A0A5K4F9G0_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A5K4F9G0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 91 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
1M51.7Low49.4Very low208 Ų208123.5 Ų123.5100%1.02557%0.572SS**  0-43.80-111.8170.211800113.4W3 R4M1-W3 PolarHBondContact O-N 3.22Å; M1-R4 PolarHBondContact O-N 2.86Å
2I51.5Low49.5Very low145 Ų145125.3 Ų125.374%0.74458%0.577SS**Hα-helixtrans-58.5-37.5-174.4-65.8154.2000114.4R4 I5 W6I2-R4 VanDerWaalsContact C-N 3.31Å; I2-R4 PolarHBondContact O-N 3.03Å; I2-I5 PolarHBondContact O-N 3.38Å; I2-W6 PolarHBondContact O-N 3.02Å; I2-W6 VanDerWaalsContact O-N 3.12Å
3W42.2Very low49.8Very low185 Ų185120.1 Ų120.170%0.70156%0.56SS**Hα-helixtrans-61.8-34.2-179.4-179.662.7000114M1 W6 I7M1-W3 PolarHBondContact O-N 3.22Å; W3-W6 PolarHBondContact O-N 3.21Å; W3-I7 HydrophobicContact CD2-CD1 3.85Å; W3-I7 VanDerWaalsContact CE2-CD1 3.43Å; W3-I7 HydrophobicContact CE3-CD1 4.25Å; W3-I7 HydrophobicContact CG-CD1 4.44Å; W3-I7 HydrophobicContact CH2-CD1 3.93Å; W3-I7 HydrophobicContact CZ2-CD1 3.49Å; W3-I7 VanDerWaalsContact CZ2-CD1 3.49Å; W3-I7 HydrophobicContact CZ3-CD1 4.28Å; W3-I7 WeakPolarHBondContact O-CG1 3.44Å; W3-I7 PolarHBondContact O-N 3.45Å
4R44.3Very low50.2Low194 Ų194116.3 Ų116.373%0.73254%0.544SS*.Hα-helixtrans-69.9-39.7176.9-73.4-174166.8-158.2-3.6111.9M1 I2 W6 I7 T8M1-R4 PolarHBondContact O-N 2.86Å; I2-R4 VanDerWaalsContact C-N 3.31Å; I2-R4 PolarHBondContact O-N 3.03Å; R4-W6 VanDerWaalsContact C-N 3.31Å; R4-W6 PolarHBondContact O-N 3.04Å; R4-I7 PolarHBondContact O-N 3.44Å; R4-T8 PolarHBondContact O-N 3.45Å; R4-T8 PolarHBondContact O-OG1 2.8Å
5I46.5Very low50.3Low97 Ų97114.7 Ų114.750%0.49754%0.539SS..Hα-helixtrans-62.8-41.4177.3-64165.5000110I2 T8 I9I2-I5 PolarHBondContact O-N 3.38Å; I5-T8 PolarHBondContact O-N 2.77Å; I5-I9 HydrophobicContact CG2-CD1 3.89Å; I5-I9 VanDerWaalsContact O-CG1 3.32Å; I5-I9 WeakPolarHBondContact O-CG1 3.29Å; I5-I9 PolarHBondContact O-N 3.11Å
6W52Low50.3Low155 Ų155115.4 Ų115.459%0.58754%0.537SS*.Hα-helixtrans-60-47.2175.7-175.7-101.2000112.3I2 W3 R4 T8 I9 Q10I2-W6 PolarHBondContact O-N 3.02Å; I2-W6 VanDerWaalsContact O-N 3.12Å; W3-W6 PolarHBondContact O-N 3.21Å; R4-W6 VanDerWaalsContact C-N 3.31Å; R4-W6 PolarHBondContact O-N 3.04Å; W6-T8 VanDerWaalsContact C-N 3.34Å; W6-T8 PolarHBondContact O-N 3.3Å; W6-I9 PolarHBondContact O-N 2.92Å; W6-Q10 VanDerWaalsContact O-CG 3.3Å; W6-Q10 WeakPolarHBondContact O-CG 3.27Å; W6-Q10 PolarHBondContact O-N 3.46Å
7I48.7Very low50.5Low64 Ų64113.8 Ų113.833%0.32853%0.528SS..Hα-helixtrans-61.6-41.9177.6-69.1168.1000111.4W3 R4 I9 Q10 L11W3-I7 HydrophobicContact CD2-CD1 3.85Å; W3-I7 VanDerWaalsContact CE2-CD1 3.43Å; W3-I7 HydrophobicContact CE3-CD1 4.25Å; W3-I7 HydrophobicContact CG-CD1 4.44Å; W3-I7 HydrophobicContact CH2-CD1 3.93Å; W3-I7 HydrophobicContact CZ2-CD1 3.49Å; W3-I7 VanDerWaalsContact CZ2-CD1 3.49Å; W3-I7 HydrophobicContact CZ3-CD1 4.28Å; W3-I7 WeakPolarHBondContact O-CG1 3.44Å; W3-I7 PolarHBondContact O-N 3.45Å; R4-I7 PolarHBondContact O-N 3.44Å; I7-I9 PolarHBondContact O-N 3.48Å; I7-Q10 PolarHBondContact O-N 2.86Å; I7-L11 HydrophobicContact CG2-CD1 3.83Å; I7-L11 WeakPolarHBondContact O-CB 3.31Å; I7-L11 PolarHBondContact O-N 3.19Å
