A0A087XAM8_POEFO Loading...

40S ribosomal protein S7

AlphaFold DB , UniProt , Accession A0A087XAM8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 192 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] 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
1M35.9Very low60.3Low242 Ų24292.4 Ų92.4100%1.19253%0.534SS*.  0127.30-81.2171.2138.100107.7S3M1-S3 PolarHBondContact O-N 3.37Å; M1-S3 VanDerWaalsContact O-N 3.14Å
2F33.4Very low61Low194 Ų19497.3 Ų97.385%0.85156%0.557SS**  trans-16.494.6-164.5-72.2-86.8000117.4T4F2-T4 HydrophobicContact CD1-CG2 4.28Å; F2-T4 PolarHBondContact O-N 3.41Å
3S45.1Very low61.6Low128 Ų12895.3 Ų95.390%0.89557%0.571SS**  trans-9083.7155.6177.80000107.2M1M1-S3 PolarHBondContact O-N 3.37Å; M1-S3 VanDerWaalsContact O-N 3.14Å
4T47.2Very low62.8Low71 Ų7197.6 Ų97.644%0.43657%0.572SS.*SBendtrans-129.4110.7173.638.90000105.8F2 A6F2-T4 HydrophobicContact CD1-CG2 4.28Å; F2-T4 PolarHBondContact O-N 3.41Å; T4-A6 PolarHBondContact O-N 3Å
5S55.5Low63.7Low107 Ų107103.3 Ų103.375%0.74859%0.587SS**  trans-4.1101.2-174.6-76.60000115.2K7S5-K7 PolarHBondContact O-N 3.08Å
6A65.2Low64.6Low69 Ų69100.7 Ų100.757%0.5758%0.575SS**  trans-57.6116.2167.100000108.2T4 I8T4-A6 PolarHBondContact O-N 3Å; A6-I8 HydrophobicContact CB-CG2 4.29Å; A6-I8 PolarHBondContact O-N 3.25Å
7K75.2Confident65.7Low15 Ų15100.5 Ų100.57%0.06557%0.572CS.*SBendtrans-73-2.8174.6-74.5-169.9174.1-170.40112.4S5 S24 L27 E31 L40 H44 I45S5-K7 PolarHBondContact O-N 3.08Å; K7-S24 PolarHBondContact N-OG 2.92Å; K7-L27 HydrophobicContact CD-CB 3.63Å; K7-L27 PolarHBondContact NZ-O 3.44Å; K7-E31 WeakPolarHBondContact CE-OE2 3.36Å; K7-E31 IonicContact NZ-OE2 2.56Å; K7-E31 PolarHBondContact NZ-OE2 3.06Å; K7-L40 PolarHBondContact NZ-O 3.06Å; K7-H44 CarbonylContact O-C 3.51Å; K7-H44 VanDerWaalsContact O-CA 3.23Å; K7-H44 WeakPolarHBondContact O-CA 3.33Å; K7-H44 VanDerWaalsContact O-CB 3.24Å; K7-H44 WeakPolarHBondContact O-CB 3.45Å; K7-I45 WeakPolarHBondContact O-CG1 3.46Å; K7-I45 PolarHBondContact O-N 3.44Å
8I80.3Confident66.7Low17 Ų17105.2 Ų105.29%0.08759%0.589CS.*BIsolated β-bridgetrans-98125.1173.4-170.9159.3000110.8A6 K10 P16 E20 I45A6-I8 HydrophobicContact CB-CG2 4.29Å; A6-I8 PolarHBondContact O-N 3.25Å; I8-K10 HydrophobicContact CD1-CG 4.46Å; I8-K10 HydrophobicContact CG1-CG 4.39Å; I8-P16 HydrophobicContact CD1-CB 4.2Å; I8-P16 HydrophobicContact CG2-CB 3.86Å; I8-P16 HydrophobicContact CG2-CG 4.33Å; I8-E20 HydrophobicContact CD1-CB 3.51Å; I8-E20 HydrophobicContact CD1-CG 3.96Å; I8-I45 WeakPolarHBondContact CA-O 3.3Å; I8-I45 HydrophobicContact CB-CG1 4.12Å; I8-I45 HydrophobicContact CG1-CG1 4.31Å
9V80Confident67.8Low77 Ų77103 Ų10347%0.46757%0.572SS.*  trans-124.996.9172.6-177.30000107.3H44 I45 T46V9-H44 HydrophobicContact CG2-CB 4.08Å; V9-I45 PolarHBondContact N-O 2.87Å; V9-T46 WeakPolarHBondContact O-CA 3.37Å
10K76.9Confident68.7Low29 Ų2998.2 Ų98.213%0.12655%0.545CS..  trans-68.5139177.1-78.3-166.1174175.40110.8I8 N12 G13 E14 K15 D17 E20I8-K10 HydrophobicContact CD1-CG 4.46Å; I8-K10 HydrophobicContact CG1-CG 4.39Å; K10-N12 PolarHBondContact O-N 3.16Å; K10-G13 PolarHBondContact O-N 2.84Å; K10-E14 HydrophobicContact CB-CB 4.39Å; K10-E14 HydrophobicContact CD-CB 3.73Å; K10-E14 WeakPolarHBondContact CD-O 3.42Å; K10-K15 PolarHBondContact NZ-O 3.49Å; K10-D17 IonicContact NZ-OD1 3.94Å; K10-E20 VanDerWaalsContact CE-CD 3.49Å; K10-E20 WeakPolarHBondContact CE-OE2 3.5Å; K10-E20 IonicContact NZ-OE1 2.82Å; K10-E20 IonicContact NZ-OE2 3.68Å; K10-E20 PolarHBondContact NZ-OE2 3.43Å
11P69Low69.6Low67 Ų6795.4 Ų95.444%0.43553%0.533SS..THydrogen-bonded Turntrans-61.6124.4166.527.1-31.3000107.9
12N68.6Low72Confident152 Ų15285.2 Ų85.281%0.81349%0.49SS*.THydrogen-bonded Turntrans846.8-177.9-41.7-30.4000117K10 E14K10-N12 PolarHBondContact O-N 3.16Å; N12-E14 VanDerWaalsContact C-N 3.3Å; N12-E14 PolarHBondContact O-N 3.28Å
13G69Low74.7Confident71 Ų7176 Ų7673%0.73245%0.449SS*.  trans71.322.517200000114.9K10K10-G13 PolarHBondContact O-N 2.84Å
14E77.8Confident76.7Confident127 Ų12770.5 Ų70.559%0.59341%0.411SS*.PPolyproline II helixtrans-63.2153.7171.7-73.3177-17800111.6K10 N12K10-E14 HydrophobicContact CB-CB 4.39Å; K10-E14 HydrophobicContact CD-CB 3.73Å; K10-E14 WeakPolarHBondContact CD-O 3.42Å; N12-E14 VanDerWaalsContact C-N 3.3Å; N12-E14 PolarHBondContact O-N 3.28Å
15K76.4Confident78.6Confident184 Ų18473.2 Ų73.280%0.842%0.418SS*.PPolyproline II helixtrans-68.4137.6177.5-67.6-178.5-179.7177.10110.1K10K10-K15 PolarHBondContact NZ-O 3.49Å
16P77.6Confident80.1Confident61 Ų6168.4 Ų68.440%0.39639%0.385SS..PPolyproline II helixtrans-67.8145176.629.1-34.1000111I8I8-P16 HydrophobicContact CD1-CB 4.2Å; I8-P16 HydrophobicContact CG2-CB 3.86Å; I8-P16 HydrophobicContact CG2-CG 4.33Å
17D83.6Confident81.2Confident98 Ų9865.3 Ų65.352%0.52436%0.359SS..PPolyproline II helixtrans-74.2162.7174.7-68.1-17.2000110.2K10 F19 E20 S21K10-D17 IonicContact NZ-OD1 3.94Å; D17-F19 VanDerWaalsContact C-N 3.27Å; D17-F19 PolarHBondContact O-N 3.16Å; D17-E20 HydrophobicContact CB-CB 4.46Å; D17-E20 HydrophobicContact CB-CG 4.17Å; D17-E20 PolarHBondContact N-OE2 3.14Å; D17-E20 PolarHBondContact O-N 3.31Å; D17-S21 WeakPolarHBondContact O-CB 3.33Å; D17-S21 PolarHBondContact O-N 3.16Å; D17-S21 PolarHBondContact O-OG 3.42Å
18E84.7Confident81.7Confident185 Ų18566.5 Ų66.586%0.86437%0.366SS*.Hα-helixtrans-58.5-41.2177.9-65.8-179.717600111.6S21 G22E18-S21 WeakPolarHBondContact O-CB 3.48Å; E18-S21 PolarHBondContact O-N 3.46Å; E18-G22 PolarHBondContact O-N 2.87Å
19F86.5Confident82Confident63 Ų6370.2 Ų70.228%0.27638%0.383SS..Hα-helixtrans-62.7-44.4176.6-178.5-106.3000112.3D17 S21 G22 I23 A48 E50 I60D17-F19 VanDerWaalsContact C-N 3.27Å; D17-F19 PolarHBondContact O-N 3.16Å; F19-S21 VanDerWaalsContact C-N 3.32Å; F19-S21 PolarHBondContact O-N 3.32Å; F19-G22 PolarHBondContact O-N 3.47Å; F19-I23 HydrophobicContact CD1-CD1 3.93Å; F19-I23 HydrophobicContact CE1-CD1 3.36Å; F19-I23 HydrophobicContact CE1-CG1 4.47Å; F19-I23 HydrophobicContact CZ-CD1 3.7Å; F19-I23 PolarHBondContact O-N 2.85Å; F19-I23 VanDerWaalsContact O-N 3.12Å; F19-A48 HydrophobicContact CE1-CB 4.29Å; F19-E50 HydrophobicContact CE1-CB 4.1Å; F19-E50 HydrophobicContact CE2-CB 4.25Å; F19-E50 HydrophobicContact CZ-CB 3.83Å; F19-E50 HydrophobicContact CZ-CG 4.48Å; F19-I60 HydrophobicContact CE1-CG2 4.14Å; F19-I60 HydrophobicContact CZ-CD1 4.06Å; F19-I60 HydrophobicContact CZ-CG1 4.03Å; F19-I60 HydrophobicContact CZ-CG2 3.9Å
20E86.9Confident82.2Confident7 Ų767.2 Ų67.23%0.03336%0.364CS..Hα-helixtrans-67.5-35.5178.7-66.4-179.714000112.2I8 K10 D17 G22 I23 S24 A47 A48I8-E20 HydrophobicContact CD1-CB 3.51Å; I8-E20 HydrophobicContact CD1-CG 3.96Å; K10-E20 VanDerWaalsContact CE-CD 3.49Å; K10-E20 WeakPolarHBondContact CE-OE2 3.5Å; K10-E20 IonicContact NZ-OE1 2.82Å; K10-E20 IonicContact NZ-OE2 3.68Å; K10-E20 PolarHBondContact NZ-OE2 3.43Å; D17-E20 HydrophobicContact CB-CB 4.46Å; D17-E20 HydrophobicContact CB-CG 4.17Å; D17-E20 PolarHBondContact N-OE2 3.14Å; D17-E20 PolarHBondContact O-N 3.31Å; E20-G22 VanDerWaalsContact C-N 3.32Å; E20-I23 PolarHBondContact O-N 3.1Å; E20-S24 PolarHBondContact O-N 3.06Å; E20-A47 VanDerWaalsContact OE1-CA 3.28Å; E20-A47 WeakPolarHBondContact OE1-CA 3.2Å; E20-A48 HydrophobicContact CG-CB 4.17Å; E20-A48 PolarHBondContact OE1-N 3.04Å; E20-A48 VanDerWaalsContact OE1-N 3.07Å
21S86.3Confident82.5Confident40 Ų4067.4 Ų67.428%0.2837%0.366SS..Hα-helixtrans-63.2-40.5173.8-59.10000110.9D17 E18 F19 I23 S24 Q25D17-S21 WeakPolarHBondContact O-CB 3.33Å; D17-S21 PolarHBondContact O-N 3.16Å; D17-S21 PolarHBondContact O-OG 3.42Å; E18-S21 WeakPolarHBondContact O-CB 3.48Å; E18-S21 PolarHBondContact O-N 3.46Å; F19-S21 VanDerWaalsContact C-N 3.32Å; F19-S21 PolarHBondContact O-N 3.32Å; S21-I23 PolarHBondContact O-N 3.21Å; S21-S24 PolarHBondContact O-N 3.33Å; S21-Q25 WeakPolarHBondContact O-CG 3.27Å; S21-Q25 PolarHBondContact O-N 3.04Å
22G87.4Confident83.1Confident28 Ų2870.7 Ų70.729%0.28938%0.377SS..Hα-helixtrans-60.8-41.3172.700000113.1E18 F19 E20 Q25 A26E18-G22 PolarHBondContact O-N 2.87Å; F19-G22 PolarHBondContact O-N 3.47Å; E20-G22 VanDerWaalsContact C-N 3.32Å; G22-Q25 PolarHBondContact O-N 3.32Å; G22-A26 PolarHBondContact O-N 3.19Å
23I88.9Confident83.5Confident0 Ų070.1 Ų70.10%037%0.374CS..Hα-helixtrans-67.6-39.8175-67.7168.5000111.3F19 E20 S21 Q25 A26 L27 I45 A48 I60 I62 F87F19-I23 HydrophobicContact CD1-CD1 3.93Å; F19-I23 HydrophobicContact CE1-CD1 3.36Å; F19-I23 HydrophobicContact CE1-CG1 4.47Å; F19-I23 HydrophobicContact CZ-CD1 3.7Å; F19-I23 PolarHBondContact O-N 2.85Å; F19-I23 VanDerWaalsContact O-N 3.12Å; E20-I23 PolarHBondContact O-N 3.1Å; S21-I23 PolarHBondContact O-N 3.21Å; I23-Q25 VanDerWaalsContact C-N 3.32Å; I23-Q25 PolarHBondContact O-N 3.31Å; I23-A26 PolarHBondContact O-N 2.86Å; I23-L27 HydrophobicContact CG2-CD1 4.18Å; I23-L27 HydrophobicContact CG2-CG 4.49Å; I23-L27 WeakPolarHBondContact O-CG 3.41Å; I23-L27 PolarHBondContact O-N 3.4Å; I23-I45 HydrophobicContact CG2-CD1 3.82Å; I23-A48 HydrophobicContact CD1-CB 3.3Å; I23-I60 HydrophobicContact CD1-CG2 3.79Å; I23-I62 HydrophobicContact CG2-CD1 4.07Å; I23-F87 HydrophobicContact CG1-CE1 4.37Å; I23-F87 HydrophobicContact CG1-CE2 4.29Å; I23-F87 HydrophobicContact CG1-CZ 3.68Å
24S87.1Confident83.8Confident13 Ų1367.7 Ų67.79%0.09135%0.346CS..Hα-helixtrans-61.5-41.6176-175.80000111.7K7 E20 S21 L27 L28K7-S24 PolarHBondContact N-OG 2.92Å; E20-S24 PolarHBondContact O-N 3.06Å; S21-S24 PolarHBondContact O-N 3.33Å; S24-L27 PolarHBondContact O-N 3.16Å; S24-L28 PolarHBondContact O-N 3.12Å
25Q87.4Confident83.7Confident127 Ų12769.5 Ų69.559%0.59336%0.359SS*.Hα-helixtrans-63.6-46.4175.2-72.9174.2-2.400111.1S21 G22 I23 L27 L28 E29S21-Q25 WeakPolarHBondContact O-CG 3.27Å; S21-Q25 PolarHBondContact O-N 3.04Å; G22-Q25 PolarHBondContact O-N 3.32Å; I23-Q25 VanDerWaalsContact C-N 3.32Å; I23-Q25 PolarHBondContact O-N 3.31Å; Q25-L27 VanDerWaalsContact C-N 3.27Å; Q25-L27 PolarHBondContact O-N 2.85Å; Q25-L28 PolarHBondContact O-N 2.6Å; Q25-E29 WeakPolarHBondContact O-CG 3.35Å; Q25-E29 PolarHBondContact O-N 3.18Å
26A88.4Confident83.7Confident7 Ų761.2 Ų61.26%0.05832%0.324CS..Hα-helixtrans-57.2-40.8177.500000112.1G22 I23 L30 L83 K86 F87G22-A26 PolarHBondContact O-N 3.19Å; I23-A26 PolarHBondContact O-N 2.86Å; A26-L30 VanDerWaalsContact O-CG 3.3Å; A26-L30 WeakPolarHBondContact O-CG 3.27Å; A26-L30 PolarHBondContact O-N 3.13Å; A26-L30 VanDerWaalsContact O-N 3.15Å; A26-L83 HydrophobicContact CB-CD2 4.32Å; A26-K86 HydrophobicContact CB-CD 4.03Å; A26-K86 PolarHBondContact O-NZ 3.37Å; A26-F87 HydrophobicContact CB-CE2 4.32Å; A26-F87 HydrophobicContact CB-CZ 4.2Å
27L87.1Confident83.7Confident4 Ų463 Ų632%0.02133%0.325CS..Hα-helixtrans-71.7-28177-72.1173000113.8K7 I23 S24 Q25 E31 I45 L79 L83K7-L27 HydrophobicContact CD-CB 3.63Å; K7-L27 PolarHBondContact NZ-O 3.44Å; I23-L27 HydrophobicContact CG2-CD1 4.18Å; I23-L27 HydrophobicContact CG2-CG 4.49Å; I23-L27 WeakPolarHBondContact O-CG 3.41Å; I23-L27 PolarHBondContact O-N 3.4Å; S24-L27 PolarHBondContact O-N 3.16Å; Q25-L27 VanDerWaalsContact C-N 3.27Å; Q25-L27 PolarHBondContact O-N 2.85Å; L27-E31 PolarHBondContact O-N 3.38Å; L27-I45 HydrophobicContact CD1-CD1 4.07Å; L27-I45 HydrophobicContact CD1-CG1 4.45Å; L27-I45 HydrophobicContact CD1-CG2 3.91Å; L27-L79 HydrophobicContact CD2-CD2 4.36Å; L27-L83 HydrophobicContact CD2-CD1 4.39Å; L27-L83 HydrophobicContact CD2-CD2 4.26Å
28L86.4Confident83.7Confident39 Ų3962.1 Ų62.120%0.20433%0.332CS..Hα-helixtrans-74-44.4176.1-166.9155.4000110.4S24 Q25 L30 E31 M32S24-L28 PolarHBondContact O-N 3.12Å; Q25-L28 PolarHBondContact O-N 2.6Å; L28-L30 VanDerWaalsContact C-N 3.27Å; L28-L30 PolarHBondContact O-N 3.49Å; L28-E31 WeakPolarHBondContact O-CB 3.48Å; L28-E31 PolarHBondContact O-N 3.16Å; L28-E31 VanDerWaalsContact O-N 3.1Å; L28-M32 HydrophobicContact CD2-CG 4.26Å; L28-M32 HydrophobicContact CD2-SD 3.93Å; L28-M32 PolarHBondContact O-N 2.64Å; L28-M32 VanDerWaalsContact O-N 3.09Å
29E86.1Confident83.6Confident96 Ų9657.9 Ų57.945%0.44931%0.312SS..Hα-helixtrans-58.9-39.4173-71.5172.5-177.900112.1Q25 E31 M32 N33 K86Q25-E29 WeakPolarHBondContact O-CG 3.35Å; Q25-E29 PolarHBondContact O-N 3.18Å; E29-E31 VanDerWaalsContact C-N 3.33Å; E29-M32 PolarHBondContact O-N 3.3Å; E29-N33 WeakPolarHBondContact O-CB 3.37Å; E29-N33 PolarHBondContact O-N 2.82Å; E29-N33 VanDerWaalsContact O-N 3.1Å; E29-N33 PolarHBondContact O-ND2 3.32Å; E29-K86 VanDerWaalsContact CB-NZ 3.3Å; E29-K86 IonicContact OE2-NZ 2.68Å; E29-K86 PolarHBondContact OE2-NZ 2.85Å
