A0A096N3H7_PAPAN Loading...

Dolichyl-diphosphooligosaccharide--protein glycosyltransferase subunit KCP2

Subunit of STT3A-containing oligosaccharyl transferase (OST-A) complex that catalyzes the initial transfer of a defined glycan (Glc(3)Man(9)GlcNAc(2) in eukaryotes) from the lipid carrier dolichol-pyrophosphate to an asparagine residue within an Asn-X-Ser/Thr consensus motif in nascent polypeptide chains, the first step in protein N-glycosylation. N-glycosylation occurs cotranslationally and the complex associates with the Sec61 complex at the channel-forming translocon complex that mediates protein translocation across the endoplasmic reticulum (ER). Within the OST-A complex, acts as an adapter that anchors the OST-A complex to the Sec61 complex. May be involved in N-glycosylation of APP (amyloid-beta precursor protein). Can modulate gamma-secretase cleavage of APP by enhancing endoprotelysis of PSEN1.

AlphaFold DB (Q8N6L1), UniProt , Accession A0A096N3H7, Species PAPAN (Papio anubis, Olive baboon), Gene n/a, Length 136 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
1M46Very low82.3Confident226 Ų22678.1 Ų78.1100%1.11348%0.484SS*.  0120.7059.2-169.8-172.700108.2
2V71.4Confident83.1Confident147 Ų14772.7 Ų72.789%0.89145%0.452SS*.PPolyproline II helixtrans-87.2119.5169.3162.80000106.6
3V77.2Confident83.9Confident62 Ų6270.3 Ų70.338%0.37644%0.439SS..PPolyproline II helixtrans-70.5132.9174.4-176.80000107.2T7 S8 L11V3-T7 WeakPolarHBondContact CG1-OG1 3.09Å; V3-S8 WeakPolarHBondContact CG1-OG 3.46Å; V3-S8 PolarHBondContact O-OG 3.17Å; V3-L11 HydrophobicContact CG1-CD1 4.36Å
4G84.2Confident84.7Confident41 Ų4172.1 Ų72.142%0.42344%0.444SS..PPolyproline II helixtrans-58.4157.6177.600000112.1G6 T7 S8G4-G6 VanDerWaalsContact C-N 3.3Å; G4-G6 PolarHBondContact O-N 2.77Å; G4-T7 PolarHBondContact N-OG1 2.87Å; G4-T7 PolarHBondContact O-N 3.13Å; G4-T7 PolarHBondContact O-OG1 2.9Å; G4-S8 WeakPolarHBondContact O-CB 3.17Å; G4-S8 PolarHBondContact O-N 2.75Å; G4-S8 PolarHBondContact O-OG 3.08Å
5T84.4Confident85.3Confident46 Ų4672 Ų7228%0.28244%0.439SS..Hα-helixtrans-58-42.2-179.3-51.70000112S8 L9 N57 N60T5-S8 PolarHBondContact O-N 3.14Å; T5-L9 WeakPolarHBondContact O-CB 3.31Å; T5-L9 PolarHBondContact O-N 2.91Å; T5-N57 HydrophobicContact CG2-CB 4.04Å; T5-N57 WeakPolarHBondContact CG2-O 3.26Å; T5-N60 HydrophobicContact CG2-CB 4.29Å; T5-N60 WeakPolarHBondContact CG2-ND2 3.45Å
6G86.9Confident85.9Confident41 Ų4168.5 Ų68.542%0.42342%0.418SS..Hα-helixtrans-65.7-41.6179.300000113.5G4 L9 A10G4-G6 VanDerWaalsContact C-N 3.3Å; G4-G6 PolarHBondContact O-N 2.77Å; G6-L9 PolarHBondContact O-N 3.5Å; G6-A10 PolarHBondContact O-N 2.92Å; G6-A10 VanDerWaalsContact O-N 3.09Å
7T89.8Confident86.4Confident78 Ų7871.6 Ų71.648%0.47943%0.431SS..Hα-helixtrans-71.1-37175.840.80000111.8V3 G4 L9 A10 L11V3-T7 WeakPolarHBondContact CG1-OG1 3.09Å; G4-T7 PolarHBondContact N-OG1 2.87Å; G4-T7 PolarHBondContact O-N 3.13Å; G4-T7 PolarHBondContact O-OG1 2.9Å; T7-L9 VanDerWaalsContact C-N 3.33Å; T7-L9 PolarHBondContact O-N 2.66Å; T7-A10 PolarHBondContact O-N 2.76Å; T7-L11 WeakPolarHBondContact O-CB 3.21Å; T7-L11 VanDerWaalsContact O-CG 3.3Å; T7-L11 WeakPolarHBondContact O-CG 3.11Å; T7-L11 PolarHBondContact O-N 3.39Å
8S89.4Confident86.9Confident28 Ų2873.6 Ų73.620%0.19644%0.438CS..Hα-helixtrans-63-39.2173.9-57.90000111.9V3 G4 T5 S12 N57V3-S8 WeakPolarHBondContact CG1-OG 3.46Å; V3-S8 PolarHBondContact O-OG 3.17Å; G4-S8 WeakPolarHBondContact O-CB 3.17Å; G4-S8 PolarHBondContact O-N 2.75Å; G4-S8 PolarHBondContact O-OG 3.08Å; T5-S8 PolarHBondContact O-N 3.14Å; S8-S12 VanDerWaalsContact O-CB 3.26Å; S8-S12 WeakPolarHBondContact O-CB 3.33Å; S8-S12 PolarHBondContact O-N 3.28Å; S8-S12 PolarHBondContact O-OG 2.73Å; S8-N57 WeakPolarHBondContact CB-ND2 3.05Å
9L90.3Very high87.3Confident39 Ų3972.2 Ų72.220%0.20443%0.428CS..Hα-helixtrans-61-51.8173.3179.4145.7000111.1T5 G6 T7 L11 S12 S13 N57 L58T5-L9 WeakPolarHBondContact O-CB 3.31Å; T5-L9 PolarHBondContact O-N 2.91Å; G6-L9 PolarHBondContact O-N 3.5Å; T7-L9 VanDerWaalsContact C-N 3.33Å; T7-L9 PolarHBondContact O-N 2.66Å; L9-L11 VanDerWaalsContact C-N 3.34Å; L9-L11 PolarHBondContact O-N 3.38Å; L9-S12 PolarHBondContact O-N 3.36Å; L9-S13 WeakPolarHBondContact O-CB 3.42Å; L9-S13 PolarHBondContact O-N 2.91Å; L9-S13 PolarHBondContact O-OG 2.93Å; L9-N57 HydrophobicContact CB-CB 3.95Å; L9-N57 HydrophobicContact CD1-CB 4.39Å; L9-L58 VanDerWaalsContact CD1-CA 3.47Å; L9-L58 HydrophobicContact CD1-CB 3.66Å; L9-L58 HydrophobicContact CD1-CD1 3.83Å; L9-L58 HydrophobicContact CD1-CG 4.38Å
10A92.5Very high87.7Confident50 Ų5072.4 Ų72.441%0.41342%0.424SS..Hα-helixtrans-61.6-41.6-178.900000112.3G6 T7 S13 L14G6-A10 PolarHBondContact O-N 2.92Å; G6-A10 VanDerWaalsContact O-N 3.09Å; T7-A10 PolarHBondContact O-N 2.76Å; A10-S13 PolarHBondContact O-OG 3.19Å; A10-S13 VanDerWaalsContact O-OG 3.06Å; A10-L14 WeakPolarHBondContact O-CB 3.38Å; A10-L14 PolarHBondContact O-N 2.84Å
11L93Very high88.1Confident101 Ų10171.6 Ų71.653%0.52943%0.425SS..Hα-helixtrans-67.3-44.3177.1-70.9174.4000111.8V3 T7 L9 L14 L15V3-L11 HydrophobicContact CG1-CD1 4.36Å; T7-L11 WeakPolarHBondContact O-CB 3.21Å; T7-L11 VanDerWaalsContact O-CG 3.3Å; T7-L11 WeakPolarHBondContact O-CG 3.11Å; T7-L11 PolarHBondContact O-N 3.39Å; L9-L11 VanDerWaalsContact C-N 3.34Å; L9-L11 PolarHBondContact O-N 3.38Å; L11-L14 PolarHBondContact O-N 3.31Å; L11-L15 WeakPolarHBondContact O-CB 3.37Å; L11-L15 PolarHBondContact O-N 3.49Å
12S92.8Very high90.4Very high13 Ų1362 Ų629%0.09139%0.385CS..Hα-helixtrans-67.4-40.5-179-55.50000111.8S8 L9 S16 T53S8-S12 VanDerWaalsContact O-CB 3.26Å; S8-S12 WeakPolarHBondContact O-CB 3.33Å; S8-S12 PolarHBondContact O-N 3.28Å; S8-S12 PolarHBondContact O-OG 2.73Å; L9-S12 PolarHBondContact O-N 3.36Å; S12-S16 WeakPolarHBondContact O-CB 3.36Å; S12-S16 PolarHBondContact O-N 3.19Å; S12-T53 VanDerWaalsContact OG-CG2 3.31Å; S12-T53 WeakPolarHBondContact OG-CG2 3.27Å
13S93.3Very high91.4Very high42 Ų4255.1 Ų55.129%0.29434%0.343SS..Hα-helixtrans-67.1-42.8176.563.60000111.7L9 A10 S16 L17L9-S13 WeakPolarHBondContact O-CB 3.42Å; L9-S13 PolarHBondContact O-N 2.91Å; L9-S13 PolarHBondContact O-OG 2.93Å; A10-S13 PolarHBondContact O-OG 3.19Å; A10-S13 VanDerWaalsContact O-OG 3.06Å; S13-S16 PolarHBondContact O-N 2.83Å; S13-L17 WeakPolarHBondContact O-CG 3.27Å; S13-L17 PolarHBondContact O-N 3.36Å
14L94.9Very high92.2Very high95 Ų9554.6 Ų54.650%0.49734%0.336SS..Hα-helixtrans-63.8-43.2176.5-171.7124000111.8A10 L11 S16 L17 L18A10-L14 WeakPolarHBondContact O-CB 3.38Å; A10-L14 PolarHBondContact O-N 2.84Å; L11-L14 PolarHBondContact O-N 3.31Å; L14-S16 VanDerWaalsContact C-N 3.35Å; L14-S16 PolarHBondContact O-N 3.41Å; L14-L17 PolarHBondContact O-N 2.95Å; L14-L18 HydrophobicContact CD2-CD1 3.63Å; L14-L18 HydrophobicContact CD2-CG 4.46Å; L14-L18 HydrophobicContact CG-CD1 4.22Å; L14-L18 WeakPolarHBondContact O-CB 3.22Å; L14-L18 VanDerWaalsContact O-CG 3.32Å; L14-L18 WeakPolarHBondContact O-CG 3.29Å; L14-L18 PolarHBondContact O-N 3.35Å
15L94.1Very high92.7Very high71 Ų7158.6 Ų58.637%0.37235%0.345SS..Hα-helixtrans-62.2-42.4174.5-11464.9000112L11 L18 L19 F50L11-L15 WeakPolarHBondContact O-CB 3.37Å; L11-L15 PolarHBondContact O-N 3.49Å; L15-L18 PolarHBondContact O-N 3.41Å; L15-L19 VanDerWaalsContact O-CB 3.31Å; L15-L19 WeakPolarHBondContact O-CB 3.35Å; L15-L19 WeakPolarHBondContact O-CG 3.5Å; L15-L19 PolarHBondContact O-N 2.85Å; L15-F50 HydrophobicContact CB-CD1 4.48Å; L15-F50 HydrophobicContact CB-CG 4.33Å; L15-F50 HydrophobicContact CD2-CD1 4.07Å; L15-F50 HydrophobicContact CD2-CE1 3.66Å; L15-F50 HydrophobicContact CD2-CE2 4.15Å; L15-F50 HydrophobicContact CD2-CZ 3.7Å
16S94.6Very high93.1Very high16 Ų1662.4 Ų62.411%0.11236%0.355CS..Hα-helixtrans-61.6-43.8176.6-170.80000111.5S12 S13 L14 F20 L47 S51S12-S16 WeakPolarHBondContact O-CB 3.36Å; S12-S16 PolarHBondContact O-N 3.19Å; S13-S16 PolarHBondContact O-N 2.83Å; L14-S16 VanDerWaalsContact C-N 3.35Å; L14-S16 PolarHBondContact O-N 3.41Å; S16-F20 WeakPolarHBondContact O-CB 3.43Å; S16-F20 PolarHBondContact O-N 2.79Å; S16-L47 WeakPolarHBondContact O-CD2 3.13Å; S16-S51 PolarHBondContact OG-OG 3.03Å; S16-S51 VanDerWaalsContact OG-OG 3.09Å
17L94.7Very high93.4Very high122 Ų12262 Ų6264%0.63935%0.346SS*.Hα-helixtrans-65.3-44.4176.8-70.8173000112.3S13 L14 F20 A21S13-L17 WeakPolarHBondContact O-CG 3.27Å; S13-L17 PolarHBondContact O-N 3.36Å; L14-L17 PolarHBondContact O-N 2.95Å; L17-F20 PolarHBondContact O-N 3.04Å; L17-A21 WeakPolarHBondContact O-CB 3.49Å; L17-A21 PolarHBondContact O-N 3.42Å
18L95.7Very high93.4Very high107 Ų10768.4 Ų68.456%0.5636%0.361SS*.Hα-helixtrans-64.7-41.8179-74.7175.7000112.2L14 L15 A21 G22L14-L18 HydrophobicContact CD2-CD1 3.63Å; L14-L18 HydrophobicContact CD2-CG 4.46Å; L14-L18 HydrophobicContact CG-CD1 4.22Å; L14-L18 WeakPolarHBondContact O-CB 3.22Å; L14-L18 VanDerWaalsContact O-CG 3.32Å; L14-L18 WeakPolarHBondContact O-CG 3.29Å; L14-L18 PolarHBondContact O-N 3.35Å; L15-L18 PolarHBondContact O-N 3.41Å; L18-A21 PolarHBondContact O-N 2.92Å; L18-G22 PolarHBondContact O-N 3.5Å