8T49.7Very low50.6Low92 Ų92111.1 Ų111.156%0.56452%0.521SS*.Hα-helixtrans-63.7-41.3178.4-54.90000112.1R4 I5 W6 L11 F12R4-T8 PolarHBondContact O-N 3.45Å; R4-T8 PolarHBondContact O-OG1 2.8Å; I5-T8 PolarHBondContact O-N 2.77Å; W6-T8 VanDerWaalsContact C-N 3.34Å; W6-T8 PolarHBondContact O-N 3.3Å; T8-L11 PolarHBondContact O-N 3.39Å; T8-F12 WeakPolarHBondContact O-CB 3.35Å; T8-F12 PolarHBondContact O-N 2.97Å
9I54.3Low50.5Low86 Ų86110.4 Ų110.444%0.44152%0.521SS..Hα-helixtrans-63.3-44.5176.2-67.5165.5000110.1I5 W6 I7 L11 F12 V13I5-I9 HydrophobicContact CG2-CD1 3.89Å; I5-I9 VanDerWaalsContact O-CG1 3.32Å; I5-I9 WeakPolarHBondContact O-CG1 3.29Å; I5-I9 PolarHBondContact O-N 3.11Å; W6-I9 PolarHBondContact O-N 2.92Å; I7-I9 PolarHBondContact O-N 3.48Å; I9-L11 PolarHBondContact O-N 3.32Å; I9-F12 PolarHBondContact O-N 2.75Å; I9-V13 HydrophobicContact CG2-CG2 4.46Å; I9-V13 VanDerWaalsContact O-CG2 3.29Å; I9-V13 WeakPolarHBondContact O-CG2 3.14Å; I9-V13 PolarHBondContact O-N 2.81Å
10Q50.1Low50.6Low40 Ų40110 Ų11019%0.18752%0.517CS..Hα-helixtrans-61.8-44.4177.2-67.1-65.6-36.100111.8W6 I7 F12 V13 I14W6-Q10 VanDerWaalsContact O-CG 3.3Å; W6-Q10 WeakPolarHBondContact O-CG 3.27Å; W6-Q10 PolarHBondContact O-N 3.46Å; I7-Q10 PolarHBondContact O-N 2.86Å; Q10-F12 PolarHBondContact O-N 3.07Å; Q10-V13 PolarHBondContact O-N 2.98Å; Q10-I14 WeakPolarHBondContact O-CD1 3.45Å; Q10-I14 WeakPolarHBondContact O-CG1 3.25Å; Q10-I14 PolarHBondContact O-N 2.98Å
11L51.8Low50.4Low93 Ų93106 Ų10649%0.48751%0.505SS..Hα-helixtrans-61.5-41.5174.9-83.3161.6000112.4I7 T8 I9 I14 I15I7-L11 HydrophobicContact CG2-CD1 3.83Å; I7-L11 WeakPolarHBondContact O-CB 3.31Å; I7-L11 PolarHBondContact O-N 3.19Å; T8-L11 PolarHBondContact O-N 3.39Å; I9-L11 PolarHBondContact O-N 3.32Å; L11-I14 PolarHBondContact O-N 3.22Å; L11-I15 WeakPolarHBondContact O-CB 3.38Å; L11-I15 VanDerWaalsContact O-CG1 3.25Å; L11-I15 WeakPolarHBondContact O-CG1 3.46Å; L11-I15 PolarHBondContact O-N 2.58Å
12F51.4Low50.1Low145 Ų145100.8 Ų100.864%0.63648%0.481SS*.Hα-helixtrans-64.4-43.2177.5-174.4-94.1000111.8T8 I9 Q10 I15 Y16T8-F12 WeakPolarHBondContact O-CB 3.35Å; T8-F12 PolarHBondContact O-N 2.97Å; I9-F12 PolarHBondContact O-N 2.75Å; Q10-F12 PolarHBondContact O-N 3.07Å; F12-I15 PolarHBondContact O-N 3.23Å; F12-Y16 VanDerWaalsContact O-CB 3.31Å; F12-Y16 WeakPolarHBondContact O-CB 3.28Å; F12-Y16 PolarHBondContact O-N 3Å
13V52.9Low49.6Very low57 Ų57100 Ų10035%0.34547%0.474SS..Hα-helixtrans-61.4-46.2175.2171.90000110.2I9 Q10 I15 Y16 F17I9-V13 HydrophobicContact CG2-CG2 4.46Å; I9-V13 VanDerWaalsContact O-CG2 3.29Å; I9-V13 WeakPolarHBondContact O-CG2 3.14Å; I9-V13 PolarHBondContact O-N 2.81Å; Q10-V13 PolarHBondContact O-N 2.98Å; V13-I15 PolarHBondContact O-N 3.34Å; V13-Y16 PolarHBondContact O-N 3.41Å; V13-F17 HydrophobicContact CG1-CD2 3.64Å; V13-F17 HydrophobicContact CG1-CE2 3.78Å; V13-F17 VanDerWaalsContact O-CD2 3.27Å; V13-F17 WeakPolarHBondContact O-CD2 3.42Å; V13-F17 PolarHBondContact O-N 2.92Å
