A0A077ZHR5_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZHR5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 84 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

 

Download Structure   PDB   PAE   Table  
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
1M54.2Low79.9Confident220 Ų22059.8 Ų59.8100%1.08430%0.297SS*.  0122.60-147170.7-177.700107.5
2L63.9Low80.8Confident50 Ų5063.8 Ų63.826%0.26231%0.314SS..  trans-69.5131.8172.6-78.4149000107.7T6 Y53 M80L2-T6 HydrophobicContact CD2-CG2 3.38Å; L2-Y53 HydrophobicContact CD1-CE1 4.15Å; L2-Y53 HydrophobicContact CD2-CE1 3.9Å; L2-Y53 WeakPolarHBondContact CD2-OH 3.2Å; L2-M80 HydrophobicContact CB-CE 3.71Å; L2-M80 HydrophobicContact CB-SD 4.24Å; L2-M80 HydrophobicContact CD1-CB 3.74Å; L2-M80 HydrophobicContact CD1-CE 4.21Å; L2-M80 HydrophobicContact CD1-CG 4.02Å; L2-M80 HydrophobicContact CD1-SD 3.73Å; L2-M80 HydrophobicContact CG-CE 4.46Å; L2-M80 HydrophobicContact CG-SD 4.38Å
3N79Confident81.7Confident91 Ų9158.9 Ų58.949%0.48729%0.289SS..  trans-76.3158.3175.863.819.6000110.1W5 T6 A7N3-W5 PolarHBondContact O-N 3.29Å; N3-W5 VanDerWaalsContact O-N 3.15Å; N3-T6 PolarHBondContact O-N 3.11Å; N3-T6 WeakPolarHBondContact OD1-CB 3.35Å; N3-T6 PolarHBondContact OD1-N 3.25Å; N3-T6 PolarHBondContact OD1-OG1 2.93Å; N3-A7 PolarHBondContact O-N 3.46Å; N3-A7 VanDerWaalsContact O-N 3.08Å
4E78.1Confident82.5Confident141 Ų14154.8 Ų54.866%0.65927%0.269SS*.Hα-helixtrans-52.7-34.5178.9167167-155.200112.8A7 S8 F73E4-A7 WeakPolarHBondContact O-CB 3.45Å; E4-A7 PolarHBondContact O-N 2.72Å; E4-S8 WeakPolarHBondContact O-CB 2.95Å; E4-S8 PolarHBondContact O-N 3.38Å; E4-S8 PolarHBondContact O-OG 3.44Å; E4-F73 HydrophobicContact CB-CZ 4.36Å; E4-F73 HydrophobicContact CG-CE2 4.33Å; E4-F73 HydrophobicContact CG-CZ 3.78Å
5W83.2Confident83.2Confident91 Ų9152.5 Ų52.535%0.34526%0.259SS..Hα-helixtrans-62.4-48.3174.7172.182.2000112.2N3 A7 S8 L9 D37 F40N3-W5 PolarHBondContact O-N 3.29Å; N3-W5 VanDerWaalsContact O-N 3.15Å; W5-A7 VanDerWaalsContact C-N 3.29Å; W5-A7 PolarHBondContact O-N 3.19Å; W5-S8 PolarHBondContact O-N 3.39Å; W5-L9 HydrophobicContact CH2-CD2 3.92Å; W5-L9 HydrophobicContact CZ2-CD2 3.81Å; W5-L9 PolarHBondContact O-N 2.88Å; W5-D37 WeakPolarHBondContact CH2-OD2 3.32Å; W5-D37 HydrophobicContact CZ2-CB 3.39Å; W5-D37 WeakPolarHBondContact CZ2-OD2 3.45Å; W5-F40 AromaticContact CH2-CE2 3.84Å; W5-F40 HydrophobicContact CH2-CE2 3.84Å; W5-F40 HydrophobicContact CZ2-CE2 4.11Å
6T84.5Confident83.8Confident13 Ų1351.3 Ų51.38%0.0826%0.257CS..Hα-helixtrans-64-39.3178.9-50.30000110.7L2 N3 L9 L10 F49 Y53L2-T6 HydrophobicContact CD2-CG2 3.38Å; N3-T6 PolarHBondContact O-N 3.11Å; N3-T6 WeakPolarHBondContact OD1-CB 3.35Å; N3-T6 PolarHBondContact OD1-N 3.25Å; N3-T6 PolarHBondContact OD1-OG1 2.93Å; T6-L9 PolarHBondContact O-N 2.85Å; T6-L10 HydrophobicContact CG2-CD1 3.99Å; T6-L10 HydrophobicContact CG2-CG 4.44Å; T6-L10 VanDerWaalsContact O-CG 3.28Å; T6-L10 WeakPolarHBondContact O-CG 3.43Å; T6-L10 PolarHBondContact O-N 3.4Å; T6-F49 HydrophobicContact CG2-CE2 3.9Å; T6-F49 HydrophobicContact CG2-CZ 3.81Å; T6-Y53 WeakPolarHBondContact CG2-OH 3.19Å
7A83.2Confident84.5Confident1 Ų148.2 Ų48.21%0.00824%0.241CC..Hα-helixtrans-55.4-53.7173.600000111.3N3 E4 W5 L9 L10 V11 F73 M80N3-A7 PolarHBondContact O-N 3.46Å; N3-A7 VanDerWaalsContact O-N 3.08Å; E4-A7 WeakPolarHBondContact O-CB 3.45Å; E4-A7 PolarHBondContact O-N 2.72Å; W5-A7 VanDerWaalsContact C-N 3.29Å; W5-A7 PolarHBondContact O-N 3.19Å; A7-L9 VanDerWaalsContact C-N 3.31Å; A7-L9 PolarHBondContact O-N 2.81Å; A7-L10 PolarHBondContact O-N 3.32Å; A7-V11 VanDerWaalsContact O-CG2 3.3Å; A7-V11 WeakPolarHBondContact O-CG2 3.29Å; A7-V11 PolarHBondContact O-N 3.42Å; A7-F73 HydrophobicContact CB-CE2 3.81Å; A7-F73 HydrophobicContact CB-CZ 4.22Å; A7-M80 HydrophobicContact CB-CE 3.12Å; A7-M80 HydrophobicContact CB-SD 4.22Å
8S83.7Confident85Confident33 Ų3350.4 Ų50.423%0.23125%0.246CC..Hα-helixtrans-60.4-42.7-176.4-600000111.6E4 W5 V11 H12E4-S8 WeakPolarHBondContact O-CB 2.95Å; E4-S8 PolarHBondContact O-N 3.38Å; E4-S8 PolarHBondContact O-OG 3.44Å; W5-S8 PolarHBondContact O-N 3.39Å; S8-V11 PolarHBondContact O-N 3.04Å; S8-H12 WeakPolarHBondContact O-CB 3.42Å; S8-H12 PolarHBondContact O-N 3.18Å; S8-H12 PolarHBondContact O-ND1 3.24Å
9L89.3Confident85.4Confident0 Ų058.3 Ų58.30%027%0.273CS..Hα-helixtrans-62.9-48.4177.5179.561.8000111.8W5 T6 A7 V11 H12 L13 A33 I36 F40 F49W5-L9 HydrophobicContact CH2-CD2 3.92Å; W5-L9 HydrophobicContact CZ2-CD2 3.81Å; W5-L9 PolarHBondContact O-N 2.88Å; T6-L9 PolarHBondContact O-N 2.85Å; A7-L9 VanDerWaalsContact C-N 3.31Å; A7-L9 PolarHBondContact O-N 2.81Å; L9-V11 VanDerWaalsContact C-N 3.32Å; L9-V11 PolarHBondContact O-N 3.11Å; L9-H12 PolarHBondContact O-N 3.5Å; L9-L13 HydrophobicContact CD1-CD1 3.78Å; L9-L13 HydrophobicContact CD1-CG 4.01Å; L9-L13 HydrophobicContact CG-CD1 3.85Å; L9-L13 HydrophobicContact CG-CG 4.43Å; L9-L13 WeakPolarHBondContact O-CB 3.3Å; L9-L13 VanDerWaalsContact O-CG 3.28Å; L9-L13 WeakPolarHBondContact O-CG 3.36Å; L9-L13 PolarHBondContact O-N 3.01Å; L9-A33 HydrophobicContact CD1-CB 4.36Å; L9-I36 HydrophobicContact CB-CG2 4.39Å; L9-I36 HydrophobicContact CD1-CB 4.08Å; L9-I36 HydrophobicContact CD1-CD1 4.05Å; L9-I36 HydrophobicContact CD1-CG2 4.13Å; L9-F40 HydrophobicContact CD2-CD2 3.9Å; L9-F40 HydrophobicContact CD2-CE2 3.34Å; L9-F40 HydrophobicContact CD2-CZ 4.09Å; L9-F49 HydrophobicContact CD2-CD1 4.44Å; L9-F49 HydrophobicContact CD2-CE1 3.69Å; L9-F49 HydrophobicContact CD2-CZ 3.76Å; L9-F49 HydrophobicContact CG-CE1 4.18Å; L9-F49 HydrophobicContact CG-CZ 4.42Å
