A0A5K4F014_SCHMA Loading...

MEG-27 protein

AlphaFold DB , UniProt , Accession A0A5K4F014, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 55 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
1M59.7Low89.4Confident225 Ų225121.6 Ų121.6100%1.10861%0.606SS**  0-50-68.5-176.588.100114.4
2N83.4Confident89.8Confident126 Ų126120.5 Ų120.567%0.67460%0.595SS**Hα-helixtrans-82.6-32-172.4-147.930.2000115.3T6N2-T6 PolarHBondContact O-N 2.85Å; N2-T6 PolarHBondContact O-OG1 3.43Å
3L90.6Very high90.2Very high131 Ų131119.5 Ų119.569%0.68659%0.59SS**Hα-helixtrans-69.8-46-173.7-171.569.5000112.6Q5 T6 L7L3-Q5 VanDerWaalsContact C-N 3.34Å; L3-Q5 PolarHBondContact O-N 3.21Å; L3-T6 PolarHBondContact O-N 3.46Å; L3-L7 HydrophobicContact CG-CD1 4.33Å; L3-L7 WeakPolarHBondContact O-CG 3.45Å; L3-L7 PolarHBondContact O-N 3.02Å
4I93.4Very high90.5Very high121 Ų121120.2 Ų120.262%0.62159%0.594SS**Hα-helixtrans-61.9-44-178.3-62.5173.3000110.6T6 L7 L8I4-T6 VanDerWaalsContact C-N 3.34Å; I4-T6 PolarHBondContact O-N 3.21Å; I4-L7 PolarHBondContact O-N 3.01Å; I4-L8 HydrophobicContact CG2-CD1 4.1Å; I4-L8 WeakPolarHBondContact O-CG 3.32Å; I4-L8 PolarHBondContact O-N 3.31Å
5Q90.9Very high90.8Very high115 Ų115118.5 Ų118.554%0.53759%0.586SS.*Hα-helixtrans-62.5-41.5177.4-176.5173.5-2300111.7L3 L7 L8 W9L3-Q5 VanDerWaalsContact C-N 3.34Å; L3-Q5 PolarHBondContact O-N 3.21Å; Q5-L7 PolarHBondContact O-N 3.3Å; Q5-L8 PolarHBondContact O-N 2.98Å; Q5-W9 VanDerWaalsContact O-CD1 3.23Å; Q5-W9 PolarHBondContact O-N 3.43Å
6T93.7Very high90.7Very high65 Ų65115.9 Ų115.940%0.39957%0.574SS.*Hα-helixtrans-62.5-42.7177.2-54.60000111.7N2 L3 I4 W9 M10N2-T6 PolarHBondContact O-N 2.85Å; N2-T6 PolarHBondContact O-OG1 3.43Å; L3-T6 PolarHBondContact O-N 3.46Å; I4-T6 VanDerWaalsContact C-N 3.34Å; I4-T6 PolarHBondContact O-N 3.21Å; T6-W9 PolarHBondContact O-N 3.02Å; T6-M10 HydrophobicContact CG2-CE 4.4Å; T6-M10 PolarHBondContact O-N 3.25Å
7L94.4Very high90.6Very high84 Ų84114.2 Ų114.244%0.4457%0.567SS.*Hα-helixtrans-62.9-43.6176.4-70.2170.2000111.8L3 I4 Q5 W9 M10 I11L3-L7 HydrophobicContact CG-CD1 4.33Å; L3-L7 WeakPolarHBondContact O-CG 3.45Å; L3-L7 PolarHBondContact O-N 3.02Å; I4-L7 PolarHBondContact O-N 3.01Å; Q5-L7 PolarHBondContact O-N 3.3Å; L7-W9 VanDerWaalsContact C-N 3.31Å; L7-W9 PolarHBondContact O-N 3.32Å; L7-M10 HydrophobicContact CD2-CE 3.73Å; L7-M10 PolarHBondContact O-N 3Å; L7-I11 WeakPolarHBondContact O-CG1 3.39Å; L7-I11 PolarHBondContact O-N 3.48Å
8L93.4Very high90.5Very high110 Ų110112.2 Ų112.258%0.57656%0.558SS**Hα-helixtrans-61-40.6176.1-72.8169.4000111.9I4 Q5 I11 F12I4-L8 HydrophobicContact CG2-CD1 4.1Å; I4-L8 WeakPolarHBondContact O-CG 3.32Å; I4-L8 PolarHBondContact O-N 3.31Å; Q5-L8 PolarHBondContact O-N 2.98Å; L8-I11 PolarHBondContact O-N 3.44Å; L8-F12 WeakPolarHBondContact O-CB 3.34Å; L8-F12 PolarHBondContact O-N 2.98Å
9W94.5Very high90.1Very high149 Ų149109.3 Ų109.356%0.56455%0.547SS*.Hα-helixtrans-63.4-43174.9-89.1105.3000112.9Q5 T6 L7 F12 M13Q5-W9 VanDerWaalsContact O-CD1 3.23Å; Q5-W9 PolarHBondContact O-N 3.43Å; T6-W9 PolarHBondContact O-N 3.02Å; L7-W9 VanDerWaalsContact C-N 3.31Å; L7-W9 PolarHBondContact O-N 3.32Å; W9-F12 HydrophobicContact CE3-CD1 4.37Å; W9-F12 HydrophobicContact CZ3-CD1 4.25Å; W9-F12 PolarHBondContact O-N 3.41Å; W9-M13 WeakPolarHBondContact O-CG 3.29Å; W9-M13 PolarHBondContact O-N 3.31Å