14I54.9Low49.6Very low67 Ų6794.9 Ų94.934%0.34446%0.463SS..Hα-helixtrans-60-47.3177-68.2162.7000111.1Q10 L11 F17 T18Q10-I14 WeakPolarHBondContact O-CD1 3.45Å; Q10-I14 WeakPolarHBondContact O-CG1 3.25Å; Q10-I14 PolarHBondContact O-N 2.98Å; L11-I14 PolarHBondContact O-N 3.22Å; I14-F17 PolarHBondContact O-N 3.37Å; I14-T18 WeakPolarHBondContact O-CB 3.05Å; I14-T18 PolarHBondContact O-N 2.84Å; I14-T18 PolarHBondContact O-OG1 3.34Å
15I52.6Low49.5Very low92 Ų9287.9 Ų87.947%0.47244%0.443SS..Hα-helixtrans-64.9-41.1179.4-67.5164.8000111.1L11 F12 V13 T18 N19L11-I15 WeakPolarHBondContact O-CB 3.38Å; L11-I15 VanDerWaalsContact O-CG1 3.25Å; L11-I15 WeakPolarHBondContact O-CG1 3.46Å; L11-I15 PolarHBondContact O-N 2.58Å; F12-I15 PolarHBondContact O-N 3.23Å; V13-I15 PolarHBondContact O-N 3.34Å; I15-T18 PolarHBondContact O-N 2.72Å; I15-N19 WeakPolarHBondContact O-CB 3.42Å; I15-N19 PolarHBondContact O-N 2.76Å; I15-N19 PolarHBondContact O-ND2 3.4Å
16Y49.8Very low49.4Very low127 Ų12786.7 Ų86.750%0.49845%0.448SS..Hα-helixtrans-62.7-48.8177.8-177.1-92.6000111.7F12 V13 T18 N19 K20F12-Y16 VanDerWaalsContact O-CB 3.31Å; F12-Y16 WeakPolarHBondContact O-CB 3.28Å; F12-Y16 PolarHBondContact O-N 3Å; V13-Y16 PolarHBondContact O-N 3.41Å; Y16-T18 VanDerWaalsContact C-N 3.33Å; Y16-N19 PolarHBondContact O-N 3.49Å; Y16-K20 HydrophobicContact CE1-CG 4.15Å; Y16-K20 WeakPolarHBondContact O-CB 3.45Å; Y16-K20 PolarHBondContact O-N 2.9Å
17F53.7Low49.1Very low88 Ų8890 Ų9039%0.38646%0.461SS..Hα-helixtrans-71.1-27176.7-80.4-74.5000112.8V13 I14 G21 I88V13-F17 HydrophobicContact CG1-CD2 3.64Å; V13-F17 HydrophobicContact CG1-CE2 3.78Å; V13-F17 VanDerWaalsContact O-CD2 3.27Å; V13-F17 WeakPolarHBondContact O-CD2 3.42Å; V13-F17 PolarHBondContact O-N 2.92Å; I14-F17 PolarHBondContact O-N 3.37Å; F17-G21 WeakPolarHBondContact O-CA 3.49Å; F17-G21 PolarHBondContact O-N 3.49Å; F17-I88 HydrophobicContact CD1-CD1 3.7Å; F17-I88 HydrophobicContact CD1-CG1 4.46Å; F17-I88 HydrophobicContact CE1-CD1 3.81Å; F17-I88 HydrophobicContact CG-CD1 4.18Å; F17-I88 HydrophobicContact CZ-CD1 4.36Å
18T52.9Low48.9Very low65 Ų6591.4 Ų91.440%0.39946%0.464SS..Hα-helixtrans-70-45.6172.5-60.40000110.1I14 I15 Y16 G21 I22I14-T18 WeakPolarHBondContact O-CB 3.05Å; I14-T18 PolarHBondContact O-N 2.84Å; I14-T18 PolarHBondContact O-OG1 3.34Å; I15-T18 PolarHBondContact O-N 2.72Å; Y16-T18 VanDerWaalsContact C-N 3.33Å; T18-G21 CarbonylContact O-C 3.6Å; T18-G21 PolarHBondContact O-N 2.86Å; T18-I22 HydrophobicContact CG2-CD1 3.52Å; T18-I22 HydrophobicContact CG2-CG1 4.25Å; T18-I22 VanDerWaalsContact O-CB 3.25Å; T18-I22 WeakPolarHBondContact O-CB 3.32Å; T18-I22 WeakPolarHBondContact O-CD1 3.12Å; T18-I22 WeakPolarHBondContact O-CG1 3.35Å; T18-I22 PolarHBondContact O-N 2.74Å
19N48.6Very low48.6Very low98 Ų9892.8 Ų92.852%0.52447%0.465SS..Hα-helixtrans-66.2-43177.6-76.4-35.7000112.3I15 Y16 I22 E23I15-N19 WeakPolarHBondContact O-CB 3.42Å; I15-N19 PolarHBondContact O-N 2.76Å; I15-N19 PolarHBondContact O-ND2 3.4Å; Y16-N19 PolarHBondContact O-N 3.49Å; N19-I22 PolarHBondContact O-N 3.25Å; N19-E23 PolarHBondContact O-N 3.43Å; N19-E23 VanDerWaalsContact O-N 3.15Å