19L94.2Very high93.5Very high46 Ų4671.6 Ų71.624%0.24137%0.373CS..Hα-helixtrans-66.6-39.7176.2-82.2172.8000111.8L15 G22 M23 L43 L47 F50L15-L19 VanDerWaalsContact O-CB 3.31Å; L15-L19 WeakPolarHBondContact O-CB 3.35Å; L15-L19 WeakPolarHBondContact O-CG 3.5Å; L15-L19 PolarHBondContact O-N 2.85Å; L19-G22 PolarHBondContact O-N 2.94Å; L19-M23 WeakPolarHBondContact O-CB 3.21Å; L19-M23 WeakPolarHBondContact O-CG 3.36Å; L19-M23 PolarHBondContact O-N 3.26Å; L19-L43 HydrophobicContact CD2-CD2 4.24Å; L19-L47 HydrophobicContact CB-CD2 3.31Å; L19-L47 HydrophobicContact CB-CG 4.14Å; L19-L47 HydrophobicContact CD1-CD2 4.27Å; L19-L47 HydrophobicContact CG-CD2 4.45Å; L19-F50 HydrophobicContact CD1-CD2 3.34Å; L19-F50 HydrophobicContact CD1-CE2 3.42Å; L19-F50 VanDerWaalsContact CD1-CE2 3.42Å
20F95.4Very high93.3Very high77 Ų7770.2 Ų70.234%0.33837%0.366SS..Hα-helixtrans-61.7-53175.1177.5-101000109.8S16 L17 G22 M23 Q24 L47 A85S16-F20 WeakPolarHBondContact O-CB 3.43Å; S16-F20 PolarHBondContact O-N 2.79Å; L17-F20 PolarHBondContact O-N 3.04Å; F20-G22 VanDerWaalsContact C-N 3.31Å; F20-G22 PolarHBondContact O-N 3.27Å; F20-M23 PolarHBondContact O-N 2.86Å; F20-Q24 HydrophobicContact CD1-CG 4.45Å; F20-Q24 HydrophobicContact CE1-CG 4.13Å; F20-Q24 HydrophobicContact CE2-CG 4.19Å; F20-Q24 HydrophobicContact CZ-CG 3.99Å; F20-Q24 VanDerWaalsContact O-CG 3.28Å; F20-Q24 WeakPolarHBondContact O-CG 3.26Å; F20-Q24 PolarHBondContact O-N 2.89Å; F20-Q24 VanDerWaalsContact O-N 3.07Å; F20-L47 HydrophobicContact CB-CD1 3.86Å; F20-L47 HydrophobicContact CB-CD2 4.3Å; F20-L47 HydrophobicContact CD2-CD1 3.99Å; F20-L47 HydrophobicContact CG-CD1 4.44Å; F20-A85 HydrophobicContact CD2-CB 3.59Å; F20-A85 HydrophobicContact CE2-CB 3.63Å
21A95.8Very high93.3Very high56 Ų5669.7 Ų69.746%0.46336%0.362SS..Hα-helixtrans-57.4-43.8177.800000112.2L17 L18 Q24 M25L17-A21 WeakPolarHBondContact O-CB 3.49Å; L17-A21 PolarHBondContact O-N 3.42Å; L18-A21 PolarHBondContact O-N 2.92Å; A21-Q24 PolarHBondContact O-N 3.46Å; A21-M25 WeakPolarHBondContact O-CB 3.33Å; A21-M25 PolarHBondContact O-N 3.46Å
22G94.1Very high93.2Very high25 Ų2568.7 Ų68.726%0.25836%0.363SS..Hα-helixtrans-61.7-45.5177.800000112.7L18 L19 F20 Q24 M25 Y26L18-G22 PolarHBondContact O-N 3.5Å; L19-G22 PolarHBondContact O-N 2.94Å; F20-G22 VanDerWaalsContact C-N 3.31Å; F20-G22 PolarHBondContact O-N 3.27Å; G22-Q24 VanDerWaalsContact C-N 3.29Å; G22-Q24 PolarHBondContact O-N 3.22Å; G22-M25 PolarHBondContact O-N 3.41Å; G22-Y26 VanDerWaalsContact O-CD2 3.29Å; G22-Y26 WeakPolarHBondContact O-CD2 3.46Å; G22-Y26 PolarHBondContact O-N 3.48Å; G22-Y26 VanDerWaalsContact O-N 3.08Å
23M93.1Very high93.2Very high2 Ų271.3 Ų71.31%0.0138%0.378CS..Hα-helixtrans-59.5-40175.3-78.8-163.4-5100112.5L19 F20 Y26 S27 L43 G44 L47 A85 I89L19-M23 WeakPolarHBondContact O-CB 3.21Å; L19-M23 WeakPolarHBondContact O-CG 3.36Å; L19-M23 PolarHBondContact O-N 3.26Å; F20-M23 PolarHBondContact O-N 2.86Å; M23-Y26 CarbonylContact O-C 3.59Å; M23-S27 WeakPolarHBondContact O-CA 3.29Å; M23-S27 PolarHBondContact O-N 3.41Å; M23-L43 HydrophobicContact CG-CB 3.87Å; M23-L43 HydrophobicContact CG-CD1 4.18Å; M23-L43 HydrophobicContact SD-CB 3.58Å; M23-L43 VanDerWaalsContact SD-CB 3.58Å; M23-G44 PolarHBondContact SD-N 3.46Å; M23-L47 HydrophobicContact CE-CD1 3.16Å; M23-L47 HydrophobicContact CE-CG 3.64Å; M23-A85 HydrophobicContact CE-CB 4Å; M23-I89 HydrophobicContact CB-CD1 3.82Å; M23-I89 HydrophobicContact CG-CD1 4.18Å; M23-I89 HydrophobicContact SD-CD1 4.01Å
24Q93.9Very high93.1Very high50 Ų5077.2 Ų77.223%0.23440%0.401CS..Hα-helixtrans-74.2-40.1-179.3-58.5-58.953.200112.9F20 A21 G22 Y26 S27 L88F20-Q24 HydrophobicContact CD1-CG 4.45Å; F20-Q24 HydrophobicContact CE1-CG 4.13Å; F20-Q24 HydrophobicContact CE2-CG 4.19Å; F20-Q24 HydrophobicContact CZ-CG 3.99Å; F20-Q24 VanDerWaalsContact O-CG 3.28Å; F20-Q24 WeakPolarHBondContact O-CG 3.26Å; F20-Q24 PolarHBondContact O-N 2.89Å; F20-Q24 VanDerWaalsContact O-N 3.07Å; A21-Q24 PolarHBondContact O-N 3.46Å; G22-Q24 VanDerWaalsContact C-N 3.29Å; G22-Q24 PolarHBondContact O-N 3.22Å; Q24-Y26 VanDerWaalsContact C-N 3.29Å; Q24-Y26 PolarHBondContact O-N 3.17Å; Q24-S27 VanDerWaalsContact O-CB 3.27Å; Q24-S27 WeakPolarHBondContact O-CB 3.19Å; Q24-S27 PolarHBondContact O-N 3.23Å; Q24-S27 PolarHBondContact O-OG 2.96Å; Q24-L88 VanDerWaalsContact NE2-CB 3.29Å
25M95.1Very high93.1Very high125 Ų12582.6 Ų82.662%0.61642%0.415SS*.Hα-helixtrans-62.7-38.6177-172.8173.668.700111.7A21 G22A21-M25 WeakPolarHBondContact O-CB 3.33Å; A21-M25 PolarHBondContact O-N 3.46Å; G22-M25 PolarHBondContact O-N 3.41Å
26Y92.6Very high93Very high126 Ų12681.5 Ų81.549%0.49441%0.41SS..THydrogen-bonded Turntrans-98.117.5178.4-63.7-65.7000113.6G22 M23 Q24 R28 Q29 L30G22-Y26 VanDerWaalsContact O-CD2 3.29Å; G22-Y26 WeakPolarHBondContact O-CD2 3.46Å; G22-Y26 PolarHBondContact O-N 3.48Å; G22-Y26 VanDerWaalsContact O-N 3.08Å; M23-Y26 CarbonylContact O-C 3.59Å; Q24-Y26 VanDerWaalsContact C-N 3.29Å; Q24-Y26 PolarHBondContact O-N 3.17Å; Y26-R28 VanDerWaalsContact C-N 3.31Å; Y26-R28 PolarHBondContact O-N 3.46Å; Y26-Q29 PolarHBondContact O-N 3.49Å; Y26-Q29 VanDerWaalsContact O-N 3.11Å; Y26-Q29 PolarHBondContact O-OE1 3.31Å; Y26-L30 WeakPolarHBondContact O-CG 3.18Å; Y26-L30 PolarHBondContact O-N 3.3Å
27S91.8Very high93Very high32 Ų3281.2 Ų81.222%0.22441%0.407CS..Hα-helixtrans-56.3-42.7-175.553.50000112.9M23 Q24 Q29 L30 A31M23-S27 WeakPolarHBondContact O-CA 3.29Å; M23-S27 PolarHBondContact O-N 3.41Å; Q24-S27 VanDerWaalsContact O-CB 3.27Å; Q24-S27 WeakPolarHBondContact O-CB 3.19Å; Q24-S27 PolarHBondContact O-N 3.23Å; Q24-S27 PolarHBondContact O-OG 2.96Å; S27-Q29 PolarHBondContact O-N 2.82Å; S27-L30 PolarHBondContact O-N 3.28Å; S27-A31 WeakPolarHBondContact O-CB 3.11Å; S27-A31 PolarHBondContact O-N 2.78Å
28R91Very high93Very high213 Ų21378.5 Ų78.580%0.80439%0.393SS*.Hα-helixtrans-63-42.7177.4-68-66.2-172.6-179-0.1112.1Y26 A31 S32Y26-R28 VanDerWaalsContact C-N 3.31Å; Y26-R28 PolarHBondContact O-N 3.46Å; R28-A31 PolarHBondContact O-N 2.91Å; R28-S32 PolarHBondContact O-N 2.83Å
29Q90.6Very high92.9Very high95 Ų9578.1 Ų78.144%0.44439%0.388SS..Hα-helixtrans-66.5-45.5176.7-6689.9-34.700110.3Y26 S27 A31 S32 L36Y26-Q29 PolarHBondContact O-N 3.49Å; Y26-Q29 VanDerWaalsContact O-N 3.11Å; Y26-Q29 PolarHBondContact O-OE1 3.31Å; S27-Q29 PolarHBondContact O-N 2.82Å; Q29-A31 PolarHBondContact O-N 3.35Å; Q29-S32 WeakPolarHBondContact O-CB 3.08Å; Q29-S32 PolarHBondContact O-N 2.78Å; Q29-S32 PolarHBondContact O-OG 2.86Å; Q29-L36 WeakPolarHBondContact O-CD1 3.35Å
30L86.4Confident93Very high11 Ų1176 Ų766%0.05838%0.377CS..Hα-helixtrans-61.6-32.5179.2-71.4174.4000112.7Y26 S27 S32 L36 T37 L43 I89Y26-L30 WeakPolarHBondContact O-CG 3.18Å; Y26-L30 PolarHBondContact O-N 3.3Å; S27-L30 PolarHBondContact O-N 3.28Å; L30-S32 VanDerWaalsContact C-N 3.34Å; L30-L36 CarbonylContact O-C 3.56Å; L30-L36 VanDerWaalsContact O-CB 3.31Å; L30-L36 WeakPolarHBondContact O-CB 3.38Å; L30-T37 WeakPolarHBondContact O-CG2 3.15Å; L30-T37 PolarHBondContact O-N 2.84Å; L30-T37 VanDerWaalsContact O-N 3.12Å; L30-L43 HydrophobicContact CD1-CD1 4.28Å; L30-L43 HydrophobicContact CD2-CD1 4.39Å; L30-I89 HydrophobicContact CB-CG2 3.62Å; L30-I89 HydrophobicContact CD1-CD1 3.93Å; L30-I89 HydrophobicContact CD1-CG2 4.44Å
31A91.4Very high93Very high39 Ų3972.3 Ų72.332%0.32236%0.36SS..THydrogen-bonded Turntrans-83.7-2.7177.300000114.6S27 R28 Q29 H90S27-A31 WeakPolarHBondContact O-CB 3.11Å; S27-A31 PolarHBondContact O-N 2.78Å; R28-A31 PolarHBondContact O-N 2.91Å; Q29-A31 PolarHBondContact O-N 3.35Å; A31-H90 HydrophobicContact CB-CB 4.3Å
32S92.2Very high93Very high79 Ų7974 Ų7455%0.55236%0.362SS*.SBendtrans-78.9-29.2-170.866.90000114.5R28 Q29 L30R28-S32 PolarHBondContact O-N 2.83Å; Q29-S32 WeakPolarHBondContact O-CB 3.08Å; Q29-S32 PolarHBondContact O-N 2.78Å; Q29-S32 PolarHBondContact O-OG 2.86Å; L30-S32 VanDerWaalsContact C-N 3.34Å
33T92.9Very high93.1Very high68 Ų6875.5 Ų75.542%0.41736%0.363SS..SBendtrans-139154.3-178.161.60000110.4W35 L36 T37T33-W35 VanDerWaalsContact C-N 3.32Å; T33-W35 PolarHBondContact O-N 3.33Å; T33-L36 PolarHBondContact O-N 3.19Å; T33-L36 VanDerWaalsContact O-N 3.15Å; T33-L36 WeakPolarHBondContact OG1-CB 2.92Å; T33-L36 WeakPolarHBondContact OG1-CD1 3.2Å; T33-L36 WeakPolarHBondContact OG1-CG 3.23Å; T33-L36 PolarHBondContact OG1-N 3.34Å; T33-T37 PolarHBondContact O-N 3.35Å; T33-T37 VanDerWaalsContact O-N 3.07Å
34E91.3Very high93.2Very high166 Ų16675.4 Ų75.478%0.77636%0.363SS*.Hα-helixtrans-58.2-44.9-179.7-59.5-176.7129.900111.7L36 T37 I38E34-L36 VanDerWaalsContact C-N 3.31Å; E34-L36 PolarHBondContact O-N 3Å; E34-T37 PolarHBondContact O-N 3.44Å; E34-T37 VanDerWaalsContact O-N 3.1Å; E34-T37 PolarHBondContact O-OG1 3.3Å; E34-I38 PolarHBondContact O-N 3.46Å; E34-I38 VanDerWaalsContact O-N 3.15Å