10M92.9Very high89.6Confident115 Ų115108.7 Ų108.757%0.56755%0.546SS*.Hα-helixtrans-63.1-42.9177-73.8-167.8-69.400111.9T6 L7 F12 M13 M14T6-M10 HydrophobicContact CG2-CE 4.4Å; T6-M10 PolarHBondContact O-N 3.25Å; L7-M10 HydrophobicContact CD2-CE 3.73Å; L7-M10 PolarHBondContact O-N 3Å; M10-F12 VanDerWaalsContact C-N 3.34Å; M10-F12 PolarHBondContact O-N 2.98Å; M10-M13 PolarHBondContact O-N 2.97Å; M10-M14 WeakPolarHBondContact O-CB 3.39Å; M10-M14 PolarHBondContact O-N 3.44Å
11I96.1Very high89.1Confident97 Ų97108.3 Ų108.350%0.49754%0.542SS..Hα-helixtrans-61.3-44.8176.1-66.6165.6000110.3L7 L8 M14 I15L7-I11 WeakPolarHBondContact O-CG1 3.39Å; L7-I11 PolarHBondContact O-N 3.48Å; L8-I11 PolarHBondContact O-N 3.44Å; I11-M14 PolarHBondContact O-N 2.97Å; I11-I15 HydrophobicContact CG2-CD1 3.77Å; I11-I15 HydrophobicContact CG2-CG1 4.44Å; I11-I15 VanDerWaalsContact O-CG1 3.29Å; I11-I15 WeakPolarHBondContact O-CG1 3.42Å; I11-I15 PolarHBondContact O-N 3.32Å
12F95.2Very high90Very high108 Ų108102.2 Ų102.247%0.47451%0.513SS..Hα-helixtrans-61-47178.7-179-101.6000112.6L8 W9 M10 M14 I15 M16L8-F12 WeakPolarHBondContact O-CB 3.34Å; L8-F12 PolarHBondContact O-N 2.98Å; W9-F12 HydrophobicContact CE3-CD1 4.37Å; W9-F12 HydrophobicContact CZ3-CD1 4.25Å; W9-F12 PolarHBondContact O-N 3.41Å; M10-F12 VanDerWaalsContact C-N 3.34Å; M10-F12 PolarHBondContact O-N 2.98Å; F12-M14 VanDerWaalsContact C-N 3.32Å; F12-M14 PolarHBondContact O-N 2.98Å; F12-I15 PolarHBondContact O-N 3.48Å; F12-M16 HydrophobicContact CD1-CE 4.44Å; F12-M16 HydrophobicContact CD1-CG 4.43Å; F12-M16 HydrophobicContact CD1-SD 4.3Å; F12-M16 HydrophobicContact CE1-CE 3.97Å; F12-M16 HydrophobicContact CE1-CG 4Å; F12-M16 HydrophobicContact CE1-SD 3.46Å; F12-M16 WeakPolarHBondContact CE1-SD 3.4Å; F12-M16 HydrophobicContact CE2-CG 4.46Å; F12-M16 HydrophobicContact CZ-CG 4.02Å; F12-M16 HydrophobicContact CZ-SD 3.66Å; F12-M16 PolarHBondContact O-N 3.4Å
13M94Very high89.6Confident108 Ų108102.6 Ų102.653%0.53251%0.509SS..Hα-helixtrans-62.9-39.6177.7-68-67.8-86.100111.8W9 M10 M16 N17W9-M13 WeakPolarHBondContact O-CG 3.29Å; W9-M13 PolarHBondContact O-N 3.31Å; M10-M13 PolarHBondContact O-N 2.97Å; M13-M16 PolarHBondContact O-N 2.98Å; M13-M16 HydrophobicContact SD-CE 3.63Å; M13-N17 PolarHBondContact O-N 2.86Å
14M94.9Very high88.5Confident129 Ų129105.2 Ų105.264%0.63551%0.51SS*.Hα-helixtrans-63-44176.3-170.5177.5-176.700111.7M10 I11 F12 N17 L18M10-M14 WeakPolarHBondContact O-CB 3.39Å; M10-M14 PolarHBondContact O-N 3.44Å; I11-M14 PolarHBondContact O-N 2.97Å; F12-M14 VanDerWaalsContact C-N 3.32Å; F12-M14 PolarHBondContact O-N 2.98Å; M14-N17 PolarHBondContact O-N 3.45Å; M14-L18 HydrophobicContact CE-CD1 4.46Å; M14-L18 HydrophobicContact CG-CD1 4.1Å; M14-L18 WeakPolarHBondContact O-CB 3.45Å; M14-L18 WeakPolarHBondContact O-CG 3.45Å; M14-L18 PolarHBondContact O-N 2.88Å
15I94.6Very high87.3Confident94 Ų94103 Ų10348%0.48250%0.502SS..Hα-helixtrans-63.6-43.7177.1-67.7167.1000111I11 F12 N17 L18 T19I11-I15 HydrophobicContact CG2-CD1 3.77Å; I11-I15 HydrophobicContact CG2-CG1 4.44Å; I11-I15 VanDerWaalsContact O-CG1 3.29Å; I11-I15 WeakPolarHBondContact O-CG1 3.42Å; I11-I15 PolarHBondContact O-N 3.32Å; F12-I15 PolarHBondContact O-N 3.48Å; I15-N17 PolarHBondContact O-N 2.96Å; I15-L18 PolarHBondContact O-N 3.44Å; I15-T19 WeakPolarHBondContact O-CB 3.46Å; I15-T19 PolarHBondContact O-N 3.49Å; I15-T19 PolarHBondContact O-OG1 3.35Å