30L84.3Confident83.4Confident14 Ų1455 Ų557%0.07330%0.299CS..Hα-helixtrans-65.6-36.2175.6-70.4179.5000112.1A26 L28 M32 N33 S34 L40 E82 L83A26-L30 VanDerWaalsContact O-CG 3.3Å; A26-L30 WeakPolarHBondContact O-CG 3.27Å; A26-L30 PolarHBondContact O-N 3.13Å; A26-L30 VanDerWaalsContact O-N 3.15Å; L28-L30 VanDerWaalsContact C-N 3.27Å; L28-L30 PolarHBondContact O-N 3.49Å; L30-M32 VanDerWaalsContact C-N 3.3Å; L30-M32 PolarHBondContact O-N 3.45Å; L30-N33 PolarHBondContact O-N 3.28Å; L30-S34 VanDerWaalsContact O-CB 3.32Å; L30-S34 WeakPolarHBondContact O-CB 3.32Å; L30-S34 PolarHBondContact O-N 3.37Å; L30-S34 VanDerWaalsContact O-N 3.13Å; L30-S34 PolarHBondContact O-OG 3.22Å; L30-L40 HydrophobicContact CB-CD1 4.31Å; L30-E82 HydrophobicContact CD1-CB 3.93Å; L30-E82 HydrophobicContact CD2-CB 3.91Å; L30-E82 HydrophobicContact CD2-CG 4.34Å; L30-E82 WeakPolarHBondContact CD2-OE2 2.87Å; L30-L83 HydrophobicContact CD1-CD2 3.74Å; L30-L83 HydrophobicContact CD1-CG 4.29Å
31E82.1Confident83.1Confident33 Ų3362.3 Ų62.315%0.15433%0.326CS..Hα-helixtrans-66.1-32.9174.1176.4-179.7173.900112.8K7 L27 L28 E29 K37 L40 R41K7-E31 WeakPolarHBondContact CE-OE2 3.36Å; K7-E31 IonicContact NZ-OE2 2.56Å; K7-E31 PolarHBondContact NZ-OE2 3.06Å; L27-E31 PolarHBondContact O-N 3.38Å; L28-E31 WeakPolarHBondContact O-CB 3.48Å; L28-E31 PolarHBondContact O-N 3.16Å; L28-E31 VanDerWaalsContact O-N 3.1Å; E29-E31 VanDerWaalsContact C-N 3.33Å; E31-K37 HydrophobicContact CG-CB 4.46Å; E31-K37 HydrophobicContact CG-CG 3.94Å; E31-K37 VanDerWaalsContact O-CB 3.26Å; E31-K37 WeakPolarHBondContact O-CB 3.1Å; E31-K37 WeakPolarHBondContact O-CD 3.3Å; E31-K37 VanDerWaalsContact O-CG 3.26Å; E31-K37 WeakPolarHBondContact O-CG 3.49Å; E31-L40 HydrophobicContact CB-CB 4.26Å; E31-L40 HydrophobicContact CG-CB 4.5Å; E31-R41 IonicContact OE1-NE 3.57Å
32M83Confident83Confident135 Ų13568 Ų6867%0.66535%0.349SS*.Hα-helixtrans-75.5-34.9179-68.4-168.8131.200112.9L28 E29 L30L28-M32 HydrophobicContact CD2-CG 4.26Å; L28-M32 HydrophobicContact CD2-SD 3.93Å; L28-M32 PolarHBondContact O-N 2.64Å; L28-M32 VanDerWaalsContact O-N 3.09Å; E29-M32 PolarHBondContact O-N 3.3Å; L30-M32 VanDerWaalsContact C-N 3.3Å; L30-M32 PolarHBondContact O-N 3.45Å
33N77.3Confident83Confident141 Ų14167.3 Ų67.375%0.75434%0.338SS*.Hα-helixtrans-102.5-10.9-167.2-66.7-25.7000115E29 L30E29-N33 WeakPolarHBondContact O-CB 3.37Å; E29-N33 PolarHBondContact O-N 2.82Å; E29-N33 VanDerWaalsContact O-N 3.1Å; E29-N33 PolarHBondContact O-ND2 3.32Å; L30-N33 PolarHBondContact O-N 3.28Å
34S73.5Confident83Confident20 Ų2070 Ų7014%0.1435%0.351CS..SBendtrans-118.9157.4-173.372.60000113.3L30 L36 K37L30-S34 VanDerWaalsContact O-CB 3.32Å; L30-S34 WeakPolarHBondContact O-CB 3.32Å; L30-S34 PolarHBondContact O-N 3.37Å; L30-S34 VanDerWaalsContact O-N 3.13Å; L30-S34 PolarHBondContact O-OG 3.22Å; S34-L36 PolarHBondContact O-N 3.24Å; S34-L36 WeakPolarHBondContact OG-CB 3.26Å; S34-L36 PolarHBondContact OG-N 3.1Å; S34-K37 PolarHBondContact O-N 2.96Å
35D76.1Confident83.1Confident165 Ų16569.4 Ų69.488%0.88235%0.346SS*.THydrogen-bonded Turntrans-62.1-9.6170.3-57.4-35.5000112.6K37D35-K37 PolarHBondContact O-N 3.48Å
36L76.1Confident83.2Confident9 Ų963.9 Ų63.95%0.04732%0.322CS..THydrogen-bonded Turntrans-77.61176.3-55.4175.4000112.9S34 A38 Q39 L40 I75 R78S34-L36 PolarHBondContact O-N 3.24Å; S34-L36 WeakPolarHBondContact OG-CB 3.26Å; S34-L36 PolarHBondContact OG-N 3.1Å; L36-A38 VanDerWaalsContact C-N 3.3Å; L36-A38 PolarHBondContact O-N 3.36Å; L36-Q39 PolarHBondContact O-N 3.15Å; L36-L40 HydrophobicContact CB-CD1 3.67Å; L36-L40 HydrophobicContact CB-CG 4.06Å; L36-L40 WeakPolarHBondContact O-CB 3.26Å; L36-L40 WeakPolarHBondContact O-CG 3.49Å; L36-L40 PolarHBondContact O-N 3.26Å; L36-I75 HydrophobicContact CD2-CG2 4.2Å; L36-R78 HydrophobicContact CD1-CB 4.38Å
37K79.4Confident83.3Confident99 Ų9964.4 Ų64.443%0.4333%0.326SS..Hα-helixtrans-49.3-46.3-179.2-175.5169.3-173.5173.40113.9E31 S34 D35 Q39 R41E31-K37 HydrophobicContact CG-CB 4.46Å; E31-K37 HydrophobicContact CG-CG 3.94Å; E31-K37 VanDerWaalsContact O-CB 3.26Å; E31-K37 WeakPolarHBondContact O-CB 3.1Å; E31-K37 WeakPolarHBondContact O-CD 3.3Å; E31-K37 VanDerWaalsContact O-CG 3.26Å; E31-K37 WeakPolarHBondContact O-CG 3.49Å; S34-K37 PolarHBondContact O-N 2.96Å; D35-K37 PolarHBondContact O-N 3.48Å; K37-Q39 VanDerWaalsContact C-N 3.3Å; K37-Q39 PolarHBondContact O-N 3.08Å; K37-R41 WeakPolarHBondContact O-CB 3.42Å; K37-R41 PolarHBondContact O-N 3.09Å
38A82.4Confident83.5Confident80 Ų8064.4 Ų64.466%0.66133%0.327SS*.Hα-helixtrans-65-35.8-178.200000112.2L36L36-A38 VanDerWaalsContact C-N 3.3Å; L36-A38 PolarHBondContact O-N 3.36Å
39Q81.9Confident83.7Confident95 Ų9568.2 Ų68.244%0.44434%0.342SS..Hα-helixtrans-82.7-36.6-178.4-66.3173.8-38.600111.7L36 K37 L43 I75L36-Q39 PolarHBondContact O-N 3.15Å; K37-Q39 VanDerWaalsContact C-N 3.3Å; K37-Q39 PolarHBondContact O-N 3.08Å; Q39-L43 VanDerWaalsContact O-CD1 3.28Å; Q39-L43 WeakPolarHBondContact O-CD1 3.43Å; Q39-L43 VanDerWaalsContact O-CG 3.24Å; Q39-L43 WeakPolarHBondContact O-CG 3.21Å; Q39-I75 HydrophobicContact CB-CG2 4.2Å; Q39-I75 HydrophobicContact CG-CG2 4.45Å
40L82.5Confident83.9Confident2 Ų267 Ų671%0.0134%0.336CS..Hα-helixtrans-79.7-14.2-176.4-75.8172.7000114.6K7 L30 E31 L36 I75 L79K7-L40 PolarHBondContact NZ-O 3.06Å; L30-L40 HydrophobicContact CB-CD1 4.31Å; E31-L40 HydrophobicContact CB-CB 4.26Å; E31-L40 HydrophobicContact CG-CB 4.5Å; L36-L40 HydrophobicContact CB-CD1 3.67Å; L36-L40 HydrophobicContact CB-CG 4.06Å; L36-L40 WeakPolarHBondContact O-CB 3.26Å; L36-L40 WeakPolarHBondContact O-CG 3.49Å; L36-L40 PolarHBondContact O-N 3.26Å; L40-I75 HydrophobicContact CD2-CD1 3.84Å; L40-I75 HydrophobicContact CG-CD1 4.38Å; L40-L79 HydrophobicContact CD2-CD1 3.81Å
41R81.6Confident84.2Confident161 Ų16167.2 Ų67.261%0.60834%0.337SS*.SBendtrans-67.4-37.6-178.1-175.8-179.4-66.2178.34.3113E31 K37E31-R41 IonicContact OE1-NE 3.57Å; K37-R41 WeakPolarHBondContact O-CB 3.42Å; K37-R41 PolarHBondContact O-N 3.09Å
42E83.6Confident84.5Confident160 Ų16072.6 Ų72.675%0.74836%0.362SS*.SBendtrans-91.1-12.5-177.2-63.7-179.6178.500113Q68E42-Q68 PolarHBondContact O-NE2 2.94Å
43L87.4Confident84.4Confident14 Ų1466.7 Ų66.77%0.07333%0.333CS..  trans-88.5136.2-174.3-64.8178.1000111.2Q39 Q68 F72 I75Q39-L43 VanDerWaalsContact O-CD1 3.28Å; Q39-L43 WeakPolarHBondContact O-CD1 3.43Å; Q39-L43 VanDerWaalsContact O-CG 3.24Å; Q39-L43 WeakPolarHBondContact O-CG 3.21Å; L43-Q68 HydrophobicContact CD2-CB 3.96Å; L43-Q68 HydrophobicContact CD2-CG 4.31Å; L43-F72 HydrophobicContact CB-CE1 4.45Å; L43-F72 HydrophobicContact CB-CE2 3.71Å; L43-F72 HydrophobicContact CB-CZ 3.66Å; L43-F72 HydrophobicContact CD1-CD1 4.36Å; L43-F72 HydrophobicContact CD1-CD2 4.13Å; L43-F72 HydrophobicContact CD1-CE1 4.27Å; L43-F72 HydrophobicContact CD1-CE2 4.06Å; L43-F72 HydrophobicContact CD1-CG 4.31Å; L43-F72 HydrophobicContact CD1-CZ 4.14Å; L43-F72 HydrophobicContact CD2-CD2 3.9Å; L43-F72 HydrophobicContact CD2-CE2 3.75Å; L43-F72 HydrophobicContact CG-CD2 4.41Å; L43-F72 HydrophobicContact CG-CE2 4.03Å; L43-F72 HydrophobicContact CG-CZ 4.3Å; L43-I75 HydrophobicContact CD1-CD1 3.51Å
44H88.6Confident84Confident55 Ų5562 Ų6226%0.25532%0.319SS..  trans-132.4160.5173.862.9-86.7000110.7K7 V9 P65 Q68K7-H44 CarbonylContact O-C 3.51Å; K7-H44 VanDerWaalsContact O-CA 3.23Å; K7-H44 WeakPolarHBondContact O-CA 3.33Å; K7-H44 VanDerWaalsContact O-CB 3.24Å; K7-H44 WeakPolarHBondContact O-CB 3.45Å; V9-H44 HydrophobicContact CG2-CB 4.08Å; H44-P65 VanDerWaalsContact CD2-CG 3.48Å; H44-P65 WeakPolarHBondContact CD2-CG 3.2Å; H44-P65 WeakPolarHBondContact NE2-CG 3.49Å; H44-P65 WeakPolarHBondContact O-CD 3.2Å; H44-Q68 PolarHBondContact CE1-NE2 3.18Å; H44-Q68 PolarHBondContact ND1-NE2 2.96Å; H44-Q68 PolarHBondContact ND1-OE1 3.05Å; H44-Q68 PolarHBondContact O-OE1 3.48Å
45I90.4Very high83.6Confident1 Ų164.6 Ų64.61%0.00535%0.349CS..BIsolated β-bridgetrans-108.4150.1175.860.8169.4000109K7 I8 V9 I23 L27 I62 F72K7-I45 WeakPolarHBondContact O-CG1 3.46Å; K7-I45 PolarHBondContact O-N 3.44Å; I8-I45 WeakPolarHBondContact CA-O 3.3Å; I8-I45 HydrophobicContact CB-CG1 4.12Å; I8-I45 HydrophobicContact CG1-CG1 4.31Å; V9-I45 PolarHBondContact N-O 2.87Å; I23-I45 HydrophobicContact CG2-CD1 3.82Å; L27-I45 HydrophobicContact CD1-CD1 4.07Å; L27-I45 HydrophobicContact CD1-CG1 4.45Å; L27-I45 HydrophobicContact CD1-CG2 3.91Å; I45-I62 HydrophobicContact CB-CG2 3.97Å; I45-I62 HydrophobicContact CD1-CG2 4.39Å; I45-I62 HydrophobicContact CG2-CG2 3.5Å; I45-I62 VanDerWaalsContact CG2-CG2 3.5Å; I45-F72 HydrophobicContact CG2-CZ 4.31Å
46T89.2Confident83.1Confident12 Ų1262.7 Ų62.77%0.07435%0.348CS..SBendtrans-92.3-38.9178.752.30000112.7V9 F63 P65 Q97V9-T46 WeakPolarHBondContact O-CA 3.37Å; T46-F63 PolarHBondContact N-O 2.98Å; T46-F63 WeakPolarHBondContact OG1-CB 3.42Å; T46-F63 PolarHBondContact OG1-O 2.83Å; T46-F63 VanDerWaalsContact OG1-O 3.09Å; T46-P65 HydrophobicContact CG2-CB 4.27Å; T46-P65 HydrophobicContact CG2-CG 3.7Å; T46-Q97 HydrophobicContact CG2-CB 4.36Å
47A89.5Confident83.4Confident17 Ų1768.9 Ų68.914%0.1437%0.371CS..EExtended strand (participates in β ladder)trans-161.3163-17800000109.6E20 F63E20-A47 VanDerWaalsContact OE1-CA 3.28Å; E20-A47 WeakPolarHBondContact OE1-CA 3.2Å; A47-F63 HydrophobicContact CB-CB 4.13Å; A47-F63 HydrophobicContact CB-CD2 3.9Å; A47-F63 HydrophobicContact CB-CG 4.38Å; A47-F63 WeakPolarHBondContact O-CB 3.46Å; A47-F63 PolarHBondContact O-N 3.34Å
48A91.2Very high84Confident5 Ų568 Ų684%0.04137%0.367CS..EExtended strand (participates in β ladder)trans-140.5143.1167.800000111.2F19 E20 I23 I61 I62F19-A48 HydrophobicContact CE1-CB 4.29Å; E20-A48 HydrophobicContact CG-CB 4.17Å; E20-A48 PolarHBondContact OE1-N 3.04Å; E20-A48 VanDerWaalsContact OE1-N 3.07Å; I23-A48 HydrophobicContact CD1-CB 3.3Å; A48-I61 CarbonylContact C-O 3.59Å; A48-I61 VanDerWaalsContact CA-O 3.24Å; A48-I61 WeakPolarHBondContact CA-O 3.33Å; A48-I62 HydrophobicContact CB-CG1 4.43Å
49K90.7Very high84.4Confident119 Ų11964.3 Ų64.352%0.51734%0.336SS..EExtended strand (participates in β ladder)trans-134.4134.6-178.6-66.4-172.4-178.3-177.30110.5I61 F63K49-I61 PolarHBondContact N-O 3Å; K49-I61 PolarHBondContact O-N 3.46Å; K49-F63 HydrophobicContact CB-CE2 4.35Å; K49-F63 HydrophobicContact CD-CE2 3.9Å; K49-F63 HydrophobicContact CG-CE2 3.96Å
50E91.1Very high84.9Confident71 Ų7159.8 Ų59.833%0.33232%0.315SS..EExtended strand (participates in β ladder)trans-89.8132.1167.3-167.3172.5-15900109.3F19 K58 K90F19-E50 HydrophobicContact CE1-CB 4.1Å; F19-E50 HydrophobicContact CE2-CB 4.25Å; F19-E50 HydrophobicContact CZ-CB 3.83Å; F19-E50 HydrophobicContact CZ-CG 4.48Å; E50-K58 HydrophobicContact CG-CB 4.12Å; E50-K58 HydrophobicContact CG-CD 4.26Å; E50-K58 WeakPolarHBondContact OE1-CB 3.23Å; E50-K58 WeakPolarHBondContact OE1-CD 3.49Å; E50-K90 IonicContact OE1-NZ 3.87Å; E50-K90 PolarHBondContact OE1-NZ 2.68Å
51I90.5Very high85.4Confident17 Ų1759.8 Ų59.89%0.08732%0.315CS..EExtended strand (participates in β ladder)trans-126.2135.9178.9-56.2-157.9000109.1V53 K58 A59 I61 K177I51-V53 HydrophobicContact CG2-CG2 4.48Å; I51-K58 CarbonylContact O-C 3.51Å; I51-K58 WeakPolarHBondContact O-CA 3.28Å; I51-A59 PolarHBondContact N-O 3.17Å; I51-A59 PolarHBondContact O-N 3.41Å; I51-I61 HydrophobicContact CD1-CD1 3.22Å; I51-I61 HydrophobicContact CD1-CG1 4.39Å; I51-I61 HydrophobicContact CG1-CD1 3.71Å; I51-I61 HydrophobicContact CG1-CG1 4.42Å; I51-K177 HydrophobicContact CD1-CB 4.16Å; I51-K177 HydrophobicContact CD1-CG 3.83Å; I51-K177 HydrophobicContact CG2-CB 4.16Å; I51-K177 HydrophobicContact CG2-CG 3.94Å
52E88Confident86Confident147 Ų14752.1 Ų52.169%0.68729%0.286SS*.EExtended strand (participates in β ladder)trans-79.5121.4169.9-61.1-173.3162.500109.4K58E52-K58 HydrophobicContact CG-CD 4.49Å; E52-K58 HydrophobicContact CG-CG 4.26Å; E52-K58 WeakPolarHBondContact OE1-CE 3.29Å; E52-K58 IonicContact OE1-NZ 3.34Å
53V81.8Confident86.5Confident10 Ų1045.3 Ų45.36%0.06125%0.254CS..EExtended strand (participates in β ladder)trans-110.1151.6174.2-1680000107.4I51 R57 A59 T170 V174I51-V53 HydrophobicContact CG2-CG2 4.48Å; V53-R57 CarbonylContact C-O 3.54Å; V53-R57 PolarHBondContact N-O 3.36Å; V53-R57 PolarHBondContact O-N 3.46Å; V53-A59 HydrophobicContact CG2-CB 3.7Å; V53-T170 HydrophobicContact CG2-CG2 4.18Å; V53-V174 HydrophobicContact CG2-CG2 4.24Å
54G68.8Low86.7Confident44 Ų4444.8 Ų44.845%0.45425%0.251SS..THydrogen-bonded Turntrans-42.9145.6-166.200000115.3
55G65.3Low86.9Confident74 Ų7443 Ų4376%0.76324%0.244SC*.THydrogen-bonded Turntrans70.444.1174.500000114.9R57G55-R57 PolarHBondContact O-N 3.17Å
56S65.8Low86.9Confident124 Ų12446.3 Ų46.387%0.86726%0.264SS*.THydrogen-bonded Turntrans70.41.4174-160.90000116.1