35W93.4Very high93.4Very high209 Ų20973.6 Ų73.679%0.79236%0.355SS*.Hα-helixtrans-56.5-43.1176-88.3108.5000112.9T33 T37 I38 Q39T33-W35 VanDerWaalsContact C-N 3.32Å; T33-W35 PolarHBondContact O-N 3.33Å; W35-T37 VanDerWaalsContact C-N 3.32Å; W35-T37 PolarHBondContact O-N 3.35Å; W35-I38 PolarHBondContact O-N 2.81Å; W35-Q39 PolarHBondContact O-N 2.89Å
36L93.6Very high93.4Very high48 Ų4868.5 Ų68.525%0.25134%0.335SS..Hα-helixtrans-71.5-27.4179.4-70.7177000112.6Q29 L30 T33 E34 Q39 G40Q29-L36 WeakPolarHBondContact O-CD1 3.35Å; L30-L36 CarbonylContact O-C 3.56Å; L30-L36 VanDerWaalsContact O-CB 3.31Å; L30-L36 WeakPolarHBondContact O-CB 3.38Å; T33-L36 PolarHBondContact O-N 3.19Å; T33-L36 VanDerWaalsContact O-N 3.15Å; T33-L36 WeakPolarHBondContact OG1-CB 2.92Å; T33-L36 WeakPolarHBondContact OG1-CD1 3.2Å; T33-L36 WeakPolarHBondContact OG1-CG 3.23Å; T33-L36 PolarHBondContact OG1-N 3.34Å; E34-L36 VanDerWaalsContact C-N 3.31Å; E34-L36 PolarHBondContact O-N 3Å; L36-Q39 PolarHBondContact O-N 3.02Å; L36-G40 PolarHBondContact O-N 2.95Å
37T94.1Very high93.6Very high9 Ų962.7 Ų62.76%0.05531%0.312CS..Hα-helixtrans-69.4-35.6172.364.80000112.2L30 T33 E34 W35 G40 G41 H90 C93L30-T37 WeakPolarHBondContact O-CG2 3.15Å; L30-T37 PolarHBondContact O-N 2.84Å; L30-T37 VanDerWaalsContact O-N 3.12Å; T33-T37 PolarHBondContact O-N 3.35Å; T33-T37 VanDerWaalsContact O-N 3.07Å; E34-T37 PolarHBondContact O-N 3.44Å; E34-T37 VanDerWaalsContact O-N 3.1Å; E34-T37 PolarHBondContact O-OG1 3.3Å; W35-T37 VanDerWaalsContact C-N 3.32Å; W35-T37 PolarHBondContact O-N 3.35Å; T37-G40 PolarHBondContact O-N 2.88Å; T37-G41 PolarHBondContact O-N 3.05Å; T37-H90 HydrophobicContact CG2-CB 4.3Å; T37-C93 PolarHBondContact O-SG 3.1Å
38I94.9Very high93.8Very high66 Ų6661.1 Ų61.134%0.33830%0.302SS..Hα-helixtrans-65.8-44.1172.6-60.9169.7000110E34 W35 G40 G41 L42 T96 F100E34-I38 PolarHBondContact O-N 3.46Å; E34-I38 VanDerWaalsContact O-N 3.15Å; W35-I38 PolarHBondContact O-N 2.81Å; I38-G40 VanDerWaalsContact C-N 3.3Å; I38-G40 PolarHBondContact O-N 2.86Å; I38-G41 PolarHBondContact O-N 3.03Å; I38-G41 VanDerWaalsContact O-N 3.17Å; I38-L42 PolarHBondContact O-N 3.42Å; I38-T96 HydrophobicContact CG1-CG2 4.23Å; I38-F100 HydrophobicContact CG2-CE2 4.01Å; I38-F100 HydrophobicContact CG2-CZ 4.19Å
39Q94Very high94Very high99 Ų9953.2 Ų53.246%0.46328%0.277SS..Hα-helixtrans-61.7-38.8174.7-174.8178.3-3000111.7W35 L36 G41 L42 L43W35-Q39 PolarHBondContact O-N 2.89Å; L36-Q39 PolarHBondContact O-N 3.02Å; Q39-G41 VanDerWaalsContact C-N 3.32Å; Q39-G41 PolarHBondContact O-N 3.3Å; Q39-L42 WeakPolarHBondContact O-CB 3.43Å; Q39-L42 PolarHBondContact O-N 2.87Å; Q39-L43 WeakPolarHBondContact O-CG 3.43Å; Q39-L43 PolarHBondContact O-N 2.79Å
40G95Very high94.2Very high0 Ų051.7 Ų51.70%027%0.269CS..Hα-helixtrans-59.5-42.6173.100000112L36 T37 I38 L43 G44L36-G40 PolarHBondContact O-N 2.95Å; T37-G40 PolarHBondContact O-N 2.88Å; I38-G40 VanDerWaalsContact C-N 3.3Å; I38-G40 PolarHBondContact O-N 2.86Å; G40-L43 PolarHBondContact O-N 3.39Å; G40-G44 PolarHBondContact O-N 3.29Å
41G95.8Very high94.5Very high0 Ų051.4 Ų51.40%027%0.268CS..Hα-helixtrans-62.5-40.5172.100000113.6T37 I38 Q39 G44 S45 T96 C97T37-G41 PolarHBondContact O-N 3.05Å; I38-G41 PolarHBondContact O-N 3.03Å; I38-G41 VanDerWaalsContact O-N 3.17Å; Q39-G41 VanDerWaalsContact C-N 3.32Å; Q39-G41 PolarHBondContact O-N 3.3Å; G41-G44 PolarHBondContact O-N 3.36Å; G41-S45 PolarHBondContact O-N 3.05Å; G41-T96 WeakPolarHBondContact CA-OG1 3.29Å; G41-C97 WeakPolarHBondContact O-CA 3.41Å
42L96Very high94.6Very high93 Ų9350.5 Ų50.549%0.48726%0.257SS..Hα-helixtrans-62.4-44.6174.8-179.564.8000111.4I38 Q39 G44 S45 G46 F100I38-L42 PolarHBondContact O-N 3.42Å; Q39-L42 WeakPolarHBondContact O-CB 3.43Å; Q39-L42 PolarHBondContact O-N 2.87Å; L42-G44 VanDerWaalsContact C-N 3.31Å; L42-G44 PolarHBondContact O-N 3.08Å; L42-S45 PolarHBondContact O-N 3.27Å; L42-S45 PolarHBondContact O-OG 2.99Å; L42-G46 PolarHBondContact O-N 2.95Å; L42-F100 HydrophobicContact CB-CD2 4.29Å; L42-F100 HydrophobicContact CB-CE2 4.28Å; L42-F100 HydrophobicContact CD1-CD1 4.31Å; L42-F100 HydrophobicContact CD1-CG 4.3Å
43L95.5Very high94.5Very high55 Ų5549.1 Ų49.129%0.28825%0.246SC..Hα-helixtrans-61.5-40.4174.5-68.3173.6000111.5L19 M23 L30 Q39 G40 S45 G46 L47L19-L43 HydrophobicContact CD2-CD2 4.24Å; M23-L43 HydrophobicContact CG-CB 3.87Å; M23-L43 HydrophobicContact CG-CD1 4.18Å; M23-L43 HydrophobicContact SD-CB 3.58Å; M23-L43 VanDerWaalsContact SD-CB 3.58Å; L30-L43 HydrophobicContact CD1-CD1 4.28Å; L30-L43 HydrophobicContact CD2-CD1 4.39Å; Q39-L43 WeakPolarHBondContact O-CG 3.43Å; Q39-L43 PolarHBondContact O-N 2.79Å; G40-L43 PolarHBondContact O-N 3.39Å; L43-S45 PolarHBondContact O-N 3.38Å; L43-G46 WeakPolarHBondContact O-CA 3.34Å; L43-G46 PolarHBondContact O-N 3.4Å; L43-G46 VanDerWaalsContact O-N 3.1Å; L43-L47 PolarHBondContact O-N 3.34Å
44G96.8Very high94.5Very high0 Ų046.6 Ų46.60%023%0.231CC..Hα-helixtrans-60.8-40.7173.100000113M23 G40 G41 L42 G46 L47 F48 S86M23-G44 PolarHBondContact SD-N 3.46Å; G40-G44 PolarHBondContact O-N 3.29Å; G41-G44 PolarHBondContact O-N 3.36Å; L42-G44 VanDerWaalsContact C-N 3.31Å; L42-G44 PolarHBondContact O-N 3.08Å; G44-G46 VanDerWaalsContact C-N 3.28Å; G44-G46 PolarHBondContact O-N 2.94Å; G44-L47 VanDerWaalsContact O-CB 3.3Å; G44-L47 WeakPolarHBondContact O-CB 3.22Å; G44-L47 PolarHBondContact O-N 3.48Å; G44-L47 VanDerWaalsContact O-N 3.17Å; G44-F48 PolarHBondContact O-N 2.93Å; G44-S86 WeakPolarHBondContact CA-OG 3.32Å
45S96.9Very high94.5Very high12 Ų1241.8 Ų41.88%0.08421%0.208CC..Hα-helixtrans-67.5-31.6173.276.90000112.4G41 L42 L43 F48 V49 F100G41-S45 PolarHBondContact O-N 3.05Å; L42-S45 PolarHBondContact O-N 3.27Å; L42-S45 PolarHBondContact O-OG 2.99Å; L43-S45 PolarHBondContact O-N 3.38Å; S45-F48 WeakPolarHBondContact O-CB 3.43Å; S45-F48 PolarHBondContact O-N 3.24Å; S45-V49 WeakPolarHBondContact O-CG2 3.49Å; S45-V49 PolarHBondContact O-N 3.44Å; S45-F100 VanDerWaalsContact CB-CB 3.47Å; S45-F100 WeakPolarHBondContact OG-CB 3.32Å
46G95.5Very high94.2Very high18 Ų1835 Ų3519%0.18619%0.187CC..Hα-helixtrans-60.5-45.3169.200000111.4L42 L43 G44 F48 V49 F50L42-G46 PolarHBondContact O-N 2.95Å; L43-G46 WeakPolarHBondContact O-CA 3.34Å; L43-G46 PolarHBondContact O-N 3.4Å; L43-G46 VanDerWaalsContact O-N 3.1Å; G44-G46 VanDerWaalsContact C-N 3.28Å; G44-G46 PolarHBondContact O-N 2.94Å; G46-F48 VanDerWaalsContact C-N 3.29Å; G46-F48 PolarHBondContact O-N 2.77Å; G46-V49 PolarHBondContact O-N 2.7Å; G46-F50 WeakPolarHBondContact O-CD2 3.45Å; G46-F50 PolarHBondContact O-N 2.88Å
47L95.8Very high93.9Very high4 Ų433.7 Ų33.72%0.02118%0.181CC..Hα-helixtrans-56.6-43.9172.2-81.4-161.1000112.8S16 L19 F20 M23 L43 G44 V49 F50 S51 A85S16-L47 WeakPolarHBondContact O-CD2 3.13Å; L19-L47 HydrophobicContact CB-CD2 3.31Å; L19-L47 HydrophobicContact CB-CG 4.14Å; L19-L47 HydrophobicContact CD1-CD2 4.27Å; L19-L47 HydrophobicContact CG-CD2 4.45Å; F20-L47 HydrophobicContact CB-CD1 3.86Å; F20-L47 HydrophobicContact CB-CD2 4.3Å; F20-L47 HydrophobicContact CD2-CD1 3.99Å; F20-L47 HydrophobicContact CG-CD1 4.44Å; M23-L47 HydrophobicContact CE-CD1 3.16Å; M23-L47 HydrophobicContact CE-CG 3.64Å; L43-L47 PolarHBondContact O-N 3.34Å; G44-L47 VanDerWaalsContact O-CB 3.3Å; G44-L47 WeakPolarHBondContact O-CB 3.22Å; G44-L47 PolarHBondContact O-N 3.48Å; G44-L47 VanDerWaalsContact O-N 3.17Å; L47-V49 VanDerWaalsContact C-N 3.34Å; L47-V49 PolarHBondContact O-N 2.94Å; L47-F50 PolarHBondContact O-N 3.09Å; L47-S51 WeakPolarHBondContact O-CB 3.34Å; L47-S51 PolarHBondContact O-N 2.68Å; L47-S51 PolarHBondContact O-OG 3.47Å; L47-A85 HydrophobicContact CD1-CB 3.81Å
48F96.3Very high93.7Very high0 Ų036.9 Ų36.90%020%0.197CC..Hα-helixtrans-57.6-47.7177167.7-109.7000111.4G44 S45 G46 S51 L52 I75 C78 L79 A82 L105G44-F48 PolarHBondContact O-N 2.93Å; S45-F48 WeakPolarHBondContact O-CB 3.43Å; S45-F48 PolarHBondContact O-N 3.24Å; G46-F48 VanDerWaalsContact C-N 3.29Å; G46-F48 PolarHBondContact O-N 2.77Å; F48-S51 PolarHBondContact O-N 3.24Å; F48-L52 HydrophobicContact CD1-CD1 4.2Å; F48-L52 HydrophobicContact CD2-CD1 4.17Å; F48-L52 HydrophobicContact CD2-CG 4.27Å; F48-L52 HydrophobicContact CE1-CD1 3.59Å; F48-L52 HydrophobicContact CE2-CD1 3.56Å; F48-L52 HydrophobicContact CE2-CG 3.9Å; F48-L52 HydrophobicContact CG-CD1 4.47Å; F48-L52 HydrophobicContact CZ-CD1 3.25Å; F48-L52 HydrophobicContact CZ-CG 4.12Å; F48-L52 WeakPolarHBondContact O-CB 3.49Å; F48-L52 WeakPolarHBondContact O-CG 3.36Å; F48-L52 PolarHBondContact O-N 2.89Å; F48-I75 HydrophobicContact CE2-CG2 4.16Å; F48-I75 HydrophobicContact CZ-CG2 4.06Å; F48-C78 HydrophobicContact CD2-CB 3.86Å; F48-C78 HydrophobicContact CE2-CB 4.02Å; F48-L79 HydrophobicContact CD2-CB 4.17Å; F48-L79 HydrophobicContact CD2-CD1 4.38Å; F48-L79 HydrophobicContact CE2-CB 3.92Å; F48-L79 HydrophobicContact CE2-CD1 4.38Å; F48-A82 HydrophobicContact CB-CB 3.69Å; F48-L105 HydrophobicContact CE1-CB 4.14Å; F48-L105 HydrophobicContact CZ-CB 4.34Å; F48-L105 HydrophobicContact CZ-CD1 3.99Å