16M89.5Confident86.2Confident78 Ų78102.1 Ų102.138%0.38450%0.501SS..Hα-helixtrans-61.7-43.4176.6-72.3-158.9-43.100111.9F12 M13 T19 N20F12-M16 HydrophobicContact CD1-CE 4.44Å; F12-M16 HydrophobicContact CD1-CG 4.43Å; F12-M16 HydrophobicContact CD1-SD 4.3Å; F12-M16 HydrophobicContact CE1-CE 3.97Å; F12-M16 HydrophobicContact CE1-CG 4Å; F12-M16 HydrophobicContact CE1-SD 3.46Å; F12-M16 WeakPolarHBondContact CE1-SD 3.4Å; F12-M16 HydrophobicContact CE2-CG 4.46Å; F12-M16 HydrophobicContact CZ-CG 4.02Å; F12-M16 HydrophobicContact CZ-SD 3.66Å; F12-M16 PolarHBondContact O-N 3.4Å; M13-M16 PolarHBondContact O-N 2.98Å; M13-M16 HydrophobicContact SD-CE 3.63Å; M16-T19 PolarHBondContact O-N 3.29Å; M16-N20 VanDerWaalsContact O-CG 3.29Å; M16-N20 PolarHBondContact O-N 3.39Å; M16-N20 PolarHBondContact O-ND2 2.87Å
17N89.5Confident84.6Confident86 Ų86102 Ų10246%0.4650%0.502SS..Hα-helixtrans-62.4-48.9178.2-17164.1000111.4M13 M14 I15 T19 N20 E21M13-N17 PolarHBondContact O-N 2.86Å; M14-N17 PolarHBondContact O-N 3.45Å; I15-N17 PolarHBondContact O-N 2.96Å; N17-T19 VanDerWaalsContact C-N 3.29Å; N17-T19 PolarHBondContact O-N 2.72Å; N17-N20 PolarHBondContact O-N 3.46Å; N17-N20 VanDerWaalsContact O-N 3.13Å; N17-E21 PolarHBondContact ND2-OE1 2.93Å; N17-E21 PolarHBondContact O-N 3.18Å
18L88.8Confident82.9Confident79 Ų79100.3 Ų100.341%0.41450%0.497SS..Hα-helixtrans-57.6-42.1175.4-77.7163.8000111.9M14 I15 N20 E21 I22M14-L18 HydrophobicContact CE-CD1 4.46Å; M14-L18 HydrophobicContact CG-CD1 4.1Å; M14-L18 WeakPolarHBondContact O-CB 3.45Å; M14-L18 WeakPolarHBondContact O-CG 3.45Å; M14-L18 PolarHBondContact O-N 2.88Å; I15-L18 PolarHBondContact O-N 3.44Å; L18-N20 VanDerWaalsContact C-N 3.32Å; L18-N20 PolarHBondContact O-N 3.13Å; L18-E21 PolarHBondContact O-N 3.45Å; L18-I22 WeakPolarHBondContact O-CB 3.48Å; L18-I22 WeakPolarHBondContact O-CD1 3.28Å; L18-I22 WeakPolarHBondContact O-CG1 3.35Å; L18-I22 PolarHBondContact O-N 3.35Å
19T82.5Confident81.2Confident57 Ų57100 Ų10035%0.3549%0.492SS..Hα-helixtrans-64.2-39.7178.2-56.50000111.4I15 M16 N17 K23I15-T19 WeakPolarHBondContact O-CB 3.46Å; I15-T19 PolarHBondContact O-N 3.49Å; I15-T19 PolarHBondContact O-OG1 3.35Å; M16-T19 PolarHBondContact O-N 3.29Å; N17-T19 VanDerWaalsContact C-N 3.29Å; N17-T19 PolarHBondContact O-N 2.72Å; T19-K23 HydrophobicContact CG2-CD 4.41Å; T19-K23 WeakPolarHBondContact O-CB 3.49Å; T19-K23 VanDerWaalsContact O-CG 3.3Å; T19-K23 WeakPolarHBondContact O-CG 3.33Å; T19-K23 PolarHBondContact O-N 2.83Å
20N79.9Confident79.4Confident96 Ų9698.6 Ų98.651%0.51349%0.492SS..Hα-helixtrans-68.9-40.9177.2-72-19.2000111.8M16 N17 L18 K23 W24M16-N20 VanDerWaalsContact O-CG 3.29Å; M16-N20 PolarHBondContact O-N 3.39Å; M16-N20 PolarHBondContact O-ND2 2.87Å; N17-N20 PolarHBondContact O-N 3.46Å; N17-N20 VanDerWaalsContact O-N 3.13Å; L18-N20 VanDerWaalsContact C-N 3.32Å; L18-N20 PolarHBondContact O-N 3.13Å; N20-K23 PolarHBondContact O-N 2.95Å; N20-W24 VanDerWaalsContact O-CB 3.28Å; N20-W24 WeakPolarHBondContact O-CB 3.3Å; N20-W24 PolarHBondContact O-N 3.32Å
21E78.7Confident77.6Confident101 Ų10198.1 Ų98.147%0.47249%0.491SS..Hα-helixtrans-63-44.9173.9-75.6179.4-158.900111.5N17 L18 K23 W24 V25N17-E21 PolarHBondContact ND2-OE1 2.93Å; N17-E21 PolarHBondContact O-N 3.18Å; L18-E21 PolarHBondContact O-N 3.45Å; E21-K23 PolarHBondContact O-N 2.79Å; E21-W24 PolarHBondContact O-N 3.37Å; E21-V25 WeakPolarHBondContact O-CB 3.42Å; E21-V25 WeakPolarHBondContact O-CG2 3.22Å; E21-V25 PolarHBondContact O-N 2.9Å