57R82.8Confident86.9Confident139 Ų13951.4 Ų51.453%0.52530%0.298SS..EExtended strand (participates in β ladder)trans-83.3129.1178.8-67.8-179.8-179.1167.70.1110.9V53 G55V53-R57 CarbonylContact C-O 3.54Å; V53-R57 PolarHBondContact N-O 3.36Å; V53-R57 PolarHBondContact O-N 3.46Å; G55-R57 PolarHBondContact O-N 3.17Å
58K90.1Very high87Confident82 Ų8252.2 Ų52.236%0.35730%0.299SS..EExtended strand (participates in β ladder)trans-98.4136.5173-59.3-167.4176.8-171.20109.9E50 I51 E52 K90E50-K58 HydrophobicContact CG-CB 4.12Å; E50-K58 HydrophobicContact CG-CD 4.26Å; E50-K58 WeakPolarHBondContact OE1-CB 3.23Å; E50-K58 WeakPolarHBondContact OE1-CD 3.49Å; I51-K58 CarbonylContact O-C 3.51Å; I51-K58 WeakPolarHBondContact O-CA 3.28Å; E52-K58 HydrophobicContact CG-CD 4.49Å; E52-K58 HydrophobicContact CG-CG 4.26Å; E52-K58 WeakPolarHBondContact OE1-CE 3.29Å; E52-K58 IonicContact OE1-NZ 3.34Å; K58-K90 HydrophobicContact CB-CD 4.19Å; K58-K90 WeakPolarHBondContact O-CB 3.37Å
59A91.6Very high86.9Confident1 Ų153.4 Ų53.41%0.00830%0.304CS..EExtended strand (participates in β ladder)trans-115.2141.7175.300000110I51 V53 H91 T170 V174I51-A59 PolarHBondContact N-O 3.17Å; I51-A59 PolarHBondContact O-N 3.41Å; V53-A59 HydrophobicContact CG2-CB 3.7Å; A59-H91 CarbonylContact C-O 3.51Å; A59-H91 WeakPolarHBondContact CA-O 3.39Å; A59-T170 HydrophobicContact CB-CG2 3.47Å; A59-T170 VanDerWaalsContact CB-CG2 3.47Å; A59-V174 HydrophobicContact CB-CG2 4.23Å
60I93.3Very high87Confident1 Ų155.6 Ų55.61%0.00531%0.314CS..EExtended strand (participates in β ladder)trans-104.2125.2178.7-55.8178.6000107.9F19 I23 I62 F87 K90 H91 V92 V93F19-I60 HydrophobicContact CE1-CG2 4.14Å; F19-I60 HydrophobicContact CZ-CD1 4.06Å; F19-I60 HydrophobicContact CZ-CG1 4.03Å; F19-I60 HydrophobicContact CZ-CG2 3.9Å; I23-I60 HydrophobicContact CD1-CG2 3.79Å; I60-I62 HydrophobicContact CG2-CG1 4.15Å; I60-F87 HydrophobicContact CD1-CB 3.79Å; I60-F87 HydrophobicContact CD1-CD1 3.75Å; I60-F87 HydrophobicContact CD1-CD2 3.96Å; I60-F87 HydrophobicContact CD1-CE1 4.34Å; I60-F87 HydrophobicContact CD1-CG 3.56Å; I60-K90 HydrophobicContact CD1-CB 4.45Å; I60-K90 HydrophobicContact CD1-CD 4.35Å; I60-H91 PolarHBondContact N-O 2.88Å; I60-V92 HydrophobicContact CB-CG2 4.27Å; I60-V92 HydrophobicContact CD1-CG2 4.47Å; I60-V92 WeakPolarHBondContact O-CA 3.41Å; I60-V93 PolarHBondContact O-N 3.3Å
61I93.2Very high87Confident1 Ų155 Ų551%0.00532%0.317CS..EExtended strand (participates in β ladder)trans-106.1125174.6-58174.4000108A48 K49 I51 F63 V93 I95 V174 L178A48-I61 CarbonylContact C-O 3.59Å; A48-I61 VanDerWaalsContact CA-O 3.24Å; A48-I61 WeakPolarHBondContact CA-O 3.33Å; K49-I61 PolarHBondContact N-O 3Å; K49-I61 PolarHBondContact O-N 3.46Å; I51-I61 HydrophobicContact CD1-CD1 3.22Å; I51-I61 HydrophobicContact CD1-CG1 4.39Å; I51-I61 HydrophobicContact CG1-CD1 3.71Å; I51-I61 HydrophobicContact CG1-CG1 4.42Å; I61-F63 HydrophobicContact CG2-CD2 4.33Å; I61-F63 HydrophobicContact CG2-CE1 4.29Å; I61-F63 HydrophobicContact CG2-CE2 3.87Å; I61-F63 HydrophobicContact CG2-CZ 3.86Å; I61-V93 WeakPolarHBondContact CA-O 3.44Å; I61-I95 HydrophobicContact CG2-CB 4.28Å; I61-I95 HydrophobicContact CG2-CD1 3.66Å; I61-I95 HydrophobicContact CG2-CG1 4.02Å; I61-V174 HydrophobicContact CD1-CB 4.31Å; I61-V174 HydrophobicContact CD1-CG1 3.35Å; I61-V174 HydrophobicContact CD1-CG2 4.09Å; I61-V174 HydrophobicContact CG1-CG1 4.01Å; I61-V174 HydrophobicContact CG1-CG2 4.28Å; I61-L178 HydrophobicContact CD1-CD1 4.32Å
62I93.5Very high87Confident0 Ų054.4 Ų54.40%031%0.314CS..EExtended strand (participates in β ladder)trans-110.3120.6175.1-57.8175.9000108.1I23 I45 A48 I60 L83 V92 V93 F94 I95I23-I62 HydrophobicContact CG2-CD1 4.07Å; I45-I62 HydrophobicContact CB-CG2 3.97Å; I45-I62 HydrophobicContact CD1-CG2 4.39Å; I45-I62 HydrophobicContact CG2-CG2 3.5Å; I45-I62 VanDerWaalsContact CG2-CG2 3.5Å; A48-I62 HydrophobicContact CB-CG1 4.43Å; I60-I62 HydrophobicContact CG2-CG1 4.15Å; I62-L83 HydrophobicContact CD1-CD1 3.75Å; I62-V92 HydrophobicContact CD1-CG1 3.68Å; I62-V92 HydrophobicContact CG1-CG1 4.24Å; I62-V93 PolarHBondContact N-O 2.99Å; I62-F94 HydrophobicContact CB-CD1 3.8Å; I62-F94 HydrophobicContact CB-CE1 3.71Å; I62-F94 HydrophobicContact CD1-CE1 3.74Å; I62-F94 HydrophobicContact CD1-CZ 3.8Å; I62-F94 HydrophobicContact CG1-CE1 4.29Å; I62-F94 HydrophobicContact CG2-CD1 3.96Å; I62-F94 HydrophobicContact CG2-CE1 3.7Å; I62-F94 WeakPolarHBondContact O-CA 3.41Å; I62-I95 PolarHBondContact O-N 2.83Å
63F93.5Very high87.1Confident18 Ų1850.3 Ų50.38%0.07930%0.295CS..EExtended strand (participates in β ladder)trans-85.5127.9176.2-67-81.7000110.3T46 A47 K49 I61 I95 Q97 L178T46-F63 PolarHBondContact N-O 2.98Å; T46-F63 WeakPolarHBondContact OG1-CB 3.42Å; T46-F63 PolarHBondContact OG1-O 2.83Å; T46-F63 VanDerWaalsContact OG1-O 3.09Å; A47-F63 HydrophobicContact CB-CB 4.13Å; A47-F63 HydrophobicContact CB-CD2 3.9Å; A47-F63 HydrophobicContact CB-CG 4.38Å; A47-F63 WeakPolarHBondContact O-CB 3.46Å; A47-F63 PolarHBondContact O-N 3.34Å; K49-F63 HydrophobicContact CB-CE2 4.35Å; K49-F63 HydrophobicContact CD-CE2 3.9Å; K49-F63 HydrophobicContact CG-CE2 3.96Å; I61-F63 HydrophobicContact CG2-CD2 4.33Å; I61-F63 HydrophobicContact CG2-CE1 4.29Å; I61-F63 HydrophobicContact CG2-CE2 3.87Å; I61-F63 HydrophobicContact CG2-CZ 3.86Å; F63-I95 CarbonylContact C-O 3.57Å; F63-I95 VanDerWaalsContact CA-O 3.26Å; F63-I95 WeakPolarHBondContact CA-O 3.28Å; F63-I95 HydrophobicContact CD1-CB 4.39Å; F63-I95 HydrophobicContact CD1-CG2 4.39Å; F63-I95 HydrophobicContact CE1-CB 4.41Å; F63-I95 HydrophobicContact CE1-CG2 4.23Å; F63-Q97 HydrophobicContact CB-CB 4.42Å; F63-L178 HydrophobicContact CZ-CD2 4.2Å
64V92.4Very high87.6Confident2 Ų258.2 Ų58.21%0.01233%0.329CS..EExtended strand (participates in β ladder)trans-115.6140.3-176.61760000109.7V66 Q68 F72 F94 I95 A96 Q97V64-V66 PolarHBondContact O-N 3.22Å; V64-Q68 HydrophobicContact CG1-CB 4.31Å; V64-F72 HydrophobicContact CB-CD2 4.41Å; V64-F72 HydrophobicContact CG1-CD2 3.28Å; V64-F72 HydrophobicContact CG1-CE2 3.51Å; V64-F72 HydrophobicContact CG1-CG 4.02Å; V64-F72 HydrophobicContact CG1-CZ 4.42Å; V64-F72 HydrophobicContact CG2-CD1 4.49Å; V64-F72 HydrophobicContact CG2-CD2 4.2Å; V64-F72 HydrophobicContact CG2-CE2 4.22Å; V64-F72 HydrophobicContact CG2-CG 4.32Å; V64-F72 HydrophobicContact CG2-CZ 4.37Å; V64-F94 HydrophobicContact CG2-CB 4.49Å; V64-F94 HydrophobicContact CG2-CD1 3.62Å; V64-F94 HydrophobicContact CG2-CE1 4.4Å; V64-I95 PolarHBondContact N-O 3.41Å; V64-A96 CarbonylContact O-C 3.59Å; V64-A96 WeakPolarHBondContact O-CA 3.24Å; V64-Q97 PolarHBondContact O-N 3.42Å
65P92.1Very high88.6Confident17 Ų1756.2 Ų56.211%0.1131%0.308CS..  trans-59.9132.6171.3-13.222.7000111.4H44 T46 P67 Q68 L69H44-P65 VanDerWaalsContact CD2-CG 3.48Å; H44-P65 WeakPolarHBondContact CD2-CG 3.2Å; H44-P65 WeakPolarHBondContact NE2-CG 3.49Å; H44-P65 WeakPolarHBondContact O-CD 3.2Å; T46-P65 HydrophobicContact CG2-CB 4.27Å; T46-P65 HydrophobicContact CG2-CG 3.7Å; P65-P67 VanDerWaalsContact C-N 3.31Å; P65-P67 VanDerWaalsContact O-N 3.15Å; P65-Q68 HydrophobicContact CB-CG 4.45Å; P65-Q68 PolarHBondContact O-N 3.27Å; P65-L69 PolarHBondContact O-N 3.42Å
66V89.8Confident89.8Confident71 Ų7153.2 Ų53.243%0.4327%0.274SS..G310 helixtrans-49.1-42.1-179.4-174.60000113.9V64 Q68 L69 A96 Q97 L98V64-V66 PolarHBondContact O-N 3.22Å; V66-Q68 PolarHBondContact O-N 2.76Å; V66-L69 WeakPolarHBondContact O-CB 3.38Å; V66-L69 PolarHBondContact O-N 3.23Å; V66-A96 HydrophobicContact CG2-CB 4.31Å; V66-Q97 WeakPolarHBondContact CG2-O 3.37Å; V66-L98 HydrophobicContact CG1-CD2 4.49Å; V66-L98 HydrophobicContact CG2-CD2 3.62Å; V66-L98 HydrophobicContact CG2-CG 4.41Å
67P90.6Very high91Very high119 Ų11950.2 Ų50.277%0.77325%0.25SS*.G310 helixtrans-62.9-27.1179-22.734.9000113.9P65P65-P67 VanDerWaalsContact C-N 3.31Å; P65-P67 VanDerWaalsContact O-N 3.15Å
68Q90.8Very high91.4Very high34 Ų3451.5 Ų51.516%0.15926%0.255CS..G310 helixtrans-94.3-10.3-175.4-61.4-163.9-26.500113.3E42 L43 H44 V64 P65 V66 K70 S71 F72E42-Q68 PolarHBondContact O-NE2 2.94Å; L43-Q68 HydrophobicContact CD2-CB 3.96Å; L43-Q68 HydrophobicContact CD2-CG 4.31Å; H44-Q68 PolarHBondContact CE1-NE2 3.18Å; H44-Q68 PolarHBondContact ND1-NE2 2.96Å; H44-Q68 PolarHBondContact ND1-OE1 3.05Å; H44-Q68 PolarHBondContact O-OE1 3.48Å; V64-Q68 HydrophobicContact CG1-CB 4.31Å; P65-Q68 HydrophobicContact CB-CG 4.45Å; P65-Q68 PolarHBondContact O-N 3.27Å; V66-Q68 PolarHBondContact O-N 2.76Å; Q68-K70 VanDerWaalsContact C-N 3.33Å; Q68-K70 PolarHBondContact O-N 2.86Å; Q68-S71 WeakPolarHBondContact O-CB 3.48Å; Q68-S71 PolarHBondContact O-N 2.7Å; Q68-F72 HydrophobicContact CB-CD2 4.15Å; Q68-F72 HydrophobicContact CB-CE2 4.23Å; Q68-F72 WeakPolarHBondContact O-CD2 3.19Å; Q68-F72 PolarHBondContact O-N 3.43Å
69L90.5Very high91.4Very high31 Ų3147.6 Ų47.616%0.16224%0.238CC..Hα-helixtrans-50.9-48.8-176.5-161.3-174.6000112.2P65 V66 S71 F72 Q73 A96P65-L69 PolarHBondContact O-N 3.42Å; V66-L69 WeakPolarHBondContact O-CB 3.38Å; V66-L69 PolarHBondContact O-N 3.23Å; L69-S71 VanDerWaalsContact C-N 3.28Å; L69-S71 PolarHBondContact O-N 3.24Å; L69-F72 WeakPolarHBondContact O-CB 3.4Å; L69-F72 PolarHBondContact O-N 2.95Å; L69-F72 VanDerWaalsContact O-N 3.11Å; L69-Q73 HydrophobicContact CD2-CG 3.63Å; L69-Q73 PolarHBondContact O-N 3.26Å; L69-A96 HydrophobicContact CD1-CB 3.58Å; L69-A96 HydrophobicContact CG-CB 4.21Å
70K90.9Very high91.4Very high165 Ų16548.2 Ų48.272%0.71724%0.242SC*.Hα-helixtrans-62.2-33.8179.4-69-173177.5-175.40113.3Q68Q68-K70 VanDerWaalsContact C-N 3.33Å; Q68-K70 PolarHBondContact O-N 2.86Å
71S91.7Very high91.2Very high58 Ų5855 Ų5541%0.40627%0.267SS..Hα-helixtrans-71.9-39176.1-61.50000110.9Q68 L69 K74Q68-S71 WeakPolarHBondContact O-CB 3.48Å; Q68-S71 PolarHBondContact O-N 2.7Å; L69-S71 VanDerWaalsContact C-N 3.28Å; L69-S71 PolarHBondContact O-N 3.24Å; S71-K74 PolarHBondContact O-N 3.03Å
72F90.6Very high91.1Very high5 Ų557.5 Ų57.52%0.02228%0.279CS..Hα-helixtrans-62.6-44.3172.2-87.2-83.8000111.9L43 I45 V64 Q68 L69 K74 I75 Q76 L79 F94L43-F72 HydrophobicContact CB-CE1 4.45Å; L43-F72 HydrophobicContact CB-CE2 3.71Å; L43-F72 HydrophobicContact CB-CZ 3.66Å; L43-F72 HydrophobicContact CD1-CD1 4.36Å; L43-F72 HydrophobicContact CD1-CD2 4.13Å; L43-F72 HydrophobicContact CD1-CE1 4.27Å; L43-F72 HydrophobicContact CD1-CE2 4.06Å; L43-F72 HydrophobicContact CD1-CG 4.31Å; L43-F72 HydrophobicContact CD1-CZ 4.14Å; L43-F72 HydrophobicContact CD2-CD2 3.9Å; L43-F72 HydrophobicContact CD2-CE2 3.75Å; L43-F72 HydrophobicContact CG-CD2 4.41Å; L43-F72 HydrophobicContact CG-CE2 4.03Å; L43-F72 HydrophobicContact CG-CZ 4.3Å; I45-F72 HydrophobicContact CG2-CZ 4.31Å; V64-F72 HydrophobicContact CB-CD2 4.41Å; V64-F72 HydrophobicContact CG1-CD2 3.28Å; V64-F72 HydrophobicContact CG1-CE2 3.51Å; V64-F72 HydrophobicContact CG1-CG 4.02Å; V64-F72 HydrophobicContact CG1-CZ 4.42Å; V64-F72 HydrophobicContact CG2-CD1 4.49Å; V64-F72 HydrophobicContact CG2-CD2 4.2Å; V64-F72 HydrophobicContact CG2-CE2 4.22Å; V64-F72 HydrophobicContact CG2-CG 4.32Å; V64-F72 HydrophobicContact CG2-CZ 4.37Å; Q68-F72 HydrophobicContact CB-CD2 4.15Å; Q68-F72 HydrophobicContact CB-CE2 4.23Å; Q68-F72 WeakPolarHBondContact O-CD2 3.19Å; Q68-F72 PolarHBondContact O-N 3.43Å; L69-F72 WeakPolarHBondContact O-CB 3.4Å; L69-F72 PolarHBondContact O-N 2.95Å; L69-F72 VanDerWaalsContact O-N 3.11Å; F72-K74 PolarHBondContact O-N 2.88Å; F72-I75 CarbonylContact O-C 3.59Å; F72-I75 WeakPolarHBondContact O-CG1 3.48Å; F72-I75 PolarHBondContact O-N 3.41Å; F72-Q76 WeakPolarHBondContact O-CA 3.39Å; F72-Q76 WeakPolarHBondContact O-CB 3.18Å; F72-Q76 PolarHBondContact O-N 2.93Å; F72-L79 HydrophobicContact CD1-CD1 4.15Å; F72-L79 HydrophobicContact CE1-CD1 4.14Å; F72-F94 HydrophobicContact CD1-CD1 4.46Å; F72-F94 HydrophobicContact CD1-CE1 4.33Å; F72-F94 HydrophobicContact CE1-CE1 4.31Å
73Q91.1Very high91Very high61 Ų6157.5 Ų57.529%0.28528%0.279SS..Hα-helixtrans-54.5-38.9179.4-77.4173.7-1900113L69 I75 Q76 F133L69-Q73 HydrophobicContact CD2-CG 3.63Å; L69-Q73 PolarHBondContact O-N 3.26Å; Q73-I75 PolarHBondContact O-N 3.17Å; Q73-Q76 PolarHBondContact O-N 3.32Å; Q73-F133 HydrophobicContact CB-CE2 3.93Å; Q73-F133 HydrophobicContact CB-CZ 3.91Å; Q73-F133 HydrophobicContact CG-CD2 4.09Å; Q73-F133 HydrophobicContact CG-CE2 3.93Å; Q73-F133 HydrophobicContact CG-CZ 4.26Å; Q73-F133 WeakPolarHBondContact O-CE1 3.48Å; Q73-F133 WeakPolarHBondContact O-CZ 3.45Å
74K91Very high90.8Very high175 Ų17558.1 Ų58.176%0.76128%0.282SS*.Hα-helixtrans-60.3-33.5177.4-68.4178.9-178.9-179.30113.2S71 F72S71-K74 PolarHBondContact O-N 3.03Å; F72-K74 PolarHBondContact O-N 2.88Å