49V94.9Very high93.2Very high46 Ų4635 Ų3528%0.27919%0.187SC..Hα-helixtrans-65-44.6179.9174.20000112.2S45 G46 L47 L52 T53 I108S45-V49 WeakPolarHBondContact O-CG2 3.49Å; S45-V49 PolarHBondContact O-N 3.44Å; G46-V49 PolarHBondContact O-N 2.7Å; L47-V49 VanDerWaalsContact C-N 3.34Å; L47-V49 PolarHBondContact O-N 2.94Å; V49-L52 PolarHBondContact O-N 3.49Å; V49-T53 WeakPolarHBondContact O-CB 3.11Å; V49-T53 PolarHBondContact O-N 3.45Å; V49-T53 PolarHBondContact O-OG1 2.95Å; V49-I108 HydrophobicContact CG1-CD1 4.23Å; V49-I108 HydrophobicContact CG2-CD1 4.08Å
50F94.8Very high92.7Very high64 Ų6432.1 Ų32.128%0.28118%0.175SC..Hα-helixtrans-71-37179.3-65.9-55.7000112.4L15 L19 G46 L47 T53 A54L15-F50 HydrophobicContact CB-CD1 4.48Å; L15-F50 HydrophobicContact CB-CG 4.33Å; L15-F50 HydrophobicContact CD2-CD1 4.07Å; L15-F50 HydrophobicContact CD2-CE1 3.66Å; L15-F50 HydrophobicContact CD2-CE2 4.15Å; L15-F50 HydrophobicContact CD2-CZ 3.7Å; L19-F50 HydrophobicContact CD1-CD2 3.34Å; L19-F50 HydrophobicContact CD1-CE2 3.42Å; L19-F50 VanDerWaalsContact CD1-CE2 3.42Å; G46-F50 WeakPolarHBondContact O-CD2 3.45Å; G46-F50 PolarHBondContact O-N 2.88Å; L47-F50 PolarHBondContact O-N 3.09Å; F50-T53 PolarHBondContact O-N 2.82Å; F50-A54 WeakPolarHBondContact O-CB 3.49Å; F50-A54 PolarHBondContact O-N 2.96Å
51S94.5Very high92.2Very high4 Ų437.3 Ų37.33%0.02820%0.202CC..Hα-helixtrans-60-52.6172.3-62.50000109.8S16 L47 F48 T53 A54 F55S16-S51 PolarHBondContact OG-OG 3.03Å; S16-S51 VanDerWaalsContact OG-OG 3.09Å; L47-S51 WeakPolarHBondContact O-CB 3.34Å; L47-S51 PolarHBondContact O-N 2.68Å; L47-S51 PolarHBondContact O-OG 3.47Å; F48-S51 PolarHBondContact O-N 3.24Å; S51-T53 PolarHBondContact O-N 3.45Å; S51-A54 WeakPolarHBondContact O-CB 3.02Å; S51-A54 PolarHBondContact O-N 3.47Å; S51-F55 VanDerWaalsContact O-CB 3.29Å; S51-F55 WeakPolarHBondContact O-CB 3.35Å; S51-F55 WeakPolarHBondContact O-CD2 3.44Å; S51-F55 PolarHBondContact O-N 3.2Å
52L92.2Very high91.7Very high20 Ų2041.9 Ų41.911%0.10523%0.23CC..Hα-helixtrans-54.1-41.3176-86.9-179.6000112.7F48 V49 N56 E74 I75 C78 I108F48-L52 HydrophobicContact CD1-CD1 4.2Å; F48-L52 HydrophobicContact CD2-CD1 4.17Å; F48-L52 HydrophobicContact CD2-CG 4.27Å; F48-L52 HydrophobicContact CE1-CD1 3.59Å; F48-L52 HydrophobicContact CE2-CD1 3.56Å; F48-L52 HydrophobicContact CE2-CG 3.9Å; F48-L52 HydrophobicContact CG-CD1 4.47Å; F48-L52 HydrophobicContact CZ-CD1 3.25Å; F48-L52 HydrophobicContact CZ-CG 4.12Å; F48-L52 WeakPolarHBondContact O-CB 3.49Å; F48-L52 WeakPolarHBondContact O-CG 3.36Å; F48-L52 PolarHBondContact O-N 2.89Å; V49-L52 PolarHBondContact O-N 3.49Å; L52-N56 WeakPolarHBondContact O-CB 3.33Å; L52-N56 PolarHBondContact O-N 2.88Å; L52-E74 HydrophobicContact CD2-CG 4.4Å; L52-I75 HydrophobicContact CD1-CG1 4.29Å; L52-I75 HydrophobicContact CD2-CB 4.46Å; L52-I75 HydrophobicContact CD2-CG1 3.71Å; L52-C78 HydrophobicContact CD2-CB 3.95Å; L52-C78 HydrophobicContact CG-CB 3.92Å; L52-I108 HydrophobicContact CD1-CD1 4.41Å
53T90.9Very high91.1Very high51 Ų5143.6 Ų43.631%0.31323%0.233SC..Hα-helixtrans-67.1-41.1178.7-54.60000111.3S12 V49 F50 S51 N57S12-T53 VanDerWaalsContact OG-CG2 3.31Å; S12-T53 WeakPolarHBondContact OG-CG2 3.27Å; V49-T53 WeakPolarHBondContact O-CB 3.11Å; V49-T53 PolarHBondContact O-N 3.45Å; V49-T53 PolarHBondContact O-OG1 2.95Å; F50-T53 PolarHBondContact O-N 2.82Å; S51-T53 PolarHBondContact O-N 3.45Å; T53-N57 VanDerWaalsContact O-CB 3.29Å; T53-N57 WeakPolarHBondContact O-CB 3.4Å; T53-N57 PolarHBondContact O-N 3.04Å; T53-N57 PolarHBondContact O-ND2 3.4Å
54A92.2Very high90.2Very high14 Ų1442.3 Ų42.312%0.11623%0.234CC..Hα-helixtrans-64.7-46176.900000111.8F50 S51 N57 L58F50-A54 WeakPolarHBondContact O-CB 3.49Å; F50-A54 PolarHBondContact O-N 2.96Å; S51-A54 WeakPolarHBondContact O-CB 3.02Å; S51-A54 PolarHBondContact O-N 3.47Å; A54-N57 PolarHBondContact O-N 2.91Å; A54-L58 WeakPolarHBondContact O-CB 3.45Å; A54-L58 PolarHBondContact O-N 3.29Å
55F90.7Very high88.7Confident65 Ų6551.8 Ų51.829%0.28528%0.275SS..Hα-helixtrans-64.4-49.9179.9-97.6-64.4000112.1S51 N57 L58 E59 E74 L77 C78S51-F55 VanDerWaalsContact O-CB 3.29Å; S51-F55 WeakPolarHBondContact O-CB 3.35Å; S51-F55 WeakPolarHBondContact O-CD2 3.44Å; S51-F55 PolarHBondContact O-N 3.2Å; F55-N57 VanDerWaalsContact C-N 3.31Å; F55-N57 PolarHBondContact O-N 3.23Å; F55-L58 WeakPolarHBondContact O-CA 3.3Å; F55-L58 WeakPolarHBondContact O-CB 3.44Å; F55-L58 PolarHBondContact O-N 2.84Å; F55-E59 PolarHBondContact O-N 3.49Å; F55-E74 VanDerWaalsContact C-OE1 3.3Å; F55-E74 HydrophobicContact CB-CG 3.96Å; F55-E74 WeakPolarHBondContact CB-OE1 3.39Å; F55-E74 VanDerWaalsContact CD1-OE1 3.27Å; F55-E74 WeakPolarHBondContact CD1-OE1 3.39Å; F55-E74 HydrophobicContact CG-CG 4.5Å; F55-E74 WeakPolarHBondContact CG-OE1 3.2Å; F55-L77 HydrophobicContact CE1-CD2 4.08Å; F55-L77 HydrophobicContact CZ-CD2 4.03Å; F55-C78 WeakPolarHBondContact CD2-SG 3.36Å
56N88.5Confident87Confident66 Ų6654.4 Ų54.435%0.35330%0.303SS..Hα-helixtrans-59.6-39173.2-178.567.2000112.8L52 N60L52-N56 WeakPolarHBondContact O-CB 3.33Å; L52-N56 PolarHBondContact O-N 2.88Å; N56-N60 WeakPolarHBondContact O-CB 3.38Å; N56-N60 PolarHBondContact O-N 3.1Å
57N87.5Confident85.1Confident22 Ų2257.7 Ų57.712%0.11831%0.313CS..Hα-helixtrans-69.4-33.3175-75-34.6000112.5T5 S8 L9 T53 A54 F55 L61T5-N57 HydrophobicContact CG2-CB 4.04Å; T5-N57 WeakPolarHBondContact CG2-O 3.26Å; S8-N57 WeakPolarHBondContact CB-ND2 3.05Å; L9-N57 HydrophobicContact CB-CB 3.95Å; L9-N57 HydrophobicContact CD1-CB 4.39Å; T53-N57 VanDerWaalsContact O-CB 3.29Å; T53-N57 WeakPolarHBondContact O-CB 3.4Å; T53-N57 PolarHBondContact O-N 3.04Å; T53-N57 PolarHBondContact O-ND2 3.4Å; A54-N57 PolarHBondContact O-N 2.91Å; F55-N57 VanDerWaalsContact C-N 3.31Å; F55-N57 PolarHBondContact O-N 3.23Å; N57-L61 WeakPolarHBondContact O-CB 3.42Å; N57-L61 PolarHBondContact O-N 3.3Å
58L87.9Confident83.3Confident76 Ų7663.8 Ų63.840%0.39834%0.341SS..Hα-helixtrans-67.5-47.6176.8-179.272.7000109.9L9 A54 F55 N60 L61 V62L9-L58 VanDerWaalsContact CD1-CA 3.47Å; L9-L58 HydrophobicContact CD1-CB 3.66Å; L9-L58 HydrophobicContact CD1-CD1 3.83Å; L9-L58 HydrophobicContact CD1-CG 4.38Å; A54-L58 WeakPolarHBondContact O-CB 3.45Å; A54-L58 PolarHBondContact O-N 3.29Å; F55-L58 WeakPolarHBondContact O-CA 3.3Å; F55-L58 WeakPolarHBondContact O-CB 3.44Å; F55-L58 PolarHBondContact O-N 2.84Å; L58-N60 VanDerWaalsContact C-N 3.3Å; L58-N60 PolarHBondContact O-N 3.3Å; L58-L61 WeakPolarHBondContact O-CB 3.36Å; L58-L61 PolarHBondContact O-N 3.44Å; L58-L61 VanDerWaalsContact O-N 3.08Å; L58-V62 HydrophobicContact CD1-CG2 4.22Å; L58-V62 HydrophobicContact CG-CG2 4.35Å; L58-V62 WeakPolarHBondContact O-CB 3.31Å; L58-V62 WeakPolarHBondContact O-CG2 3.15Å; L58-V62 PolarHBondContact O-N 2.94Å
59E85.5Confident81.2Confident25 Ų2564.6 Ų64.612%0.11735%0.348CS..Hα-helixtrans-59.5-43175.4-70.3-165.9148.100111.4F55 L61 V62 F63 F67 A69F55-E59 PolarHBondContact O-N 3.49Å; E59-L61 PolarHBondContact O-N 3Å; E59-V62 PolarHBondContact O-N 3.49Å; E59-F63 HydrophobicContact CB-CD2 3.99Å; E59-F63 HydrophobicContact CG-CD2 4.2Å; E59-F63 HydrophobicContact CG-CE2 4.23Å; E59-F63 WeakPolarHBondContact O-CA 3.47Å; E59-F63 WeakPolarHBondContact O-CB 3.26Å; E59-F63 PolarHBondContact O-N 2.69Å; E59-F67 HydrophobicContact CB-CD1 4.34Å; E59-A69 VanDerWaalsContact OE2-CA 3.23Å; E59-A69 WeakPolarHBondContact OE2-CA 3.48Å; E59-A69 WeakPolarHBondContact OE2-CB 3.35Å
60N83.9Confident79.6Confident40 Ų4069.9 Ų69.921%0.21437%0.367CS..Hα-helixtrans-64.4-28.1176.5-171.172.1000113.2T5 N56 L58 G64 K65T5-N60 HydrophobicContact CG2-CB 4.29Å; T5-N60 WeakPolarHBondContact CG2-ND2 3.45Å; N56-N60 WeakPolarHBondContact O-CB 3.38Å; N56-N60 PolarHBondContact O-N 3.1Å; L58-N60 VanDerWaalsContact C-N 3.3Å; L58-N60 PolarHBondContact O-N 3.3Å; N60-G64 CarbonylContact O-C 3.12Å; N60-G64 VanDerWaalsContact O-CA 3.29Å; N60-G64 WeakPolarHBondContact O-CA 3.46Å; N60-G64 PolarHBondContact O-N 3.44Å; N60-G64 PolarHBondContact OD1-O 3.35Å; N60-K65 WeakPolarHBondContact OD1-CA 3.42Å
61L84.4Confident78.1Confident109 Ų10970.4 Ų70.457%0.57137%0.372SS*.Hα-helixtrans-78.8-42.2175.3-169.277.5000112N57 L58 E59N57-L61 WeakPolarHBondContact O-CB 3.42Å; N57-L61 PolarHBondContact O-N 3.3Å; L58-L61 WeakPolarHBondContact O-CB 3.36Å; L58-L61 PolarHBondContact O-N 3.44Å; L58-L61 VanDerWaalsContact O-N 3.08Å; E59-L61 PolarHBondContact O-N 3Å
62V85.1Confident77Confident96 Ų9678.9 Ų78.958%0.58241%0.409SS*.Hα-helixtrans-82.8-45.9-174174.60000111.9L58 E59L58-V62 HydrophobicContact CD1-CG2 4.22Å; L58-V62 HydrophobicContact CG-CG2 4.35Å; L58-V62 WeakPolarHBondContact O-CB 3.31Å; L58-V62 WeakPolarHBondContact O-CG2 3.15Å; L58-V62 PolarHBondContact O-N 2.94Å; E59-V62 PolarHBondContact O-N 3.49Å