10L90.4Very high85.8Confident1 Ų159.1 Ų59.11%0.00529%0.285CS..Hα-helixtrans-63.2-39.6-179.5-68.5167.7000111.8T6 A7 N14 F49 L50 Y53 F57 M80T6-L10 HydrophobicContact CG2-CD1 3.99Å; T6-L10 HydrophobicContact CG2-CG 4.44Å; T6-L10 VanDerWaalsContact O-CG 3.28Å; T6-L10 WeakPolarHBondContact O-CG 3.43Å; T6-L10 PolarHBondContact O-N 3.4Å; A7-L10 PolarHBondContact O-N 3.32Å; L10-N14 WeakPolarHBondContact O-CB 3.48Å; L10-N14 PolarHBondContact O-N 3.43Å; L10-F49 HydrophobicContact CD2-CE1 3.55Å; L10-F49 HydrophobicContact CD2-CZ 3.77Å; L10-F49 HydrophobicContact CG-CE1 4.22Å; L10-F49 HydrophobicContact CG-CZ 4.05Å; L10-L50 HydrophobicContact CD2-CD2 4.28Å; L10-Y53 HydrophobicContact CD1-CD1 3.77Å; L10-Y53 HydrophobicContact CD1-CD2 4.2Å; L10-Y53 HydrophobicContact CD1-CE1 3.62Å; L10-Y53 HydrophobicContact CD1-CE2 4.08Å; L10-Y53 HydrophobicContact CD1-CG 4.06Å; L10-Y53 HydrophobicContact CD2-CD1 4.37Å; L10-Y53 HydrophobicContact CD2-CD2 3.5Å; L10-Y53 VanDerWaalsContact CD2-CD2 3.5Å; L10-Y53 HydrophobicContact CD2-CE2 3.84Å; L10-Y53 HydrophobicContact CD2-CG 3.8Å; L10-Y53 HydrophobicContact CG-CD2 4.5Å; L10-F57 HydrophobicContact CD2-CD2 4.48Å; L10-F57 HydrophobicContact CD2-CE2 3.65Å; L10-F57 HydrophobicContact CD2-CZ 4.39Å; L10-M80 HydrophobicContact CD1-SD 3.57Å; L10-M80 VanDerWaalsContact CD1-SD 3.57Å
11V89Confident86.2Confident17 Ų1759 Ų5910%0.10330%0.3CS..Hα-helixtrans-63.2-49.4175.5173.80000111.2A7 S8 L9 L13 N14 N15 I70 A76A7-V11 VanDerWaalsContact O-CG2 3.3Å; A7-V11 WeakPolarHBondContact O-CG2 3.29Å; A7-V11 PolarHBondContact O-N 3.42Å; S8-V11 PolarHBondContact O-N 3.04Å; L9-V11 VanDerWaalsContact C-N 3.32Å; L9-V11 PolarHBondContact O-N 3.11Å; V11-L13 PolarHBondContact O-N 2.98Å; V11-N14 PolarHBondContact O-N 3.37Å; V11-N15 VanDerWaalsContact O-CB 3.31Å; V11-N15 WeakPolarHBondContact O-CB 3.42Å; V11-N15 VanDerWaalsContact O-CG 3.29Å; V11-N15 PolarHBondContact O-N 3.1Å; V11-I70 HydrophobicContact CG1-CB 4.42Å; V11-I70 HydrophobicContact CG1-CG2 4.41Å; V11-I70 HydrophobicContact CG2-CD1 4.4Å; V11-I70 HydrophobicContact CG2-CG2 3.99Å; V11-A76 HydrophobicContact CG2-CB 3.12Å
12H90.7Very high88.1Confident108 Ų10851.2 Ų51.250%0.526%0.262SS..Hα-helixtrans-61.2-45.9-179.5-84.576.7000111.8S8 L9 N15 S16 I36S8-H12 WeakPolarHBondContact O-CB 3.42Å; S8-H12 PolarHBondContact O-N 3.18Å; S8-H12 PolarHBondContact O-ND1 3.24Å; L9-H12 PolarHBondContact O-N 3.5Å; H12-N15 PolarHBondContact O-N 3.43Å; H12-S16 VanDerWaalsContact O-CB 3.28Å; H12-S16 WeakPolarHBondContact O-CB 3.35Å; H12-S16 PolarHBondContact O-N 3.32Å; H12-I36 HydrophobicContact CB-CD1 3.3Å; H12-I36 VanDerWaalsContact CG-CD1 3.47Å
13L93.3Very high89.7Confident0 Ų051.5 Ų51.50%027%0.269CS..Hα-helixtrans-62.7-48177.6-69173.9000111.1L9 V11 N15 S16 V17 L29 V32 A33 L46 L50 F57L9-L13 HydrophobicContact CD1-CD1 3.78Å; L9-L13 HydrophobicContact CD1-CG 4.01Å; L9-L13 HydrophobicContact CG-CD1 3.85Å; L9-L13 HydrophobicContact CG-CG 4.43Å; L9-L13 WeakPolarHBondContact O-CB 3.3Å; L9-L13 VanDerWaalsContact O-CG 3.28Å; L9-L13 WeakPolarHBondContact O-CG 3.36Å; L9-L13 PolarHBondContact O-N 3.01Å; V11-L13 PolarHBondContact O-N 2.98Å; L13-N15 PolarHBondContact O-N 3.19Å; L13-S16 PolarHBondContact O-N 2.87Å; L13-V17 WeakPolarHBondContact O-CG2 3.4Å; L13-V17 PolarHBondContact O-N 3.49Å; L13-L29 HydrophobicContact CD2-CB 4.22Å; L13-L29 HydrophobicContact CD2-CD2 4.3Å; L13-V32 HydrophobicContact CD2-CB 4.14Å; L13-V32 HydrophobicContact CD2-CG1 3.98Å; L13-A33 HydrophobicContact CD2-CB 4.16Å; L13-L46 HydrophobicContact CD1-CD1 3.88Å; L13-L50 HydrophobicContact CD1-CD2 3.9Å; L13-F57 HydrophobicContact CB-CE1 4.19Å; L13-F57 HydrophobicContact CB-CZ 4.06Å
14N93Very high90.5Very high1 Ų147.9 Ų47.91%0.00525%0.25CS..Hα-helixtrans-57.9-49.4178.7176.4-79.7000111.6L10 V11 S16 V17 W18 F57 R68 I70L10-N14 WeakPolarHBondContact O-CB 3.48Å; L10-N14 PolarHBondContact O-N 3.43Å; V11-N14 PolarHBondContact O-N 3.37Å; N14-S16 VanDerWaalsContact C-N 3.29Å; N14-S16 PolarHBondContact O-N 3.3Å; N14-V17 PolarHBondContact O-N 2.94Å; N14-W18 PolarHBondContact O-N 3.46Å; N14-F57 HydrophobicContact CB-CE1 4.01Å; N14-F57 HydrophobicContact CB-CZ 3.82Å; N14-R68 PolarHBondContact ND2-O 3.29Å; N14-R68 PolarHBondContact OD1-O 2.84Å; N14-I70 HydrophobicContact CB-CD1 3.81Å; N14-I70 HydrophobicContact CB-CG1 4.4Å
15N91.9Very high91.4Very high21 Ų2144 Ų4411%0.11224%0.237CC..Hα-helixtrans-67.3-32.3-178.4-71-7.4000111.8V11 H12 L13 R19 I69 I70V11-N15 VanDerWaalsContact O-CB 3.31Å; V11-N15 WeakPolarHBondContact O-CB 3.42Å; V11-N15 VanDerWaalsContact O-CG 3.29Å; V11-N15 PolarHBondContact O-N 3.1Å; H12-N15 PolarHBondContact O-N 3.43Å; L13-N15 PolarHBondContact O-N 3.19Å; N15-R19 WeakPolarHBondContact O-CB 3.36Å; N15-R19 WeakPolarHBondContact O-CG 3.46Å; N15-R19 PolarHBondContact O-N 3.23Å; N15-I69 VanDerWaalsContact OD1-CG1 3.28Å; N15-I69 WeakPolarHBondContact OD1-CG1 3.47Å; N15-I70 PolarHBondContact ND2-O 2.86Å; N15-I70 PolarHBondContact OD1-N 2.88Å; N15-I70 PolarHBondContact OD1-O 3.49Å
16S93.7Very high92Very high32 Ų3240 Ų4022%0.22422%0.222CC..Hα-helixtrans-64.8-44.6172.8-1710000112H12 L13 N14 S20H12-S16 VanDerWaalsContact O-CB 3.28Å; H12-S16 WeakPolarHBondContact O-CB 3.35Å; H12-S16 PolarHBondContact O-N 3.32Å; L13-S16 PolarHBondContact O-N 2.87Å; N14-S16 VanDerWaalsContact C-N 3.29Å; N14-S16 PolarHBondContact O-N 3.3Å; S16-S20 WeakPolarHBondContact O-CB 3.28Å; S16-S20 PolarHBondContact O-N 2.83Å; S16-S20 PolarHBondContact O-OG 2.82Å
17V95.9Very high92.5Very high0 Ų043.4 Ų43.40%024%0.243CC..Hα-helixtrans-63.5-45.9175.5-176.80000110.4L13 N14 R19 S20 N22 V24 L29 V64 V66L13-V17 WeakPolarHBondContact O-CG2 3.4Å; L13-V17 PolarHBondContact O-N 3.49Å; N14-V17 PolarHBondContact O-N 2.94Å; V17-R19 PolarHBondContact O-N 3.44Å; V17-S20 PolarHBondContact O-N 2.87Å; V17-S20 VanDerWaalsContact O-N 3.12Å; V17-N22 WeakPolarHBondContact CG1-O 3.34Å; V17-N22 WeakPolarHBondContact O-CA 3.41Å; V17-N22 PolarHBondContact O-N 2.99Å; V17-V24 HydrophobicContact CB-CG2 4.35Å; V17-V24 HydrophobicContact CG1-CG2 4.1Å; V17-V24 HydrophobicContact CG2-CG2 3.78Å; V17-L29 HydrophobicContact CG2-CD1 3.63Å; V17-L29 HydrophobicContact CG2-CD2 3.76Å; V17-L29 HydrophobicContact CG2-CG 4.25Å; V17-V64 WeakPolarHBondContact CG1-O 3.46Å; V17-V64 HydrophobicContact CG2-CG1 4.1Å; V17-V66 HydrophobicContact CB-CB 4.45Å; V17-V66 HydrophobicContact CB-CG1 3.83Å; V17-V66 HydrophobicContact CB-CG2 3.77Å; V17-V66 HydrophobicContact CG1-CB 4.32Å; V17-V66 HydrophobicContact CG1-CG1 3.94Å; V17-V66 HydrophobicContact CG1-CG2 3.69Å; V17-V66 HydrophobicContact CG2-CG1 4.21Å