75I90.9Very high90.7Very high3 Ų366.3 Ų66.32%0.01532%0.318CS..Hα-helixtrans-105.5-10.8-176.261.8176.8000113.2L36 Q39 L40 L43 F72 Q73 V77 R78 L79L36-I75 HydrophobicContact CD2-CG2 4.2Å; Q39-I75 HydrophobicContact CB-CG2 4.2Å; Q39-I75 HydrophobicContact CG-CG2 4.45Å; L40-I75 HydrophobicContact CD2-CD1 3.84Å; L40-I75 HydrophobicContact CG-CD1 4.38Å; L43-I75 HydrophobicContact CD1-CD1 3.51Å; F72-I75 CarbonylContact O-C 3.59Å; F72-I75 WeakPolarHBondContact O-CG1 3.48Å; F72-I75 PolarHBondContact O-N 3.41Å; Q73-I75 PolarHBondContact O-N 3.17Å; I75-V77 VanDerWaalsContact C-N 3.33Å; I75-V77 PolarHBondContact O-N 3.03Å; I75-R78 PolarHBondContact O-N 2.71Å; I75-L79 HydrophobicContact CD1-CD1 3.77Å; I75-L79 HydrophobicContact CG1-CD1 4.1Å; I75-L79 WeakPolarHBondContact O-CB 3.44Å; I75-L79 PolarHBondContact O-N 3.2Å
76Q90.4Very high90.6Very high11 Ų1169.2 Ų69.25%0.05133%0.328CS..Hα-helixtrans-58.4-40.4-166.3176.5169-9.500112.7F72 Q73 R78 L79 V80 F94 F133F72-Q76 WeakPolarHBondContact O-CA 3.39Å; F72-Q76 WeakPolarHBondContact O-CB 3.18Å; F72-Q76 PolarHBondContact O-N 2.93Å; Q73-Q76 PolarHBondContact O-N 3.32Å; Q76-R78 VanDerWaalsContact C-N 3.3Å; Q76-R78 PolarHBondContact O-N 3.1Å; Q76-L79 PolarHBondContact O-N 3.05Å; Q76-V80 HydrophobicContact CG-CG2 3.97Å; Q76-V80 VanDerWaalsContact O-CB 3.3Å; Q76-V80 WeakPolarHBondContact O-CB 3.47Å; Q76-V80 WeakPolarHBondContact O-CG2 3.46Å; Q76-V80 PolarHBondContact O-N 3.07Å; Q76-F94 HydrophobicContact CG-CD2 3.92Å; Q76-F133 HydrophobicContact CB-CD1 4.07Å; Q76-F133 HydrophobicContact CB-CE1 3.7Å; Q76-F133 HydrophobicContact CG-CD1 3.69Å; Q76-F133 HydrophobicContact CG-CE1 3.86Å; Q76-F133 VanDerWaalsContact OE1-CD1 3.31Å
77V90.3Very high90.5Very high61 Ų6167.8 Ų67.837%0.3732%0.316SS..Hα-helixtrans-61.2-39.3179.5-178.50000112.1I75 R81 F133 P134I75-V77 VanDerWaalsContact C-N 3.33Å; I75-V77 PolarHBondContact O-N 3.03Å; V77-R81 WeakPolarHBondContact O-CD 3.41Å; V77-R81 WeakPolarHBondContact O-CG 3.41Å; V77-F133 HydrophobicContact CG2-CE1 4.16Å; V77-P134 HydrophobicContact CG2-CB 4.08Å; V77-P134 HydrophobicContact CG2-CG 4.26Å
78R90.4Very high90.3Very high165 Ų16567.6 Ų67.662%0.62332%0.318SS*.Hα-helixtrans-77-46.3178.3-65.2-176-179.1-169.9-0.7110.9L36 I75 Q76 V80 R81 E82L36-R78 HydrophobicContact CD1-CB 4.38Å; I75-R78 PolarHBondContact O-N 2.71Å; Q76-R78 VanDerWaalsContact C-N 3.3Å; Q76-R78 PolarHBondContact O-N 3.1Å; R78-V80 PolarHBondContact O-N 3.17Å; R78-R81 WeakPolarHBondContact O-CB 3.22Å; R78-R81 PolarHBondContact O-N 2.98Å; R78-R81 VanDerWaalsContact O-N 3.16Å; R78-E82 PolarHBondContact O-N 2.97Å; R78-E82 VanDerWaalsContact O-N 3.12Å
79L90.1Very high90Very high0 Ų068.4 Ų68.40%034%0.335CS..Hα-helixtrans-61.6-43.9-177.4-166.5168.5000111.4L27 L40 F72 I75 Q76 R81 E82 L83 F94L27-L79 HydrophobicContact CD2-CD2 4.36Å; L40-L79 HydrophobicContact CD2-CD1 3.81Å; F72-L79 HydrophobicContact CD1-CD1 4.15Å; F72-L79 HydrophobicContact CE1-CD1 4.14Å; I75-L79 HydrophobicContact CD1-CD1 3.77Å; I75-L79 HydrophobicContact CG1-CD1 4.1Å; I75-L79 WeakPolarHBondContact O-CB 3.44Å; I75-L79 PolarHBondContact O-N 3.2Å; Q76-L79 PolarHBondContact O-N 3.05Å; L79-R81 VanDerWaalsContact C-N 3.34Å; L79-R81 PolarHBondContact O-N 3.42Å; L79-E82 PolarHBondContact O-N 3.28Å; L79-L83 HydrophobicContact CD2-CD1 3.3Å; L79-L83 HydrophobicContact CD2-CG 3.78Å; L79-L83 WeakPolarHBondContact O-CG 3.16Å; L79-L83 PolarHBondContact O-N 2.94Å; L79-F94 HydrophobicContact CD2-CE1 4.31Å; L79-F94 HydrophobicContact CD2-CE2 3.71Å; L79-F94 HydrophobicContact CD2-CZ 3.27Å
80V92Very high90Very high15 Ų1570.2 Ų70.29%0.09134%0.342CS..Hα-helixtrans-57.8-45.8175170.40000110.7Q76 R78 E82 L83 E84 F94Q76-V80 HydrophobicContact CG-CG2 3.97Å; Q76-V80 VanDerWaalsContact O-CB 3.3Å; Q76-V80 WeakPolarHBondContact O-CB 3.47Å; Q76-V80 WeakPolarHBondContact O-CG2 3.46Å; Q76-V80 PolarHBondContact O-N 3.07Å; R78-V80 PolarHBondContact O-N 3.17Å; V80-E82 VanDerWaalsContact C-N 3.32Å; V80-E82 PolarHBondContact O-N 2.82Å; V80-L83 PolarHBondContact O-N 2.79Å; V80-E84 HydrophobicContact CG1-CG 4Å; V80-E84 WeakPolarHBondContact O-CB 3.36Å; V80-E84 WeakPolarHBondContact O-CG 3.35Å; V80-E84 PolarHBondContact O-N 3.42Å; V80-F94 HydrophobicContact CG2-CD2 3.91Å; V80-F94 HydrophobicContact CG2-CE2 3.64Å
81R90.2Very high90Very high143 Ų14363.6 Ų63.654%0.5431%0.313SS..Hα-helixtrans-61.8-39.4179.4-68.7172.4-175.4179.61.3112.5V77 R78 L79 K85V77-R81 WeakPolarHBondContact O-CD 3.41Å; V77-R81 WeakPolarHBondContact O-CG 3.41Å; R78-R81 WeakPolarHBondContact O-CB 3.22Å; R78-R81 PolarHBondContact O-N 2.98Å; R78-R81 VanDerWaalsContact O-N 3.16Å; L79-R81 VanDerWaalsContact C-N 3.34Å; L79-R81 PolarHBondContact O-N 3.42Å; R81-K85 VanDerWaalsContact O-CG 3.27Å; R81-K85 WeakPolarHBondContact O-CG 3.39Å; R81-K85 PolarHBondContact O-N 3.28Å; R81-K85 VanDerWaalsContact O-N 3.16Å
82E90.3Very high90.1Very high54 Ų5461 Ų6125%0.25230%0.295SS..Hα-helixtrans-70-41.2178.7-72.2176.717600112.1L30 R78 L79 V80 K85 K86L30-E82 HydrophobicContact CD1-CB 3.93Å; L30-E82 HydrophobicContact CD2-CB 3.91Å; L30-E82 HydrophobicContact CD2-CG 4.34Å; L30-E82 WeakPolarHBondContact CD2-OE2 2.87Å; R78-E82 PolarHBondContact O-N 2.97Å; R78-E82 VanDerWaalsContact O-N 3.12Å; L79-E82 PolarHBondContact O-N 3.28Å; V80-E82 VanDerWaalsContact C-N 3.32Å; V80-E82 PolarHBondContact O-N 2.82Å; E82-K85 PolarHBondContact O-N 3.01Å; E82-K86 PolarHBondContact O-N 3.45Å
83L90.8Very high90.2Very high0 Ų061 Ų610%030%0.296CS..Hα-helixtrans-69-42175.5-66.9-178.1000111.8A26 L27 L30 I62 L79 V80 K85 K86 F87 V92 F94A26-L83 HydrophobicContact CB-CD2 4.32Å; L27-L83 HydrophobicContact CD2-CD1 4.39Å; L27-L83 HydrophobicContact CD2-CD2 4.26Å; L30-L83 HydrophobicContact CD1-CD2 3.74Å; L30-L83 HydrophobicContact CD1-CG 4.29Å; I62-L83 HydrophobicContact CD1-CD1 3.75Å; L79-L83 HydrophobicContact CD2-CD1 3.3Å; L79-L83 HydrophobicContact CD2-CG 3.78Å; L79-L83 WeakPolarHBondContact O-CG 3.16Å; L79-L83 PolarHBondContact O-N 2.94Å; V80-L83 PolarHBondContact O-N 2.79Å; L83-K85 PolarHBondContact O-N 2.69Å; L83-K86 PolarHBondContact O-N 3.38Å; L83-F87 HydrophobicContact CB-CD2 4.23Å; L83-F87 HydrophobicContact CB-CE2 4.47Å; L83-F87 HydrophobicContact CD2-CE2 4.12Å; L83-F87 WeakPolarHBondContact O-CD2 3.44Å; L83-F87 PolarHBondContact O-N 2.79Å; L83-V92 HydrophobicContact CB-CG2 4.06Å; L83-V92 HydrophobicContact CD1-CG1 4.06Å; L83-F94 HydrophobicContact CD1-CZ 3.92Å
84E90.4Very high90.3Very high30 Ų3058.6 Ų58.614%0.1428%0.284CS..Hα-helixtrans-60.6-36.3177.1-72.2-175.315400111.3V80 G89 K90 H91 V92 K167V80-E84 HydrophobicContact CG1-CG 4Å; V80-E84 WeakPolarHBondContact O-CB 3.36Å; V80-E84 WeakPolarHBondContact O-CG 3.35Å; V80-E84 PolarHBondContact O-N 3.42Å; E84-G89 WeakPolarHBondContact O-CA 3.38Å; E84-G89 PolarHBondContact O-N 2.87Å; E84-K90 WeakPolarHBondContact CG-O 3.45Å; E84-H91 WeakPolarHBondContact OE1-CA 3.1Å; E84-H91 IonicContact OE1-ND1 3.61Å; E84-V92 HydrophobicContact CG-CB 4.28Å; E84-V92 HydrophobicContact CG-CG2 3.99Å; E84-V92 PolarHBondContact OE1-N 2.83Å; E84-K167 IonicContact OE1-NZ 2.64Å; E84-K167 PolarHBondContact OE1-NZ 3.35Å; E84-K167 IonicContact OE2-NZ 3.06Å; E84-K167 PolarHBondContact OE2-NZ 3.39Å
85K90.4Very high90.5Very high175 Ų17550.4 Ų50.476%0.76125%0.249SC*.Hα-helixtrans-63.2-41.1171.9-75.4173.8-177.9-175.40112.7R81 E82 L83R81-K85 VanDerWaalsContact O-CG 3.27Å; R81-K85 WeakPolarHBondContact O-CG 3.39Å; R81-K85 PolarHBondContact O-N 3.28Å; R81-K85 VanDerWaalsContact O-N 3.16Å; E82-K85 PolarHBondContact O-N 3.01Å; L83-K85 PolarHBondContact O-N 2.69Å
86K89.6Confident90.6Very high77 Ų7750.4 Ų50.434%0.33525%0.249SC..Hα-helixtrans-72.2-35.8178.9-72.1-170.7177.9-167.10112.8A26 E29 E82 L83 S88A26-K86 HydrophobicContact CB-CD 4.03Å; A26-K86 PolarHBondContact O-NZ 3.37Å; E29-K86 VanDerWaalsContact CB-NZ 3.3Å; E29-K86 IonicContact OE2-NZ 2.68Å; E29-K86 PolarHBondContact OE2-NZ 2.85Å; E82-K86 PolarHBondContact O-N 3.45Å; L83-K86 PolarHBondContact O-N 3.38Å; K86-S88 VanDerWaalsContact C-N 3.32Å; K86-S88 PolarHBondContact O-N 2.87Å
87F88Confident90.6Very high41 Ų4153.8 Ų53.818%0.1827%0.265CS..THydrogen-bonded Turntrans-95.536.2-175.8-69-69.8000113.4I23 A26 I60 L83 G89 K90I23-F87 HydrophobicContact CG1-CE1 4.37Å; I23-F87 HydrophobicContact CG1-CE2 4.29Å; I23-F87 HydrophobicContact CG1-CZ 3.68Å; A26-F87 HydrophobicContact CB-CE2 4.32Å; A26-F87 HydrophobicContact CB-CZ 4.2Å; I60-F87 HydrophobicContact CD1-CB 3.79Å; I60-F87 HydrophobicContact CD1-CD1 3.75Å; I60-F87 HydrophobicContact CD1-CD2 3.96Å; I60-F87 HydrophobicContact CD1-CE1 4.34Å; I60-F87 HydrophobicContact CD1-CG 3.56Å; L83-F87 HydrophobicContact CB-CD2 4.23Å; L83-F87 HydrophobicContact CB-CE2 4.47Å; L83-F87 HydrophobicContact CD2-CE2 4.12Å; L83-F87 WeakPolarHBondContact O-CD2 3.44Å; L83-F87 PolarHBondContact O-N 2.79Å; F87-G89 PolarHBondContact O-N 2.82Å; F87-G89 VanDerWaalsContact O-N 3.16Å; F87-K90 HydrophobicContact CB-CB 4.42Å; F87-K90 WeakPolarHBondContact O-CB 3.33Å; F87-K90 VanDerWaalsContact O-CG 3.28Å; F87-K90 WeakPolarHBondContact O-CG 3.36Å; F87-K90 PolarHBondContact O-N 3.41Å
88S86.3Confident90.6Very high116 Ų11653.1 Ų53.181%0.81126%0.259SS*.THydrogen-bonded Turntrans54.234.8174.3-51.40000114.3K86 K90K86-S88 VanDerWaalsContact C-N 3.32Å; K86-S88 PolarHBondContact O-N 2.87Å; S88-K90 VanDerWaalsContact C-N 3.32Å; S88-K90 PolarHBondContact O-N 3.41Å
89G83.5Confident90.6Very high50 Ų5052.2 Ų52.252%0.51526%0.26SS..THydrogen-bonded Turntrans77.79179.100000115.2E84 F87E84-G89 WeakPolarHBondContact O-CA 3.38Å; E84-G89 PolarHBondContact O-N 2.87Å; F87-G89 PolarHBondContact O-N 2.82Å; F87-G89 VanDerWaalsContact O-N 3.16Å
90K90.8Very high90.6Very high69 Ų6956 Ų5630%0.328%0.279SS..  trans-63.2137.1170.7-69.3177.4-174.6-179.40110.1E50 K58 I60 E84 F87 S88 V92E50-K90 IonicContact OE1-NZ 3.87Å; E50-K90 PolarHBondContact OE1-NZ 2.68Å; K58-K90 HydrophobicContact CB-CD 4.19Å; K58-K90 WeakPolarHBondContact O-CB 3.37Å; I60-K90 HydrophobicContact CD1-CB 4.45Å; I60-K90 HydrophobicContact CD1-CD 4.35Å; E84-K90 WeakPolarHBondContact CG-O 3.45Å; F87-K90 HydrophobicContact CB-CB 4.42Å; F87-K90 WeakPolarHBondContact O-CB 3.33Å; F87-K90 VanDerWaalsContact O-CG 3.28Å; F87-K90 WeakPolarHBondContact O-CG 3.36Å; F87-K90 PolarHBondContact O-N 3.41Å; S88-K90 VanDerWaalsContact C-N 3.32Å; S88-K90 PolarHBondContact O-N 3.41Å; K90-V92 PolarHBondContact O-N 3.02Å
91H91.4Very high90.2Very high27 Ų2759.1 Ų59.113%0.12529%0.289CS..EExtended strand (participates in β ladder)trans-66.7129.4178.4-66.3-49.9000111.5A59 I60 E84 H166 T170A59-H91 CarbonylContact C-O 3.51Å; A59-H91 WeakPolarHBondContact CA-O 3.39Å; I60-H91 PolarHBondContact N-O 2.88Å; E84-H91 WeakPolarHBondContact OE1-CA 3.1Å; E84-H91 IonicContact OE1-ND1 3.61Å; H91-H166 AromaticContact CE1-CD2 3.87Å; H91-T170 HydrophobicContact CB-CG2 3.95Å; H91-T170 PolarHBondContact CD2-OG1 3.11Å
92V92.8Very high89.9Confident3 Ų357.6 Ų57.62%0.01830%0.298CS..EExtended strand (participates in β ladder)trans-110.5128.6177.4-175.60000109.5I60 I62 L83 E84 K90 F94I60-V92 HydrophobicContact CB-CG2 4.27Å; I60-V92 HydrophobicContact CD1-CG2 4.47Å; I60-V92 WeakPolarHBondContact O-CA 3.41Å; I62-V92 HydrophobicContact CD1-CG1 3.68Å; I62-V92 HydrophobicContact CG1-CG1 4.24Å; L83-V92 HydrophobicContact CB-CG2 4.06Å; L83-V92 HydrophobicContact CD1-CG1 4.06Å; E84-V92 HydrophobicContact CG-CB 4.28Å; E84-V92 HydrophobicContact CG-CG2 3.99Å; E84-V92 PolarHBondContact OE1-N 2.83Å; K90-V92 PolarHBondContact O-N 3.02Å; V92-F94 HydrophobicContact CG1-CE2 4.3Å; V92-F94 HydrophobicContact CG1-CZ 4.44Å
93V92.9Very high89.4Confident6 Ų664.1 Ų64.14%0.03633%0.325CS..EExtended strand (participates in β ladder)trans-128.3139.5178.7-167.90000110.5I60 I61 I62 I95 L131 F171I60-V93 PolarHBondContact O-N 3.3Å; I61-V93 WeakPolarHBondContact CA-O 3.44Å; I62-V93 PolarHBondContact N-O 2.99Å; V93-I95 HydrophobicContact CG1-CG1 4.5Å; V93-L131 HydrophobicContact CB-CD2 4.44Å; V93-L131 HydrophobicContact CG1-CD2 3.58Å; V93-F171 HydrophobicContact CG2-CD1 4.24Å; V93-F171 HydrophobicContact CG2-CE1 3.89Å
94F94.4Very high88.6Confident9 Ų970 Ų704%0.03935%0.351CS..EExtended strand (participates in β ladder)trans-98.7133.2176.1-70.3-82.2000109.9I62 V64 F72 Q76 L79 V80 L83 V92I62-F94 HydrophobicContact CB-CD1 3.8Å; I62-F94 HydrophobicContact CB-CE1 3.71Å; I62-F94 HydrophobicContact CD1-CE1 3.74Å; I62-F94 HydrophobicContact CD1-CZ 3.8Å; I62-F94 HydrophobicContact CG1-CE1 4.29Å; I62-F94 HydrophobicContact CG2-CD1 3.96Å; I62-F94 HydrophobicContact CG2-CE1 3.7Å; I62-F94 WeakPolarHBondContact O-CA 3.41Å; V64-F94 HydrophobicContact CG2-CB 4.49Å; V64-F94 HydrophobicContact CG2-CD1 3.62Å; V64-F94 HydrophobicContact CG2-CE1 4.4Å; F72-F94 HydrophobicContact CD1-CD1 4.46Å; F72-F94 HydrophobicContact CD1-CE1 4.33Å; F72-F94 HydrophobicContact CE1-CE1 4.31Å; Q76-F94 HydrophobicContact CG-CD2 3.92Å; L79-F94 HydrophobicContact CD2-CE1 4.31Å; L79-F94 HydrophobicContact CD2-CE2 3.71Å; L79-F94 HydrophobicContact CD2-CZ 3.27Å; V80-F94 HydrophobicContact CG2-CD2 3.91Å; V80-F94 HydrophobicContact CG2-CE2 3.64Å; L83-F94 HydrophobicContact CD1-CZ 3.92Å; V92-F94 HydrophobicContact CG1-CE2 4.3Å; V92-F94 HydrophobicContact CG1-CZ 4.44Å