22I79.8Confident75.5Confident97 Ų9798.6 Ų98.650%0.49750%0.495SS..Hα-helixtrans-61.9-43.6176.3-68.5163.8000110.9L18 W24 V25 N26L18-I22 WeakPolarHBondContact O-CB 3.48Å; L18-I22 WeakPolarHBondContact O-CD1 3.28Å; L18-I22 WeakPolarHBondContact O-CG1 3.35Å; L18-I22 PolarHBondContact O-N 3.35Å; I22-W24 VanDerWaalsContact C-N 3.32Å; I22-W24 PolarHBondContact O-N 2.7Å; I22-V25 PolarHBondContact O-N 3.42Å; I22-N26 VanDerWaalsContact O-CB 3.29Å; I22-N26 WeakPolarHBondContact O-CB 3.3Å; I22-N26 VanDerWaalsContact O-CG 3.27Å; I22-N26 PolarHBondContact O-N 3.39Å
23K73.7Confident73.3Confident134 Ų13498.1 Ų98.158%0.58349%0.494SS*.Hα-helixtrans-63-39.5175-77.7177.7-179.8-179.90112T19 N20 E21 N26 C27T19-K23 HydrophobicContact CG2-CD 4.41Å; T19-K23 WeakPolarHBondContact O-CB 3.49Å; T19-K23 VanDerWaalsContact O-CG 3.3Å; T19-K23 WeakPolarHBondContact O-CG 3.33Å; T19-K23 PolarHBondContact O-N 2.83Å; N20-K23 PolarHBondContact O-N 2.95Å; E21-K23 PolarHBondContact O-N 2.79Å; K23-N26 PolarHBondContact O-N 3.48Å; K23-C27 WeakPolarHBondContact O-CB 3.41Å; K23-C27 PolarHBondContact O-N 3.34Å
24W67.6Low71.2Confident187 Ų18798.6 Ų98.671%0.70850%0.495SS*.Hα-helixtrans-67.2-44.5177.8-176.982.2000111.2N20 E21 I22 C27 S28N20-W24 VanDerWaalsContact O-CB 3.28Å; N20-W24 WeakPolarHBondContact O-CB 3.3Å; N20-W24 PolarHBondContact O-N 3.32Å; E21-W24 PolarHBondContact O-N 3.37Å; I22-W24 VanDerWaalsContact C-N 3.32Å; I22-W24 PolarHBondContact O-N 2.7Å; W24-C27 PolarHBondContact O-N 3.47Å; W24-S28 VanDerWaalsContact O-CB 3.3Å; W24-S28 WeakPolarHBondContact O-CB 3.29Å; W24-S28 PolarHBondContact O-N 2.8Å; W24-S28 PolarHBondContact O-OG 3.44Å
25V69.3Low68.7Low75 Ų7596.6 Ų96.646%0.45549%0.49SS..Hα-helixtrans-61.1-45.8173.2172.10000110.3E21 I22 S28 H29E21-V25 WeakPolarHBondContact O-CB 3.42Å; E21-V25 WeakPolarHBondContact O-CG2 3.22Å; E21-V25 PolarHBondContact O-N 2.9Å; I22-V25 PolarHBondContact O-N 3.42Å; V25-S28 WeakPolarHBondContact CA-OG 3.44Å; V25-S28 CarbonylContact O-C 3.58Å; V25-S28 PolarHBondContact O-N 2.79Å; V25-S28 PolarHBondContact O-OG 3.5Å; V25-H29 VanDerWaalsContact O-CB 3.31Å; V25-H29 WeakPolarHBondContact O-CB 3.19Å; V25-H29 PolarHBondContact O-N 2.8Å
26N67.5Low66.4Low96 Ų9693.8 Ų93.851%0.51348%0.478SS..Hα-helixtrans-67.1-38.9178.4-75.9-2000112.5I22 K23 S28 H29 E30I22-N26 VanDerWaalsContact O-CB 3.29Å; I22-N26 WeakPolarHBondContact O-CB 3.3Å; I22-N26 VanDerWaalsContact O-CG 3.27Å; I22-N26 PolarHBondContact O-N 3.39Å; K23-N26 PolarHBondContact O-N 3.48Å; N26-S28 VanDerWaalsContact C-N 3.35Å; N26-H29 CarbonylContact O-C 3.51Å; N26-H29 WeakPolarHBondContact O-CB 3.29Å; N26-H29 PolarHBondContact O-N 2.79Å; N26-E30 VanDerWaalsContact O-CB 3.26Å; N26-E30 WeakPolarHBondContact O-CB 3.31Å; N26-E30 PolarHBondContact O-N 2.69Å
27C59.7Low64.4Low63 Ų6395.6 Ų95.643%0.42649%0.486SS..Hα-helixtrans-67-39.7174.1-1790000110.7K23 W24 H29 E30 L31K23-C27 WeakPolarHBondContact O-CB 3.41Å; K23-C27 PolarHBondContact O-N 3.34Å; W24-C27 PolarHBondContact O-N 3.47Å; C27-H29 VanDerWaalsContact C-N 3.29Å; C27-H29 PolarHBondContact O-N 2.78Å; C27-E30 PolarHBondContact O-N 3.19Å; C27-L31 WeakPolarHBondContact O-CB 2.96Å; C27-L31 VanDerWaalsContact O-CG 3.29Å; C27-L31 WeakPolarHBondContact O-CG 3.34Å; C27-L31 PolarHBondContact O-N 3.28Å