63F83Confident76.7Confident128 Ų12881.8 Ų81.856%0.56143%0.429SS*.THydrogen-bonded Turntrans-95.9-8.5-177.4-58.9-69.1000113.4E59 F67E59-F63 HydrophobicContact CB-CD2 3.99Å; E59-F63 HydrophobicContact CG-CD2 4.2Å; E59-F63 HydrophobicContact CG-CE2 4.23Å; E59-F63 WeakPolarHBondContact O-CA 3.47Å; E59-F63 WeakPolarHBondContact O-CB 3.26Å; E59-F63 PolarHBondContact O-N 2.69Å; F63-F67 HydrophobicContact CB-CB 3.69Å; F63-F67 HydrophobicContact CB-CD1 4.23Å; F63-F67 HydrophobicContact CB-CD2 3.94Å; F63-F67 HydrophobicContact CB-CG 3.7Å; F63-F67 HydrophobicContact CD2-CD1 4.07Å; F63-F67 HydrophobicContact CD2-CE1 4.22Å; F63-F67 HydrophobicContact CD2-CG 4.38Å; F63-F67 HydrophobicContact CG-CD1 4.35Å; F63-F67 HydrophobicContact CG-CD2 4.35Å; F63-F67 HydrophobicContact CG-CG 4.21Å
64G76.6Confident76.6Confident29 Ų2980.2 Ų80.230%0.29942%0.418SS..  trans97.7171.4175.900000114.7N60 G66 F67N60-G64 CarbonylContact O-C 3.12Å; N60-G64 VanDerWaalsContact O-CA 3.29Å; N60-G64 WeakPolarHBondContact O-CA 3.46Å; N60-G64 PolarHBondContact O-N 3.44Å; N60-G64 PolarHBondContact OD1-O 3.35Å; G64-G66 PolarHBondContact O-N 3.4Å; G64-F67 PolarHBondContact O-N 2.98Å
65K66.1Low76.5Confident199 Ų19980.8 Ų80.887%0.86542%0.419SS*.THydrogen-bonded Turntrans-63.712.7-163.1-72-178.8175.2175.50117.6N60N60-K65 WeakPolarHBondContact OD1-CA 3.42Å
66G60.8Low76.6Confident66 Ų6682.4 Ų82.468%0.6843%0.43SS*.THydrogen-bonded Turntrans-160.316.6-174.800000113.8G64 Q68G64-G66 PolarHBondContact O-N 3.4Å; G66-Q68 PolarHBondContact O-N 3.4Å
67F56.2Low76.8Confident88 Ų8883.6 Ų83.639%0.38644%0.436SS..  trans-63.9105.8168.1-168.7-105.6000107.4E59 F63 G64 A69E59-F67 HydrophobicContact CB-CD1 4.34Å; F63-F67 HydrophobicContact CB-CB 3.69Å; F63-F67 HydrophobicContact CB-CD1 4.23Å; F63-F67 HydrophobicContact CB-CD2 3.94Å; F63-F67 HydrophobicContact CB-CG 3.7Å; F63-F67 HydrophobicContact CD2-CD1 4.07Å; F63-F67 HydrophobicContact CD2-CE1 4.22Å; F63-F67 HydrophobicContact CD2-CG 4.38Å; F63-F67 HydrophobicContact CG-CD1 4.35Å; F63-F67 HydrophobicContact CG-CD2 4.35Å; F63-F67 HydrophobicContact CG-CG 4.21Å; G64-F67 PolarHBondContact O-N 2.98Å; F67-A69 PolarHBondContact O-N 3.45Å
68Q56.4Low77.2Confident131 Ų13182.6 Ų82.661%0.61243%0.43SS*.  trans-64.489.5164.9-90.5-94.6-54.500105.7G66 K70G66-Q68 PolarHBondContact O-N 3.4Å; Q68-K70 PolarHBondContact O-N 3.38Å
69A52.9Low77.5Confident18 Ų1879.7 Ų79.715%0.14942%0.415CS..  trans-35.9118.2167.200000107.3E59 F67 I71E59-A69 VanDerWaalsContact OE2-CA 3.23Å; E59-A69 WeakPolarHBondContact OE2-CA 3.48Å; E59-A69 WeakPolarHBondContact OE2-CB 3.35Å; F67-A69 PolarHBondContact O-N 3.45Å; A69-I71 VanDerWaalsContact C-N 3.27Å; A69-I71 PolarHBondContact O-N 3Å
70K60.4Low78Confident157 Ų15783.4 Ų83.468%0.68344%0.435SS*.  trans-63.5104.1173.1-77.5-173.6175.4-177.20104.5Q68 F72 P73Q68-K70 PolarHBondContact O-N 3.38Å; K70-F72 PolarHBondContact O-N 2.91Å; K70-P73 HydrophobicContact CB-CG 3.93Å; K70-P73 WeakPolarHBondContact O-CD 3.4Å; K70-P73 WeakPolarHBondContact O-CG 3.29Å
71I65Low78.5Confident74 Ų7485.5 Ų85.538%0.37945%0.446SS..Hα-helixtrans-44.7-34.2-178.5-77-168.8000111A69 I75A69-I71 VanDerWaalsContact C-N 3.27Å; A69-I71 PolarHBondContact O-N 3Å; I71-I75 HydrophobicContact CB-CD1 4Å; I71-I75 HydrophobicContact CG1-CD1 4.45Å; I71-I75 HydrophobicContact CG2-CD1 3.26Å; I71-I75 WeakPolarHBondContact O-CB 3.36Å; I71-I75 WeakPolarHBondContact O-CD1 3.42Å; I71-I75 WeakPolarHBondContact O-CG1 3.18Å; I71-I75 PolarHBondContact O-N 2.95Å
72F70.9Confident79.1Confident182 Ų18280.3 Ų80.380%0.79842%0.419SS*.Hα-helixtrans-64.8-62.9-176-88.6-90.1000116.2K70 L76K70-F72 PolarHBondContact O-N 2.91Å; F72-L76 WeakPolarHBondContact O-CB 3Å; F72-L76 PolarHBondContact O-N 3.06Å
73P85.5Confident79.7Confident81 Ų8177.2 Ų77.253%0.52640%0.399SS..Hα-helixtrans-63.3-43-177.421.2-34.7000113.3K70 L76 L77K70-P73 HydrophobicContact CB-CG 3.93Å; K70-P73 WeakPolarHBondContact O-CD 3.4Å; K70-P73 WeakPolarHBondContact O-CG 3.29Å; P73-L76 PolarHBondContact O-N 3.03Å; P73-L77 WeakPolarHBondContact O-CB 3.5Å; P73-L77 PolarHBondContact O-N 3.5Å
74E88.1Confident80.2Confident19 Ų1977.7 Ų77.79%0.08940%0.401CS..Hα-helixtrans-70.4-44.2-172-164.380.7139.800112.2L52 F55 L76 L77 C78L52-E74 HydrophobicContact CD2-CG 4.4Å; F55-E74 VanDerWaalsContact C-OE1 3.3Å; F55-E74 HydrophobicContact CB-CG 3.96Å; F55-E74 WeakPolarHBondContact CB-OE1 3.39Å; F55-E74 VanDerWaalsContact CD1-OE1 3.27Å; F55-E74 WeakPolarHBondContact CD1-OE1 3.39Å; F55-E74 HydrophobicContact CG-CG 4.5Å; F55-E74 WeakPolarHBondContact CG-OE1 3.2Å; E74-L76 VanDerWaalsContact C-N 3.35Å; E74-L77 PolarHBondContact O-N 3.3Å; E74-C78 WeakPolarHBondContact O-CB 3.41Å; E74-C78 PolarHBondContact O-N 3.46Å; E74-C78 PolarHBondContact O-SG 3.03Å
75I91.7Very high81.1Confident25 Ų2576.3 Ų76.313%0.12839%0.387CS..Hα-helixtrans-64.4-43.5176.6-72.9165000110.7F48 L52 I71 L77 C78 L79 L105F48-I75 HydrophobicContact CE2-CG2 4.16Å; F48-I75 HydrophobicContact CZ-CG2 4.06Å; L52-I75 HydrophobicContact CD1-CG1 4.29Å; L52-I75 HydrophobicContact CD2-CB 4.46Å; L52-I75 HydrophobicContact CD2-CG1 3.71Å; I71-I75 HydrophobicContact CB-CD1 4Å; I71-I75 HydrophobicContact CG1-CD1 4.45Å; I71-I75 HydrophobicContact CG2-CD1 3.26Å; I71-I75 WeakPolarHBondContact O-CB 3.36Å; I71-I75 WeakPolarHBondContact O-CD1 3.42Å; I71-I75 WeakPolarHBondContact O-CG1 3.18Å; I71-I75 PolarHBondContact O-N 2.95Å; I75-L77 VanDerWaalsContact C-N 3.31Å; I75-L77 PolarHBondContact O-N 2.89Å; I75-C78 PolarHBondContact O-N 3.31Å; I75-L79 WeakPolarHBondContact O-CB 3.24Å; I75-L79 PolarHBondContact O-N 2.92Å; I75-L105 HydrophobicContact CB-CD1 4.21Å; I75-L105 HydrophobicContact CD1-CD1 3.54Å; I75-L105 HydrophobicContact CD1-CG 4.39Å; I75-L105 HydrophobicContact CG1-CD1 3.97Å; I75-L105 HydrophobicContact CG2-CD1 3.25Å
76L92.6Very high82.6Confident100 Ų10066.9 Ų66.952%0.52435%0.346SS..Hα-helixtrans-62-44.2179.6-176.661.4000110.5F72 P73 E74 L79 L80F72-L76 WeakPolarHBondContact O-CB 3Å; F72-L76 PolarHBondContact O-N 3.06Å; P73-L76 PolarHBondContact O-N 3.03Å; E74-L76 VanDerWaalsContact C-N 3.35Å; L76-L79 PolarHBondContact O-N 2.94Å; L76-L80 HydrophobicContact CD1-CD1 4.36Å; L76-L80 HydrophobicContact CD1-CG 4.3Å; L76-L80 HydrophobicContact CG-CD1 4.18Å; L76-L80 WeakPolarHBondContact O-CB 3.09Å; L76-L80 VanDerWaalsContact O-CG 3.24Å; L76-L80 WeakPolarHBondContact O-CG 3.33Å; L76-L80 PolarHBondContact O-N 2.96Å
77L92.8Very high84.2Confident91 Ų9165.4 Ų65.448%0.47633%0.331SS..Hα-helixtrans-60.3-50.3176.9-175.668.9000111.7F55 P73 E74 I75 L79 L80 L81F55-L77 HydrophobicContact CE1-CD2 4.08Å; F55-L77 HydrophobicContact CZ-CD2 4.03Å; P73-L77 WeakPolarHBondContact O-CB 3.5Å; P73-L77 PolarHBondContact O-N 3.5Å; E74-L77 PolarHBondContact O-N 3.3Å; I75-L77 VanDerWaalsContact C-N 3.31Å; I75-L77 PolarHBondContact O-N 2.89Å; L77-L79 VanDerWaalsContact C-N 3.33Å; L77-L79 PolarHBondContact O-N 3.35Å; L77-L80 PolarHBondContact O-N 3.19Å; L77-L81 WeakPolarHBondContact O-CB 3.34Å; L77-L81 PolarHBondContact O-N 3.43Å
78C94.4Very high86Confident0 Ų065.3 Ų65.30%033%0.334CS..Hα-helixtrans-64-38.3179.2-69.30000112.2F48 L52 F55 E74 I75 L81 A82F48-C78 HydrophobicContact CD2-CB 3.86Å; F48-C78 HydrophobicContact CE2-CB 4.02Å; L52-C78 HydrophobicContact CD2-CB 3.95Å; L52-C78 HydrophobicContact CG-CB 3.92Å; F55-C78 WeakPolarHBondContact CD2-SG 3.36Å; E74-C78 WeakPolarHBondContact O-CB 3.41Å; E74-C78 PolarHBondContact O-N 3.46Å; E74-C78 PolarHBondContact O-SG 3.03Å; I75-C78 PolarHBondContact O-N 3.31Å; C78-L81 PolarHBondContact O-N 3.17Å; C78-A82 WeakPolarHBondContact O-CB 3.41Å; C78-A82 PolarHBondContact O-N 3.44Å
79L95.1Very high87.7Confident15 Ų1559.9 Ų59.98%0.07931%0.309CS..Hα-helixtrans-66-47.1177.9-176.968.1000110.3F48 I75 L76 L77 L81 A82 L83 F98 M102F48-L79 HydrophobicContact CD2-CB 4.17Å; F48-L79 HydrophobicContact CD2-CD1 4.38Å; F48-L79 HydrophobicContact CE2-CB 3.92Å; F48-L79 HydrophobicContact CE2-CD1 4.38Å; I75-L79 WeakPolarHBondContact O-CB 3.24Å; I75-L79 PolarHBondContact O-N 2.92Å; L76-L79 PolarHBondContact O-N 2.94Å; L77-L79 VanDerWaalsContact C-N 3.33Å; L77-L79 PolarHBondContact O-N 3.35Å; L79-L81 VanDerWaalsContact C-N 3.3Å; L79-L81 PolarHBondContact O-N 2.88Å; L79-A82 PolarHBondContact O-N 2.88Å; L79-L83 HydrophobicContact CD1-CD1 4.38Å; L79-L83 HydrophobicContact CD1-CG 4.3Å; L79-L83 HydrophobicContact CG-CD1 3.96Å; L79-L83 HydrophobicContact CG-CG 4.27Å; L79-L83 WeakPolarHBondContact O-CB 3.19Å; L79-L83 WeakPolarHBondContact O-CG 3.39Å; L79-L83 PolarHBondContact O-N 2.94Å; L79-F98 HydrophobicContact CD1-CD2 4.4Å; L79-F98 HydrophobicContact CD2-CD2 4.27Å; L79-F98 HydrophobicContact CD2-CE2 4.1Å; L79-M102 HydrophobicContact CD1-CE 4.22Å; L79-M102 HydrophobicContact CD2-CE 3.65Å