18W93.9Very high92.9Very high87 Ų8746.7 Ų46.733%0.3327%0.266SS..Hα-helixtrans-59-49.6179.7-177.1-94.4000111.9N14 S20 G21 N22 V66 G67 R68 I69N14-W18 PolarHBondContact O-N 3.46Å; W18-S20 PolarHBondContact O-N 3.48Å; W18-S20 VanDerWaalsContact O-N 3.11Å; W18-G21 PolarHBondContact O-N 3.02Å; W18-N22 HydrophobicContact CE3-CB 4.44Å; W18-N22 VanDerWaalsContact CE3-CG 3.48Å; W18-N22 WeakPolarHBondContact CZ3-ND2 3.43Å; W18-N22 VanDerWaalsContact CZ3-OD1 3.3Å; W18-N22 WeakPolarHBondContact CZ3-OD1 3.38Å; W18-N22 PolarHBondContact O-N 3.38Å; W18-N22 PolarHBondContact O-OD1 3.31Å; W18-V66 HydrophobicContact CB-CG2 4Å; W18-V66 HydrophobicContact CE3-CG2 4.18Å; W18-G67 VanDerWaalsContact CZ3-C 3.48Å; W18-G67 VanDerWaalsContact CZ3-O 3.31Å; W18-G67 WeakPolarHBondContact CZ3-O 3.4Å; W18-R68 VanDerWaalsContact CE3-C 3.48Å; W18-R68 VanDerWaalsContact CE3-CA 3.46Å; W18-I69 HydrophobicContact CD2-CB 4.11Å; W18-I69 HydrophobicContact CG-CB 3.86Å; W18-I69 HydrophobicContact CG-CG1 4.43Å
19R92.5Very high93.4Very high201 Ų20145.2 Ų45.276%0.75826%0.256SS*.Hα-helixtrans-60.7-22.6177.5-73.5172.8-177.41762113.5N15 V17 G21N15-R19 WeakPolarHBondContact O-CB 3.36Å; N15-R19 WeakPolarHBondContact O-CG 3.46Å; N15-R19 PolarHBondContact O-N 3.23Å; V17-R19 PolarHBondContact O-N 3.44Å; R19-G21 VanDerWaalsContact C-N 3.35Å
20S93.4Very high93.6Very high73 Ų7346.2 Ų46.251%0.5126%0.262SS..THydrogen-bonded Turntrans-92.712.4179.5-55.10000113.6S16 V17 W18S16-S20 WeakPolarHBondContact O-CB 3.28Å; S16-S20 PolarHBondContact O-N 2.83Å; S16-S20 PolarHBondContact O-OG 2.82Å; V17-S20 PolarHBondContact O-N 2.87Å; V17-S20 VanDerWaalsContact O-N 3.12Å; W18-S20 PolarHBondContact O-N 3.48Å; W18-S20 VanDerWaalsContact O-N 3.11Å
21G93.4Very high93.6Very high57 Ų5749.6 Ų49.659%0.58829%0.286SS*.THydrogen-bonded Turntrans93.628.2-179.800000114W18 R19 S23W18-G21 PolarHBondContact O-N 3.02Å; R19-G21 VanDerWaalsContact C-N 3.35Å; G21-S23 PolarHBondContact O-N 3.36Å
22N94.7Very high93.7Very high57 Ų5750.2 Ų50.231%0.30529%0.289SS..SBendtrans70.4-7.4172.4-53.1-17.4000116.3V17 W18 T65 V66V17-N22 WeakPolarHBondContact CG1-O 3.34Å; V17-N22 WeakPolarHBondContact O-CA 3.41Å; V17-N22 PolarHBondContact O-N 2.99Å; W18-N22 HydrophobicContact CE3-CB 4.44Å; W18-N22 VanDerWaalsContact CE3-CG 3.48Å; W18-N22 WeakPolarHBondContact CZ3-ND2 3.43Å; W18-N22 VanDerWaalsContact CZ3-OD1 3.3Å; W18-N22 WeakPolarHBondContact CZ3-OD1 3.38Å; W18-N22 PolarHBondContact O-N 3.38Å; W18-N22 PolarHBondContact O-OD1 3.31Å; N22-T65 CarbonylContact O-C 3.51Å; N22-T65 VanDerWaalsContact O-CA 3.23Å; N22-T65 WeakPolarHBondContact O-CA 3.43Å; N22-T65 WeakPolarHBondContact O-CG2 3.26Å; N22-V66 PolarHBondContact O-N 2.88Å
23S96.9Very high93.8Very high57 Ų5745 Ų4540%0.39927%0.265SS..EExtended strand (participates in β ladder)trans-143.8129.1176.5-62.30000110.7G21 V64 T65G21-S23 PolarHBondContact O-N 3.36Å; S23-V64 VanDerWaalsContact CA-O 3.32Å; S23-V64 WeakPolarHBondContact CA-O 3.44Å; S23-T65 PolarHBondContact OG-OG1 3.35Å
24V96.7Very high93.6Very high15 Ų1547.5 Ų47.59%0.09128%0.282CS..EExtended strand (participates in β ladder)trans-142.3154.2177.8-59.40000111.6V17 I26 L29 I63 V64V17-V24 HydrophobicContact CB-CG2 4.35Å; V17-V24 HydrophobicContact CG1-CG2 4.1Å; V17-V24 HydrophobicContact CG2-CG2 3.78Å; V24-I26 PolarHBondContact O-N 3.13Å; V24-L29 HydrophobicContact CG2-CD1 3.91Å; V24-L29 HydrophobicContact CG2-CD2 3.93Å; V24-L29 HydrophobicContact CG2-CG 3.73Å; V24-I63 WeakPolarHBondContact O-CA 3.21Å; V24-V64 PolarHBondContact N-O 3.08Å; V24-V64 PolarHBondContact O-N 2.87Å
25P96.7Very high93.3Very high59 Ų5955.2 Ų55.238%0.38332%0.318SS..EExtended strand (participates in β ladder)trans-58.6136.8166.1-21.433.6000111T27 S28 I63P25-T27 PolarHBondContact O-N 3.16Å; P25-S28 WeakPolarHBondContact O-CB 3.37Å; P25-S28 PolarHBondContact O-N 3Å; P25-I63 HydrophobicContact CB-CD1 4.35Å; P25-I63 HydrophobicContact CG-CD1 4.19Å
26I95Very high93Very high6 Ų656.8 Ų56.83%0.03133%0.326CS..Hα-helixtrans-58.9-30.2177.7-170.7161.8000112.5V24 S28 L29 V30 T43 L46 E47 G62 V64V24-I26 PolarHBondContact O-N 3.13Å; I26-S28 PolarHBondContact O-N 3.29Å; I26-L29 WeakPolarHBondContact O-CB 3.28Å; I26-L29 PolarHBondContact O-N 3.21Å; I26-V30 PolarHBondContact O-N 3.25Å; I26-T43 HydrophobicContact CB-CG2 4.31Å; I26-T43 HydrophobicContact CD1-CG2 4.31Å; I26-T43 HydrophobicContact CG1-CG2 4.15Å; I26-T43 HydrophobicContact CG2-CG2 3.29Å; I26-L46 HydrophobicContact CG1-CD2 4.17Å; I26-L46 HydrophobicContact CG1-CG 4.4Å; I26-E47 VanDerWaalsContact CD1-CA 3.46Å; I26-E47 HydrophobicContact CD1-CB 3.45Å; I26-E47 VanDerWaalsContact CD1-CB 3.45Å; I26-E47 HydrophobicContact CD1-CG 3.79Å; I26-G62 WeakPolarHBondContact CG2-O 3.2Å; I26-G62 PolarHBondContact N-O 3.28Å; I26-V64 HydrophobicContact CB-CG2 3.86Å; I26-V64 HydrophobicContact CD1-CG2 4.17Å; I26-V64 HydrophobicContact CG1-CG2 4.01Å
27T94.5Very high92.7Very high85 Ų8556.4 Ų56.452%0.52132%0.321SS..Hα-helixtrans-59.8-34.5176.547.80000112.2P25 L29 V30P25-T27 PolarHBondContact O-N 3.16Å; T27-L29 VanDerWaalsContact C-N 3.26Å; T27-L29 PolarHBondContact O-N 3.37Å; T27-V30 PolarHBondContact O-N 3.32Å
28S92.7Very high92.1Very high70 Ų7060.7 Ų60.749%0.4935%0.351SS..Hα-helixtrans-70.5-24176.7-560000112.7P25 I26P25-S28 WeakPolarHBondContact O-CB 3.37Å; P25-S28 PolarHBondContact O-N 3Å; I26-S28 PolarHBondContact O-N 3.29Å
29L94Very high91.7Very high3 Ų361.9 Ų61.92%0.01636%0.364CS..Hα-helixtrans-84.3-16.5178.6-65.8177.1000113.2L13 V17 V24 I26 T27 S31 V32 A33 L46 L50 V64L13-L29 HydrophobicContact CD2-CB 4.22Å; L13-L29 HydrophobicContact CD2-CD2 4.3Å; V17-L29 HydrophobicContact CG2-CD1 3.63Å; V17-L29 HydrophobicContact CG2-CD2 3.76Å; V17-L29 HydrophobicContact CG2-CG 4.25Å; V24-L29 HydrophobicContact CG2-CD1 3.91Å; V24-L29 HydrophobicContact CG2-CD2 3.93Å; V24-L29 HydrophobicContact CG2-CG 3.73Å; I26-L29 WeakPolarHBondContact O-CB 3.28Å; I26-L29 PolarHBondContact O-N 3.21Å; T27-L29 VanDerWaalsContact C-N 3.26Å; T27-L29 PolarHBondContact O-N 3.37Å; L29-S31 VanDerWaalsContact C-N 3.32Å; L29-S31 PolarHBondContact O-N 3.43Å; L29-V32 PolarHBondContact O-N 2.83Å; L29-A33 WeakPolarHBondContact O-CB 3.33Å; L29-A33 PolarHBondContact O-N 3.24Å; L29-L46 HydrophobicContact CB-CD2 3.64Å; L29-L50 HydrophobicContact CD1-CD1 4.36Å; L29-V64 HydrophobicContact CD1-CB 3.83Å; L29-V64 HydrophobicContact CD1-CG1 3.96Å; L29-V64 HydrophobicContact CD1-CG2 3.83Å