28S59.4Low62.4Low48 Ų4895.4 Ų95.434%0.33649%0.488SS..Hα-helixtrans-66.2-34.1172.578.30000111.5W24 V25 N26 N32W24-S28 VanDerWaalsContact O-CB 3.3Å; W24-S28 WeakPolarHBondContact O-CB 3.29Å; W24-S28 PolarHBondContact O-N 2.8Å; W24-S28 PolarHBondContact O-OG 3.44Å; V25-S28 WeakPolarHBondContact CA-OG 3.44Å; V25-S28 CarbonylContact O-C 3.58Å; V25-S28 PolarHBondContact O-N 2.79Å; V25-S28 PolarHBondContact O-OG 3.5Å; N26-S28 VanDerWaalsContact C-N 3.35Å; S28-N32 WeakPolarHBondContact O-CA 3.21Å; S28-N32 WeakPolarHBondContact O-CB 2.95Å; S28-N32 PolarHBondContact O-N 3.44Å
29H58Low60.6Low103 Ų10395.1 Ų95.148%0.47749%0.493SS..Hα-helixtrans-68.9-49.3174.5-168.1-83.5000109.4V25 N26 C27 L31 N32 E33V25-H29 VanDerWaalsContact O-CB 3.31Å; V25-H29 WeakPolarHBondContact O-CB 3.19Å; V25-H29 PolarHBondContact O-N 2.8Å; N26-H29 CarbonylContact O-C 3.51Å; N26-H29 WeakPolarHBondContact O-CB 3.29Å; N26-H29 PolarHBondContact O-N 2.79Å; C27-H29 VanDerWaalsContact C-N 3.29Å; C27-H29 PolarHBondContact O-N 2.78Å; H29-L31 PolarHBondContact O-N 2.85Å; H29-N32 CarbonylContact O-C 3.54Å; H29-N32 PolarHBondContact O-N 3.42Å; H29-E33 VanDerWaalsContact CE1-CD 3.48Å; H29-E33 IonicContact CE1-OE1 3.56Å; H29-E33 IonicContact CE1-OE2 3.22Å; H29-E33 PolarHBondContact CE1-OE2 3.5Å; H29-E33 IonicContact ND1-OE2 2.91Å; H29-E33 PolarHBondContact ND1-OE2 3.23Å; H29-E33 WeakPolarHBondContact O-CA 3.26Å; H29-E33 WeakPolarHBondContact O-CB 3.47Å; H29-E33 PolarHBondContact O-N 2.72Å
30E56.6Low59.2Low119 Ų11996.4 Ų96.456%0.55650%0.497SS*.Hα-helixtrans-65.5-36.2179.2-168.6173.3-166.100111.8N26 C27 E33 H34N26-E30 VanDerWaalsContact O-CB 3.26Å; N26-E30 WeakPolarHBondContact O-CB 3.31Å; N26-E30 PolarHBondContact O-N 2.69Å; C27-E30 PolarHBondContact O-N 3.19Å; E30-E33 PolarHBondContact O-N 2.91Å; E30-H34 WeakPolarHBondContact O-CB 2.86Å; E30-H34 PolarHBondContact O-CD2 2.69Å; E30-H34 PolarHBondContact O-N 2.59Å
31L54.3Low58.2Low106 Ų106100.6 Ų100.656%0.55551%0.506SS*.Hα-helixtrans-70-42.7170.9-79166.5000111.8C27 H29 E33 T35C27-L31 WeakPolarHBondContact O-CB 2.96Å; C27-L31 VanDerWaalsContact O-CG 3.29Å; C27-L31 WeakPolarHBondContact O-CG 3.34Å; C27-L31 PolarHBondContact O-N 3.28Å; H29-L31 PolarHBondContact O-N 2.85Å; L31-E33 VanDerWaalsContact C-N 3.26Å; L31-T35 WeakPolarHBondContact O-CB 3.24Å; L31-T35 PolarHBondContact O-N 2.7Å; L31-T35 PolarHBondContact O-OG1 2.58Å
32N51.7Low57.5Low107 Ų107104.6 Ų104.657%0.57252%0.517SS*.Hα-helixtrans-71.9-25.3176.3-164.133.5000110.8S28 H29 S36S28-N32 WeakPolarHBondContact O-CA 3.21Å; S28-N32 WeakPolarHBondContact O-CB 2.95Å; S28-N32 PolarHBondContact O-N 3.44Å; H29-N32 CarbonylContact O-C 3.54Å; H29-N32 PolarHBondContact O-N 3.42Å; N32-S36 VanDerWaalsContact O-CA 3.24Å; N32-S36 WeakPolarHBondContact O-CA 2.82Å; N32-S36 WeakPolarHBondContact O-CB 3.26Å; N32-S36 PolarHBondContact O-N 2.65Å; N32-S36 PolarHBondContact O-OG 3.22Å
33E50.3Low57Low98 Ų98108.4 Ų108.446%0.45853%0.525SS..Hα-helixtrans-82.7-38.6177.3-166.3164.8-14700108.4H29 E30 L31 E37H29-E33 VanDerWaalsContact CE1-CD 3.48Å; H29-E33 IonicContact CE1-OE1 3.56Å; H29-E33 IonicContact CE1-OE2 3.22Å; H29-E33 PolarHBondContact CE1-OE2 3.5Å; H29-E33 IonicContact ND1-OE2 2.91Å; H29-E33 PolarHBondContact ND1-OE2 3.23Å; H29-E33 WeakPolarHBondContact O-CA 3.26Å; H29-E33 WeakPolarHBondContact O-CB 3.47Å; H29-E33 PolarHBondContact O-N 2.72Å; E30-E33 PolarHBondContact O-N 2.91Å; L31-E33 VanDerWaalsContact C-N 3.26Å; E33-E37 VanDerWaalsContact O-CA 3.26Å; E33-E37 WeakPolarHBondContact O-CA 3.18Å; E33-E37 WeakPolarHBondContact O-CB 3.32Å; E33-E37 PolarHBondContact O-N 2.76Å