20K52.3Low48.4Very low101 Ų10197.9 Ų97.944%0.43949%0.486SS..Hα-helixtrans-70.2-38.9174.4-74-66.9174.7-161.10112.7Y16 I22 E23 V24Y16-K20 HydrophobicContact CE1-CG 4.15Å; Y16-K20 WeakPolarHBondContact O-CB 3.45Å; Y16-K20 PolarHBondContact O-N 2.9Å; K20-I22 VanDerWaalsContact C-N 3.32Å; K20-I22 PolarHBondContact O-N 3.31Å; K20-E23 IonicContact NZ-OE2 3.16Å; K20-E23 PolarHBondContact NZ-OE2 3.47Å; K20-E23 VanDerWaalsContact NZ-OE2 3.16Å; K20-E23 PolarHBondContact O-N 2.76Å; K20-V24 VanDerWaalsContact O-CG2 3.29Å; K20-V24 WeakPolarHBondContact O-CG2 3.29Å; K20-V24 PolarHBondContact O-N 3.49Å
21G45.9Very low48.4Very low27 Ų2798.1 Ų98.128%0.27849%0.491SS..Hα-helixtrans-64.1-34.9174.400000112.1F17 T18 S25F17-G21 WeakPolarHBondContact O-CA 3.49Å; F17-G21 PolarHBondContact O-N 3.49Å; T18-G21 CarbonylContact O-C 3.6Å; T18-G21 PolarHBondContact O-N 2.86Å; G21-S25 WeakPolarHBondContact O-CA 3.49Å; G21-S25 WeakPolarHBondContact O-CB 3.4Å; G21-S25 PolarHBondContact O-N 3.04Å; G21-S25 PolarHBondContact O-OG 3.33Å
22I45.2Very low48.5Very low99 Ų9998.8 Ų98.851%0.50850%0.501SS..Hα-helixtrans-72.9-42176.6-72.1163.7000111.2T18 N19 K20 V24 S25 A26T18-I22 HydrophobicContact CG2-CD1 3.52Å; T18-I22 HydrophobicContact CG2-CG1 4.25Å; T18-I22 VanDerWaalsContact O-CB 3.25Å; T18-I22 WeakPolarHBondContact O-CB 3.32Å; T18-I22 WeakPolarHBondContact O-CD1 3.12Å; T18-I22 WeakPolarHBondContact O-CG1 3.35Å; T18-I22 PolarHBondContact O-N 2.74Å; N19-I22 PolarHBondContact O-N 3.25Å; K20-I22 VanDerWaalsContact C-N 3.32Å; K20-I22 PolarHBondContact O-N 3.31Å; I22-V24 VanDerWaalsContact C-N 3.3Å; I22-V24 PolarHBondContact O-N 3.26Å; I22-S25 PolarHBondContact O-N 3.44Å; I22-A26 WeakPolarHBondContact O-CB 3.05Å; I22-A26 PolarHBondContact O-N 2.82Å
23E42.3Very low48.6Very low129 Ų12997.2 Ų97.260%0.60350%0.498SS*.Hα-helixtrans-60.7-39.1173.5-82.7-174.6147.600112.1N19 K20N19-E23 PolarHBondContact O-N 3.43Å; N19-E23 VanDerWaalsContact O-N 3.15Å; K20-E23 IonicContact NZ-OE2 3.16Å; K20-E23 PolarHBondContact NZ-OE2 3.47Å; K20-E23 VanDerWaalsContact NZ-OE2 3.16Å; K20-E23 PolarHBondContact O-N 2.76Å
24V42.6Very low48.4Very low77 Ų7797 Ų9747%0.46749%0.492SS..Hα-helixtrans-73.7-46.3175.1175.90000110.2K20 I22 A26 R27 F28K20-V24 VanDerWaalsContact O-CG2 3.29Å; K20-V24 WeakPolarHBondContact O-CG2 3.29Å; K20-V24 PolarHBondContact O-N 3.49Å; I22-V24 VanDerWaalsContact C-N 3.3Å; I22-V24 PolarHBondContact O-N 3.26Å; V24-A26 VanDerWaalsContact C-N 3.29Å; V24-A26 PolarHBondContact O-N 3.36Å; V24-R27 PolarHBondContact O-N 2.82Å; V24-F28 HydrophobicContact CG1-CD2 3.72Å; V24-F28 HydrophobicContact CG1-CE2 3.7Å; V24-F28 VanDerWaalsContact O-CD2 3.29Å; V24-F28 WeakPolarHBondContact O-CD2 3.35Å; V24-F28 PolarHBondContact O-N 2.84Å
25S42.1Very low48.1Very low46 Ų4698.9 Ų98.932%0.32250%0.503SS..Hα-helixtrans-62-32.3-177-64.20000113.2G21 I22 R27 F28 Q29G21-S25 WeakPolarHBondContact O-CA 3.49Å; G21-S25 WeakPolarHBondContact O-CB 3.4Å; G21-S25 PolarHBondContact O-N 3.04Å; G21-S25 PolarHBondContact O-OG 3.33Å; I22-S25 PolarHBondContact O-N 3.44Å; S25-R27 PolarHBondContact O-N 3.15Å; S25-F28 PolarHBondContact O-N 3.41Å; S25-Q29 WeakPolarHBondContact O-CG 3.25Å; S25-Q29 PolarHBondContact O-N 3.21Å; S25-Q29 VanDerWaalsContact O-N 3.11Å