95I94.3Very high87.6Confident3 Ų375.5 Ų75.52%0.01539%0.387CS..EExtended strand (participates in β ladder)trans-133.1138177.5-61-178.3000108.4I61 I62 F63 V64 V93 I127 L131 V174 L178I61-I95 HydrophobicContact CG2-CB 4.28Å; I61-I95 HydrophobicContact CG2-CD1 3.66Å; I61-I95 HydrophobicContact CG2-CG1 4.02Å; I62-I95 PolarHBondContact O-N 2.83Å; F63-I95 CarbonylContact C-O 3.57Å; F63-I95 VanDerWaalsContact CA-O 3.26Å; F63-I95 WeakPolarHBondContact CA-O 3.28Å; F63-I95 HydrophobicContact CD1-CB 4.39Å; F63-I95 HydrophobicContact CD1-CG2 4.39Å; F63-I95 HydrophobicContact CE1-CB 4.41Å; F63-I95 HydrophobicContact CE1-CG2 4.23Å; V64-I95 PolarHBondContact N-O 3.41Å; V93-I95 HydrophobicContact CG1-CG1 4.5Å; I95-I127 HydrophobicContact CG2-CG1 4.25Å; I95-I127 HydrophobicContact CG2-CG2 4.47Å; I95-L131 HydrophobicContact CD1-CD2 3.7Å; I95-L131 HydrophobicContact CD1-CG 4.26Å; I95-L131 HydrophobicContact CG1-CD2 4.12Å; I95-V174 HydrophobicContact CD1-CG1 4.03Å; I95-L178 HydrophobicContact CD1-CD1 3.35Å
96A93.7Very high86.4Confident4 Ų471.1 Ų71.13%0.03338%0.378CS..EExtended strand (participates in β ladder)trans-69.1137.8173.300000111.9V64 V66 L69 L98 D130V64-A96 CarbonylContact O-C 3.59Å; V64-A96 WeakPolarHBondContact O-CA 3.24Å; V66-A96 HydrophobicContact CG2-CB 4.31Å; L69-A96 HydrophobicContact CD1-CB 3.58Å; L69-A96 HydrophobicContact CG-CB 4.21Å; A96-L98 HydrophobicContact CB-CG 4.12Å; A96-L98 PolarHBondContact O-N 3.42Å; A96-D130 VanDerWaalsContact CB-OD2 3.22Å; A96-D130 WeakPolarHBondContact CB-OD2 3.24Å; A96-D130 PolarHBondContact N-OD2 3.13Å
97Q90.9Very high84.9Confident81 Ų8175.8 Ų75.838%0.37940%0.401SS..  trans-74.389.2171.5-173.464.82300109.8T46 F63 V64 V66T46-Q97 HydrophobicContact CG2-CB 4.36Å; F63-Q97 HydrophobicContact CB-CB 4.42Å; V64-Q97 PolarHBondContact O-N 3.42Å; V66-Q97 WeakPolarHBondContact CG2-O 3.37Å
98L90.2Very high83.3Confident47 Ų4781.8 Ų81.825%0.24643%0.434CS..  trans-95.4139.5179.9-65.8168.1000111.6V66 A96 V123 A126 I127V66-L98 HydrophobicContact CG1-CD2 4.49Å; V66-L98 HydrophobicContact CG2-CD2 3.62Å; V66-L98 HydrophobicContact CG2-CG 4.41Å; A96-L98 HydrophobicContact CB-CG 4.12Å; A96-L98 PolarHBondContact O-N 3.42Å; L98-V123 HydrophobicContact CB-CG1 3.74Å; L98-V123 HydrophobicContact CB-CG2 4.08Å; L98-V123 HydrophobicContact CD1-CB 4.44Å; L98-V123 HydrophobicContact CD1-CG1 3.93Å; L98-V123 HydrophobicContact CD1-CG2 4.45Å; L98-V123 HydrophobicContact CG-CG1 4.5Å; L98-A126 HydrophobicContact CD1-CB 3.64Å; L98-I127 HydrophobicContact CD1-CG1 4.42Å
99K88.8Confident81.9Confident147 Ų14782.2 Ų82.264%0.63943%0.426SS*.  trans-99.9113.8177.2-170.7172.6-178169.50110.4
100I90.3Very high80.5Confident78 Ų7888.6 Ų88.640%0.444%0.443SS..PPolyproline II helixtrans-81.7129.3172.2-57172.8000108.7L120 V123I100-L120 HydrophobicContact CG2-CB 4.12Å; I100-V123 HydrophobicContact CD1-CB 4.36Å; I100-V123 HydrophobicContact CD1-CG1 3.96Å; I100-V123 HydrophobicContact CG1-CB 3.91Å; I100-V123 HydrophobicContact CG1-CG1 3.71Å; I100-V123 HydrophobicContact CG1-CG2 3.95Å
101W85.3Confident79Confident82 Ų8294.6 Ų94.631%0.31147%0.469SS..PPolyproline II helixtrans-98.3142.7169.9-77.620.3000110.2L114 R118W101-L114 HydrophobicContact CB-CD1 3.42Å; W101-L114 VanDerWaalsContact CB-CD1 3.42Å; W101-L114 HydrophobicContact CD2-CD1 3.61Å; W101-L114 HydrophobicContact CE3-CD1 3.2Å; W101-L114 HydrophobicContact CG-CD1 3.75Å; W101-L114 HydrophobicContact CZ3-CD1 4.1Å; W101-R118 HydrophobicContact CG-CB 4.46Å; W101-R118 PolarHBondContact N-O 2.91Å
102P83.8Confident77.9Confident111 Ų11199.4 Ų99.472%0.72150%0.495SS*.PPolyproline II helixtrans-64.1144.5177.527-33.6000110.6K104P102-K104 PolarHBondContact O-N 3.44Å
103K79.4Confident76.9Confident190 Ų190109 Ų10983%0.82654%0.537SS*.PPolyproline II helixtrans-63.5122.9173.1-173.3178.6180-176.70108.1
104K74.1Confident75.9Confident124 Ų124111 Ų11154%0.53955%0.547SS..PPolyproline II helixtrans-72.2129.3176.5-61-178.2179.9-177.50109P102 N112P102-K104 PolarHBondContact O-N 3.44Å; K104-N112 PolarHBondContact NZ-O 2.95Å
105T69.5Low75.4Confident145 Ų145112.9 Ų112.989%0.8956%0.56SS**  trans-107.4-3.9-172.91.60000114.8
106S65.4Low74.9Confident83 Ų83117.7 Ų117.758%0.5859%0.591SS**SBendtrans-145159.3-174-176.40000114.4L108S106-L108 PolarHBondContact O-N 3.11Å
107E56.8Low74.6Confident176 Ų176120.9 Ų120.982%0.82261%0.614SS**SBendtrans-54.39.8-170.9-63.5178.5152.600117.8I109E107-I109 PolarHBondContact O-N 3.2Å
108L54.7Low74.5Confident167 Ų167121.9 Ų121.987%0.87461%0.614SS**  trans-72.630.9166.4-68.2162000111.9S106 Q110S106-L108 PolarHBondContact O-N 3.11Å; L108-Q110 PolarHBondContact O-N 2.67Å
109I57.2Low74.5Confident125 Ų125121.9 Ų121.964%0.64162%0.616SS**  trans-82.9104.1179.7-58.6168.8000105.6E107E107-I109 PolarHBondContact O-N 3.2Å
110Q54.5Low74.6Confident184 Ų184119 Ų11986%0.8661%0.607SS**SBendtrans-174.2-26138.4-104165.637.700113.4L108L108-Q110 PolarHBondContact O-N 2.67Å
111K58.9Low74.6Confident194 Ų194119.6 Ų119.684%0.84362%0.615SS**SBendtrans-79.5-32.6-168.9-68.8-171.5178.7-178.80115.3
112N68.2Low75Confident129 Ų129117.9 Ų117.969%0.6962%0.615SS**  trans-145.5106.9179.8-71.2-48.8000112.4K104K104-N112 PolarHBondContact NZ-O 2.95Å
113K71.3Confident75.4Confident203 Ų203112.8 Ų112.888%0.88358%0.582SS**PPolyproline II helixtrans-61.4138.4170.9-70.7-179.1-178.9177.40109.5
114L72.1Confident76.1Confident49 Ų49104.5 Ų104.526%0.25755%0.546SS..PPolyproline II helixtrans-68.1129.9174.3176.568.5000109.1W101 R118 T119W101-L114 HydrophobicContact CB-CD1 3.42Å; W101-L114 VanDerWaalsContact CB-CD1 3.42Å; W101-L114 HydrophobicContact CD2-CD1 3.61Å; W101-L114 HydrophobicContact CE3-CD1 3.2Å; W101-L114 HydrophobicContact CG-CD1 3.75Å; W101-L114 HydrophobicContact CZ3-CD1 4.1Å; L114-R118 HydrophobicContact CD1-CB 4.18Å; L114-T119 HydrophobicContact CD2-CG2 3.86Å
115P84.6Confident77Confident48 Ų48101.2 Ų101.231%0.31254%0.535SS..PPolyproline II helixtrans-62.7134.2171.8-22.233.8000110.7S117 R118P115-S117 PolarHBondContact O-N 3.4Å; P115-R118 PolarHBondContact O-N 3.48Å
116P83.7Confident78.2Confident104 Ų10495.6 Ų95.668%0.67550%0.503SS*.G310 helixtrans-59.3-32.8-178.123.1-32.9000112.4R118 T119 S122P116-R118 PolarHBondContact O-N 3.46Å; P116-R118 VanDerWaalsContact O-N 3.13Å; P116-T119 WeakPolarHBondContact O-CB 3.32Å; P116-T119 WeakPolarHBondContact O-CG2 3.17Å; P116-T119 PolarHBondContact O-N 3.39Å; P116-T119 VanDerWaalsContact O-N 3.15Å; P116-T119 PolarHBondContact O-OG1 2.92Å; P116-S122 WeakPolarHBondContact O-CB 3.46Å
117S86.8Confident79.6Confident72 Ų7292.6 Ų92.650%0.50348%0.48SS..G310 helixtrans-62.7-14.9176.656.50000114.8P115P115-S117 PolarHBondContact O-N 3.4Å
118R88.2Confident81.3Confident102 Ų10284.3 Ų84.339%0.38544%0.441SS..G310 helixtrans-105.210.6179-66-171.7177.9167.70.8113.5W101 L114 P115 P116W101-R118 HydrophobicContact CG-CB 4.46Å; W101-R118 PolarHBondContact N-O 2.91Å; L114-R118 HydrophobicContact CD1-CB 4.18Å; P115-R118 PolarHBondContact O-N 3.48Å; P116-R118 PolarHBondContact O-N 3.46Å; P116-R118 VanDerWaalsContact O-N 3.13Å
119T90.3Very high83.1Confident47 Ų4782.2 Ų82.229%0.28843%0.427SS..SBendtrans-79150173.861.40000111L114 P116 T121 S122 V123L114-T119 HydrophobicContact CD2-CG2 3.86Å; P116-T119 WeakPolarHBondContact O-CB 3.32Å; P116-T119 WeakPolarHBondContact O-CG2 3.17Å; P116-T119 PolarHBondContact O-N 3.39Å; P116-T119 VanDerWaalsContact O-N 3.15Å; P116-T119 PolarHBondContact O-OG1 2.92Å; T119-T121 VanDerWaalsContact C-N 3.28Å; T119-T121 PolarHBondContact O-N 3.25Å; T119-S122 PolarHBondContact O-N 3.45Å; T119-S122 VanDerWaalsContact OG1-CB 3.28Å; T119-S122 WeakPolarHBondContact OG1-CB 3.41Å; T119-S122 PolarHBondContact OG1-N 2.8Å; T119-V123 WeakPolarHBondContact O-CG2 3.19Å; T119-V123 PolarHBondContact O-N 2.79Å
120L91.3Very high84.8Confident86 Ų8676.8 Ų76.845%0.4540%0.399SS..Hα-helixtrans-54.2-45.9177.9-174.8159.7000111.4I100 V123 H124I100-L120 HydrophobicContact CG2-CB 4.12Å; L120-V123 PolarHBondContact O-N 2.87Å; L120-H124 WeakPolarHBondContact CD2-NE2 3.38Å; L120-H124 WeakPolarHBondContact O-CB 3.35Å; L120-H124 PolarHBondContact O-CD2 3.26Å; L120-H124 PolarHBondContact O-N 3.26Å
121T91.3Very high86.6Confident91 Ų9168.1 Ų68.156%0.55836%0.359SS*.Hα-helixtrans-61.3-50.6-179.5-47.10000111.6T119 V123 H124 D125T119-T121 VanDerWaalsContact C-N 3.28Å; T119-T121 PolarHBondContact O-N 3.25Å; T121-V123 VanDerWaalsContact C-N 3.33Å; T121-V123 PolarHBondContact O-N 2.91Å; T121-H124 PolarHBondContact O-N 3.05Å; T121-D125 VanDerWaalsContact O-CG 3.32Å; T121-D125 PolarHBondContact O-N 2.97Å
122S92.7Very high88.2Confident46 Ų4658.9 Ų58.932%0.32232%0.319SS..Hα-helixtrans-62.7-39.1-179.9178.50000112.5P116 T119 D125 A126P116-S122 WeakPolarHBondContact O-CB 3.46Å; T119-S122 PolarHBondContact O-N 3.45Å; T119-S122 VanDerWaalsContact OG1-CB 3.28Å; T119-S122 WeakPolarHBondContact OG1-CB 3.41Å; T119-S122 PolarHBondContact OG1-N 2.8Å; S122-D125 PolarHBondContact O-N 2.83Å; S122-A126 WeakPolarHBondContact O-CB 3.27Å; S122-A126 PolarHBondContact O-N 3.46Å
123V93.6Very high89.3Confident4 Ų455.5 Ų55.52%0.02430%0.298CS..Hα-helixtrans-66.6-39.7176.6171.20000111.3L98 I100 T119 L120 T121 D125 A126 I127L98-V123 HydrophobicContact CB-CG1 3.74Å; L98-V123 HydrophobicContact CB-CG2 4.08Å; L98-V123 HydrophobicContact CD1-CB 4.44Å; L98-V123 HydrophobicContact CD1-CG1 3.93Å; L98-V123 HydrophobicContact CD1-CG2 4.45Å; L98-V123 HydrophobicContact CG-CG1 4.5Å; I100-V123 HydrophobicContact CD1-CB 4.36Å; I100-V123 HydrophobicContact CD1-CG1 3.96Å; I100-V123 HydrophobicContact CG1-CB 3.91Å; I100-V123 HydrophobicContact CG1-CG1 3.71Å; I100-V123 HydrophobicContact CG1-CG2 3.95Å; T119-V123 WeakPolarHBondContact O-CG2 3.19Å; T119-V123 PolarHBondContact O-N 2.79Å; L120-V123 PolarHBondContact O-N 2.87Å; T121-V123 VanDerWaalsContact C-N 3.33Å; T121-V123 PolarHBondContact O-N 2.91Å; V123-D125 VanDerWaalsContact C-N 3.27Å; V123-D125 PolarHBondContact O-N 3.49Å; V123-A126 PolarHBondContact O-N 3.2Å; V123-I127 HydrophobicContact CG1-CD1 3.79Å; V123-I127 HydrophobicContact CG1-CG1 4.34Å; V123-I127 VanDerWaalsContact O-CG1 3.23Å; V123-I127 WeakPolarHBondContact O-CG1 3.31Å; V123-I127 PolarHBondContact O-N 3.48Å
124H93.6Very high90.2Very high15 Ų1547.9 Ų47.97%0.06927%0.269CS..Hα-helixtrans-67.3-29.1177.4-79.3-136.1000113L120 T121 L128 Y175 T179 K181L120-H124 WeakPolarHBondContact CD2-NE2 3.38Å; L120-H124 WeakPolarHBondContact O-CB 3.35Å; L120-H124 PolarHBondContact O-CD2 3.26Å; L120-H124 PolarHBondContact O-N 3.26Å; T121-H124 PolarHBondContact O-N 3.05Å; H124-L128 WeakPolarHBondContact O-CG 3.44Å; H124-L128 PolarHBondContact O-N 3.02Å; H124-Y175 WeakPolarHBondContact O-CE2 3.23Å; H124-Y175 PolarHBondContact O-OH 3.15Å; H124-T179 VanDerWaalsContact CE1-CB 3.48Å; H124-T179 WeakPolarHBondContact CE1-CB 3.19Å; H124-K181 WeakPolarHBondContact ND1-CE 3.4Å; H124-K181 PolarHBondContact ND1-NZ 3.21Å
125D93.1Very high91.1Very high56 Ų5645.8 Ų45.830%0.29926%0.259SS..Hα-helixtrans-75.2-45.4174.3-64.8-25.4000110.5T121 S122 V123 I127 L128 E129 K140T121-D125 VanDerWaalsContact O-CG 3.32Å; T121-D125 PolarHBondContact O-N 2.97Å; S122-D125 PolarHBondContact O-N 2.83Å; V123-D125 VanDerWaalsContact C-N 3.27Å; V123-D125 PolarHBondContact O-N 3.49Å; D125-I127 VanDerWaalsContact C-N 3.34Å; D125-I127 PolarHBondContact O-N 3.12Å; D125-L128 WeakPolarHBondContact O-CB 3.44Å; D125-L128 PolarHBondContact O-N 3.26Å; D125-E129 PolarHBondContact O-N 3.34Å; D125-E129 VanDerWaalsContact O-N 3.13Å; D125-K140 IonicContact OD1-NZ 3.73Å; D125-K140 PolarHBondContact OD1-NZ 3.31Å
126A93.6Very high91.4Very high27 Ų2750.5 Ų50.522%0.22328%0.277CS..Hα-helixtrans-60.9-39.4175.800000113L98 S122 V123 L128 E129 D130L98-A126 HydrophobicContact CD1-CB 3.64Å; S122-A126 WeakPolarHBondContact O-CB 3.27Å; S122-A126 PolarHBondContact O-N 3.46Å; V123-A126 PolarHBondContact O-N 3.2Å; A126-L128 VanDerWaalsContact C-N 3.27Å; A126-L128 PolarHBondContact O-N 3.24Å; A126-E129 PolarHBondContact O-N 2.88Å; A126-D130 PolarHBondContact O-N 2.56Å