34H48Very low56.9Low117 Ų117106.4 Ų106.454%0.54252%0.52SS..Hα-helixtrans-68.3-38.1168.9-92.4-67000113E30 T38E30-H34 WeakPolarHBondContact O-CB 2.86Å; E30-H34 PolarHBondContact O-CD2 2.69Å; E30-H34 PolarHBondContact O-N 2.59Å; H34-T38 PolarHBondContact O-N 2.97Å; H34-T38 PolarHBondContact O-OG1 2.81Å
35T42.8Very low57Low88 Ų88103.4 Ų103.454%0.5451%0.513SS..Hα-helixtrans-78.6-41.4-179.5-51.90000111.3L31 S39L31-T35 WeakPolarHBondContact O-CB 3.24Å; L31-T35 PolarHBondContact O-N 2.7Å; L31-T35 PolarHBondContact O-OG1 2.58Å; T35-S39 WeakPolarHBondContact O-CB 3.47Å; T35-S39 PolarHBondContact O-N 2.84Å; T35-S39 VanDerWaalsContact O-N 3.16Å; T35-S39 PolarHBondContact O-OG 3.16Å
36S46.6Very low57.5Low34 Ų34104.1 Ų104.124%0.23852%0.518CS..Hα-helixtrans-76.4-35.7174.477.80000111.3N32 T38 S39 L40N32-S36 VanDerWaalsContact O-CA 3.24Å; N32-S36 WeakPolarHBondContact O-CA 2.82Å; N32-S36 WeakPolarHBondContact O-CB 3.26Å; N32-S36 PolarHBondContact O-N 2.65Å; N32-S36 PolarHBondContact O-OG 3.22Å; S36-T38 PolarHBondContact O-N 3.48Å; S36-S39 CarbonylContact O-C 3.47Å; S36-S39 WeakPolarHBondContact O-CA 3.23Å; S36-S39 PolarHBondContact O-N 3.31Å; S36-L40 WeakPolarHBondContact O-CA 3.11Å; S36-L40 WeakPolarHBondContact O-CB 3.38Å; S36-L40 PolarHBondContact O-N 2.77Å
37E46.8Very low57.9Low116 Ų116102.1 Ų102.154%0.54251%0.509SS..Hα-helixtrans-60.4-38.5174.7-173.6-178.3-155.900109.6E33 S39 R41E33-E37 VanDerWaalsContact O-CA 3.26Å; E33-E37 WeakPolarHBondContact O-CA 3.18Å; E33-E37 WeakPolarHBondContact O-CB 3.32Å; E33-E37 PolarHBondContact O-N 2.76Å; E37-S39 PolarHBondContact O-N 3.27Å; E37-R41 WeakPolarHBondContact O-CA 3.49Å; E37-R41 WeakPolarHBondContact O-CB 3.47Å; E37-R41 PolarHBondContact O-N 2.72Å
38T48.3Very low58.5Low82 Ų82105.4 Ų105.450%0.50352%0.516SS..Hα-helixtrans-66.2-39.2173.1-45.40000112.3H34 S36 R42H34-T38 PolarHBondContact O-N 2.97Å; H34-T38 PolarHBondContact O-OG1 2.81Å; S36-T38 PolarHBondContact O-N 3.48Å; T38-R42 WeakPolarHBondContact O-CB 3.42Å; T38-R42 WeakPolarHBondContact O-CG 3.34Å; T38-R42 PolarHBondContact O-N 3.07Å; T38-R42 VanDerWaalsContact O-N 3.07Å
39S50.6Low59.3Low73 Ų73106.2 Ų106.251%0.5152%0.522SS..Hα-helixtrans-78-43.6-177.9-55.80000113.4T35 S36 E37 R42 W43T35-S39 WeakPolarHBondContact O-CB 3.47Å; T35-S39 PolarHBondContact O-N 2.84Å; T35-S39 VanDerWaalsContact O-N 3.16Å; T35-S39 PolarHBondContact O-OG 3.16Å; S36-S39 CarbonylContact O-C 3.47Å; S36-S39 WeakPolarHBondContact O-CA 3.23Å; S36-S39 PolarHBondContact O-N 3.31Å; E37-S39 PolarHBondContact O-N 3.27Å; S39-R42 CarbonylContact O-C 3.59Å; S39-R42 WeakPolarHBondContact O-CB 3.27Å; S39-R42 PolarHBondContact O-N 3.11Å; S39-W43 WeakPolarHBondContact O-CB 3.36Å; S39-W43 PolarHBondContact O-N 3.1Å
40L54Low60.1Low85 Ų85108.2 Ų108.245%0.44553%0.529SS..Hα-helixtrans-64.7-44.6170.4-89153.7000110.5S36 R42 W43 I44S36-L40 WeakPolarHBondContact O-CA 3.11Å; S36-L40 WeakPolarHBondContact O-CB 3.38Å; S36-L40 PolarHBondContact O-N 2.77Å; L40-R42 VanDerWaalsContact C-N 3.28Å; L40-R42 PolarHBondContact O-N 2.75Å; L40-W43 CarbonylContact O-C 3.39Å; L40-W43 PolarHBondContact O-N 3.39Å; L40-W43 VanDerWaalsContact O-N 3.11Å; L40-I44 HydrophobicContact CD2-CD1 4.48Å; L40-I44 VanDerWaalsContact O-CB 3.27Å; L40-I44 WeakPolarHBondContact O-CB 3.45Å; L40-I44 VanDerWaalsContact O-CG1 3.23Å; L40-I44 WeakPolarHBondContact O-CG1 2.84Å; L40-I44 PolarHBondContact O-N 3.42Å