26A42.9Very low48.2Very low72 Ų72103.4 Ų103.460%0.59551%0.514SS*.Hα-helixtrans-62.6-23.9175.900000113.3I22 V24I22-A26 WeakPolarHBondContact O-CB 3.05Å; I22-A26 PolarHBondContact O-N 2.82Å; V24-A26 VanDerWaalsContact C-N 3.29Å; V24-A26 PolarHBondContact O-N 3.36Å
27R45.6Very low48.5Very low226 Ų226100.2 Ų100.285%0.85351%0.505SS*.Hα-helixtrans-92.2-12173.4-72.1-165.7173.7-156.2-0.7114.3V24 S25V24-R27 PolarHBondContact O-N 2.82Å; S25-R27 PolarHBondContact O-N 3.15Å
28F45.9Very low48.5Very low92 Ų92101.2 Ų101.240%0.40451%0.511SS..Hα-helixtrans-106.3-9.9-176.9-79.9-88000114.4V24 S25 E30 T31 F34V24-F28 HydrophobicContact CG1-CD2 3.72Å; V24-F28 HydrophobicContact CG1-CE2 3.7Å; V24-F28 VanDerWaalsContact O-CD2 3.29Å; V24-F28 WeakPolarHBondContact O-CD2 3.35Å; V24-F28 PolarHBondContact O-N 2.84Å; S25-F28 PolarHBondContact O-N 3.41Å; F28-E30 PolarHBondContact O-N 2.79Å; F28-T31 HydrophobicContact CD1-CG2 4.47Å; F28-T31 PolarHBondContact O-N 2.81Å; F28-T31 PolarHBondContact O-OG1 3.36Å; F28-F34 VanDerWaalsContact O-CB 3.31Å; F28-F34 WeakPolarHBondContact O-CB 3.29Å
29Q43.1Very low48.8Very low122 Ų122101.1 Ų101.157%0.5751%0.513SS*.THydrogen-bonded Turntrans-60.6-12.9179.6-84.9176.2400115.1S25 F34S25-Q29 WeakPolarHBondContact O-CG 3.25Å; S25-Q29 PolarHBondContact O-N 3.21Å; S25-Q29 VanDerWaalsContact O-N 3.11Å; Q29-F34 HydrophobicContact CG-CD1 4.33Å; Q29-F34 HydrophobicContact CG-CE1 3.86Å; Q29-F34 HydrophobicContact CG-CE2 4.21Å; Q29-F34 HydrophobicContact CG-CZ 3.79Å
30E50Low49.4Very low192 Ų192100.3 Ų100.390%0.89751%0.509SS*.THydrogen-bonded Turntrans-98.4-0.4175.6-64.9-172.3165.100114.2F28F28-E30 PolarHBondContact O-N 2.79Å
31T49.9Very low49.6Very low46 Ų4699 Ų9928%0.28251%0.506SS..SBendtrans-87.7137.4179.4560000111.7F28 I33 F34F28-T31 HydrophobicContact CD1-CG2 4.47Å; F28-T31 PolarHBondContact O-N 2.81Å; F28-T31 PolarHBondContact O-OG1 3.36Å; T31-I33 PolarHBondContact O-N 3.36Å; T31-F34 VanDerWaalsContact O-CB 3.29Å; T31-F34 WeakPolarHBondContact O-CB 3.17Å; T31-F34 PolarHBondContact O-N 3.43Å
32P52.9Low50.3Low107 Ų107100.8 Ų100.870%0.69551%0.514SS*.Hα-helixtrans-59-21.217523.1-33.1000112.8F34 R36P32-F34 VanDerWaalsContact C-N 3.35Å; P32-R36 PolarHBondContact O-N 3.36Å
33I54.9Low51.5Low112 Ų112100.9 Ų100.957%0.57451%0.512SS*.Hα-helixtrans-64.7-39.8172.7-60170.4000110.4T31 R36 I37T31-I33 PolarHBondContact O-N 3.36Å; I33-R36 PolarHBondContact O-N 2.99Å; I33-I37 HydrophobicContact CG2-CD1 3.66Å; I33-I37 HydrophobicContact CG2-CG1 4.19Å; I33-I37 WeakPolarHBondContact O-CB 3.32Å; I33-I37 VanDerWaalsContact O-CG1 3.25Å; I33-I37 WeakPolarHBondContact O-CG1 3.33Å; I33-I37 PolarHBondContact O-N 2.79Å
34F47.5Very low52.4Low53 Ų5398 Ų9823%0.23250%0.504CS..Hα-helixtrans-62.6-44.7177.7-171.3-92.5000112.1F28 Q29 T31 P32 R36 I37 Q38F28-F34 VanDerWaalsContact O-CB 3.31Å; F28-F34 WeakPolarHBondContact O-CB 3.29Å; Q29-F34 HydrophobicContact CG-CD1 4.33Å; Q29-F34 HydrophobicContact CG-CE1 3.86Å; Q29-F34 HydrophobicContact CG-CE2 4.21Å; Q29-F34 HydrophobicContact CG-CZ 3.79Å; T31-F34 VanDerWaalsContact O-CB 3.29Å; T31-F34 WeakPolarHBondContact O-CB 3.17Å; T31-F34 PolarHBondContact O-N 3.43Å; P32-F34 VanDerWaalsContact C-N 3.35Å; F34-R36 VanDerWaalsContact C-N 3.3Å; F34-R36 PolarHBondContact O-N 3.41Å; F34-I37 PolarHBondContact O-N 2.71Å; F34-Q38 VanDerWaalsContact O-CB 3.27Å; F34-Q38 WeakPolarHBondContact O-CB 3.47Å; F34-Q38 PolarHBondContact O-N 3.1Å