30V93.4Very high91.3Very high21 Ų2153.2 Ų53.213%0.12733%0.332CS..Hα-helixtrans-59.8-44.7177.5177.90000110.4I26 T27 V32 A33 S34 L46I26-V30 PolarHBondContact O-N 3.25Å; T27-V30 PolarHBondContact O-N 3.32Å; V30-V32 VanDerWaalsContact C-N 3.35Å; V30-V32 PolarHBondContact O-N 2.8Å; V30-A33 PolarHBondContact O-N 3.11Å; V30-S34 WeakPolarHBondContact O-CB 3.44Å; V30-S34 PolarHBondContact O-N 3.03Å; V30-S34 PolarHBondContact O-OG 2.96Å; V30-L46 HydrophobicContact CG2-CD2 4.07Å
31S90.4Very high90.8Very high72 Ų7255.4 Ų55.450%0.50334%0.338SS..Hα-helixtrans-60.1-45.2176.3-55.80000111.8L29 A33 S34 E35L29-S31 VanDerWaalsContact C-N 3.32Å; L29-S31 PolarHBondContact O-N 3.43Å; S31-A33 PolarHBondContact O-N 3.12Å; S31-S34 WeakPolarHBondContact CA-OG 3.46Å; S31-S34 PolarHBondContact O-N 3.49Å; S31-S34 PolarHBondContact O-OG 2.96Å; S31-E35 WeakPolarHBondContact O-CG 3.43Å; S31-E35 PolarHBondContact O-N 3.05Å; S31-E35 VanDerWaalsContact O-N 3.1Å
32V90.2Very high90.6Very high29 Ų2953.7 Ų53.718%0.17632%0.32CS..Hα-helixtrans-63-42.4178.6-1770000111.4L13 L29 V30 S34L13-V32 HydrophobicContact CD2-CB 4.14Å; L13-V32 HydrophobicContact CD2-CG1 3.98Å; L29-V32 PolarHBondContact O-N 2.83Å; V30-V32 VanDerWaalsContact C-N 3.35Å; V30-V32 PolarHBondContact O-N 2.8Å; V32-S34 VanDerWaalsContact C-N 3.34Å
33A92.8Very high90.4Very high0 Ų053.3 Ų53.30%032%0.321CS..Hα-helixtrans-63.9-42.217600000111L9 L13 L29 V30 S31 E35 I36 D37 F40 L46L9-A33 HydrophobicContact CD1-CB 4.36Å; L13-A33 HydrophobicContact CD2-CB 4.16Å; L29-A33 WeakPolarHBondContact O-CB 3.33Å; L29-A33 PolarHBondContact O-N 3.24Å; V30-A33 PolarHBondContact O-N 3.11Å; S31-A33 PolarHBondContact O-N 3.12Å; A33-E35 VanDerWaalsContact C-N 3.31Å; A33-E35 PolarHBondContact O-N 2.97Å; A33-I36 PolarHBondContact O-N 2.71Å; A33-I36 VanDerWaalsContact O-N 3.11Å; A33-D37 PolarHBondContact O-N 2.94Å; A33-F40 HydrophobicContact CB-CB 3.58Å; A33-F40 HydrophobicContact CB-CD2 4.39Å; A33-F40 HydrophobicContact CB-CG 4.08Å; A33-L46 HydrophobicContact CB-CD1 3.92Å; A33-L46 HydrophobicContact CB-CD2 4.25Å
34S90Very high90.2Very high51 Ų5154.1 Ų54.136%0.35733%0.331SS..Hα-helixtrans-67.4-26.4-177.9740000114.4V30 S31 V32 I36 D37 S38V30-S34 WeakPolarHBondContact O-CB 3.44Å; V30-S34 PolarHBondContact O-N 3.03Å; V30-S34 PolarHBondContact O-OG 2.96Å; S31-S34 WeakPolarHBondContact CA-OG 3.46Å; S31-S34 PolarHBondContact O-N 3.49Å; S31-S34 PolarHBondContact O-OG 2.96Å; V32-S34 VanDerWaalsContact C-N 3.34Å; S34-I36 PolarHBondContact O-N 3.15Å; S34-D37 WeakPolarHBondContact CA-O 3.19Å; S34-D37 CarbonylContact O-C 3.58Å; S34-S38 PolarHBondContact O-N 2.81Å
35E87.2Confident89.9Confident163 Ų16358.1 Ų58.176%0.76235%0.348SS*.Hα-helixtrans-66.3-28173-74172.7-166.200112.3S31 A33S31-E35 WeakPolarHBondContact O-CG 3.43Å; S31-E35 PolarHBondContact O-N 3.05Å; S31-E35 VanDerWaalsContact O-N 3.1Å; A33-E35 VanDerWaalsContact C-N 3.31Å; A33-E35 PolarHBondContact O-N 2.97Å
36I86.1Confident89.8Confident55 Ų5555.3 Ų55.328%0.28233%0.33SS..Hα-helixtrans-99.1-39.2-178.2-59.7172.2000110.8L9 H12 A33 S34L9-I36 HydrophobicContact CB-CG2 4.39Å; L9-I36 HydrophobicContact CD1-CB 4.08Å; L9-I36 HydrophobicContact CD1-CD1 4.05Å; L9-I36 HydrophobicContact CD1-CG2 4.13Å; H12-I36 HydrophobicContact CB-CD1 3.3Å; H12-I36 VanDerWaalsContact CG-CD1 3.47Å; A33-I36 PolarHBondContact O-N 2.71Å; A33-I36 VanDerWaalsContact O-N 3.11Å; S34-I36 PolarHBondContact O-N 3.15Å
37D85.8Confident89.8Confident23 Ų2358.8 Ų58.812%0.12335%0.346CS..  trans-145.7111173.9-178.95000111.5W5 A33 S34 N39 F40W5-D37 WeakPolarHBondContact CH2-OD2 3.32Å; W5-D37 HydrophobicContact CZ2-CB 3.39Å; W5-D37 WeakPolarHBondContact CZ2-OD2 3.45Å; A33-D37 PolarHBondContact O-N 2.94Å; S34-D37 WeakPolarHBondContact CA-O 3.19Å; S34-D37 CarbonylContact O-C 3.58Å; D37-N39 PolarHBondContact O-N 2.65Å; D37-N39 VanDerWaalsContact OD1-CB 3.29Å; D37-N39 WeakPolarHBondContact OD1-CB 3.46Å; D37-N39 VanDerWaalsContact OD1-CG 3.23Å; D37-N39 PolarHBondContact OD1-N 3.42Å; D37-N39 PolarHBondContact OD1-ND2 2.84Å; D37-N39 PolarHBondContact OD2-ND2 2.9Å; D37-F40 HydrophobicContact CB-CD2 4.17Å; D37-F40 PolarHBondContact O-N 3Å
38S84.8Confident89.7Confident90 Ų9057.8 Ų57.863%0.62935%0.347SS*.THydrogen-bonded Turntrans-55.7-15.4175.757.40000115S34 F40S34-S38 PolarHBondContact O-N 2.81Å; S38-F40 VanDerWaalsContact C-N 3.27Å; S38-F40 PolarHBondContact O-N 2.8Å
39N84.3Confident89.7Confident112 Ų11255.4 Ų55.460%0.59933%0.327SS*.THydrogen-bonded Turntrans-69.1-23.4174.3-63.8-46.4000112.9D37 N41 Q45D37-N39 PolarHBondContact O-N 2.65Å; D37-N39 VanDerWaalsContact OD1-CB 3.29Å; D37-N39 WeakPolarHBondContact OD1-CB 3.46Å; D37-N39 VanDerWaalsContact OD1-CG 3.23Å; D37-N39 PolarHBondContact OD1-N 3.42Å; D37-N39 PolarHBondContact OD1-ND2 2.84Å; D37-N39 PolarHBondContact OD2-ND2 2.9Å; N39-N41 VanDerWaalsContact C-N 3.31Å; N39-N41 PolarHBondContact O-N 3.49Å; N39-N41 VanDerWaalsContact O-N 3.11Å; N39-Q45 PolarHBondContact O-OE1 3.46Å
40F85Confident89.7Confident19 Ų1955.3 Ų55.38%0.08333%0.327CS..  trans-8671.1175-73.7-72.8000111.3W5 L9 A33 D37 S38 Q45 L46 F49W5-F40 AromaticContact CH2-CE2 3.84Å; W5-F40 HydrophobicContact CH2-CE2 3.84Å; W5-F40 HydrophobicContact CZ2-CE2 4.11Å; L9-F40 HydrophobicContact CD2-CD2 3.9Å; L9-F40 HydrophobicContact CD2-CE2 3.34Å; L9-F40 HydrophobicContact CD2-CZ 4.09Å; A33-F40 HydrophobicContact CB-CB 3.58Å; A33-F40 HydrophobicContact CB-CD2 4.39Å; A33-F40 HydrophobicContact CB-CG 4.08Å; D37-F40 HydrophobicContact CB-CD2 4.17Å; D37-F40 PolarHBondContact O-N 3Å; S38-F40 VanDerWaalsContact C-N 3.27Å; S38-F40 PolarHBondContact O-N 2.8Å; F40-Q45 HydrophobicContact CD1-CB 4.31Å; F40-L46 HydrophobicContact CD1-CB 4.15Å; F40-L46 HydrophobicContact CD1-CD1 4.06Å; F40-L46 HydrophobicContact CE1-CD1 4.37Å; F40-L46 HydrophobicContact CG-CD1 4.49Å; F40-F49 HydrophobicContact CE1-CB 3.53Å; F40-F49 HydrophobicContact CE1-CD1 4.19Å; F40-F49 HydrophobicContact CE1-CD2 4.4Å; F40-F49 AromaticContact CE1-CG 3.8Å; F40-F49 HydrophobicContact CE1-CG 3.8Å; F40-F49 HydrophobicContact CZ-CB 3.77Å; F40-F49 AromaticContact CZ-CD1 3.87Å; F40-F49 HydrophobicContact CZ-CD1 3.87Å; F40-F49 AromaticContact CZ-CD2 3.74Å; F40-F49 HydrophobicContact CZ-CD2 3.74Å; F40-F49 HydrophobicContact CZ-CE1 4.4Å; F40-F49 HydrophobicContact CZ-CE2 4.28Å; F40-F49 AromaticContact CZ-CG 3.51Å; F40-F49 HydrophobicContact CZ-CG 3.51Å