80L95.8Very high89.6Confident103 Ų10362 Ų6254%0.53932%0.315SS..Hα-helixtrans-59.7-41.9176.5-72175.2000111.7L76 L77 L83 F84L76-L80 HydrophobicContact CD1-CD1 4.36Å; L76-L80 HydrophobicContact CD1-CG 4.3Å; L76-L80 HydrophobicContact CG-CD1 4.18Å; L76-L80 WeakPolarHBondContact O-CB 3.09Å; L76-L80 VanDerWaalsContact O-CG 3.24Å; L76-L80 WeakPolarHBondContact O-CG 3.33Å; L76-L80 PolarHBondContact O-N 2.96Å; L77-L80 PolarHBondContact O-N 3.19Å; L80-L83 PolarHBondContact O-N 3.45Å; L80-F84 VanDerWaalsContact O-CB 3.26Å; L80-F84 WeakPolarHBondContact O-CB 3.43Å; L80-F84 PolarHBondContact O-N 3.49Å
81L94.9Very high91.2Very high84 Ų8464.2 Ų64.244%0.4432%0.319SS..Hα-helixtrans-59.1-48.4174.7-179.170.9000111.7L77 C78 L79 F84 A85L77-L81 WeakPolarHBondContact O-CB 3.34Å; L77-L81 PolarHBondContact O-N 3.43Å; C78-L81 PolarHBondContact O-N 3.17Å; L79-L81 VanDerWaalsContact C-N 3.3Å; L79-L81 PolarHBondContact O-N 2.88Å; L81-F84 PolarHBondContact O-N 3.45Å; L81-A85 WeakPolarHBondContact O-CB 3.39Å; L81-A85 PolarHBondContact O-N 3.17Å
82A96.7Very high92.6Very high0 Ų063.4 Ų63.40%032%0.318CS..Hα-helixtrans-68.3-38.3-178.900000113.1F48 C78 L79 A85 S86F48-A82 HydrophobicContact CB-CB 3.69Å; C78-A82 WeakPolarHBondContact O-CB 3.41Å; C78-A82 PolarHBondContact O-N 3.44Å; L79-A82 PolarHBondContact O-N 2.88Å; A82-A85 PolarHBondContact O-N 3.26Å; A82-S86 WeakPolarHBondContact O-CB 3.3Å; A82-S86 PolarHBondContact O-N 3.17Å; A82-S86 PolarHBondContact O-OG 3.38Å
83L96.9Very high93.8Very high31 Ų3154.7 Ų54.716%0.16228%0.28CS..Hα-helixtrans-66.2-42.2174.8-69.1177.3000111.1L79 L80 S86 G87 V94 C97 F98L79-L83 HydrophobicContact CD1-CD1 4.38Å; L79-L83 HydrophobicContact CD1-CG 4.3Å; L79-L83 HydrophobicContact CG-CD1 3.96Å; L79-L83 HydrophobicContact CG-CG 4.27Å; L79-L83 WeakPolarHBondContact O-CB 3.19Å; L79-L83 WeakPolarHBondContact O-CG 3.39Å; L79-L83 PolarHBondContact O-N 2.94Å; L80-L83 PolarHBondContact O-N 3.45Å; L83-S86 PolarHBondContact O-N 3.02Å; L83-G87 PolarHBondContact O-N 3.1Å; L83-V94 HydrophobicContact CB-CG1 4.33Å; L83-V94 HydrophobicContact CD2-CG1 3.9Å; L83-V94 WeakPolarHBondContact CD2-O 3.33Å; L83-C97 HydrophobicContact CD2-CB 4.28Å; L83-F98 HydrophobicContact CD1-CD2 4.33Å; L83-F98 HydrophobicContact CD2-CB 3.82Å; L83-F98 HydrophobicContact CD2-CD2 4.48Å
84F95.5Very high94.3Very high139 Ų13952.9 Ų52.961%0.6127%0.267SS*.Hα-helixtrans-61.2-49.2174.5-177-104.6000110.9L80 L81 S86 G87 L88L80-F84 VanDerWaalsContact O-CB 3.26Å; L80-F84 WeakPolarHBondContact O-CB 3.43Å; L80-F84 PolarHBondContact O-N 3.49Å; L81-F84 PolarHBondContact O-N 3.45Å; F84-S86 VanDerWaalsContact C-N 3.31Å; F84-S86 PolarHBondContact O-N 3.48Å; F84-G87 PolarHBondContact O-N 2.93Å; F84-G87 VanDerWaalsContact O-N 3.13Å; F84-L88 HydrophobicContact CD1-CD1 4.05Å; F84-L88 HydrophobicContact CE1-CD1 3.7Å; F84-L88 HydrophobicContact CE1-CG 4.39Å; F84-L88 HydrophobicContact CZ-CD1 4.19Å; F84-L88 HydrophobicContact CZ-CD2 4.23Å; F84-L88 HydrophobicContact CZ-CG 4.48Å; F84-L88 WeakPolarHBondContact O-CG 3.45Å; F84-L88 PolarHBondContact O-N 2.82Å; F84-L88 VanDerWaalsContact O-N 3.15Å
85A95.3Very high94.8Very high0 Ų055.9 Ų55.90%029%0.286CS..Hα-helixtrans-56.3-43.8176.500000112.7F20 M23 L47 L81 A82F20-A85 HydrophobicContact CD2-CB 3.59Å; F20-A85 HydrophobicContact CE2-CB 3.63Å; M23-A85 HydrophobicContact CE-CB 4Å; L47-A85 HydrophobicContact CD1-CB 3.81Å; L81-A85 WeakPolarHBondContact O-CB 3.39Å; L81-A85 PolarHBondContact O-N 3.17Å; A82-A85 PolarHBondContact O-N 3.26Å
86S96.2Very high95Very high0 Ų055.5 Ų55.50%029%0.286CS..Hα-helixtrans-70.3-34.9178.5-54.30000112.2G44 A82 L83 F84 L88 I89 H90 C93 C97G44-S86 WeakPolarHBondContact CA-OG 3.32Å; A82-S86 WeakPolarHBondContact O-CB 3.3Å; A82-S86 PolarHBondContact O-N 3.17Å; A82-S86 PolarHBondContact O-OG 3.38Å; L83-S86 PolarHBondContact O-N 3.02Å; F84-S86 VanDerWaalsContact C-N 3.31Å; F84-S86 PolarHBondContact O-N 3.48Å; S86-L88 VanDerWaalsContact C-N 3.28Å; S86-L88 PolarHBondContact O-N 2.9Å; S86-I89 WeakPolarHBondContact O-CB 3.02Å; S86-I89 PolarHBondContact O-N 2.75Å; S86-I89 VanDerWaalsContact O-N 3.12Å; S86-H90 PolarHBondContact O-N 3.09Å; S86-C93 WeakPolarHBondContact O-CB 3.01Å; S86-C97 WeakPolarHBondContact OG-CB 3.26Å; S86-C97 PolarHBondContact OG-SG 2.93Å; S86-C97 VanDerWaalsContact OG-SG 3.37Å
87G94.4Very high95.2Very high35 Ų3550.8 Ų50.836%0.36126%0.261SS..Hα-helixtrans-68.7-24.417900000114.2L83 F84 I89L83-G87 PolarHBondContact O-N 3.1Å; F84-G87 PolarHBondContact O-N 2.93Å; F84-G87 VanDerWaalsContact O-N 3.13Å; G87-I89 PolarHBondContact O-N 3.11Å
88L93.9Very high95.4Very high87 Ų8750.9 Ų50.946%0.45526%0.257SS..THydrogen-bonded Turntrans-68-19.6172.3-66.1170.9000112.6Q24 F84 S86Q24-L88 VanDerWaalsContact NE2-CB 3.29Å; F84-L88 HydrophobicContact CD1-CD1 4.05Å; F84-L88 HydrophobicContact CE1-CD1 3.7Å; F84-L88 HydrophobicContact CE1-CG 4.39Å; F84-L88 HydrophobicContact CZ-CD1 4.19Å; F84-L88 HydrophobicContact CZ-CD2 4.23Å; F84-L88 HydrophobicContact CZ-CG 4.48Å; F84-L88 WeakPolarHBondContact O-CG 3.45Å; F84-L88 PolarHBondContact O-N 2.82Å; F84-L88 VanDerWaalsContact O-N 3.15Å; S86-L88 VanDerWaalsContact C-N 3.28Å; S86-L88 PolarHBondContact O-N 2.9Å
89I93.1Very high95.6Very high16 Ų1655.8 Ų55.88%0.08228%0.283CS..THydrogen-bonded Turntrans-87.8-61.7176.7-53.4167.5000110M23 L30 S86 G87M23-I89 HydrophobicContact CB-CD1 3.82Å; M23-I89 HydrophobicContact CG-CD1 4.18Å; M23-I89 HydrophobicContact SD-CD1 4.01Å; L30-I89 HydrophobicContact CB-CG2 3.62Å; L30-I89 HydrophobicContact CD1-CD1 3.93Å; L30-I89 HydrophobicContact CD1-CG2 4.44Å; S86-I89 WeakPolarHBondContact O-CB 3.02Å; S86-I89 PolarHBondContact O-N 2.75Å; S86-I89 VanDerWaalsContact O-N 3.12Å; G87-I89 PolarHBondContact O-N 3.11Å
90H92.8Very high95.7Very high62 Ų6258.4 Ų58.429%0.28729%0.294SS..  trans-163.3148.9-178.8-167.4-114.5000110.9A31 T37 S86 V92 C93A31-H90 HydrophobicContact CB-CB 4.3Å; T37-H90 HydrophobicContact CG2-CB 4.3Å; S86-H90 PolarHBondContact O-N 3.09Å; H90-V92 VanDerWaalsContact CE1-CG2 3.47Å; H90-V92 WeakPolarHBondContact CE1-CG2 3.49Å; H90-V92 WeakPolarHBondContact ND1-CB 3.36Å; H90-V92 WeakPolarHBondContact ND1-CG2 3.3Å; H90-V92 PolarHBondContact ND1-N 2.98Å; H90-V92 PolarHBondContact O-N 3.17Å; H90-C93 VanDerWaalsContact O-CB 3.25Å; H90-C93 WeakPolarHBondContact O-CB 3.42Å; H90-C93 PolarHBondContact O-N 2.85Å
91R94.5Very high95.7Very high204 Ų20453.5 Ų53.577%0.7727%0.268SS*.Hα-helixtrans-59.8-29.9178.557.4-166.5179.3170.33.3114.4C93 V94R91-C93 VanDerWaalsContact C-N 3.34Å; R91-V94 WeakPolarHBondContact O-CB 3.49Å; R91-V94 PolarHBondContact O-N 3.37Å
92V94.6Very high95.7Very high57 Ų5752.8 Ų52.835%0.34526%0.263SS..Hα-helixtrans-73.2-27.6174.8-179.90000111.7H90 V94 T95 T96H90-V92 VanDerWaalsContact CE1-CG2 3.47Å; H90-V92 WeakPolarHBondContact CE1-CG2 3.49Å; H90-V92 WeakPolarHBondContact ND1-CB 3.36Å; H90-V92 WeakPolarHBondContact ND1-CG2 3.3Å; H90-V92 PolarHBondContact ND1-N 2.98Å; H90-V92 PolarHBondContact O-N 3.17Å; V92-V94 PolarHBondContact O-N 3.39Å; V92-T95 PolarHBondContact O-N 3.44Å; V92-T95 PolarHBondContact O-OG1 3.46Å; V92-T96 HydrophobicContact CG1-CG2 4.4Å; V92-T96 WeakPolarHBondContact O-CG2 3.48Å; V92-T96 PolarHBondContact O-N 2.77Å; V92-T96 PolarHBondContact O-OG1 2.85Å
93C95Very high95.7Very high0 Ų056.2 Ų56.20%028%0.284CS..Hα-helixtrans-65.6-31.7174.4-60.50000111.1T37 S86 H90 R91 T96 C97T37-C93 PolarHBondContact O-SG 3.1Å; S86-C93 WeakPolarHBondContact O-CB 3.01Å; H90-C93 VanDerWaalsContact O-CB 3.25Å; H90-C93 WeakPolarHBondContact O-CB 3.42Å; H90-C93 PolarHBondContact O-N 2.85Å; R91-C93 VanDerWaalsContact C-N 3.34Å; C93-T96 VanDerWaalsContact CA-OG1 3.3Å; C93-T96 WeakPolarHBondContact CA-OG1 3.46Å; C93-T96 PolarHBondContact O-OG1 3.49Å; C93-T96 VanDerWaalsContact O-OG1 3.11Å; C93-C97 WeakPolarHBondContact O-CB 3.43Å; C93-C97 PolarHBondContact O-N 2.95Å
94V97.1Very high95.5Very high43 Ų4355.7 Ų55.726%0.26129%0.286SS..Hα-helixtrans-62.8-49.1177.6-176.50000111L83 R91 V92 C97 F98L83-V94 HydrophobicContact CB-CG1 4.33Å; L83-V94 HydrophobicContact CD2-CG1 3.9Å; L83-V94 WeakPolarHBondContact CD2-O 3.33Å; R91-V94 WeakPolarHBondContact O-CB 3.49Å; R91-V94 PolarHBondContact O-N 3.37Å; V92-V94 PolarHBondContact O-N 3.39Å; V94-C97 PolarHBondContact O-N 3.47Å; V94-F98 WeakPolarHBondContact O-CB 3.39Å; V94-F98 PolarHBondContact O-N 3.41Å
95T96.8Very high95.4Very high81 Ų8150.5 Ų50.550%0.49726%0.264SS..Hα-helixtrans-68.5-42-176.955.90000111.5V92 F98 I99V92-T95 PolarHBondContact O-N 3.44Å; V92-T95 PolarHBondContact O-OG1 3.46Å; T95-F98 WeakPolarHBondContact O-CB 3.42Å; T95-F98 PolarHBondContact O-N 2.9Å; T95-I99 WeakPolarHBondContact O-CG1 3.31Å; T95-I99 PolarHBondContact O-N 2.88Å; T95-I99 VanDerWaalsContact O-N 3.1Å