41R58.1Low60.7Low184 Ų184108.1 Ų108.169%0.69453%0.532SS*.Hα-helixtrans-60.5-42.9173.4-175.7177.4177.3-137.2-2.1109.9E37 H45E37-R41 WeakPolarHBondContact O-CA 3.49Å; E37-R41 WeakPolarHBondContact O-CB 3.47Å; E37-R41 PolarHBondContact O-N 2.72Å; R41-H45 WeakPolarHBondContact O-CB 3.09Å; R41-H45 PolarHBondContact O-N 2.61Å
42R63.8Low61.4Low185 Ų185110.4 Ų110.470%0.69854%0.538SS*.Hα-helixtrans-62.6-41.8171.7-86.2-177.5-179.8173.52112.5T38 S39 L40 H45 T46T38-R42 WeakPolarHBondContact O-CB 3.42Å; T38-R42 WeakPolarHBondContact O-CG 3.34Å; T38-R42 PolarHBondContact O-N 3.07Å; T38-R42 VanDerWaalsContact O-N 3.07Å; S39-R42 CarbonylContact O-C 3.59Å; S39-R42 WeakPolarHBondContact O-CB 3.27Å; S39-R42 PolarHBondContact O-N 3.11Å; L40-R42 VanDerWaalsContact C-N 3.28Å; L40-R42 PolarHBondContact O-N 2.75Å; R42-H45 PolarHBondContact O-N 3.36Å; R42-T46 WeakPolarHBondContact O-CB 3.35Å; R42-T46 PolarHBondContact O-N 2.85Å; R42-T46 PolarHBondContact O-OG1 2.94Å
43W69.5Low61.9Low176 Ų176113.1 Ų113.167%0.66755%0.547SS*.Hα-helixtrans-68.1-50.9-178.2-166.284000111.7S39 L40 H45 T46 V47S39-W43 WeakPolarHBondContact O-CB 3.36Å; S39-W43 PolarHBondContact O-N 3.1Å; L40-W43 CarbonylContact O-C 3.39Å; L40-W43 PolarHBondContact O-N 3.39Å; L40-W43 VanDerWaalsContact O-N 3.11Å; W43-H45 VanDerWaalsContact C-N 3.31Å; W43-H45 PolarHBondContact O-N 2.67Å; W43-T46 WeakPolarHBondContact O-CB 3.47Å; W43-T46 PolarHBondContact O-N 2.89Å; W43-T46 VanDerWaalsContact O-N 3.1Å; W43-V47 HydrophobicContact CD2-CG2 4Å; W43-V47 HydrophobicContact CE3-CG2 3.96Å; W43-V47 HydrophobicContact CH2-CG2 3.96Å; W43-V47 HydrophobicContact CZ2-CG2 3.99Å; W43-V47 HydrophobicContact CZ3-CG2 3.94Å; W43-V47 WeakPolarHBondContact O-CG2 3.4Å; W43-V47 PolarHBondContact O-N 3.49Å
44I71.1Confident62.2Low93 Ų93114.2 Ų114.248%0.47756%0.555SS.*Hα-helixtrans-55.6-47.2173.4-67.8167.9000109.7L40 T46 V47 F48L40-I44 HydrophobicContact CD2-CD1 4.48Å; L40-I44 VanDerWaalsContact O-CB 3.27Å; L40-I44 WeakPolarHBondContact O-CB 3.45Å; L40-I44 VanDerWaalsContact O-CG1 3.23Å; L40-I44 WeakPolarHBondContact O-CG1 2.84Å; L40-I44 PolarHBondContact O-N 3.42Å; I44-T46 VanDerWaalsContact C-N 3.31Å; I44-T46 PolarHBondContact O-N 2.95Å; I44-V47 PolarHBondContact O-N 2.8Å; I44-F48 WeakPolarHBondContact O-CB 3.35Å; I44-F48 PolarHBondContact O-N 2.93Å
45H70.9Confident62.4Low123 Ų123120 Ų12057%0.56958%0.58SS**Hα-helixtrans-64.9-34.7179.1-159.6-67000112.5R41 R42 W43 S49R41-H45 WeakPolarHBondContact O-CB 3.09Å; R41-H45 PolarHBondContact O-N 2.61Å; R42-H45 PolarHBondContact O-N 3.36Å; W43-H45 VanDerWaalsContact C-N 3.31Å; W43-H45 PolarHBondContact O-N 2.67Å; H45-S49 WeakPolarHBondContact O-CB 3.38Å; H45-S49 PolarHBondContact O-N 3.32Å; H45-S49 PolarHBondContact O-OG 3.45Å
46T78.8Confident63.3Low91 Ų91121.6 Ų121.656%0.55858%0.582SS**Hα-helixtrans-68.8-46.2175.8-56.30000110.7R42 W43 I44 S49 F50R42-T46 WeakPolarHBondContact O-CB 3.35Å; R42-T46 PolarHBondContact O-N 2.85Å; R42-T46 PolarHBondContact O-OG1 2.94Å; W43-T46 WeakPolarHBondContact O-CB 3.47Å; W43-T46 PolarHBondContact O-N 2.89Å; W43-T46 VanDerWaalsContact O-N 3.1Å; I44-T46 VanDerWaalsContact C-N 3.31Å; I44-T46 PolarHBondContact O-N 2.95Å; T46-S49 PolarHBondContact O-N 3.39Å; T46-F50 WeakPolarHBondContact O-CB 3.36Å; T46-F50 PolarHBondContact O-N 3.27Å