41N82.1Confident89.6Confident119 Ų11956.7 Ų56.764%0.63634%0.341SS*.  trans-97.7-2.5179.164.414.5000113.6N39 Q45N39-N41 VanDerWaalsContact C-N 3.31Å; N39-N41 PolarHBondContact O-N 3.49Å; N39-N41 VanDerWaalsContact O-N 3.11Å; N41-Q45 PolarHBondContact OD1-OE1 2.94Å
42G89.1Confident89.6Confident21 Ų2162 Ų6222%0.21635%0.35CS..SBendtrans-135.6143.3-175.800000113.4A44 Q45 L46G42-A44 VanDerWaalsContact C-N 3.3Å; G42-A44 PolarHBondContact O-N 3.38Å; G42-Q45 PolarHBondContact O-N 3.22Å; G42-L46 PolarHBondContact O-N 3.47Å
43T91.3Very high89.6Confident50 Ų5061.6 Ų61.631%0.30735%0.345SS..Hα-helixtrans-53.2-45.2175.4-58.90000112.5I26 Q45 L46 E47I26-T43 HydrophobicContact CB-CG2 4.31Å; I26-T43 HydrophobicContact CD1-CG2 4.31Å; I26-T43 HydrophobicContact CG1-CG2 4.15Å; I26-T43 HydrophobicContact CG2-CG2 3.29Å; T43-Q45 PolarHBondContact O-N 3.26Å; T43-L46 PolarHBondContact O-N 3.32Å; T43-E47 WeakPolarHBondContact O-CB 3.4Å; T43-E47 PolarHBondContact O-N 3.41Å
44A91.7Very high89.5Confident74 Ų7466.6 Ų66.661%0.61238%0.376SS*.Hα-helixtrans-64.7-37.2-175.800000113.1G42 A48G42-A44 VanDerWaalsContact C-N 3.3Å; G42-A44 PolarHBondContact O-N 3.38Å; A44-A48 WeakPolarHBondContact O-CB 3.37Å; A44-A48 PolarHBondContact O-N 3Å
45Q91.9Very high89.3Confident98 Ų9873 Ų7346%0.45839%0.392SS..Hα-helixtrans-69.2-44177.4-68.3167.3-12.300110.7N39 F40 N41 G42 T43 E47 A48 F49N39-Q45 PolarHBondContact O-OE1 3.46Å; F40-Q45 HydrophobicContact CD1-CB 4.31Å; N41-Q45 PolarHBondContact OD1-OE1 2.94Å; G42-Q45 PolarHBondContact O-N 3.22Å; T43-Q45 PolarHBondContact O-N 3.26Å; Q45-E47 VanDerWaalsContact C-N 3.31Å; Q45-E47 PolarHBondContact O-N 3.01Å; Q45-A48 PolarHBondContact O-N 3.39Å; Q45-F49 WeakPolarHBondContact O-CB 3.36Å; Q45-F49 PolarHBondContact O-N 3.06Å
46L93.9Very high89.4Confident0 Ų065.9 Ų65.90%036%0.359CS..Hα-helixtrans-63.6-40.6176.7-175.659.6000111.1L13 I26 L29 V30 A33 F40 G42 T43 F49 L50L13-L46 HydrophobicContact CD1-CD1 3.88Å; I26-L46 HydrophobicContact CG1-CD2 4.17Å; I26-L46 HydrophobicContact CG1-CG 4.4Å; L29-L46 HydrophobicContact CB-CD2 3.64Å; V30-L46 HydrophobicContact CG2-CD2 4.07Å; A33-L46 HydrophobicContact CB-CD1 3.92Å; A33-L46 HydrophobicContact CB-CD2 4.25Å; F40-L46 HydrophobicContact CD1-CB 4.15Å; F40-L46 HydrophobicContact CD1-CD1 4.06Å; F40-L46 HydrophobicContact CE1-CD1 4.37Å; F40-L46 HydrophobicContact CG-CD1 4.49Å; G42-L46 PolarHBondContact O-N 3.47Å; T43-L46 PolarHBondContact O-N 3.32Å; L46-F49 HydrophobicContact CD1-CD1 4.42Å; L46-F49 PolarHBondContact O-N 2.9Å; L46-L50 HydrophobicContact CD1-CD1 4.13Å; L46-L50 HydrophobicContact CD1-CG 4.06Å; L46-L50 HydrophobicContact CG-CD1 4Å; L46-L50 HydrophobicContact CG-CG 4.31Å; L46-L50 WeakPolarHBondContact O-CB 3.24Å; L46-L50 VanDerWaalsContact O-CG 3.3Å; L46-L50 WeakPolarHBondContact O-CG 3.37Å; L46-L50 PolarHBondContact O-N 3.35Å
47E94.2Very high89.7Confident80 Ų8063.3 Ų63.337%0.37435%0.346SS..Hα-helixtrans-62-50.5177-162.9172.4168.700111.3I26 T43 Q45 F49 L50 A51 I59I26-E47 VanDerWaalsContact CD1-CA 3.46Å; I26-E47 HydrophobicContact CD1-CB 3.45Å; I26-E47 VanDerWaalsContact CD1-CB 3.45Å; I26-E47 HydrophobicContact CD1-CG 3.79Å; T43-E47 WeakPolarHBondContact O-CB 3.4Å; T43-E47 PolarHBondContact O-N 3.41Å; Q45-E47 VanDerWaalsContact C-N 3.31Å; Q45-E47 PolarHBondContact O-N 3.01Å; E47-F49 PolarHBondContact O-N 2.93Å; E47-L50 PolarHBondContact O-N 2.89Å; E47-A51 WeakPolarHBondContact O-CB 3.41Å; E47-A51 PolarHBondContact O-N 3.24Å; E47-I59 HydrophobicContact CG-CD1 4.07Å; E47-I59 HydrophobicContact CG-CG2 4.12Å
48A93.3Very high90.2Very high64 Ų6468 Ų6853%0.52937%0.365SS..Hα-helixtrans-60.8-36.217800000112A44 Q45A44-A48 WeakPolarHBondContact O-CB 3.37Å; A44-A48 PolarHBondContact O-N 3Å; Q45-A48 PolarHBondContact O-N 3.39Å
49F92.5Very high90.7Very high20 Ų2065.7 Ų65.79%0.08835%0.345CS..Hα-helixtrans-66.5-53.9174.5173-101.9000111.7T6 L9 L10 F40 Q45 L46 E47 A51 R52 Y53T6-F49 HydrophobicContact CG2-CE2 3.9Å; T6-F49 HydrophobicContact CG2-CZ 3.81Å; L9-F49 HydrophobicContact CD2-CD1 4.44Å; L9-F49 HydrophobicContact CD2-CE1 3.69Å; L9-F49 HydrophobicContact CD2-CZ 3.76Å; L9-F49 HydrophobicContact CG-CE1 4.18Å; L9-F49 HydrophobicContact CG-CZ 4.42Å; L10-F49 HydrophobicContact CD2-CE1 3.55Å; L10-F49 HydrophobicContact CD2-CZ 3.77Å; L10-F49 HydrophobicContact CG-CE1 4.22Å; L10-F49 HydrophobicContact CG-CZ 4.05Å; F40-F49 HydrophobicContact CE1-CB 3.53Å; F40-F49 HydrophobicContact CE1-CD1 4.19Å; F40-F49 HydrophobicContact CE1-CD2 4.4Å; F40-F49 AromaticContact CE1-CG 3.8Å; F40-F49 HydrophobicContact CE1-CG 3.8Å; F40-F49 HydrophobicContact CZ-CB 3.77Å; F40-F49 AromaticContact CZ-CD1 3.87Å; F40-F49 HydrophobicContact CZ-CD1 3.87Å; F40-F49 AromaticContact CZ-CD2 3.74Å; F40-F49 HydrophobicContact CZ-CD2 3.74Å; F40-F49 HydrophobicContact CZ-CE1 4.4Å; F40-F49 HydrophobicContact CZ-CE2 4.28Å; F40-F49 AromaticContact CZ-CG 3.51Å; F40-F49 HydrophobicContact CZ-CG 3.51Å; Q45-F49 WeakPolarHBondContact O-CB 3.36Å; Q45-F49 PolarHBondContact O-N 3.06Å; L46-F49 HydrophobicContact CD1-CD1 4.42Å; L46-F49 PolarHBondContact O-N 2.9Å; E47-F49 PolarHBondContact O-N 2.93Å; F49-A51 VanDerWaalsContact C-N 3.3Å; F49-A51 PolarHBondContact O-N 2.95Å; F49-R52 WeakPolarHBondContact O-CB 3.46Å; F49-R52 PolarHBondContact O-N 3.38Å; F49-R52 VanDerWaalsContact O-N 3.16Å; F49-Y53 HydrophobicContact CD2-CE2 4.07Å; F49-Y53 HydrophobicContact CE1-CE2 4.23Å; F49-Y53 AromaticContact CE2-CE2 3.7Å; F49-Y53 HydrophobicContact CE2-CE2 3.7Å; F49-Y53 HydrophobicContact CG-CE2 4.49Å; F49-Y53 AromaticContact CZ-CE2 3.79Å; F49-Y53 HydrophobicContact CZ-CE2 3.79Å; F49-Y53 WeakPolarHBondContact O-CD2 3.3Å; F49-Y53 WeakPolarHBondContact O-CE2 3.28Å