35N50.3Low53Low105 Ų105101.1 Ų101.156%0.56151%0.508SS*.Hα-helixtrans-62.7-37.2175.3-78.8-13.5000112.3Q38 S39N35-Q38 PolarHBondContact O-N 2.85Å; N35-S39 WeakPolarHBondContact O-CB 3.22Å; N35-S39 PolarHBondContact O-N 2.98Å
36R54.7Low54.1Low187 Ų187103 Ų10371%0.70651%0.512SS*.Hα-helixtrans-70.1-41.6176.8-162.1175-173.1-1741.2111.9P32 I33 F34 Q38 S39 N40P32-R36 PolarHBondContact O-N 3.36Å; I33-R36 PolarHBondContact O-N 2.99Å; F34-R36 VanDerWaalsContact C-N 3.3Å; F34-R36 PolarHBondContact O-N 3.41Å; R36-Q38 VanDerWaalsContact C-N 3.34Å; R36-S39 PolarHBondContact O-N 3.17Å; R36-N40 WeakPolarHBondContact O-CB 3.39Å; R36-N40 VanDerWaalsContact O-CG 3.26Å; R36-N40 PolarHBondContact O-N 3.17Å
37I55.4Low55.3Low60 Ų60108.3 Ų108.331%0.30852%0.517SS..Hα-helixtrans-61.3-45.9172.6-69.7170.3000109.5I33 F34 S39 N40 L41 L87I33-I37 HydrophobicContact CG2-CD1 3.66Å; I33-I37 HydrophobicContact CG2-CG1 4.19Å; I33-I37 WeakPolarHBondContact O-CB 3.32Å; I33-I37 VanDerWaalsContact O-CG1 3.25Å; I33-I37 WeakPolarHBondContact O-CG1 3.33Å; I33-I37 PolarHBondContact O-N 2.79Å; F34-I37 PolarHBondContact O-N 2.71Å; I37-S39 PolarHBondContact O-N 3.14Å; I37-N40 PolarHBondContact O-N 2.78Å; I37-L41 WeakPolarHBondContact O-CB 3.47Å; I37-L41 PolarHBondContact O-N 3.47Å; I37-L87 HydrophobicContact CG2-CD2 4.1Å
38Q54Low56Low109 Ų10999 Ų9951%0.50948%0.483SS..Hα-helixtrans-63.8-39.8-180-168.1-179.3-5.400112.1F34 N35 R36 L41 S42F34-Q38 VanDerWaalsContact O-CB 3.27Å; F34-Q38 WeakPolarHBondContact O-CB 3.47Å; F34-Q38 PolarHBondContact O-N 3.1Å; N35-Q38 PolarHBondContact O-N 2.85Å; R36-Q38 VanDerWaalsContact C-N 3.34Å; Q38-L41 PolarHBondContact O-N 3.1Å; Q38-S42 WeakPolarHBondContact O-CB 3.2Å; Q38-S42 PolarHBondContact O-N 3.41Å
39S58.3Low57Low63 Ų6399.1 Ų99.144%0.44148%0.484SS..Hα-helixtrans-63.8-49.5173.8-167.20000111.4N35 R36 I37 L41 S42 E43N35-S39 WeakPolarHBondContact O-CB 3.22Å; N35-S39 PolarHBondContact O-N 2.98Å; R36-S39 PolarHBondContact O-N 3.17Å; I37-S39 PolarHBondContact O-N 3.14Å; S39-L41 VanDerWaalsContact C-N 3.29Å; S39-L41 PolarHBondContact O-N 3.34Å; S39-S42 WeakPolarHBondContact O-CB 3.29Å; S39-S42 PolarHBondContact O-N 3.41Å; S39-E43 PolarHBondContact O-N 2.86Å
40N61.2Low58.3Low82 Ų8298 Ų9844%0.43948%0.482SS..Hα-helixtrans-63.7-36.7178.2-71.2-2.8000111.8R36 I37 E43 T44R36-N40 WeakPolarHBondContact O-CB 3.39Å; R36-N40 VanDerWaalsContact O-CG 3.26Å; R36-N40 PolarHBondContact O-N 3.17Å; I37-N40 PolarHBondContact O-N 2.78Å; N40-E43 PolarHBondContact O-N 3.08Å; N40-T44 WeakPolarHBondContact O-CB 3.49Å; N40-T44 PolarHBondContact O-N 2.83Å; N40-T44 PolarHBondContact O-OG1 2.78Å