127I94.4Very high91.8Very high19 Ų1948 Ų4810%0.09726%0.257CS..Hα-helixtrans-62.3-36.4174.3-68.8166.1000111I95 L98 V123 D125 L131 Y175 L178I95-I127 HydrophobicContact CG2-CG1 4.25Å; I95-I127 HydrophobicContact CG2-CG2 4.47Å; L98-I127 HydrophobicContact CD1-CG1 4.42Å; V123-I127 HydrophobicContact CG1-CD1 3.79Å; V123-I127 HydrophobicContact CG1-CG1 4.34Å; V123-I127 VanDerWaalsContact O-CG1 3.23Å; V123-I127 WeakPolarHBondContact O-CG1 3.31Å; V123-I127 PolarHBondContact O-N 3.48Å; D125-I127 VanDerWaalsContact C-N 3.34Å; D125-I127 PolarHBondContact O-N 3.12Å; I127-L131 HydrophobicContact CG2-CD1 4.05Å; I127-L131 HydrophobicContact CG2-CG 4.34Å; I127-L131 WeakPolarHBondContact O-CB 3.48Å; I127-L131 WeakPolarHBondContact O-CG 3.37Å; I127-L131 PolarHBondContact O-N 3.26Å; I127-L131 VanDerWaalsContact O-N 3.11Å; I127-Y175 HydrophobicContact CB-CE2 4.4Å; I127-Y175 HydrophobicContact CG2-CD2 3.94Å; I127-Y175 HydrophobicContact CG2-CE2 4.06Å; I127-L178 HydrophobicContact CG2-CD1 4.33Å
128L93.3Very high92.1Very high2 Ų247.9 Ų47.91%0.0125%0.253CS..Hα-helixtrans-65.4-42.7176.8-77.2169000111.5H124 D125 A126 L131 V132 I137 Y175 V183 F185H124-L128 WeakPolarHBondContact O-CG 3.44Å; H124-L128 PolarHBondContact O-N 3.02Å; D125-L128 WeakPolarHBondContact O-CB 3.44Å; D125-L128 PolarHBondContact O-N 3.26Å; A126-L128 VanDerWaalsContact C-N 3.27Å; A126-L128 PolarHBondContact O-N 3.24Å; L128-L131 PolarHBondContact O-N 2.88Å; L128-V132 WeakPolarHBondContact O-CG2 3.35Å; L128-V132 PolarHBondContact O-N 3.03Å; L128-I137 HydrophobicContact CB-CD1 4.05Å; L128-Y175 HydrophobicContact CB-CE2 4.5Å; L128-Y175 HydrophobicContact CD1-CE2 4.2Å; L128-Y175 HydrophobicContact CD2-CD1 4.18Å; L128-Y175 HydrophobicContact CD2-CD2 3.53Å; L128-Y175 HydrophobicContact CD2-CE1 4.06Å; L128-Y175 HydrophobicContact CD2-CE2 3.46Å; L128-Y175 VanDerWaalsContact CD2-CE2 3.46Å; L128-Y175 HydrophobicContact CD2-CG 3.87Å; L128-Y175 HydrophobicContact CG-CD2 3.96Å; L128-Y175 HydrophobicContact CG-CE1 4.41Å; L128-Y175 HydrophobicContact CG-CE2 3.38Å; L128-V183 HydrophobicContact CD2-CG1 4.31Å; L128-V183 HydrophobicContact CD2-CG2 4.07Å; L128-F185 HydrophobicContact CD2-CZ 4.37Å
129E93Very high92.3Very high124 Ų12444.1 Ų44.158%0.57925%0.246SC*.Hα-helixtrans-63.2-45.4178.5-68.8172.9-170.200111.7D125 A126 L131 V132 I137D125-E129 PolarHBondContact O-N 3.34Å; D125-E129 VanDerWaalsContact O-N 3.13Å; A126-E129 PolarHBondContact O-N 2.88Å; E129-L131 VanDerWaalsContact C-N 3.32Å; E129-L131 PolarHBondContact O-N 3.14Å; E129-V132 WeakPolarHBondContact O-CG2 3.44Å; E129-V132 PolarHBondContact O-N 2.76Å; E129-I137 HydrophobicContact CG-CD1 4.19Å
130D93.3Very high92.4Very high11 Ų1145.8 Ų45.86%0.05925%0.249CC..Hα-helixtrans-63.1-38.8178.5-74.7-14.6000112.4A96 A126 V132A96-D130 VanDerWaalsContact CB-OD2 3.22Å; A96-D130 WeakPolarHBondContact CB-OD2 3.24Å; A96-D130 PolarHBondContact N-OD2 3.13Å; A126-D130 PolarHBondContact O-N 2.56Å; D130-V132 VanDerWaalsContact C-N 3.32Å; D130-V132 PolarHBondContact O-N 3.38Å
131L92.3Very high92.5Very high1 Ų148.1 Ų48.11%0.00525%0.252CS..Hα-helixtrans-62.5-37.9-178.7-83.4175.3000113V93 I95 I127 L128 E129 F171 V174 Y175V93-L131 HydrophobicContact CB-CD2 4.44Å; V93-L131 HydrophobicContact CG1-CD2 3.58Å; I95-L131 HydrophobicContact CD1-CD2 3.7Å; I95-L131 HydrophobicContact CD1-CG 4.26Å; I95-L131 HydrophobicContact CG1-CD2 4.12Å; I127-L131 HydrophobicContact CG2-CD1 4.05Å; I127-L131 HydrophobicContact CG2-CG 4.34Å; I127-L131 WeakPolarHBondContact O-CB 3.48Å; I127-L131 WeakPolarHBondContact O-CG 3.37Å; I127-L131 PolarHBondContact O-N 3.26Å; I127-L131 VanDerWaalsContact O-N 3.11Å; L128-L131 PolarHBondContact O-N 2.88Å; E129-L131 VanDerWaalsContact C-N 3.32Å; E129-L131 PolarHBondContact O-N 3.14Å; L131-F171 WeakPolarHBondContact O-CE1 3.45Å; L131-F171 WeakPolarHBondContact O-CZ 3.15Å; L131-V174 HydrophobicContact CD2-CB 4.24Å; L131-V174 HydrophobicContact CD2-CG1 3.69Å; L131-Y175 HydrophobicContact CD1-CD2 3.74Å; L131-Y175 HydrophobicContact CD1-CG 4.24Å
132V92.1Very high92.7Very high1 Ų148.4 Ų48.41%0.00625%0.249CC..Hα-helixtrans-92.5-6.4-169.9-60.70000113.5L128 E129 D130 S135 I137 L156 F171 F185L128-V132 WeakPolarHBondContact O-CG2 3.35Å; L128-V132 PolarHBondContact O-N 3.03Å; E129-V132 WeakPolarHBondContact O-CG2 3.44Å; E129-V132 PolarHBondContact O-N 2.76Å; D130-V132 VanDerWaalsContact C-N 3.32Å; D130-V132 PolarHBondContact O-N 3.38Å; V132-S135 CarbonylContact C-O 3.51Å; V132-S135 WeakPolarHBondContact CG2-O 3.39Å; V132-S135 WeakPolarHBondContact O-CA 3.49Å; V132-S135 WeakPolarHBondContact O-CB 3.22Å; V132-S135 PolarHBondContact O-N 3.39Å; V132-I137 HydrophobicContact CG2-CD1 4.08Å; V132-I137 HydrophobicContact CG2-CG1 3.71Å; V132-L156 HydrophobicContact CB-CD2 3.84Å; V132-L156 HydrophobicContact CG1-CD2 3.76Å; V132-L156 HydrophobicContact CG2-CD2 4.17Å; V132-F171 HydrophobicContact CG1-CD2 4.31Å; V132-F185 HydrophobicContact CG1-CD1 3.99Å; V132-F185 HydrophobicContact CG1-CE1 3.38Å; V132-F185 HydrophobicContact CG1-CZ 4.05Å
133F90.7Very high92.7Very high58 Ų5853.6 Ų53.625%0.25426%0.262SS..THydrogen-bonded Turntrans-54.8130176.4-173.7-83.6000110.8Q73 Q76 V77Q73-F133 HydrophobicContact CB-CE2 3.93Å; Q73-F133 HydrophobicContact CB-CZ 3.91Å; Q73-F133 HydrophobicContact CG-CD2 4.09Å; Q73-F133 HydrophobicContact CG-CE2 3.93Å; Q73-F133 HydrophobicContact CG-CZ 4.26Å; Q73-F133 WeakPolarHBondContact O-CE1 3.48Å; Q73-F133 WeakPolarHBondContact O-CZ 3.45Å; Q76-F133 HydrophobicContact CB-CD1 4.07Å; Q76-F133 HydrophobicContact CB-CE1 3.7Å; Q76-F133 HydrophobicContact CG-CD1 3.69Å; Q76-F133 HydrophobicContact CG-CE1 3.86Å; Q76-F133 VanDerWaalsContact OE1-CD1 3.31Å; V77-F133 HydrophobicContact CG2-CE1 4.16Å
134P89.9Confident92.8Very high43 Ų4357.6 Ų57.628%0.27929%0.286SS..THydrogen-bonded Turncis-86.4-4.118.331-33.2000116.6V77 Q160V77-P134 HydrophobicContact CG2-CB 4.08Å; V77-P134 HydrophobicContact CG2-CG 4.26Å; P134-Q160 VanDerWaalsContact O-CD 3.32Å; P134-Q160 PolarHBondContact O-NE2 2.85Å; P134-Q160 PolarHBondContact O-OE1 3.01Å
135S91.4Very high92.8Very high4 Ų461.3 Ų61.33%0.02830%0.302CS..SBendtrans-78.1145.1-178.1-178.50000110.2V132 D157V132-S135 CarbonylContact C-O 3.51Å; V132-S135 WeakPolarHBondContact CG2-O 3.39Å; V132-S135 WeakPolarHBondContact O-CA 3.49Å; V132-S135 WeakPolarHBondContact O-CB 3.22Å; V132-S135 PolarHBondContact O-N 3.39Å; S135-D157 PolarHBondContact OG-N 3.22Å
136E90.8Very high92.9Very high148 Ų14867.2 Ų67.269%0.69233%0.333SS*.  trans-93.8154.5173.7-63.1-176.5175.600110.4D157E136-D157 PolarHBondContact O-N 3.4Å
137I92.9Very high92.9Very high52 Ų5272.3 Ų72.327%0.26736%0.356SS..EExtended strand (participates in β ladder)trans-87.8112.1174.4-59.1177.6000107.7L128 E129 V132 G139 V154 H155 L156L128-I137 HydrophobicContact CB-CD1 4.05Å; E129-I137 HydrophobicContact CG-CD1 4.19Å; V132-I137 HydrophobicContact CG2-CD1 4.08Å; V132-I137 HydrophobicContact CG2-CG1 3.71Å; I137-G139 WeakPolarHBondContact CG2-O 3.18Å; I137-V154 HydrophobicContact CB-CG1 4.32Å; I137-V154 HydrophobicContact CD1-CG1 3.91Å; I137-V154 HydrophobicContact CG1-CG1 3.85Å; I137-V154 HydrophobicContact CG2-CG1 3.66Å; I137-H155 CarbonylContact C-O 3.56Å; I137-L156 HydrophobicContact CG1-CD2 4.26Å
138V92.6Very high92.8Very high68 Ų6876.7 Ų76.741%0.41238%0.384SS..EExtended strand (participates in β ladder)trans-79.6-31.6177.6-179.80000110.9H155 D157V138-H155 PolarHBondContact N-O 3.26Å; V138-D157 HydrophobicContact CG2-CB 3.96Å
139G92.2Very high92.7Very high24 Ų2479 Ų7925%0.24740%0.4CS..EExtended strand (participates in β ladder)trans-160.5157.8-178.500000113I137 H155I137-G139 WeakPolarHBondContact CG2-O 3.18Å; G139-H155 PolarHBondContact N-O 3.34Å; G139-H155 PolarHBondContact O-N 3.23Å
140K93.4Very high92.7Very high81 Ų8181.6 Ų81.635%0.35241%0.405SS..EExtended strand (participates in β ladder)trans-137.8126.1177.8-177.8176.7179.2168.60109.6D125 I152D125-K140 IonicContact OD1-NZ 3.73Å; D125-K140 PolarHBondContact OD1-NZ 3.31Å; K140-I152 HydrophobicContact CG-CG2 4.16Å
141R93.1Very high92.7Very high135 Ų13582.6 Ų82.651%0.50941%0.41SS..EExtended strand (participates in β ladder)trans-124.6139.3177.6-65.4178.8175.6171.3-5.9109.3K153 L192R141-K153 HydrophobicContact CB-CB 4.3Å; R141-K153 PolarHBondContact N-O 2.81Å; R141-K153 PolarHBondContact O-N 3.23Å; R141-L192 VanDerWaalsContact NH2-CD1 3.26Å
142I94.8Very high92.8Very high97 Ų9783 Ų8350%0.49741%0.412SS..EExtended strand (participates in β ladder)trans-113.6111175.4-57.1178.2000107.2R150 I152I142-R150 HydrophobicContact CG2-CB 4.19Å; I142-I152 HydrophobicContact CG1-CG1 4.39Å
143R93.4Very high92.9Very high155 Ų15585.4 Ų85.459%0.58542%0.422SS*.EExtended strand (participates in β ladder)trans-89.8122.9173.6-177.2177.4178.7174.80.7108.8R150 L151R143-R150 WeakPolarHBondContact O-CA 3.47Å; R143-L151 PolarHBondContact N-O 2.98Å; R143-L151 PolarHBondContact O-N 2.9Å
144V95.2Very high93.2Very high88 Ų8882.7 Ų82.753%0.53341%0.41SS..EExtended strand (participates in β ladder)trans-93.7123.1169.7-172.80000107.7R150V144-R150 HydrophobicContact CG2-CG 4.4Å
145K93.6Very high93.3Very high93 Ų9381.1 Ų81.140%0.40440%0.399SS..PPolyproline II helixtrans-82.2167.7175.7-60.2-170.9-171.5172.30110.4D147 T148 S149K145-D147 PolarHBondContact O-N 3.07Å; K145-T148 PolarHBondContact O-N 3.45Å; K145-S149 WeakPolarHBondContact CD-OG 3.5Å; K145-S149 PolarHBondContact N-O 2.85Å
146L95.5Very high93.4Very high180 Ų18081 Ų8194%0.94240%0.398SS*.THydrogen-bonded Turntrans-56.6-36.2174.4-65.1173.9000111.6T148L146-T148 PolarHBondContact O-N 2.85Å
147D92.9Very high93.4Very high135 Ų13576.2 Ų76.272%0.72238%0.378SS*.THydrogen-bonded Turntrans-7414.5176.7-43.9-35.7000113.5K145 S149K145-D147 PolarHBondContact O-N 3.07Å; D147-S149 PolarHBondContact O-N 2.93Å
148T91.5Very high93.2Very high110 Ų11078.6 Ų78.668%0.67539%0.386SS*.SBendtrans64.5-9.5-175.8-490000115K145 L146K145-T148 PolarHBondContact O-N 3.45Å; L146-T148 PolarHBondContact O-N 2.85Å
149S91.5Very high93Very high50 Ų5079.4 Ų79.435%0.3540%0.4SS..  trans-60138.917561.40000111.4K145 D147K145-S149 WeakPolarHBondContact CD-OG 3.5Å; K145-S149 PolarHBondContact N-O 2.85Å; D147-S149 PolarHBondContact O-N 2.93Å
150R93.1Very high92.7Very high179 Ų17980.5 Ų80.568%0.67540%0.399SS*.EExtended strand (participates in β ladder)trans-105.4127.1-178.3-58.5-175.2-175-1771109.2I142 R143 V144I142-R150 HydrophobicContact CG2-CB 4.19Å; R143-R150 WeakPolarHBondContact O-CA 3.47Å; V144-R150 HydrophobicContact CG2-CG 4.4Å
151L93.6Very high92.4Very high32 Ų3279.1 Ų79.117%0.16839%0.393CS..EExtended strand (participates in β ladder)trans-114120.2173.3-172.3151.1000108.4R143 K153 V184R143-L151 PolarHBondContact N-O 2.98Å; R143-L151 PolarHBondContact O-N 2.9Å; L151-K153 HydrophobicContact CD2-CD 4.42Å; L151-K153 HydrophobicContact CD2-CG 3.49Å; L151-K153 VanDerWaalsContact CD2-CG 3.49Å; L151-V184 HydrophobicContact CD1-CG2 4.14Å; L151-V184 HydrophobicContact CD2-CB 4.21Å; L151-V184 HydrophobicContact CD2-CG2 3.9Å; L151-V184 HydrophobicContact CG-CG2 4.2Å
152I95.1Very high92.2Very high10 Ų1079.4 Ų79.45%0.05141%0.405CS..EExtended strand (participates in β ladder)trans-88.7119.4178.4-55.4174.3000107.6K140 I142 V154 Y175 K181 D182 V183 V184K140-I152 HydrophobicContact CG-CG2 4.16Å; I142-I152 HydrophobicContact CG1-CG1 4.39Å; I152-V154 HydrophobicContact CG2-CG2 3.87Å; I152-Y175 HydrophobicContact CD1-CE1 4.38Å; I152-K181 HydrophobicContact CD1-CB 4.23Å; I152-K181 HydrophobicContact CD1-CD 4.16Å; I152-D182 PolarHBondContact N-O 2.94Å; I152-V183 HydrophobicContact CB-CG2 3.92Å; I152-V183 HydrophobicContact CD1-CG2 4.14Å; I152-V183 HydrophobicContact CG2-CG2 4.3Å; I152-V183 CarbonylContact O-C 3.54Å; I152-V183 VanDerWaalsContact O-CA 3.32Å; I152-V183 WeakPolarHBondContact O-CA 3.48Å; I152-V184 PolarHBondContact O-N 3.05Å
153K94.4Very high91.8Very high52 Ų5279.2 Ų79.223%0.22641%0.405CS..EExtended strand (participates in β ladder)trans-99.4117.4170.9-65.1-173.7166.2-133.30108.7R141 L151 V184 E186R141-K153 HydrophobicContact CB-CB 4.3Å; R141-K153 PolarHBondContact N-O 2.81Å; R141-K153 PolarHBondContact O-N 3.23Å; L151-K153 HydrophobicContact CD2-CD 4.42Å; L151-K153 HydrophobicContact CD2-CG 3.49Å; L151-K153 VanDerWaalsContact CD2-CG 3.49Å; K153-V184 CarbonylContact C-O 3.56Å; K153-V184 WeakPolarHBondContact CA-O 3.4Å; K153-E186 WeakPolarHBondContact CE-OE1 3.4Å; K153-E186 IonicContact NZ-OE1 2.69Å; K153-E186 PolarHBondContact NZ-OE1 3.04Å; K153-E186 IonicContact NZ-OE2 3.94Å