50L93.2Very high91.2Very high0 Ų065.8 Ų65.80%034%0.342CS..Hα-helixtrans-65.1-32.6-178.1-69-178.9000112.7L10 L13 L29 L46 E47 R52 Y53 F57 I59 V64L10-L50 HydrophobicContact CD2-CD2 4.28Å; L13-L50 HydrophobicContact CD1-CD2 3.9Å; L29-L50 HydrophobicContact CD1-CD1 4.36Å; L46-L50 HydrophobicContact CD1-CD1 4.13Å; L46-L50 HydrophobicContact CD1-CG 4.06Å; L46-L50 HydrophobicContact CG-CD1 4Å; L46-L50 HydrophobicContact CG-CG 4.31Å; L46-L50 WeakPolarHBondContact O-CB 3.24Å; L46-L50 VanDerWaalsContact O-CG 3.3Å; L46-L50 WeakPolarHBondContact O-CG 3.37Å; L46-L50 PolarHBondContact O-N 3.35Å; E47-L50 PolarHBondContact O-N 2.89Å; L50-R52 PolarHBondContact O-N 3.47Å; L50-R52 VanDerWaalsContact O-N 3.1Å; L50-Y53 CarbonylContact O-C 3.6Å; L50-Y53 WeakPolarHBondContact O-CA 3.18Å; L50-Y53 PolarHBondContact O-N 2.91Å; L50-F57 HydrophobicContact CB-CB 4.48Å; L50-F57 HydrophobicContact CB-CG 4.5Å; L50-F57 HydrophobicContact CD2-CD1 4.16Å; L50-F57 HydrophobicContact CD2-CD2 3.7Å; L50-F57 HydrophobicContact CD2-CE1 4.1Å; L50-F57 HydrophobicContact CD2-CE2 3.66Å; L50-F57 HydrophobicContact CD2-CG 3.95Å; L50-F57 HydrophobicContact CD2-CZ 3.85Å; L50-I59 HydrophobicContact CB-CD1 3.66Å; L50-V64 HydrophobicContact CD1-CG1 4.3Å; L50-V64 HydrophobicContact CD1-CG2 4.15Å
51A92.1Very high91.5Very high51 Ų5170.7 Ų70.742%0.42138%0.379SS..G310 helixtrans-61-18.6176.400000113.3E47 F49 Y53 T54 I59E47-A51 WeakPolarHBondContact O-CB 3.41Å; E47-A51 PolarHBondContact O-N 3.24Å; F49-A51 VanDerWaalsContact C-N 3.3Å; F49-A51 PolarHBondContact O-N 2.95Å; A51-Y53 VanDerWaalsContact C-N 3.26Å; A51-T54 WeakPolarHBondContact O-CG2 3.5Å; A51-I59 HydrophobicContact CB-CD1 4.35Å
52R91.1Very high92.1Very high184 Ų18466.3 Ų66.369%0.69436%0.362SS*.G310 helixtrans-76.3-16.1173-61.717063.3-175.3-1.4112.8F49 L50F49-R52 WeakPolarHBondContact O-CB 3.46Å; F49-R52 PolarHBondContact O-N 3.38Å; F49-R52 VanDerWaalsContact O-N 3.16Å; L50-R52 PolarHBondContact O-N 3.47Å; L50-R52 VanDerWaalsContact O-N 3.1Å
53Y89.8Confident92.4Very high20 Ų2068.3 Ų68.38%0.07837%0.367CS..G310 helixtrans-118.449-174.4-53.3-80.9000111L2 T6 L10 F49 L50 A51 R55 L56 F57L2-Y53 HydrophobicContact CD1-CE1 4.15Å; L2-Y53 HydrophobicContact CD2-CE1 3.9Å; L2-Y53 WeakPolarHBondContact CD2-OH 3.2Å; T6-Y53 WeakPolarHBondContact CG2-OH 3.19Å; L10-Y53 HydrophobicContact CD1-CD1 3.77Å; L10-Y53 HydrophobicContact CD1-CD2 4.2Å; L10-Y53 HydrophobicContact CD1-CE1 3.62Å; L10-Y53 HydrophobicContact CD1-CE2 4.08Å; L10-Y53 HydrophobicContact CD1-CG 4.06Å; L10-Y53 HydrophobicContact CD2-CD1 4.37Å; L10-Y53 HydrophobicContact CD2-CD2 3.5Å; L10-Y53 VanDerWaalsContact CD2-CD2 3.5Å; L10-Y53 HydrophobicContact CD2-CE2 3.84Å; L10-Y53 HydrophobicContact CD2-CG 3.8Å; L10-Y53 HydrophobicContact CG-CD2 4.5Å; F49-Y53 HydrophobicContact CD2-CE2 4.07Å; F49-Y53 HydrophobicContact CE1-CE2 4.23Å; F49-Y53 AromaticContact CE2-CE2 3.7Å; F49-Y53 HydrophobicContact CE2-CE2 3.7Å; F49-Y53 HydrophobicContact CG-CE2 4.49Å; F49-Y53 AromaticContact CZ-CE2 3.79Å; F49-Y53 HydrophobicContact CZ-CE2 3.79Å; F49-Y53 WeakPolarHBondContact O-CD2 3.3Å; F49-Y53 WeakPolarHBondContact O-CE2 3.28Å; L50-Y53 CarbonylContact O-C 3.6Å; L50-Y53 WeakPolarHBondContact O-CA 3.18Å; L50-Y53 PolarHBondContact O-N 2.91Å; A51-Y53 VanDerWaalsContact C-N 3.26Å; Y53-R55 PolarHBondContact O-N 2.98Å; Y53-L56 WeakPolarHBondContact O-CA 3.31Å; Y53-L56 PolarHBondContact O-N 2.85Å; Y53-F57 PolarHBondContact O-N 2.88Å
54T89.7Confident92.7Very high104 Ų10466 Ų6664%0.63835%0.352SS*.THydrogen-bonded Turntrans-58.4-22.7-175.956.80000114.7A51 L56 F57A51-T54 WeakPolarHBondContact O-CG2 3.5Å; T54-L56 VanDerWaalsContact C-N 3.27Å; T54-L56 PolarHBondContact O-N 3.05Å; T54-F57 VanDerWaalsContact CA-O 3.32Å; T54-F57 WeakPolarHBondContact CA-O 3.33Å
55R85.8Confident93Very high187 Ų18764.8 Ų64.871%0.70634%0.338SS*.THydrogen-bonded Turntrans-72.7-20.5174.1-56.9-147.4-164.7142.2-8.7113.1Y53 R82 L83Y53-R55 PolarHBondContact O-N 2.98Å; R55-R82 PolarHBondContact NH1-O 3.28Å; R55-L83 HydrophobicContact CB-CD2 3.52Å; R55-L83 HydrophobicContact CG-CD2 3.49Å; R55-L83 VanDerWaalsContact CG-CD2 3.49Å
56L89.2Confident93.1Very high13 Ų1360.3 Ų60.37%0.06832%0.317CS..THydrogen-bonded Turntrans-101-41.1177.7-64.2178.8000111.5Y53 T54 I70 L83Y53-L56 WeakPolarHBondContact O-CA 3.31Å; Y53-L56 PolarHBondContact O-N 2.85Å; T54-L56 VanDerWaalsContact C-N 3.27Å; T54-L56 PolarHBondContact O-N 3.05Å; L56-I70 HydrophobicContact CD2-CD1 4.25Å; L56-L83 HydrophobicContact CD1-CD1 4.24Å; L56-L83 HydrophobicContact CD2-CD1 4.5Å; L56-L83 HydrophobicContact CG-CD1 4.15Å
57F93.6Very high92.9Very high1 Ų163.6 Ų63.60%0.00435%0.351CS..EExtended strand (participates in β ladder)trans-123.4123.6-173.9-56.7-84.1000110.3L10 L13 N14 L50 Y53 T54 V64 V66L10-F57 HydrophobicContact CD2-CD2 4.48Å; L10-F57 HydrophobicContact CD2-CE2 3.65Å; L10-F57 HydrophobicContact CD2-CZ 4.39Å; L13-F57 HydrophobicContact CB-CE1 4.19Å; L13-F57 HydrophobicContact CB-CZ 4.06Å; N14-F57 HydrophobicContact CB-CE1 4.01Å; N14-F57 HydrophobicContact CB-CZ 3.82Å; L50-F57 HydrophobicContact CB-CB 4.48Å; L50-F57 HydrophobicContact CB-CG 4.5Å; L50-F57 HydrophobicContact CD2-CD1 4.16Å; L50-F57 HydrophobicContact CD2-CD2 3.7Å; L50-F57 HydrophobicContact CD2-CE1 4.1Å; L50-F57 HydrophobicContact CD2-CE2 3.66Å; L50-F57 HydrophobicContact CD2-CG 3.95Å; L50-F57 HydrophobicContact CD2-CZ 3.85Å; Y53-F57 PolarHBondContact O-N 2.88Å; T54-F57 VanDerWaalsContact CA-O 3.32Å; T54-F57 WeakPolarHBondContact CA-O 3.33Å; F57-V64 HydrophobicContact CB-CG1 4.2Å; F57-V64 HydrophobicContact CD1-CG1 3.61Å; F57-V64 HydrophobicContact CE1-CG1 4.49Å; F57-V64 HydrophobicContact CG-CG1 4.34Å; F57-V66 HydrophobicContact CD1-CG1 3.58Å; F57-V66 HydrophobicContact CE1-CG1 3.78Å
58K95.6Very high92.6Very high121 Ų12166.1 Ų66.153%0.52636%0.357SS..EExtended strand (participates in β ladder)trans-94.4127.3163.5-174.6-175.1174.4-158.20107.7E60 V64 T65K58-E60 VanDerWaalsContact CE-OE2 3.24Å; K58-E60 WeakPolarHBondContact CE-OE2 3.5Å; K58-E60 IonicContact NZ-OE2 2.71Å; K58-E60 PolarHBondContact NZ-OE2 3.1Å; K58-V64 CarbonylContact O-C 3.55Å; K58-V64 WeakPolarHBondContact O-CA 3.3Å; K58-T65 PolarHBondContact N-O 2.88Å; K58-T65 PolarHBondContact O-N 2.98Å