41L55.8Low59.1Low74 Ų7492.5 Ų92.539%0.38746%0.456SS..Hα-helixtrans-67.8-40176.4-162.797.4000110.7I37 Q38 S39 T44 Y45 T83 L87I37-L41 WeakPolarHBondContact O-CB 3.47Å; I37-L41 PolarHBondContact O-N 3.47Å; Q38-L41 PolarHBondContact O-N 3.1Å; S39-L41 VanDerWaalsContact C-N 3.29Å; S39-L41 PolarHBondContact O-N 3.34Å; L41-T44 PolarHBondContact O-N 2.97Å; L41-Y45 WeakPolarHBondContact O-CB 3.38Å; L41-Y45 PolarHBondContact O-N 3.41Å; L41-T83 HydrophobicContact CD1-CG2 4.4Å; L41-L87 HydrophobicContact CD1-CD1 3.67Å; L41-L87 HydrophobicContact CD1-CG 4.47Å
42S61Low59.5Low64 Ų6492 Ų9245%0.44845%0.453SS..Hα-helixtrans-62.5-46.2175.1-165.60000110.9Q38 S39 T44 Y45 Q46Q38-S42 WeakPolarHBondContact O-CB 3.2Å; Q38-S42 PolarHBondContact O-N 3.41Å; S39-S42 WeakPolarHBondContact O-CB 3.29Å; S39-S42 PolarHBondContact O-N 3.41Å; S42-T44 PolarHBondContact O-N 2.64Å; S42-Y45 PolarHBondContact O-N 3.42Å; S42-Q46 WeakPolarHBondContact O-CB 3.35Å; S42-Q46 VanDerWaalsContact O-CG 3.28Å; S42-Q46 WeakPolarHBondContact O-CG 3.49Å; S42-Q46 PolarHBondContact O-N 2.96Å
43E70Confident60.2Low100 Ų10090.4 Ų90.447%0.46744%0.438SS..Hα-helixtrans-61.3-45.1175-72.6-178.7-161.100112.2S39 N40 Y45 Q46 R47S39-E43 PolarHBondContact O-N 2.86Å; N40-E43 PolarHBondContact O-N 3.08Å; E43-Y45 VanDerWaalsContact C-N 3.34Å; E43-Q46 PolarHBondContact O-N 3.16Å; E43-R47 WeakPolarHBondContact O-CG 3.46Å; E43-R47 PolarHBondContact O-N 2.96Å
44T61.8Low60.9Low70 Ų7089.3 Ų89.343%0.42943%0.434SS..Hα-helixtrans-65-41178.6-55.20000111N40 L41 S42 R47 L48N40-T44 WeakPolarHBondContact O-CB 3.49Å; N40-T44 PolarHBondContact O-N 2.83Å; N40-T44 PolarHBondContact O-OG1 2.78Å; L41-T44 PolarHBondContact O-N 2.97Å; S42-T44 PolarHBondContact O-N 2.64Å; T44-R47 PolarHBondContact O-N 3.5Å; T44-L48 WeakPolarHBondContact O-CB 3.37Å; T44-L48 PolarHBondContact O-N 2.86Å
45Y55.5Low61.5Low142 Ų14288.3 Ų88.356%0.55743%0.431SS*.Hα-helixtrans-65.2-42.5176.3179.1-96.8000111.7L41 S42 E43 L48 K49L41-Y45 WeakPolarHBondContact O-CB 3.38Å; L41-Y45 PolarHBondContact O-N 3.41Å; S42-Y45 PolarHBondContact O-N 3.42Å; E43-Y45 VanDerWaalsContact C-N 3.34Å; Y45-L48 PolarHBondContact O-N 3.18Å; Y45-K49 HydrophobicContact CE1-CD 4.34Å; Y45-K49 WeakPolarHBondContact O-CB 3.16Å; Y45-K49 PolarHBondContact O-N 2.69Å
46Q64.9Low62Low86 Ų8685.9 Ų85.940%0.40242%0.42SS..Hα-helixtrans-64.2-44175.4-69.7-64.8-11.600111.1S42 E43 L48 K49 D50S42-Q46 WeakPolarHBondContact O-CB 3.35Å; S42-Q46 VanDerWaalsContact O-CG 3.28Å; S42-Q46 WeakPolarHBondContact O-CG 3.49Å; S42-Q46 PolarHBondContact O-N 2.96Å; E43-Q46 PolarHBondContact O-N 3.16Å; Q46-L48 VanDerWaalsContact C-N 3.34Å; Q46-L48 PolarHBondContact O-N 3.3Å; Q46-K49 WeakPolarHBondContact O-CB 3.44Å; Q46-K49 PolarHBondContact O-N 2.78Å; Q46-D50 WeakPolarHBondContact O-CB 3.47Å; Q46-D50 PolarHBondContact O-N 2.94Å
47R68.5Low62.3Low182 Ų18283.6 Ų83.669%0.68742%0.415SS*.Hα-helixtrans-59.5-44.8174.2-73.2179.7-171.3-168.65.6112E43 T44 K49 D50 E51E43-R47 WeakPolarHBondContact O-CG 3.46Å; E43-R47 PolarHBondContact O-N 2.96Å; T44-R47 PolarHBondContact O-N 3.5Å; R47-K49 VanDerWaalsContact C-N 3.33Å; R47-D50 PolarHBondContact O-N 3.49Å; R47-E51 WeakPolarHBondContact O-CB 3.47Å; R47-E51 PolarHBondContact O-N 3.38Å