154V95.3Very high91.6Very high0 Ų072 Ų720%038%0.378CS..EExtended strand (participates in β ladder)trans-107.1124.7178.7-179.80000107.8I137 I152 L156 V183 V184 F185 E186I137-V154 HydrophobicContact CB-CG1 4.32Å; I137-V154 HydrophobicContact CD1-CG1 3.91Å; I137-V154 HydrophobicContact CG1-CG1 3.85Å; I137-V154 HydrophobicContact CG2-CG1 3.66Å; I152-V154 HydrophobicContact CG2-CG2 3.87Å; V154-L156 HydrophobicContact CG1-CD2 4.12Å; V154-V183 HydrophobicContact CB-CG1 4.45Å; V154-V183 HydrophobicContact CG2-CG1 3.77Å; V154-V184 PolarHBondContact N-O 3.39Å; V154-F185 HydrophobicContact CB-CD1 3.66Å; V154-F185 HydrophobicContact CB-CE1 3.91Å; V154-F185 HydrophobicContact CG1-CD1 3.81Å; V154-F185 HydrophobicContact CG1-CE1 3.94Å; V154-F185 HydrophobicContact CG2-CD1 4.43Å; V154-F185 HydrophobicContact CG2-CE1 4.23Å; V154-F185 CarbonylContact O-C 3.56Å; V154-F185 WeakPolarHBondContact O-CA 3.18Å; V154-E186 PolarHBondContact O-N 3.27Å
155H93.3Very high91.3Very high11 Ų1172.6 Ų72.65%0.05138%0.375CS..EExtended strand (participates in β ladder)trans-92.9118.6176-64.1-54.7000109.1I137 V138 G139 E186 P188I137-H155 CarbonylContact C-O 3.56Å; V138-H155 PolarHBondContact N-O 3.26Å; G139-H155 PolarHBondContact N-O 3.34Å; G139-H155 PolarHBondContact O-N 3.23Å; H155-E186 VanDerWaalsContact CA-O 3.29Å; H155-E186 WeakPolarHBondContact CA-O 3.44Å; H155-E186 IonicContact CE1-OE2 2.7Å; H155-E186 PolarHBondContact CE1-OE2 2.8Å; H155-E186 IonicContact ND1-OE2 2.71Å; H155-P188 HydrophobicContact CB-CG 4.17Å
156L92.9Very high91.1Very high0 Ų073 Ų730%038%0.378CS..EExtended strand (participates in β ladder)trans-95.3156.3177.1-62.8-177.7000110.8V132 I137 V154 K158 V164 F185 E186 F187 P188V132-L156 HydrophobicContact CB-CD2 3.84Å; V132-L156 HydrophobicContact CG1-CD2 3.76Å; V132-L156 HydrophobicContact CG2-CD2 4.17Å; I137-L156 HydrophobicContact CG1-CD2 4.26Å; V154-L156 HydrophobicContact CG1-CD2 4.12Å; L156-K158 PolarHBondContact O-N 2.87Å; L156-V164 HydrophobicContact CD1-CG1 4.11Å; L156-F185 HydrophobicContact CD1-CB 3.99Å; L156-F185 HydrophobicContact CD1-CD1 3.96Å; L156-F185 HydrophobicContact CD1-CG 4.26Å; L156-F185 HydrophobicContact CD2-CD1 4.07Å; L156-F185 HydrophobicContact CG-CB 4.35Å; L156-F185 HydrophobicContact CG-CD1 4.05Å; L156-E186 PolarHBondContact N-O 3.26Å; L156-F187 HydrophobicContact CB-CD1 3.88Å; L156-F187 HydrophobicContact CB-CE1 3.63Å; L156-F187 HydrophobicContact CB-CZ 4.39Å; L156-F187 HydrophobicContact CD1-CE1 4.09Å; L156-F187 HydrophobicContact CD1-CZ 4.07Å; L156-F187 HydrophobicContact CG-CE1 4.48Å; L156-P188 VanDerWaalsContact O-CD 3.23Å; L156-P188 WeakPolarHBondContact O-CD 3.35Å
157D91.1Very high90.8Very high49 Ų4965.5 Ų65.526%0.26234%0.338SS..PPolyproline II helixtrans-64.3131.5174.9-17618.7000111.6S135 E136 V138 A159 Q160S135-D157 PolarHBondContact OG-N 3.22Å; E136-D157 PolarHBondContact O-N 3.4Å; V138-D157 HydrophobicContact CG2-CB 3.96Å; D157-A159 VanDerWaalsContact C-N 3.29Å; D157-A159 PolarHBondContact O-N 3.37Å; D157-A159 PolarHBondContact OD1-N 2.88Å; D157-A159 WeakPolarHBondContact OD2-CB 3.41Å; D157-Q160 PolarHBondContact O-N 2.92Å
158K89.2Confident90.7Very high102 Ų10260.4 Ų60.444%0.44331%0.312SS..G310 helixtrans-69.2-28.1-178.1-173.3170.7176.91750112L156 Q160 Q161 E189L156-K158 PolarHBondContact O-N 2.87Å; K158-Q160 PolarHBondContact O-N 2.7Å; K158-Q160 VanDerWaalsContact O-N 3.16Å; K158-Q161 VanDerWaalsContact O-CB 3.27Å; K158-Q161 WeakPolarHBondContact O-CB 3.28Å; K158-Q161 PolarHBondContact O-N 3.46Å; K158-Q161 VanDerWaalsContact O-N 3.14Å; K158-E189 PolarHBondContact NZ-O 2.87Å
159A88.3Confident90.6Very high85 Ų8560.5 Ų60.570%0.70231%0.305SS*.G310 helixtrans-60.7-27.7179.500000112.9D157D157-A159 VanDerWaalsContact C-N 3.29Å; D157-A159 PolarHBondContact O-N 3.37Å; D157-A159 PolarHBondContact OD1-N 2.88Å; D157-A159 WeakPolarHBondContact OD2-CB 3.41Å
160Q85.3Confident90.6Very high47 Ų4758.3 Ų58.322%0.2229%0.289CS..G310 helixtrans-102.27.8-178.6-59.9-160.718.800114.2P134 D157 K158 N162 N163 V164P134-Q160 VanDerWaalsContact O-CD 3.32Å; P134-Q160 PolarHBondContact O-NE2 2.85Å; P134-Q160 PolarHBondContact O-OE1 3.01Å; D157-Q160 PolarHBondContact O-N 2.92Å; K158-Q160 PolarHBondContact O-N 2.7Å; K158-Q160 VanDerWaalsContact O-N 3.16Å; Q160-N162 VanDerWaalsContact C-N 3.34Å; Q160-N162 PolarHBondContact O-N 3.19Å; Q160-N163 PolarHBondContact O-N 3.22Å; Q160-V164 HydrophobicContact CB-CG2 4.42Å; Q160-V164 PolarHBondContact O-N 2.78Å
161Q87.2Confident90.6Very high52 Ų5250.1 Ų50.124%0.24326%0.258CS..Hα-helixtrans-49.6-51.6-176.3-178.6174.2-2.400112.1K158 N163 V164 E165 F187K158-Q161 VanDerWaalsContact O-CB 3.27Å; K158-Q161 WeakPolarHBondContact O-CB 3.28Å; K158-Q161 PolarHBondContact O-N 3.46Å; K158-Q161 VanDerWaalsContact O-N 3.14Å; Q161-N163 PolarHBondContact O-N 2.71Å; Q161-N163 VanDerWaalsContact O-N 3.08Å; Q161-V164 PolarHBondContact O-N 3.09Å; Q161-V164 VanDerWaalsContact O-N 3.1Å; Q161-E165 HydrophobicContact CG-CB 4.32Å; Q161-E165 WeakPolarHBondContact CG-OE2 3.2Å; Q161-E165 PolarHBondContact NE2-OE2 2.81Å; Q161-E165 WeakPolarHBondContact O-CB 3.26Å; Q161-E165 PolarHBondContact O-N 2.89Å; Q161-F187 HydrophobicContact CB-CD1 3.95Å; Q161-F187 HydrophobicContact CB-CE1 3.96Å; Q161-F187 HydrophobicContact CB-CG 4.32Å; Q161-F187 HydrophobicContact CB-CZ 4.35Å; Q161-F187 HydrophobicContact CG-CD1 4.08Å; Q161-F187 HydrophobicContact CG-CD2 3.94Å; Q161-F187 HydrophobicContact CG-CE1 4.16Å; Q161-F187 HydrophobicContact CG-CE2 4.02Å; Q161-F187 HydrophobicContact CG-CG 3.97Å; Q161-F187 HydrophobicContact CG-CZ 4.13Å
162N89.2Confident90.6Very high140 Ų14050.2 Ų50.275%0.74926%0.261SS*.Hα-helixtrans-57-32.1-178.6-63.8-20.3000113.9Q160Q160-N162 VanDerWaalsContact C-N 3.34Å; Q160-N162 PolarHBondContact O-N 3.19Å
163N86.7Confident90.5Very high94 Ų9450.8 Ų50.850%0.50327%0.27SS..Hα-helixtrans-85.2-25.7-177.4-68.2-41.1000112.9Q160 Q161 H166Q160-N163 PolarHBondContact O-N 3.22Å; Q161-N163 PolarHBondContact O-N 2.71Å; Q161-N163 VanDerWaalsContact O-N 3.08Å; N163-H166 PolarHBondContact O-CE1 2.82Å; N163-H166 PolarHBondContact O-ND1 2.9Å
164V88.5Confident90.4Very high4 Ų448.3 Ų48.32%0.02426%0.259CS..Hα-helixtrans-114.6-25.2-167.2-177.60000112.7L156 Q160 Q161 H166 K167 V168 F171L156-V164 HydrophobicContact CD1-CG1 4.11Å; Q160-V164 HydrophobicContact CB-CG2 4.42Å; Q160-V164 PolarHBondContact O-N 2.78Å; Q161-V164 PolarHBondContact O-N 3.09Å; Q161-V164 VanDerWaalsContact O-N 3.1Å; V164-H166 VanDerWaalsContact C-N 3.29Å; V164-H166 PolarHBondContact O-N 3.07Å; V164-K167 WeakPolarHBondContact O-CA 3.46Å; V164-K167 PolarHBondContact O-N 3.18Å; V164-V168 PolarHBondContact O-N 2.82Å; V164-F171 HydrophobicContact CG1-CD2 4.46Å; V164-F171 HydrophobicContact CG1-CE2 3.51Å; V164-F171 HydrophobicContact CG1-CZ 4.24Å
165E89.1Confident90.3Very high100 Ų10048.3 Ų48.347%0.46726%0.259SS..G310 helixtrans-53.5-42.6-175.4179.9165.6-156.800113.1Q161 K167 V168 F187Q161-E165 HydrophobicContact CG-CB 4.32Å; Q161-E165 WeakPolarHBondContact CG-OE2 3.2Å; Q161-E165 PolarHBondContact NE2-OE2 2.81Å; Q161-E165 WeakPolarHBondContact O-CB 3.26Å; Q161-E165 PolarHBondContact O-N 2.89Å; E165-K167 PolarHBondContact O-N 3.41Å; E165-K167 VanDerWaalsContact O-N 3.16Å; E165-V168 WeakPolarHBondContact O-CB 3.39Å; E165-V168 PolarHBondContact O-N 2.99Å; E165-F187 HydrophobicContact CB-CE2 4.15Å; E165-F187 HydrophobicContact CB-CZ 4.36Å; E165-F187 HydrophobicContact CG-CE2 4.4Å
166H89.2Confident90.3Very high101 Ų10152.9 Ų52.947%0.46828%0.279SS..G310 helixtrans-68.2-13178.565.6-89.8000114.3H91 N163 V164H91-H166 AromaticContact CE1-CD2 3.87Å; N163-H166 PolarHBondContact O-CE1 2.82Å; N163-H166 PolarHBondContact O-ND1 2.9Å; V164-H166 VanDerWaalsContact C-N 3.29Å; V164-H166 PolarHBondContact O-N 3.07Å
167K89.3Confident90.3Very high23 Ų2360.3 Ų60.310%0.131%0.311CS..G310 helixtrans-103.4-7.6178.9-54.3-164.7-174.6-165.90113.7E84 V164 E165 E169 T170 F171E84-K167 IonicContact OE1-NZ 2.64Å; E84-K167 PolarHBondContact OE1-NZ 3.35Å; E84-K167 IonicContact OE2-NZ 3.06Å; E84-K167 PolarHBondContact OE2-NZ 3.39Å; V164-K167 WeakPolarHBondContact O-CA 3.46Å; V164-K167 PolarHBondContact O-N 3.18Å; E165-K167 PolarHBondContact O-N 3.41Å; E165-K167 VanDerWaalsContact O-N 3.16Å; K167-E169 VanDerWaalsContact C-N 3.32Å; K167-E169 PolarHBondContact O-N 2.96Å; K167-T170 WeakPolarHBondContact O-CA 3.39Å; K167-T170 VanDerWaalsContact O-CB 3.22Å; K167-T170 WeakPolarHBondContact O-CB 3.24Å; K167-T170 PolarHBondContact O-N 3.34Å; K167-F171 HydrophobicContact CB-CD1 4.44Å; K167-F171 HydrophobicContact CB-CE1 3.82Å; K167-F171 HydrophobicContact CB-CE2 4.04Å; K167-F171 HydrophobicContact CB-CZ 3.6Å; K167-F171 HydrophobicContact CD-CE1 4.47Å; K167-F171 HydrophobicContact CD-CZ 4.29Å; K167-F171 WeakPolarHBondContact O-CG 3.22Å; K167-F171 PolarHBondContact O-N 2.94Å
168V91.2Very high90.3Very high28 Ų2860.9 Ų60.917%0.1731%0.314CS..Hα-helixtrans-55.4-43.2-174.2163.40000113V164 E165 T170 F171 S172 F185 F187V164-V168 PolarHBondContact O-N 2.82Å; E165-V168 WeakPolarHBondContact O-CB 3.39Å; E165-V168 PolarHBondContact O-N 2.99Å; V168-T170 VanDerWaalsContact C-N 3.29Å; V168-T170 PolarHBondContact O-N 3.06Å; V168-F171 PolarHBondContact O-N 3.04Å; V168-S172 PolarHBondContact O-N 3.18Å; V168-F185 HydrophobicContact CG1-CB 3.75Å; V168-F185 HydrophobicContact CG1-CD2 4.05Å; V168-F185 HydrophobicContact CG1-CG 4.32Å; V168-F185 HydrophobicContact CG2-CB 4.26Å; V168-F187 HydrophobicContact CG2-CE2 4.15Å; V168-F187 HydrophobicContact CG2-CZ 4.25Å
169E90.4Very high90.4Very high112 Ų11257.1 Ų57.152%0.52330%0.3SS..Hα-helixtrans-64.1-37.9177.5-172.5175.7-162.900111.6K167 S172 G173K167-E169 VanDerWaalsContact C-N 3.32Å; K167-E169 PolarHBondContact O-N 2.96Å; E169-S172 PolarHBondContact O-N 3.28Å; E169-G173 PolarHBondContact O-N 3.38Å; E169-G173 VanDerWaalsContact O-N 3.17Å
170T91.4Very high90.6Very high4 Ų456 Ų563%0.02530%0.297CS..Hα-helixtrans-62.2-46.2176.4-580000111.3V53 A59 H91 K167 V168 S172 G173 V174V53-T170 HydrophobicContact CG2-CG2 4.18Å; A59-T170 HydrophobicContact CB-CG2 3.47Å; A59-T170 VanDerWaalsContact CB-CG2 3.47Å; H91-T170 HydrophobicContact CB-CG2 3.95Å; H91-T170 PolarHBondContact CD2-OG1 3.11Å; K167-T170 WeakPolarHBondContact O-CA 3.39Å; K167-T170 VanDerWaalsContact O-CB 3.22Å; K167-T170 WeakPolarHBondContact O-CB 3.24Å; K167-T170 PolarHBondContact O-N 3.34Å; V168-T170 VanDerWaalsContact C-N 3.29Å; V168-T170 PolarHBondContact O-N 3.06Å; T170-S172 VanDerWaalsContact C-N 3.32Å; T170-S172 PolarHBondContact O-N 2.99Å; T170-G173 PolarHBondContact O-N 3Å; T170-V174 HydrophobicContact CG2-CG2 4.25Å; T170-V174 WeakPolarHBondContact O-CG2 3.23Å; T170-V174 PolarHBondContact O-N 3.41Å
171F92.9Very high91Very high6 Ų657.5 Ų57.53%0.02630%0.302CS..Hα-helixtrans-62.4-39.5-180-59.7-23.3000112.5V93 L131 V132 V164 K167 V168 V174 Y175 F185V93-F171 HydrophobicContact CG2-CD1 4.24Å; V93-F171 HydrophobicContact CG2-CE1 3.89Å; L131-F171 WeakPolarHBondContact O-CE1 3.45Å; L131-F171 WeakPolarHBondContact O-CZ 3.15Å; V132-F171 HydrophobicContact CG1-CD2 4.31Å; V164-F171 HydrophobicContact CG1-CD2 4.46Å; V164-F171 HydrophobicContact CG1-CE2 3.51Å; V164-F171 HydrophobicContact CG1-CZ 4.24Å; K167-F171 HydrophobicContact CB-CD1 4.44Å; K167-F171 HydrophobicContact CB-CE1 3.82Å; K167-F171 HydrophobicContact CB-CE2 4.04Å; K167-F171 HydrophobicContact CB-CZ 3.6Å; K167-F171 HydrophobicContact CD-CE1 4.47Å; K167-F171 HydrophobicContact CD-CZ 4.29Å; K167-F171 WeakPolarHBondContact O-CG 3.22Å; K167-F171 PolarHBondContact O-N 2.94Å; V168-F171 PolarHBondContact O-N 3.04Å; F171-V174 PolarHBondContact O-N 2.95Å; F171-Y175 VanDerWaalsContact O-CB 3.31Å; F171-Y175 WeakPolarHBondContact O-CB 3.14Å; F171-Y175 PolarHBondContact O-N 2.95Å; F171-F185 HydrophobicContact CB-CD2 4.18Å; F171-F185 HydrophobicContact CB-CE2 3.41Å; F171-F185 VanDerWaalsContact CB-CE2 3.41Å; F171-F185 HydrophobicContact CB-CZ 3.77Å
172S93Very high91.2Very high34 Ų3458.3 Ų58.324%0.23831%0.308CS..Hα-helixtrans-61.3-47.4176.3-175.60000111V168 E169 T170 Y175 K176 V183V168-S172 PolarHBondContact O-N 3.18Å; E169-S172 PolarHBondContact O-N 3.28Å; T170-S172 VanDerWaalsContact C-N 3.32Å; T170-S172 PolarHBondContact O-N 2.99Å; S172-Y175 PolarHBondContact O-N 2.87Å; S172-K176 VanDerWaalsContact O-CB 3.27Å; S172-K176 WeakPolarHBondContact O-CB 3.41Å; S172-K176 PolarHBondContact O-N 3Å; S172-V183 WeakPolarHBondContact CB-O 3.35Å; S172-V183 PolarHBondContact OG-O 3.22Å
173G92.3Very high91.5Very high22 Ų2251.7 Ų51.723%0.22727%0.273CS..Hα-helixtrans-64-44178.300000113.4E169 T170 K176 K177E169-G173 PolarHBondContact O-N 3.38Å; E169-G173 VanDerWaalsContact O-N 3.17Å; T170-G173 PolarHBondContact O-N 3Å; G173-K176 PolarHBondContact O-N 3.26Å; G173-K177 WeakPolarHBondContact O-CB 3.28Å; G173-K177 PolarHBondContact O-N 3.34Å