59I95.2Very high92.3Very high42 Ų4265.5 Ų65.522%0.21534%0.344CS..EExtended strand (participates in β ladder)trans-114.6121.6177.2-49.9177.8000108E47 L50 A51 I63 V64E47-I59 HydrophobicContact CG-CD1 4.07Å; E47-I59 HydrophobicContact CG-CG2 4.12Å; L50-I59 HydrophobicContact CB-CD1 3.66Å; A51-I59 HydrophobicContact CB-CD1 4.35Å; I59-I63 WeakPolarHBondContact CA-O 3.23Å; I59-V64 HydrophobicContact CG1-CG2 4.4Å
60E94.1Very high91.9Very high114 Ų11464.9 Ų64.953%0.53334%0.342SS..EExtended strand (participates in β ladder)trans-144.9125.5178.8-174.2171.2-176.300109.8K58 G62 I63K58-E60 VanDerWaalsContact CE-OE2 3.24Å; K58-E60 WeakPolarHBondContact CE-OE2 3.5Å; K58-E60 IonicContact NZ-OE2 2.71Å; K58-E60 PolarHBondContact NZ-OE2 3.1Å; E60-G62 PolarHBondContact O-N 3.06Å; E60-G62 VanDerWaalsContact O-N 3.13Å; E60-I63 PolarHBondContact N-O 2.89Å; E60-I63 WeakPolarHBondContact O-CB 3.32Å; E60-I63 PolarHBondContact O-N 3.43Å
61S93.2Very high91.1Very high122 Ų12270.3 Ų70.385%0.85337%0.371SS*.THydrogen-bonded Turntrans50.438.3179.1-54.60000114I63S61-I63 PolarHBondContact O-N 2.99Å
62G93.2Very high89.8Confident27 Ų2772.7 Ų72.728%0.27838%0.377SS..THydrogen-bonded Turntrans75.36.8-178.100000115I26 E60I26-G62 WeakPolarHBondContact CG2-O 3.2Å; I26-G62 PolarHBondContact N-O 3.28Å; E60-G62 PolarHBondContact O-N 3.06Å; E60-G62 VanDerWaalsContact O-N 3.13Å
63I96.6Very high88.3Confident63 Ų6367.9 Ų67.932%0.32336%0.361SS..EExtended strand (participates in β ladder)trans-99.4129.1173-55.6-56.1000109.1V24 P25 I59 E60 S61V24-I63 WeakPolarHBondContact O-CA 3.21Å; P25-I63 HydrophobicContact CB-CD1 4.35Å; P25-I63 HydrophobicContact CG-CD1 4.19Å; I59-I63 WeakPolarHBondContact CA-O 3.23Å; E60-I63 PolarHBondContact N-O 2.89Å; E60-I63 WeakPolarHBondContact O-CB 3.32Å; E60-I63 PolarHBondContact O-N 3.43Å; S61-I63 PolarHBondContact O-N 2.99Å
64V96.8Very high87.1Confident0 Ų074.4 Ų74.40%039%0.392CS..EExtended strand (participates in β ladder)trans-97122.8171.8-177.20000108.4V17 S23 V24 I26 L29 L50 F57 K58 I59V17-V64 WeakPolarHBondContact CG1-O 3.46Å; V17-V64 HydrophobicContact CG2-CG1 4.1Å; S23-V64 VanDerWaalsContact CA-O 3.32Å; S23-V64 WeakPolarHBondContact CA-O 3.44Å; V24-V64 PolarHBondContact N-O 3.08Å; V24-V64 PolarHBondContact O-N 2.87Å; I26-V64 HydrophobicContact CB-CG2 3.86Å; I26-V64 HydrophobicContact CD1-CG2 4.17Å; I26-V64 HydrophobicContact CG1-CG2 4.01Å; L29-V64 HydrophobicContact CD1-CB 3.83Å; L29-V64 HydrophobicContact CD1-CG1 3.96Å; L29-V64 HydrophobicContact CD1-CG2 3.83Å; L50-V64 HydrophobicContact CD1-CG1 4.3Å; L50-V64 HydrophobicContact CD1-CG2 4.15Å; F57-V64 HydrophobicContact CB-CG1 4.2Å; F57-V64 HydrophobicContact CD1-CG1 3.61Å; F57-V64 HydrophobicContact CE1-CG1 4.49Å; F57-V64 HydrophobicContact CG-CG1 4.34Å; K58-V64 CarbonylContact O-C 3.55Å; K58-V64 WeakPolarHBondContact O-CA 3.3Å; I59-V64 HydrophobicContact CG1-CG2 4.4Å
65T97.3Very high85.7Confident49 Ų4976.5 Ų76.530%0.30139%0.388SS..EExtended strand (participates in β ladder)trans-115.8139.8176.8-59.60000110.3N22 S23 K58N22-T65 CarbonylContact O-C 3.51Å; N22-T65 VanDerWaalsContact O-CA 3.23Å; N22-T65 WeakPolarHBondContact O-CA 3.43Å; N22-T65 WeakPolarHBondContact O-CG2 3.26Å; S23-T65 PolarHBondContact OG-OG1 3.35Å; K58-T65 PolarHBondContact N-O 2.88Å; K58-T65 PolarHBondContact O-N 2.98Å
66V94.6Very high84.6Confident4 Ų467.7 Ų67.72%0.02436%0.356CS..EExtended strand (participates in β ladder)trans-123.4145.6173.8-590000110.7V17 W18 N22 F57V17-V66 HydrophobicContact CB-CB 4.45Å; V17-V66 HydrophobicContact CB-CG1 3.83Å; V17-V66 HydrophobicContact CB-CG2 3.77Å; V17-V66 HydrophobicContact CG1-CB 4.32Å; V17-V66 HydrophobicContact CG1-CG1 3.94Å; V17-V66 HydrophobicContact CG1-CG2 3.69Å; V17-V66 HydrophobicContact CG2-CG1 4.21Å; W18-V66 HydrophobicContact CB-CG2 4Å; W18-V66 HydrophobicContact CE3-CG2 4.18Å; N22-V66 PolarHBondContact O-N 2.88Å; F57-V66 HydrophobicContact CD1-CG1 3.58Å; F57-V66 HydrophobicContact CE1-CG1 3.78Å
67G90.1Very high83.4Confident70 Ų7069.1 Ų69.172%0.72237%0.366SS*.SBendtrans-90.7-18-176.600000115.1W18W18-G67 VanDerWaalsContact CZ3-C 3.48Å; W18-G67 VanDerWaalsContact CZ3-O 3.31Å; W18-G67 WeakPolarHBondContact CZ3-O 3.4Å
68R87.1Confident82Confident132 Ų13274.8 Ų74.850%0.49839%0.393SS..SBendtrans-161.6155.9-177.161-177.3174.9-162.1-3.6111.1N14 W18N14-R68 PolarHBondContact ND2-O 3.29Å; N14-R68 PolarHBondContact OD1-O 2.84Å; W18-R68 VanDerWaalsContact CE3-C 3.48Å; W18-R68 VanDerWaalsContact CE3-CA 3.46Å
69I87.8Confident80.4Confident51 Ų5170.7 Ų70.726%0.26238%0.377SS..  trans-68.1152.8164.4-165.2167.2000111N15 W18 D71N15-I69 VanDerWaalsContact OD1-CG1 3.28Å; N15-I69 WeakPolarHBondContact OD1-CG1 3.47Å; W18-I69 HydrophobicContact CD2-CB 4.11Å; W18-I69 HydrophobicContact CG-CB 3.86Å; W18-I69 HydrophobicContact CG-CG1 4.43Å; I69-D71 VanDerWaalsContact CG2-OD1 3.28Å; I69-D71 WeakPolarHBondContact CG2-OD1 3.16Å
70I85Confident78.9Confident8 Ų869.2 Ų69.24%0.04137%0.369CS..  trans-110102.7169.1-57170.1000107.8V11 N14 N15 L56 A76V11-I70 HydrophobicContact CG1-CB 4.42Å; V11-I70 HydrophobicContact CG1-CG2 4.41Å; V11-I70 HydrophobicContact CG2-CD1 4.4Å; V11-I70 HydrophobicContact CG2-CG2 3.99Å; N14-I70 HydrophobicContact CB-CD1 3.81Å; N14-I70 HydrophobicContact CB-CG1 4.4Å; N15-I70 PolarHBondContact ND2-O 2.86Å; N15-I70 PolarHBondContact OD1-N 2.88Å; N15-I70 PolarHBondContact OD1-O 3.49Å; L56-I70 HydrophobicContact CD2-CD1 4.25Å; I70-A76 HydrophobicContact CG2-CB 3.85Å
71D74.7Confident77.6Confident113 Ų11369 Ų6960%0.60437%0.371SS*.  trans-78.3-25.8-170.6-65.6-44.3000114.2I69I69-D71 VanDerWaalsContact CG2-OD1 3.28Å; I69-D71 WeakPolarHBondContact CG2-OD1 3.16Å
72D64.6Low76Confident101 Ų10172.4 Ų72.454%0.5437%0.366SS..  trans-135.7136.1-174.6-82-51.2000112.4E74 R75 A76D72-E74 VanDerWaalsContact C-N 3.33Å; D72-E74 PolarHBondContact O-N 2.9Å; D72-R75 HydrophobicContact CB-CB 3.86Å; D72-R75 CarbonylContact O-C 3.6Å; D72-R75 WeakPolarHBondContact O-CA 3.25Å; D72-R75 WeakPolarHBondContact O-CB 3.43Å; D72-R75 PolarHBondContact O-N 3.5Å; D72-A76 PolarHBondContact O-N 3.48Å