47V76.2Confident64.2Low53 Ų53126.2 Ų126.232%0.32160%0.6SS.*Hα-helixtrans-61.9-44.5176.2172.50000110.7W43 I44 F50 L51W43-V47 HydrophobicContact CD2-CG2 4Å; W43-V47 HydrophobicContact CE3-CG2 3.96Å; W43-V47 HydrophobicContact CH2-CG2 3.96Å; W43-V47 HydrophobicContact CZ2-CG2 3.99Å; W43-V47 HydrophobicContact CZ3-CG2 3.94Å; W43-V47 WeakPolarHBondContact O-CG2 3.4Å; W43-V47 PolarHBondContact O-N 3.49Å; I44-V47 PolarHBondContact O-N 2.8Å; V47-F50 PolarHBondContact O-N 2.93Å; V47-L51 HydrophobicContact CG1-CD1 3.93Å; V47-L51 HydrophobicContact CG1-CG 4.44Å; V47-L51 WeakPolarHBondContact O-CG 3.33Å; V47-L51 PolarHBondContact O-N 3.47Å
48F72.2Confident65.2Low133 Ų133126.8 Ų126.858%0.58360%0.603SS**Hα-helixtrans-63.5-47.7178.6-131-90.5000111.6I44 F50 L51 F52I44-F48 WeakPolarHBondContact O-CB 3.35Å; I44-F48 PolarHBondContact O-N 2.93Å; F48-F50 VanDerWaalsContact C-N 3.27Å; F48-F50 PolarHBondContact O-N 3.37Å; F48-L51 PolarHBondContact O-N 2.98Å; F48-F52 WeakPolarHBondContact O-CB 3.25Å; F48-F52 PolarHBondContact O-N 3.44Å
49S76.2Confident66.2Low64 Ų64129.4 Ų129.445%0.44861%0.609SS.*Hα-helixtrans-60-37.3175.2-76.60000112.1H45 T46 H53H45-S49 WeakPolarHBondContact O-CB 3.38Å; H45-S49 PolarHBondContact O-N 3.32Å; H45-S49 PolarHBondContact O-OG 3.45Å; T46-S49 PolarHBondContact O-N 3.39Å; S49-H53 VanDerWaalsContact O-CB 3.25Å; S49-H53 WeakPolarHBondContact O-CB 3.37Å; S49-H53 PolarHBondContact O-N 2.93Å
50F75.9Confident67.2Low145 Ų145132.9 Ų132.964%0.63662%0.615SS**Hα-helixtrans-71.1-40.5179.5-157.6-87.7000113T46 V47 F48 H53 N54T46-F50 WeakPolarHBondContact O-CB 3.36Å; T46-F50 PolarHBondContact O-N 3.27Å; V47-F50 PolarHBondContact O-N 2.93Å; F48-F50 VanDerWaalsContact C-N 3.27Å; F48-F50 PolarHBondContact O-N 3.37Å; F50-H53 PolarHBondContact O-N 3.26Å; F50-N54 WeakPolarHBondContact CE1-ND2 3.39Å; F50-N54 PolarHBondContact O-N 3.03Å; F50-N54 PolarHBondContact O-ND2 3.34Å
51L69.2Low68Low117 Ų117136.1 Ų136.161%0.61363%0.626SS**Hα-helixtrans-66-43.7175.4-74171.7000111.2V47 F48 H53 N54 F55V47-L51 HydrophobicContact CG1-CD1 3.93Å; V47-L51 HydrophobicContact CG1-CG 4.44Å; V47-L51 WeakPolarHBondContact O-CG 3.33Å; V47-L51 PolarHBondContact O-N 3.47Å; F48-L51 PolarHBondContact O-N 2.98Å; L51-H53 VanDerWaalsContact C-N 3.29Å; L51-H53 PolarHBondContact O-N 3.36Å; L51-N54 PolarHBondContact O-N 3.48Å; L51-F55 PolarHBondContact O-N 3.26Å
52F67.7Low68.7Low154 Ų154132.7 Ų132.768%0.67562%0.621SS**Hα-helixtrans-70.9-25.7179.4-138.9-86.3000112.8F48 N54F48-F52 WeakPolarHBondContact O-CB 3.25Å; F48-F52 PolarHBondContact O-N 3.44Å; F52-N54 VanDerWaalsContact C-N 3.32Å
53H63.4Low69.1Low165 Ų165128.7 Ų128.776%0.76462%0.615SS**Hα-helixtrans-76.5-20.3175.1-159.673000113.1S49 F50 L51S49-H53 VanDerWaalsContact O-CB 3.25Å; S49-H53 WeakPolarHBondContact O-CB 3.37Å; S49-H53 PolarHBondContact O-N 2.93Å; F50-H53 PolarHBondContact O-N 3.26Å; L51-H53 VanDerWaalsContact C-N 3.29Å; L51-H53 PolarHBondContact O-N 3.36Å
54N56Low69.1Low120 Ų120124.8 Ų124.864%0.64261%0.611SS**THydrogen-bonded Turntrans-930.9175.7-83-73.3000113.6F50 L51 F52F50-N54 WeakPolarHBondContact CE1-ND2 3.39Å; F50-N54 PolarHBondContact O-N 3.03Å; F50-N54 PolarHBondContact O-ND2 3.34Å; L51-N54 PolarHBondContact O-N 3.48Å; F52-N54 VanDerWaalsContact C-N 3.32Å
55F51.6Low68.9Low239 Ų239127.6 Ų127.6100%1.04862%0.623SS**  trans-109.10175.8-150.5-82.3000110.1L51L51-F55 PolarHBondContact O-N 3.26Å

Retrieved 55 of 55 residues in 59.8 ms (Link to these results)