96T96.8Very high95.2Very high18 Ų1857.1 Ų57.111%0.1129%0.29CS..Hα-helixtrans-66.3-42.2176.149.50000111.6I38 G41 V92 C93 F98 I99 F100I38-T96 HydrophobicContact CG1-CG2 4.23Å; G41-T96 WeakPolarHBondContact CA-OG1 3.29Å; V92-T96 HydrophobicContact CG1-CG2 4.4Å; V92-T96 WeakPolarHBondContact O-CG2 3.48Å; V92-T96 PolarHBondContact O-N 2.77Å; V92-T96 PolarHBondContact O-OG1 2.85Å; C93-T96 VanDerWaalsContact CA-OG1 3.3Å; C93-T96 WeakPolarHBondContact CA-OG1 3.46Å; C93-T96 PolarHBondContact O-OG1 3.49Å; C93-T96 VanDerWaalsContact O-OG1 3.11Å; T96-F98 VanDerWaalsContact C-N 3.34Å; T96-F98 PolarHBondContact O-N 2.84Å; T96-I99 PolarHBondContact O-N 3.39Å; T96-F100 WeakPolarHBondContact O-CD2 3.36Å; T96-F100 PolarHBondContact O-N 3.33Å
97C97.5Very high95Very high0 Ų063.5 Ų63.50%032%0.315CS..Hα-helixtrans-57.5-45172.3176.90000112G41 L83 S86 C93 V94 I99 F100 S101G41-C97 WeakPolarHBondContact O-CA 3.41Å; L83-C97 HydrophobicContact CD2-CB 4.28Å; S86-C97 WeakPolarHBondContact OG-CB 3.26Å; S86-C97 PolarHBondContact OG-SG 2.93Å; S86-C97 VanDerWaalsContact OG-SG 3.37Å; C93-C97 WeakPolarHBondContact O-CB 3.43Å; C93-C97 PolarHBondContact O-N 2.95Å; V94-C97 PolarHBondContact O-N 3.47Å; C97-I99 PolarHBondContact O-N 2.91Å; C97-F100 PolarHBondContact O-N 3.37Å; C97-S101 WeakPolarHBondContact O-CB 3.42Å; C97-S101 PolarHBondContact O-N 3.39Å; C97-S101 PolarHBondContact O-OG 3.21Å
98F97.4Very high94.7Very high93 Ų9364.9 Ų64.941%0.40831%0.314SS..Hα-helixtrans-58.6-49.6176.9-178.2-100.9000111.9L79 L83 V94 T95 T96 S101 M102L79-F98 HydrophobicContact CD1-CD2 4.4Å; L79-F98 HydrophobicContact CD2-CD2 4.27Å; L79-F98 HydrophobicContact CD2-CE2 4.1Å; L83-F98 HydrophobicContact CD1-CD2 4.33Å; L83-F98 HydrophobicContact CD2-CB 3.82Å; L83-F98 HydrophobicContact CD2-CD2 4.48Å; V94-F98 WeakPolarHBondContact O-CB 3.39Å; V94-F98 PolarHBondContact O-N 3.41Å; T95-F98 WeakPolarHBondContact O-CB 3.42Å; T95-F98 PolarHBondContact O-N 2.9Å; T96-F98 VanDerWaalsContact C-N 3.34Å; T96-F98 PolarHBondContact O-N 2.84Å; F98-S101 PolarHBondContact O-N 3.01Å; F98-M102 HydrophobicContact CD1-CG 4.36Å; F98-M102 HydrophobicContact CD2-CE 4.23Å; F98-M102 HydrophobicContact CE1-CG 3.98Å; F98-M102 HydrophobicContact CE2-CE 3.69Å; F98-M102 HydrophobicContact CE2-CG 4.35Å; F98-M102 HydrophobicContact CE2-SD 4.46Å; F98-M102 HydrophobicContact CZ-CE 4.05Å; F98-M102 HydrophobicContact CZ-CG 3.98Å; F98-M102 HydrophobicContact CZ-SD 4.23Å; F98-M102 WeakPolarHBondContact O-CG 3.35Å; F98-M102 PolarHBondContact O-N 3.15Å
99I97.3Very high94.5Very high103 Ų10363.1 Ų63.153%0.52831%0.305SS..Hα-helixtrans-60.8-50.7-179.4-66.5166000110.7T95 T96 C97 S101 M102 V103T95-I99 WeakPolarHBondContact O-CG1 3.31Å; T95-I99 PolarHBondContact O-N 2.88Å; T95-I99 VanDerWaalsContact O-N 3.1Å; T96-I99 PolarHBondContact O-N 3.39Å; C97-I99 PolarHBondContact O-N 2.91Å; I99-S101 VanDerWaalsContact C-N 3.3Å; I99-S101 PolarHBondContact O-N 3.29Å; I99-M102 PolarHBondContact O-N 3.47Å; I99-V103 WeakPolarHBondContact O-CG2 3.4Å; I99-V103 PolarHBondContact O-N 3.07Å; I99-V103 VanDerWaalsContact O-N 3.1Å
100F96.9Very high94.2Very high71 Ų7167.8 Ų67.831%0.31133%0.325SS..Hα-helixtrans-64.6-35179.3-72.1-59000112.4I38 L42 S45 T96 C97 V103 G104I38-F100 HydrophobicContact CG2-CE2 4.01Å; I38-F100 HydrophobicContact CG2-CZ 4.19Å; L42-F100 HydrophobicContact CB-CD2 4.29Å; L42-F100 HydrophobicContact CB-CE2 4.28Å; L42-F100 HydrophobicContact CD1-CD1 4.31Å; L42-F100 HydrophobicContact CD1-CG 4.3Å; S45-F100 VanDerWaalsContact CB-CB 3.47Å; S45-F100 WeakPolarHBondContact OG-CB 3.32Å; T96-F100 WeakPolarHBondContact O-CD2 3.36Å; T96-F100 PolarHBondContact O-N 3.33Å; C97-F100 PolarHBondContact O-N 3.37Å; F100-V103 PolarHBondContact O-N 3.12Å; F100-G104 PolarHBondContact O-N 3.34Å
101S96.6Very high93.9Very high0 Ų069.5 Ų69.50%034%0.335CS..Hα-helixtrans-66.5-39.4175.9-60.70000112.1C97 F98 I99 G104 L105C97-S101 WeakPolarHBondContact O-CB 3.42Å; C97-S101 PolarHBondContact O-N 3.39Å; C97-S101 PolarHBondContact O-OG 3.21Å; F98-S101 PolarHBondContact O-N 3.01Å; I99-S101 VanDerWaalsContact C-N 3.3Å; I99-S101 PolarHBondContact O-N 3.29Å; S101-G104 PolarHBondContact O-N 2.68Å; S101-L105 VanDerWaalsContact O-CB 3.22Å; S101-L105 WeakPolarHBondContact O-CB 3.32Å; S101-L105 PolarHBondContact O-N 3.47Å
102M95.4Very high93.3Very high68 Ų6861.3 Ų61.334%0.33531%0.308SS..Hα-helixtrans-63.3-41.9174-70.6-62.512200111.8L79 F98 I99 L105 Y106L79-M102 HydrophobicContact CD1-CE 4.22Å; L79-M102 HydrophobicContact CD2-CE 3.65Å; F98-M102 HydrophobicContact CD1-CG 4.36Å; F98-M102 HydrophobicContact CD2-CE 4.23Å; F98-M102 HydrophobicContact CE1-CG 3.98Å; F98-M102 HydrophobicContact CE2-CE 3.69Å; F98-M102 HydrophobicContact CE2-CG 4.35Å; F98-M102 HydrophobicContact CE2-SD 4.46Å; F98-M102 HydrophobicContact CZ-CE 4.05Å; F98-M102 HydrophobicContact CZ-CG 3.98Å; F98-M102 HydrophobicContact CZ-SD 4.23Å; F98-M102 WeakPolarHBondContact O-CG 3.35Å; F98-M102 PolarHBondContact O-N 3.15Å; I99-M102 PolarHBondContact O-N 3.47Å; M102-L105 PolarHBondContact O-N 3.1Å; M102-Y106 PolarHBondContact O-N 3.33Å
103V95.8Very high92.6Very high73 Ų7360.6 Ų60.644%0.44231%0.306SS..Hα-helixtrans-62.9-47.6174.2175.20000110.6I99 F100 L105 Y106 Y107I99-V103 WeakPolarHBondContact O-CG2 3.4Å; I99-V103 PolarHBondContact O-N 3.07Å; I99-V103 VanDerWaalsContact O-N 3.1Å; F100-V103 PolarHBondContact O-N 3.12Å; V103-L105 VanDerWaalsContact C-N 3.34Å; V103-L105 PolarHBondContact O-N 2.79Å; V103-Y106 WeakPolarHBondContact O-CB 3.38Å; V103-Y106 PolarHBondContact O-N 2.98Å; V103-Y107 HydrophobicContact CG1-CD2 3.95Å; V103-Y107 HydrophobicContact CG1-CE2 3.69Å; V103-Y107 WeakPolarHBondContact O-CD2 3.42Å; V103-Y107 PolarHBondContact O-N 3.43Å
104G93.2Very high91.9Very high19 Ų1964.6 Ų64.620%0.19633%0.331CS..Hα-helixtrans-59.2-44.6177.300000112.3F100 S101 Y106 Y107 I108F100-G104 PolarHBondContact O-N 3.34Å; S101-G104 PolarHBondContact O-N 2.68Å; G104-Y106 VanDerWaalsContact C-N 3.35Å; G104-Y106 PolarHBondContact O-N 3.35Å; G104-Y107 PolarHBondContact O-N 2.9Å; G104-I108 VanDerWaalsContact O-CG1 3.32Å; G104-I108 WeakPolarHBondContact O-CG1 3.38Å; G104-I108 PolarHBondContact O-N 2.96Å
105L92.1Very high90.9Very high30 Ų3067.9 Ų67.916%0.15735%0.346CS..Hα-helixtrans-62.7-39.6176.7-180143000112.3F48 I75 S101 M102 V103 Y107 I108 N109F48-L105 HydrophobicContact CE1-CB 4.14Å; F48-L105 HydrophobicContact CZ-CB 4.34Å; F48-L105 HydrophobicContact CZ-CD1 3.99Å; I75-L105 HydrophobicContact CB-CD1 4.21Å; I75-L105 HydrophobicContact CD1-CD1 3.54Å; I75-L105 HydrophobicContact CD1-CG 4.39Å; I75-L105 HydrophobicContact CG1-CD1 3.97Å; I75-L105 HydrophobicContact CG2-CD1 3.25Å; S101-L105 VanDerWaalsContact O-CB 3.22Å; S101-L105 WeakPolarHBondContact O-CB 3.32Å; S101-L105 PolarHBondContact O-N 3.47Å; M102-L105 PolarHBondContact O-N 3.1Å; V103-L105 VanDerWaalsContact C-N 3.34Å; V103-L105 PolarHBondContact O-N 2.79Å; L105-Y107 VanDerWaalsContact C-N 3.33Å; L105-Y107 PolarHBondContact O-N 2.9Å; L105-I108 PolarHBondContact O-N 3.31Å; L105-N109 WeakPolarHBondContact CD2-ND2 3.39Å; L105-N109 VanDerWaalsContact O-CB 3.26Å; L105-N109 WeakPolarHBondContact O-CB 3.25Å; L105-N109 VanDerWaalsContact O-CG 3.32Å; L105-N109 PolarHBondContact O-N 3.12Å; L105-N109 PolarHBondContact O-ND2 3.02Å
106Y92Very high89.6Confident139 Ų13970.4 Ų70.455%0.54535%0.348SS..Hα-helixtrans-58.2-46.1174.1171.5-95.7000111.4M102 V103 G104 N109 K110M102-Y106 PolarHBondContact O-N 3.33Å; V103-Y106 WeakPolarHBondContact O-CB 3.38Å; V103-Y106 PolarHBondContact O-N 2.98Å; G104-Y106 VanDerWaalsContact C-N 3.35Å; G104-Y106 PolarHBondContact O-N 3.35Å; Y106-N109 PolarHBondContact O-N 3.41Å; Y106-K110 HydrophobicContact CE1-CD 4.42Å; Y106-K110 WeakPolarHBondContact O-CB 3.47Å; Y106-K110 PolarHBondContact O-N 3.37Å
107Y91.5Very high87.9Confident134 Ų13476.5 Ų76.553%0.52538%0.375SS..Hα-helixtrans-68.2-42.5178.1-76-70.6000112.8V103 G104 L105 N109 K110 I111V103-Y107 HydrophobicContact CG1-CD2 3.95Å; V103-Y107 HydrophobicContact CG1-CE2 3.69Å; V103-Y107 WeakPolarHBondContact O-CD2 3.42Å; V103-Y107 PolarHBondContact O-N 3.43Å; G104-Y107 PolarHBondContact O-N 2.9Å; L105-Y107 VanDerWaalsContact C-N 3.33Å; L105-Y107 PolarHBondContact O-N 2.9Å; Y107-N109 VanDerWaalsContact C-N 3.32Å; Y107-N109 PolarHBondContact O-N 3.29Å; Y107-K110 PolarHBondContact O-N 3.39Å; Y107-I111 VanDerWaalsContact O-CG1 3.29Å; Y107-I111 WeakPolarHBondContact O-CG1 3.49Å; Y107-I111 PolarHBondContact O-N 3.13Å
108I89.6Confident85.9Confident65 Ų6580.7 Ų80.733%0.33341%0.409SS..Hα-helixtrans-59.7-45.5175.8-70167.6000110.2V49 L52 G104 L105 K110 I111 S112V49-I108 HydrophobicContact CG1-CD1 4.23Å; V49-I108 HydrophobicContact CG2-CD1 4.08Å; L52-I108 HydrophobicContact CD1-CD1 4.41Å; G104-I108 VanDerWaalsContact O-CG1 3.32Å; G104-I108 WeakPolarHBondContact O-CG1 3.38Å; G104-I108 PolarHBondContact O-N 2.96Å; L105-I108 PolarHBondContact O-N 3.31Å; I108-K110 PolarHBondContact O-N 3.32Å; I108-I111 PolarHBondContact O-N 2.82Å; I108-S112 WeakPolarHBondContact O-CB 3.38Å; I108-S112 PolarHBondContact O-N 3.39Å