174V93Very high91.9Very high0 Ų050 Ų500%027%0.266CS..Hα-helixtrans-62.3-48.8177171.30000110.8V53 A59 I61 I95 L131 T170 F171 K176 K177 L178V53-V174 HydrophobicContact CG2-CG2 4.24Å; A59-V174 HydrophobicContact CB-CG2 4.23Å; I61-V174 HydrophobicContact CD1-CB 4.31Å; I61-V174 HydrophobicContact CD1-CG1 3.35Å; I61-V174 HydrophobicContact CD1-CG2 4.09Å; I61-V174 HydrophobicContact CG1-CG1 4.01Å; I61-V174 HydrophobicContact CG1-CG2 4.28Å; I95-V174 HydrophobicContact CD1-CG1 4.03Å; L131-V174 HydrophobicContact CD2-CB 4.24Å; L131-V174 HydrophobicContact CD2-CG1 3.69Å; T170-V174 HydrophobicContact CG2-CG2 4.25Å; T170-V174 WeakPolarHBondContact O-CG2 3.23Å; T170-V174 PolarHBondContact O-N 3.41Å; F171-V174 PolarHBondContact O-N 2.95Å; V174-K176 VanDerWaalsContact C-N 3.32Å; V174-K176 PolarHBondContact O-N 3.13Å; V174-K177 PolarHBondContact O-N 3.19Å; V174-L178 HydrophobicContact CG1-CD1 3.78Å; V174-L178 HydrophobicContact CG1-CG 4.34Å; V174-L178 WeakPolarHBondContact O-CG 3.48Å; V174-L178 PolarHBondContact O-N 3.32Å
175Y93.9Very high92.1Very high1 Ų150.4 Ų50.40%0.00427%0.267CS..Hα-helixtrans-62.9-41.4-179.3-169.7-101.7000111.9H124 I127 L128 L131 I152 F171 S172 K177 L178 T179 K181 V183H124-Y175 WeakPolarHBondContact O-CE2 3.23Å; H124-Y175 PolarHBondContact O-OH 3.15Å; I127-Y175 HydrophobicContact CB-CE2 4.4Å; I127-Y175 HydrophobicContact CG2-CD2 3.94Å; I127-Y175 HydrophobicContact CG2-CE2 4.06Å; L128-Y175 HydrophobicContact CB-CE2 4.5Å; L128-Y175 HydrophobicContact CD1-CE2 4.2Å; L128-Y175 HydrophobicContact CD2-CD1 4.18Å; L128-Y175 HydrophobicContact CD2-CD2 3.53Å; L128-Y175 HydrophobicContact CD2-CE1 4.06Å; L128-Y175 HydrophobicContact CD2-CE2 3.46Å; L128-Y175 VanDerWaalsContact CD2-CE2 3.46Å; L128-Y175 HydrophobicContact CD2-CG 3.87Å; L128-Y175 HydrophobicContact CG-CD2 3.96Å; L128-Y175 HydrophobicContact CG-CE1 4.41Å; L128-Y175 HydrophobicContact CG-CE2 3.38Å; L131-Y175 HydrophobicContact CD1-CD2 3.74Å; L131-Y175 HydrophobicContact CD1-CG 4.24Å; I152-Y175 HydrophobicContact CD1-CE1 4.38Å; F171-Y175 VanDerWaalsContact O-CB 3.31Å; F171-Y175 WeakPolarHBondContact O-CB 3.14Å; F171-Y175 PolarHBondContact O-N 2.95Å; S172-Y175 PolarHBondContact O-N 2.87Å; Y175-K177 VanDerWaalsContact C-N 3.33Å; Y175-K177 PolarHBondContact O-N 2.8Å; Y175-L178 PolarHBondContact O-N 3.39Å; Y175-T179 HydrophobicContact CD1-CG2 4.48Å; Y175-T179 VanDerWaalsContact CD1-OG1 3.28Å; Y175-T179 WeakPolarHBondContact CD1-OG1 3.48Å; Y175-T179 HydrophobicContact CD2-CG2 3.92Å; Y175-T179 HydrophobicContact CE1-CG2 4.22Å; Y175-T179 WeakPolarHBondContact CE1-OG1 3.41Å; Y175-T179 HydrophobicContact CE2-CG2 3.55Å; Y175-T179 HydrophobicContact CG-CG2 4.4Å; Y175-T179 WeakPolarHBondContact O-CB 2.72Å; Y175-T179 PolarHBondContact O-N 3.3Å; Y175-T179 PolarHBondContact O-OG1 2.74Å; Y175-K181 HydrophobicContact CD1-CB 4.39Å; Y175-K181 WeakPolarHBondContact CD1-O 3.39Å; Y175-K181 HydrophobicContact CE1-CB 3.83Å; Y175-V183 HydrophobicContact CD1-CB 4.13Å; Y175-V183 HydrophobicContact CD1-CG2 3.13Å; Y175-V183 HydrophobicContact CE1-CG2 3.31Å; Y175-V183 HydrophobicContact CG-CG2 3.99Å
176K93.3Very high92.2Very high106 Ų10648.6 Ų48.646%0.46126%0.259SS..Hα-helixtrans-60.9-41.7175.3-176.1174.5-174.11480111.6S172 G173 V174 G180 K181 D182S172-K176 VanDerWaalsContact O-CB 3.27Å; S172-K176 WeakPolarHBondContact O-CB 3.41Å; S172-K176 PolarHBondContact O-N 3Å; G173-K176 PolarHBondContact O-N 3.26Å; V174-K176 VanDerWaalsContact C-N 3.32Å; V174-K176 PolarHBondContact O-N 3.13Å; K176-G180 WeakPolarHBondContact O-CA 3.4Å; K176-G180 PolarHBondContact O-N 3Å; K176-K181 WeakPolarHBondContact CA-O 3.48Å; K176-D182 WeakPolarHBondContact CD-OD1 3.49Å; K176-D182 WeakPolarHBondContact CE-OD1 3.28Å; K176-D182 IonicContact NZ-OD1 3.96Å; K176-D182 PolarHBondContact NZ-OD1 3.38Å; K176-D182 IonicContact NZ-OD2 2.71Å
177K92.1Very high92.3Very high157 Ų15745.8 Ų45.868%0.68325%0.245SC*.Hα-helixtrans-70-36180-166.364.1171.4-170.40112.8I51 G173 V174 Y175I51-K177 HydrophobicContact CD1-CB 4.16Å; I51-K177 HydrophobicContact CD1-CG 3.83Å; I51-K177 HydrophobicContact CG2-CB 4.16Å; I51-K177 HydrophobicContact CG2-CG 3.94Å; G173-K177 WeakPolarHBondContact O-CB 3.28Å; G173-K177 PolarHBondContact O-N 3.34Å; V174-K177 PolarHBondContact O-N 3.19Å; Y175-K177 VanDerWaalsContact C-N 3.33Å; Y175-K177 PolarHBondContact O-N 2.8Å
178L91.8Very high92.1Very high61 Ų6146 Ų4632%0.31925%0.249SC..Hα-helixtrans-79.1-37.4179.7-68175.4000113.2I61 F63 I95 I127 V174 Y175I61-L178 HydrophobicContact CD1-CD1 4.32Å; F63-L178 HydrophobicContact CZ-CD2 4.2Å; I95-L178 HydrophobicContact CD1-CD1 3.35Å; I127-L178 HydrophobicContact CG2-CD1 4.33Å; V174-L178 HydrophobicContact CG1-CD1 3.78Å; V174-L178 HydrophobicContact CG1-CG 4.34Å; V174-L178 WeakPolarHBondContact O-CG 3.48Å; V174-L178 PolarHBondContact O-N 3.32Å; Y175-L178 PolarHBondContact O-N 3.39Å
179T91.5Very high91.5Very high23 Ų2351.8 Ų51.814%0.14127%0.274CS..Hα-helixtrans-116.2-15.3-169.171.20000114.9H124 Y175 K181H124-T179 VanDerWaalsContact CE1-CB 3.48Å; H124-T179 WeakPolarHBondContact CE1-CB 3.19Å; Y175-T179 HydrophobicContact CD1-CG2 4.48Å; Y175-T179 VanDerWaalsContact CD1-OG1 3.28Å; Y175-T179 WeakPolarHBondContact CD1-OG1 3.48Å; Y175-T179 HydrophobicContact CD2-CG2 3.92Å; Y175-T179 HydrophobicContact CE1-CG2 4.22Å; Y175-T179 WeakPolarHBondContact CE1-OG1 3.41Å; Y175-T179 HydrophobicContact CE2-CG2 3.55Å; Y175-T179 HydrophobicContact CG-CG2 4.4Å; Y175-T179 WeakPolarHBondContact O-CB 2.72Å; Y175-T179 PolarHBondContact O-N 3.3Å; Y175-T179 PolarHBondContact O-OG1 2.74Å; T179-K181 PolarHBondContact O-N 3.42Å; T179-K181 PolarHBondContact OG1-N 2.98Å
180G91.8Very high90.3Very high62 Ų6254.4 Ų54.464%0.63928%0.284SS*.SBendtrans72.25.7-172.900000114.7K176K176-G180 WeakPolarHBondContact O-CA 3.4Å; K176-G180 PolarHBondContact O-N 3Å
181K92.9Very high88.7Confident77 Ų7762.4 Ų62.434%0.33532%0.321SS..  trans-102.4138.3-178-64.3176.8-177.8172.70110.9H124 I152 Y175 K176 T179H124-K181 WeakPolarHBondContact ND1-CE 3.4Å; H124-K181 PolarHBondContact ND1-NZ 3.21Å; I152-K181 HydrophobicContact CD1-CB 4.23Å; I152-K181 HydrophobicContact CD1-CD 4.16Å; Y175-K181 HydrophobicContact CD1-CB 4.39Å; Y175-K181 WeakPolarHBondContact CD1-O 3.39Å; Y175-K181 HydrophobicContact CE1-CB 3.83Å; K176-K181 WeakPolarHBondContact CA-O 3.48Å; T179-K181 PolarHBondContact O-N 3.42Å; T179-K181 PolarHBondContact OG1-N 2.98Å
182D92.9Very high86.8Confident69 Ų6971 Ų7137%0.36937%0.367SS..EExtended strand (participates in β ladder)trans-81.5129175.7-69.8-40000111.1I152 K176I152-D182 PolarHBondContact N-O 2.94Å; K176-D182 WeakPolarHBondContact CD-OD1 3.49Å; K176-D182 WeakPolarHBondContact CE-OD1 3.28Å; K176-D182 IonicContact NZ-OD1 3.96Å; K176-D182 PolarHBondContact NZ-OD1 3.38Å; K176-D182 IonicContact NZ-OD2 2.71Å
183V94.6Very high86.5Confident1 Ų172.9 Ų72.91%0.00637%0.373CS..EExtended strand (participates in β ladder)trans-127.2139.4178.6176.30000110.2L128 I152 V154 S172 Y175 F185L128-V183 HydrophobicContact CD2-CG1 4.31Å; L128-V183 HydrophobicContact CD2-CG2 4.07Å; I152-V183 HydrophobicContact CB-CG2 3.92Å; I152-V183 HydrophobicContact CD1-CG2 4.14Å; I152-V183 HydrophobicContact CG2-CG2 4.3Å; I152-V183 CarbonylContact O-C 3.54Å; I152-V183 VanDerWaalsContact O-CA 3.32Å; I152-V183 WeakPolarHBondContact O-CA 3.48Å; V154-V183 HydrophobicContact CB-CG1 4.45Å; V154-V183 HydrophobicContact CG2-CG1 3.77Å; S172-V183 WeakPolarHBondContact CB-O 3.35Å; S172-V183 PolarHBondContact OG-O 3.22Å; Y175-V183 HydrophobicContact CD1-CB 4.13Å; Y175-V183 HydrophobicContact CD1-CG2 3.13Å; Y175-V183 HydrophobicContact CE1-CG2 3.31Å; Y175-V183 HydrophobicContact CG-CG2 3.99Å; V183-F185 HydrophobicContact CB-CE2 4.48Å; V183-F185 HydrophobicContact CG1-CD1 4.44Å; V183-F185 HydrophobicContact CG1-CD2 4.15Å; V183-F185 HydrophobicContact CG1-CE1 3.99Å; V183-F185 HydrophobicContact CG1-CE2 3.66Å; V183-F185 HydrophobicContact CG1-CZ 3.59Å
184V94.3Very high86.2Confident58 Ų5875.6 Ų75.635%0.35238%0.381SS..EExtended strand (participates in β ladder)trans-122.9131.1170.1179.60000107.8L151 I152 K153 V154 E186L151-V184 HydrophobicContact CD1-CG2 4.14Å; L151-V184 HydrophobicContact CD2-CB 4.21Å; L151-V184 HydrophobicContact CD2-CG2 3.9Å; L151-V184 HydrophobicContact CG-CG2 4.2Å; I152-V184 PolarHBondContact O-N 3.05Å; K153-V184 CarbonylContact C-O 3.56Å; K153-V184 WeakPolarHBondContact CA-O 3.4Å; V154-V184 PolarHBondContact N-O 3.39Å; V184-E186 HydrophobicContact CG1-CG 4.27Å
185F93.6Very high85.8Confident14 Ų1479.8 Ų79.86%0.06140%0.402CS..EExtended strand (participates in β ladder)trans-98.7135.3175-56-90.6000109.7L128 V132 V154 L156 V168 F171 V183L128-F185 HydrophobicContact CD2-CZ 4.37Å; V132-F185 HydrophobicContact CG1-CD1 3.99Å; V132-F185 HydrophobicContact CG1-CE1 3.38Å; V132-F185 HydrophobicContact CG1-CZ 4.05Å; V154-F185 HydrophobicContact CB-CD1 3.66Å; V154-F185 HydrophobicContact CB-CE1 3.91Å; V154-F185 HydrophobicContact CG1-CD1 3.81Å; V154-F185 HydrophobicContact CG1-CE1 3.94Å; V154-F185 HydrophobicContact CG2-CD1 4.43Å; V154-F185 HydrophobicContact CG2-CE1 4.23Å; V154-F185 CarbonylContact O-C 3.56Å; V154-F185 WeakPolarHBondContact O-CA 3.18Å; L156-F185 HydrophobicContact CD1-CB 3.99Å; L156-F185 HydrophobicContact CD1-CD1 3.96Å; L156-F185 HydrophobicContact CD1-CG 4.26Å; L156-F185 HydrophobicContact CD2-CD1 4.07Å; L156-F185 HydrophobicContact CG-CB 4.35Å; L156-F185 HydrophobicContact CG-CD1 4.05Å; V168-F185 HydrophobicContact CG1-CB 3.75Å; V168-F185 HydrophobicContact CG1-CD2 4.05Å; V168-F185 HydrophobicContact CG1-CG 4.32Å; V168-F185 HydrophobicContact CG2-CB 4.26Å; F171-F185 HydrophobicContact CB-CD2 4.18Å; F171-F185 HydrophobicContact CB-CE2 3.41Å; F171-F185 VanDerWaalsContact CB-CE2 3.41Å; F171-F185 HydrophobicContact CB-CZ 3.77Å; V183-F185 HydrophobicContact CB-CE2 4.48Å; V183-F185 HydrophobicContact CG1-CD1 4.44Å; V183-F185 HydrophobicContact CG1-CD2 4.15Å; V183-F185 HydrophobicContact CG1-CE1 3.99Å; V183-F185 HydrophobicContact CG1-CE2 3.66Å; V183-F185 HydrophobicContact CG1-CZ 3.59Å
186E91.8Very high85.3Confident62 Ų6284.4 Ų84.429%0.2943%0.425SS..EExtended strand (participates in β ladder)trans-131.7146.4-179-65.6176.1178.700109K153 V154 H155 L156 V184K153-E186 WeakPolarHBondContact CE-OE1 3.4Å; K153-E186 IonicContact NZ-OE1 2.69Å; K153-E186 PolarHBondContact NZ-OE1 3.04Å; K153-E186 IonicContact NZ-OE2 3.94Å; V154-E186 PolarHBondContact O-N 3.27Å; H155-E186 VanDerWaalsContact CA-O 3.29Å; H155-E186 WeakPolarHBondContact CA-O 3.44Å; H155-E186 IonicContact CE1-OE2 2.7Å; H155-E186 PolarHBondContact CE1-OE2 2.8Å; H155-E186 IonicContact ND1-OE2 2.71Å; L156-E186 PolarHBondContact N-O 3.26Å; V184-E186 HydrophobicContact CG1-CG 4.27Å
187F89.8Confident84.8Confident42 Ų4283.1 Ų83.118%0.18442%0.423CS..  trans-102.7109.5172-62.2-82.4000108.3L156 Q161 E165 V168L156-F187 HydrophobicContact CB-CD1 3.88Å; L156-F187 HydrophobicContact CB-CE1 3.63Å; L156-F187 HydrophobicContact CB-CZ 4.39Å; L156-F187 HydrophobicContact CD1-CE1 4.09Å; L156-F187 HydrophobicContact CD1-CZ 4.07Å; L156-F187 HydrophobicContact CG-CE1 4.48Å; Q161-F187 HydrophobicContact CB-CD1 3.95Å; Q161-F187 HydrophobicContact CB-CE1 3.96Å; Q161-F187 HydrophobicContact CB-CG 4.32Å; Q161-F187 HydrophobicContact CB-CZ 4.35Å; Q161-F187 HydrophobicContact CG-CD1 4.08Å; Q161-F187 HydrophobicContact CG-CD2 3.94Å; Q161-F187 HydrophobicContact CG-CE1 4.16Å; Q161-F187 HydrophobicContact CG-CE2 4.02Å; Q161-F187 HydrophobicContact CG-CG 3.97Å; Q161-F187 HydrophobicContact CG-CZ 4.13Å; E165-F187 HydrophobicContact CB-CE2 4.15Å; E165-F187 HydrophobicContact CB-CZ 4.36Å; E165-F187 HydrophobicContact CG-CE2 4.4Å; V168-F187 HydrophobicContact CG2-CE2 4.15Å; V168-F187 HydrophobicContact CG2-CZ 4.25Å
188P86.2Confident84.3Confident28 Ų2878.1 Ų78.118%0.18241%0.406CS..  trans-69.2141.1177.730.5-32.6000110.1H155 L156 F190H155-P188 HydrophobicContact CB-CG 4.17Å; L156-P188 VanDerWaalsContact O-CD 3.23Å; L156-P188 WeakPolarHBondContact O-CD 3.35Å; P188-F190 VanDerWaalsContact C-N 3.3Å; P188-F190 PolarHBondContact O-N 3.45Å
189E77.4Confident83.8Confident149 Ų14979.4 Ų79.470%0.69641%0.412SS*.SBendtrans-72.9-24.8-179.6-70.2-176.2163.300113.4K158K158-E189 PolarHBondContact NZ-O 2.87Å
190F66.9Low83.2Confident166 Ų16683.7 Ų83.773%0.72843%0.433SS*.SBendtrans-131.2144.8-179.8-65.9-85.5000110.6P188 L192P188-F190 VanDerWaalsContact C-N 3.3Å; P188-F190 PolarHBondContact O-N 3.45Å; F190-L192 PolarHBondContact O-N 2.86Å
191Q57.1Low82.5Confident173 Ų17385.5 Ų85.581%0.80842%0.416SS*.  trans-64.3126.7167.4-91.2173.7-31.800108.8
192L52.3Low81.5Confident187 Ų18786.3 Ų86.398%0.97942%0.423SS*.  trans-77.50170.2-79.4160.2000110.7R141 F190R141-L192 VanDerWaalsContact NH2-CD1 3.26Å; F190-L192 PolarHBondContact O-N 2.86Å

Retrieved 192 of 192 residues in 125.4 ms (Link to these results)

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