3.95Å; C322-F324 HydrophobicContact CB-CE2 3.9Å; C322-F324 HydrophobicContact CB-CZ 3.51Å
325	S	60.4	Low	74.6	Confident	192 Å²	192	121.6 Å²	121.6	100%	1.343	65%	0.652	S	S	*	*			trans	-106.9	0	173.2	-58.2	0	0	0	0	110.1

Retrieved 325 of 325 residues in 299.1 ms (Link to these results)

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