73F61.5Low74.3Confident84 Ų8473.5 Ų73.537%0.36837%0.365SS..Hα-helixtrans-59.4-42174.9177.9-95.2000111.8E4 A7 R75 A76 C77E4-F73 HydrophobicContact CB-CZ 4.36Å; E4-F73 HydrophobicContact CG-CE2 4.33Å; E4-F73 HydrophobicContact CG-CZ 3.78Å; A7-F73 HydrophobicContact CB-CE2 3.81Å; A7-F73 HydrophobicContact CB-CZ 4.22Å; F73-R75 VanDerWaalsContact C-N 3.25Å; F73-R75 PolarHBondContact O-N 3.45Å; F73-A76 WeakPolarHBondContact O-CA 3.28Å; F73-A76 VanDerWaalsContact O-CB 3.25Å; F73-A76 WeakPolarHBondContact O-CB 3.31Å; F73-A76 PolarHBondContact O-N 3.06Å; F73-C77 VanDerWaalsContact CE1-SG 3.6Å; F73-C77 PolarHBondContact O-N 3.35Å
74E63.9Low72.3Confident157 Ų15776.2 Ų76.273%0.73441%0.408SS*.Hα-helixtrans-57.5-42.2172.3-82.9-175.1154.300111.1D72 A76 C77 E78D72-E74 VanDerWaalsContact C-N 3.33Å; D72-E74 PolarHBondContact O-N 2.9Å; E74-A76 VanDerWaalsContact C-N 3.29Å; E74-A76 PolarHBondContact O-N 2.82Å; E74-C77 WeakPolarHBondContact O-CB 3.38Å; E74-C77 PolarHBondContact O-N 2.86Å; E74-E78 WeakPolarHBondContact O-CG 3.45Å; E74-E78 PolarHBondContact O-N 3.04Å
75R60.3Low71Confident147 Ų14780 Ų8056%0.55543%0.428SS*.Hα-helixtrans-69.5-29.2177.4-164.7157.1-173.8174.20.1112.6D72 F73 L79D72-R75 HydrophobicContact CB-CB 3.86Å; D72-R75 CarbonylContact O-C 3.6Å; D72-R75 WeakPolarHBondContact O-CA 3.25Å; D72-R75 WeakPolarHBondContact O-CB 3.43Å; D72-R75 PolarHBondContact O-N 3.5Å; F73-R75 VanDerWaalsContact C-N 3.25Å; F73-R75 PolarHBondContact O-N 3.45Å; R75-L79 HydrophobicContact CG-CD1 4.3Å; R75-L79 WeakPolarHBondContact O-CB 3.27Å; R75-L79 WeakPolarHBondContact O-CD1 3.46Å; R75-L79 VanDerWaalsContact O-CG 3.27Å; R75-L79 WeakPolarHBondContact O-CG 3.2Å; R75-L79 PolarHBondContact O-N 2.84Å
76A62Low69.6Low3 Ų381.6 Ų81.63%0.02544%0.435CS..Hα-helixtrans-65.4-47.9170.100000110.7V11 I70 D72 F73 E74 E78 L79 M80V11-A76 HydrophobicContact CG2-CB 3.12Å; I70-A76 HydrophobicContact CG2-CB 3.85Å; D72-A76 PolarHBondContact O-N 3.48Å; F73-A76 WeakPolarHBondContact O-CA 3.28Å; F73-A76 VanDerWaalsContact O-CB 3.25Å; F73-A76 WeakPolarHBondContact O-CB 3.31Å; F73-A76 PolarHBondContact O-N 3.06Å; E74-A76 VanDerWaalsContact C-N 3.29Å; E74-A76 PolarHBondContact O-N 2.82Å; A76-E78 PolarHBondContact O-N 3.33Å; A76-L79 PolarHBondContact O-N 2.87Å; A76-M80 VanDerWaalsContact O-CB 3.26Å; A76-M80 WeakPolarHBondContact O-CB 3.49Å; A76-M80 WeakPolarHBondContact O-CG 3.5Å; A76-M80 PolarHBondContact O-N 3.15Å
77C63.6Low68.3Low42 Ų4285.9 Ų85.928%0.28446%0.458SS..Hα-helixtrans-57.6-48.3173.7-71.10000111.4F73 E74 L79 M80 D81F73-C77 VanDerWaalsContact CE1-SG 3.6Å; F73-C77 PolarHBondContact O-N 3.35Å; E74-C77 WeakPolarHBondContact O-CB 3.38Å; E74-C77 PolarHBondContact O-N 2.86Å; C77-L79 PolarHBondContact O-N 3.21Å; C77-M80 PolarHBondContact O-N 3.42Å; C77-M80 VanDerWaalsContact O-N 3.15Å; C77-D81 PolarHBondContact O-N 2.84Å
78E65.6Low67Low121 Ų12186.9 Ų86.957%0.56544%0.442SS*.Hα-helixtrans-61.9-43.1176.7-74.4-171.1159.800113E74 A76 M80 R82E74-E78 WeakPolarHBondContact O-CG 3.45Å; E74-E78 PolarHBondContact O-N 3.04Å; A76-E78 PolarHBondContact O-N 3.33Å; E78-M80 PolarHBondContact O-N 3.38Å; E78-R82 WeakPolarHBondContact O-CG 3.43Å; E78-R82 PolarHBondContact O-N 2.94Å
79L61.8Low65.7Low35 Ų3584.1 Ų84.118%0.18344%0.439CS..Hα-helixtrans-61.7-38.7175.5-85.4165.3000110.6R75 A76 C77 R82 L83R75-L79 HydrophobicContact CG-CD1 4.3Å; R75-L79 WeakPolarHBondContact O-CB 3.27Å; R75-L79 WeakPolarHBondContact O-CD1 3.46Å; R75-L79 VanDerWaalsContact O-CG 3.27Å; R75-L79 WeakPolarHBondContact O-CG 3.2Å; R75-L79 PolarHBondContact O-N 2.84Å; A76-L79 PolarHBondContact O-N 2.87Å; C77-L79 PolarHBondContact O-N 3.21Å; L79-R82 PolarHBondContact O-N 3.43Å; L79-L83 WeakPolarHBondContact O-CD1 3.28Å; L79-L83 WeakPolarHBondContact O-CG 3.46Å; L79-L83 PolarHBondContact O-N 3.27Å
80M64.4Low64.3Low10 Ų1086.3 Ų86.35%0.04945%0.451CS..Hα-helixtrans-75.6-35.4-178-75.3-161.5-39.100113.7L2 A7 L10 A76 C77 E78 R82 L83 G84L2-M80 HydrophobicContact CB-CE 3.71Å; L2-M80 HydrophobicContact CB-SD 4.24Å; L2-M80 HydrophobicContact CD1-CB 3.74Å; L2-M80 HydrophobicContact CD1-CE 4.21Å; L2-M80 HydrophobicContact CD1-CG 4.02Å; L2-M80 HydrophobicContact CD1-SD 3.73Å; L2-M80 HydrophobicContact CG-CE 4.46Å; L2-M80 HydrophobicContact CG-SD 4.38Å; A7-M80 HydrophobicContact CB-CE 3.12Å; A7-M80 HydrophobicContact CB-SD 4.22Å; L10-M80 HydrophobicContact CD1-SD 3.57Å; L10-M80 VanDerWaalsContact CD1-SD 3.57Å; A76-M80 VanDerWaalsContact O-CB 3.26Å; A76-M80 WeakPolarHBondContact O-CB 3.49Å; A76-M80 WeakPolarHBondContact O-CG 3.5Å; A76-M80 PolarHBondContact O-N 3.15Å; C77-M80 PolarHBondContact O-N 3.42Å; C77-M80 VanDerWaalsContact O-N 3.15Å; E78-M80 PolarHBondContact O-N 3.38Å; M80-R82 PolarHBondContact O-N 3.35Å; M80-L83 WeakPolarHBondContact O-CA 3.19Å; M80-L83 PolarHBondContact O-N 3.36Å; M80-G84 PolarHBondContact O-N 3.07Å; M80-G84 VanDerWaalsContact O-N 3.07Å
81D64.9Low62.8Low110 Ų11091.9 Ų91.959%0.58848%0.48SS*.Hα-helixtrans-62.4-26.1171.2-87.7-7.2000111.9C77C77-D81 PolarHBondContact O-N 2.84Å
82R59.6Low61.9Low194 Ų19490.2 Ų90.273%0.73247%0.471SS*.THydrogen-bonded Turntrans-84-8.4172.2-65.5179.2179.6-171.62.6114.1R55 E78 L79 M80R55-R82 PolarHBondContact NH1-O 3.28Å; E78-R82 WeakPolarHBondContact O-CG 3.43Å; E78-R82 PolarHBondContact O-N 2.94Å; L79-R82 PolarHBondContact O-N 3.43Å; M80-R82 PolarHBondContact O-N 3.35Å
83L58.9Low61.6Low49 Ų4989.3 Ų89.326%0.25747%0.465SS..THydrogen-bonded Turntrans-103-20.3-179.7-70169000113.2R55 L56 L79 M80R55-L83 HydrophobicContact CB-CD2 3.52Å; R55-L83 HydrophobicContact CG-CD2 3.49Å; R55-L83 VanDerWaalsContact CG-CD2 3.49Å; L56-L83 HydrophobicContact CD1-CD1 4.24Å; L56-L83 HydrophobicContact CD2-CD1 4.5Å; L56-L83 HydrophobicContact CG-CD1 4.15Å; L79-L83 WeakPolarHBondContact O-CD1 3.28Å; L79-L83 WeakPolarHBondContact O-CG 3.46Å; L79-L83 PolarHBondContact O-N 3.27Å; M80-L83 WeakPolarHBondContact O-CA 3.19Å; M80-L83 PolarHBondContact O-N 3.36Å
84G53.2Low61.6Low120 Ų12089.8 Ų89.8100%1.23747%0.474SS*.  trans-74.1016900000112.2M80M80-G84 PolarHBondContact O-N 3.07Å; M80-G84 VanDerWaalsContact O-N 3.07Å

Retrieved 84 of 84 residues in 266.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).