109N87.9Confident83.6Confident50 Ų5079.4 Ų79.427%0.26742%0.416SS..Hα-helixtrans-65.6-39.2178-78.7-17.8000112.4L105 Y106 Y107 S112 S113L105-N109 WeakPolarHBondContact CD2-ND2 3.39Å; L105-N109 VanDerWaalsContact O-CB 3.26Å; L105-N109 WeakPolarHBondContact O-CB 3.25Å; L105-N109 VanDerWaalsContact O-CG 3.32Å; L105-N109 PolarHBondContact O-N 3.12Å; L105-N109 PolarHBondContact O-ND2 3.02Å; Y106-N109 PolarHBondContact O-N 3.41Å; Y107-N109 VanDerWaalsContact C-N 3.32Å; Y107-N109 PolarHBondContact O-N 3.29Å; N109-S112 PolarHBondContact O-N 3.15Å; N109-S113 WeakPolarHBondContact O-CB 3.2Å; N109-S113 PolarHBondContact O-N 3.33Å; N109-S113 PolarHBondContact O-OG 3.35Å
110K87.6Confident81.1Confident114 Ų11477.4 Ų77.450%0.49642%0.415SS..Hα-helixtrans-64.2-42.9176-173.4-178.5177.5-173.80111.6Y106 Y107 I108 S113 T114Y106-K110 HydrophobicContact CE1-CD 4.42Å; Y106-K110 WeakPolarHBondContact O-CB 3.47Å; Y106-K110 PolarHBondContact O-N 3.37Å; Y107-K110 PolarHBondContact O-N 3.39Å; I108-K110 PolarHBondContact O-N 3.32Å; K110-S113 PolarHBondContact O-OG 3.22Å; K110-T114 WeakPolarHBondContact O-CG2 3.31Å; K110-T114 PolarHBondContact O-N 3.15Å; K110-T114 PolarHBondContact O-OG1 3.07Å
111I86.5Confident78.6Confident98 Ų9879.1 Ų79.150%0.50343%0.433SS..Hα-helixtrans-66.3-45.7176.1-66.8164.4000109.7Y107 I108 S113 T114 L115Y107-I111 VanDerWaalsContact O-CG1 3.29Å; Y107-I111 WeakPolarHBondContact O-CG1 3.49Å; Y107-I111 PolarHBondContact O-N 3.13Å; I108-I111 PolarHBondContact O-N 2.82Å; I111-S113 PolarHBondContact O-N 3.48Å; I111-T114 PolarHBondContact O-N 3.38Å; I111-T114 PolarHBondContact O-OG1 3.03Å; I111-L115 HydrophobicContact CG2-CD1 3.61Å; I111-L115 HydrophobicContact CG2-CG 4.19Å; I111-L115 WeakPolarHBondContact O-CG 3.41Å; I111-L115 PolarHBondContact O-N 3.24Å
112S82.4Confident76.1Confident31 Ų3185.3 Ų85.322%0.21747%0.471CS..Hα-helixtrans-57.2-46.3177.3-178.30000111.9I108 N109 T114 L115 Y116I108-S112 WeakPolarHBondContact O-CB 3.38Å; I108-S112 PolarHBondContact O-N 3.39Å; N109-S112 PolarHBondContact O-N 3.15Å; S112-T114 VanDerWaalsContact C-N 3.35Å; S112-T114 PolarHBondContact O-N 3.26Å; S112-L115 PolarHBondContact O-N 3.08Å; S112-Y116 WeakPolarHBondContact O-CB 3.4Å; S112-Y116 VanDerWaalsContact O-CD2 3.27Å; S112-Y116 WeakPolarHBondContact O-CD2 3.13Å; S112-Y116 PolarHBondContact O-N 3.44Å; S112-Y116 WeakPolarHBondContact OG-CD2 3.4Å
113S79.8Confident73.6Confident43 Ų4389.5 Ų89.530%0.30149%0.494SS..Hα-helixtrans-62.7-41.5177.566.20000111.9N109 K110 I111 L115 Q117N109-S113 WeakPolarHBondContact O-CB 3.2Å; N109-S113 PolarHBondContact O-N 3.33Å; N109-S113 PolarHBondContact O-OG 3.35Å; K110-S113 PolarHBondContact O-OG 3.22Å; I111-S113 PolarHBondContact O-N 3.48Å; S113-L115 PolarHBondContact O-N 2.83Å; S113-Q117 WeakPolarHBondContact O-CA 3.36Å; S113-Q117 WeakPolarHBondContact O-CB 3.38Å; S113-Q117 VanDerWaalsContact O-CG 3.31Å; S113-Q117 WeakPolarHBondContact O-CG 3.38Å; S113-Q117 PolarHBondContact O-N 3.34Å
114T80.8Confident70.9Confident84 Ų8491.8 Ų91.852%0.51551%0.508SS..Hα-helixtrans-66.1-38.5177.3580000113.3K110 I111 S112 A118K110-T114 WeakPolarHBondContact O-CG2 3.31Å; K110-T114 PolarHBondContact O-N 3.15Å; K110-T114 PolarHBondContact O-OG1 3.07Å; I111-T114 PolarHBondContact O-N 3.38Å; I111-T114 PolarHBondContact O-OG1 3.03Å; S112-T114 VanDerWaalsContact C-N 3.35Å; S112-T114 PolarHBondContact O-N 3.26Å; T114-A118 WeakPolarHBondContact O-CB 3.37Å
115L75.1Confident68.5Low111 Ų11196.4 Ų96.458%0.58154%0.535SS*.Hα-helixtrans-79.8-42.4-177.1-66.5176.5000112.1I111 S112 S113 A119I111-L115 HydrophobicContact CG2-CD1 3.61Å; I111-L115 HydrophobicContact CG2-CG 4.19Å; I111-L115 WeakPolarHBondContact O-CG 3.41Å; I111-L115 PolarHBondContact O-N 3.24Å; S112-L115 PolarHBondContact O-N 3.08Å; S113-L115 PolarHBondContact O-N 2.83Å; L115-A119 WeakPolarHBondContact O-CB 3.29Å; L115-A119 PolarHBondContact O-N 2.97Å
116Y68.7Low66.2Low135 Ų13599.1 Ų99.153%0.52956%0.561SS.*Hα-helixtrans-92.2-29.9-174.4-65.7-73.7000113.7S112 A119 A120S112-Y116 WeakPolarHBondContact O-CB 3.4Å; S112-Y116 VanDerWaalsContact O-CD2 3.27Å; S112-Y116 WeakPolarHBondContact O-CD2 3.13Å; S112-Y116 PolarHBondContact O-N 3.44Å; S112-Y116 WeakPolarHBondContact OG-CD2 3.4Å; Y116-A119 CarbonylContact O-C 3.15Å; Y116-A119 PolarHBondContact O-N 3.35Å; Y116-A120 PolarHBondContact O-N 2.63Å
117Q62.3Low63.8Low145 Ų145102.2 Ų102.268%0.67858%0.578SS**Hα-helixtrans-76.6-31.8172.9-59.4-177.518.200111.9S113 A119 A120S113-Q117 WeakPolarHBondContact O-CA 3.36Å; S113-Q117 WeakPolarHBondContact O-CB 3.38Å; S113-Q117 VanDerWaalsContact O-CG 3.31Å; S113-Q117 WeakPolarHBondContact O-CG 3.38Å; S113-Q117 PolarHBondContact O-N 3.34Å; Q117-A119 PolarHBondContact O-N 2.9Å; Q117-A120 VanDerWaalsContact O-CB 3.26Å; Q117-A120 WeakPolarHBondContact O-CB 3.28Å; Q117-A120 PolarHBondContact O-N 3.47Å; Q117-A120 VanDerWaalsContact O-N 3.14Å
118A54.7Low61.4Low88 Ų88102 Ų10273%0.72759%0.59SS**THydrogen-bonded Turntrans-66.7-25.8170.200000112.3T114 A120T114-A118 WeakPolarHBondContact O-CB 3.37Å; A118-A120 VanDerWaalsContact C-N 3.33Å
119A50Low59Low67 Ų67105.2 Ų105.255%0.55461%0.613SS**THydrogen-bonded Turntrans-86.61.7174.100000113.7L115 Y116 Q117 P121L115-A119 WeakPolarHBondContact O-CB 3.29Å; L115-A119 PolarHBondContact O-N 2.97Å; Y116-A119 CarbonylContact O-C 3.15Å; Y116-A119 PolarHBondContact O-N 3.35Å; Q117-A119 PolarHBondContact O-N 2.9Å; A119-P121 WeakPolarHBondContact O-CD 3.32Å
120A43.4Very low56.6Low61 Ų61106.1 Ų106.150%0.50463%0.634SS.*SBendtrans-56.4114.1167.800000106.3Y116 Q117 A118 V122Y116-A120 PolarHBondContact O-N 2.63Å; Q117-A120 VanDerWaalsContact O-CB 3.26Å; Q117-A120 WeakPolarHBondContact O-CB 3.28Å; Q117-A120 PolarHBondContact O-N 3.47Å; Q117-A120 VanDerWaalsContact O-N 3.14Å; A118-A120 VanDerWaalsContact C-N 3.33Å; A120-V122 PolarHBondContact O-N 3.05Å
121P45.8Very low54.2Low107 Ų107110.7 Ų110.770%0.69565%0.654SS**  trans-60120.1176.325-29000104.1A119 L123A119-P121 WeakPolarHBondContact O-CD 3.32Å; P121-L123 PolarHBondContact O-N 3.27Å
122V44.3Very low51.9Low129 Ų129111.4 Ų111.478%0.78267%0.668SS**  trans-48.1107.9158.1-151.60000102.5A120 T124A120-V122 PolarHBondContact O-N 3.05Å; V122-T124 PolarHBondContact O-N 3.44Å
123L42.4Very low49.9Very low156 Ų156119.1 Ų119.182%0.81770%0.697SS**  trans-60.288168.5-78.5163.2000102.8P121 P125P121-L123 PolarHBondContact O-N 3.27Å; L123-P125 VanDerWaalsContact C-N 3.31Å; L123-P125 WeakPolarHBondContact O-CD 3.27Å
124T39.4Very low47.7Very low121 Ų121126.8 Ų126.874%0.74273%0.725SS**  trans-56.2109.2161.845.30000102.5V122 A126V122-T124 PolarHBondContact O-N 3.44Å; T124-A126 PolarHBondContact O-N 3.11Å; T124-A126 VanDerWaalsContact O-N 3.08Å
125P42Very low45.9Very low117 Ų117134.4 Ų134.476%0.7674%0.744SS**  trans-58127-168.721.9-30.3000106L123 K127L123-P125 VanDerWaalsContact C-N 3.31Å; L123-P125 WeakPolarHBondContact O-CD 3.27Å; P125-K127 PolarHBondContact O-N 3.5Å
126A44.6Very low44.7Very low87 Ų87140.4 Ų140.472%0.71978%0.777SS**  trans-44.7114.3174.600000106.9T124 V128T124-A126 PolarHBondContact O-N 3.11Å; T124-A126 VanDerWaalsContact O-N 3.08Å; A126-V128 VanDerWaalsContact C-N 3.25Å; A126-V128 PolarHBondContact O-N 3.25Å
127K41.6Very low43.5Very low203 Ų203140.7 Ų140.788%0.88379%0.789SS**  trans-56.6102.9172.5-172.1176.8-176.7178.20105P125 T129P125-K127 PolarHBondContact O-N 3.5Å; K127-T129 PolarHBondContact O-N 3.28Å; K127-T129 VanDerWaalsContact O-N 3.13Å
128V40Very low42.5Very low129 Ų129140.4 Ų140.478%0.78280%0.795SS**  trans-50.7121.7-175-176.20000106.6A126 G130A126-V128 VanDerWaalsContact C-N 3.25Å; A126-V128 PolarHBondContact O-N 3.25Å; V128-G130 PolarHBondContact O-N 3.43Å
129T39Very low41.8Very low134 Ų134143.3 Ų143.382%0.82280%0.799SS**  trans-6482.4169.1350000108K127 K131K127-T129 PolarHBondContact O-N 3.28Å; K127-T129 VanDerWaalsContact O-N 3.13Å; T129-K131 VanDerWaalsContact C-N 3.26Å; T129-K131 PolarHBondContact O-N 3.34Å
130G38.1Very low41.3Very low69 Ų69147.8 Ų147.871%0.71181%0.814SS**  trans-67.785.1170.900000109.8V128 S132V128-G130 PolarHBondContact O-N 3.43Å; G130-S132 PolarHBondContact O-N 2.81Å; G130-S132 VanDerWaalsContact O-N 3.17Å
131K37.4Very low41.2Very low210 Ų210153.3 Ų153.391%0.91383%0.833SS**  trans-58108.4156.4-76179.3173.8177.20108.2T129T129-K131 VanDerWaalsContact C-N 3.26Å; T129-K131 PolarHBondContact O-N 3.34Å
132S38.2Very low40.9Very low113 Ų113156.3 Ų156.379%0.7984%0.842SS**  trans-132.987.6160.7-165.70000107.1G130G130-S132 PolarHBondContact O-N 2.81Å; G130-S132 VanDerWaalsContact O-N 3.17Å
133K39.9Very low40.6Very low192 Ų192158.3 Ų158.384%0.83585%0.846SS**  70.29093.7-164.1176.2-176.6178.90113.1
134K34.6Very low40.5Very low204 Ų204158.5 Ų158.589%0.88785%0.849SS**  trans25.5112.3130.4-150.4-174.8-167.3-170.30115.9
135R41.8Very low40.6Very low244 Ų244161.6 Ų161.692%0.92186%0.857SS**  trans-150121.6146-150.3166.882.3178.16110.2
136N49.6Very low40.4Very low237 Ų237165.6 Ų165.6100%1.26787%0.866SS**  trans10.50168.8-86.59.6000118.4

Retrieved 136 of 136 residues in 194.3 ms (Link to these results)