48L60.7Low62.4Low30 Ų3086.1 Ų86.116%0.15743%0.426CS..Hα-helixtrans-65.3-40177.8-17365.9000111.1T44 Y45 Q46 E51 V52 L76 S79T44-L48 WeakPolarHBondContact O-CB 3.37Å; T44-L48 PolarHBondContact O-N 2.86Å; Y45-L48 PolarHBondContact O-N 3.18Å; Q46-L48 VanDerWaalsContact C-N 3.34Å; Q46-L48 PolarHBondContact O-N 3.3Å; L48-E51 PolarHBondContact O-N 3.49Å; L48-V52 WeakPolarHBondContact O-CB 3.41Å; L48-V52 WeakPolarHBondContact O-CG2 3.41Å; L48-V52 PolarHBondContact O-N 3.45Å; L48-L76 HydrophobicContact CD1-CD1 4.37Å; L48-L76 HydrophobicContact CD2-CD1 4.36Å; L48-L76 HydrophobicContact CG-CD1 4.34Å; L48-S79 VanDerWaalsContact CD1-OG 3.29Å; L48-S79 WeakPolarHBondContact CD1-OG 3.32Å
49K65.5Low62.2Low95 Ų9582.7 Ų82.741%0.41341%0.412SS..Hα-helixtrans-63.5-42.7175.8-176.9-177176.9-172.10111.4Y45 Q46 R47 V52 N53Y45-K49 HydrophobicContact CE1-CD 4.34Å; Y45-K49 WeakPolarHBondContact O-CB 3.16Å; Y45-K49 PolarHBondContact O-N 2.69Å; Q46-K49 WeakPolarHBondContact O-CB 3.44Å; Q46-K49 PolarHBondContact O-N 2.78Å; R47-K49 VanDerWaalsContact C-N 3.33Å; K49-V52 PolarHBondContact O-N 3.43Å; K49-N53 WeakPolarHBondContact O-CB 3.33Å; K49-N53 PolarHBondContact O-N 2.78Å; K49-N53 PolarHBondContact O-ND2 2.85Å
50D72.3Confident61.9Low98 Ų9887.1 Ų87.152%0.52443%0.426SS..Hα-helixtrans-66.6-40.8175.7-73.2-20.2000111.3Q46 R47 N53 N54Q46-D50 WeakPolarHBondContact O-CB 3.47Å; Q46-D50 PolarHBondContact O-N 2.94Å; R47-D50 PolarHBondContact O-N 3.49Å; D50-N53 PolarHBondContact O-N 2.82Å; D50-N54 VanDerWaalsContact O-CB 3.32Å; D50-N54 WeakPolarHBondContact O-CB 3.26Å; D50-N54 PolarHBondContact O-N 2.9Å
51E65.6Low61.6Low78 Ų7889.5 Ų89.536%0.36444%0.443SS..Hα-helixtrans-63.1-43.5174.3-168.7178.6176.500111.2R47 L48 N54 L55 R75R47-E51 WeakPolarHBondContact O-CB 3.47Å; R47-E51 PolarHBondContact O-N 3.38Å; L48-E51 PolarHBondContact O-N 3.49Å; E51-N54 PolarHBondContact O-N 3.3Å; E51-L55 HydrophobicContact CG-CD1 4.13Å; E51-L55 WeakPolarHBondContact O-CB 3.22Å; E51-L55 VanDerWaalsContact O-CG 3.22Å; E51-L55 WeakPolarHBondContact O-CG 3.37Å; E51-L55 PolarHBondContact O-N 3.35Å; E51-R75 IonicContact OE1-CZ 3.21Å; E51-R75 IonicContact OE1-NH1 2.78Å; E51-R75 PolarHBondContact OE1-NH1 2.77Å; E51-R75 IonicContact OE1-NH2 2.78Å; E51-R75 PolarHBondContact OE1-NH2 2.95Å
52V59.8Low61.2Low34 Ų3487.1 Ų87.121%0.20644%0.436CS..Hα-helixtrans-63.5-43.1174.7168.30000111.6L48 K49 N54 L55 T56 L76L48-V52 WeakPolarHBondContact O-CB 3.41Å; L48-V52 WeakPolarHBondContact O-CG2 3.41Å; L48-V52 PolarHBondContact O-N 3.45Å; K49-V52 PolarHBondContact O-N 3.43Å; V52-N54 VanDerWaalsContact C-N 3.3Å; V52-N54 PolarHBondContact O-N 2.85Å; V52-L55 PolarHBondContact O-N 3.36Å; V52-T56 VanDerWaalsContact O-CB 3.26Å; V52-T56 WeakPolarHBondContact O-CB 3.45Å; V52-T56 PolarHBondContact O-N 3.49Å; V52-T56 PolarHBondContact O-OG1 3.47Å; V52-L76 HydrophobicContact CG1-CD2 4.49Å; V52-L76 HydrophobicContact CG2-CD1 3.27Å; V52-L76 HydrophobicContact CG2-CD2 4.05Å; V52-L76 HydrophobicContact CG2-CG 4.24Å
53N66.5Low60.4Low74 Ų7492.2 Ų92.240%0.39646%0.458SS..Hα-helixtrans-64.5-38.9176.9-76.4-25.8000111.1K49 D50 T56 K57K49-N53 WeakPolarHBondContact O-CB 3.33Å; K49-N53 PolarHBondContact O-N 2.78Å; K49-N53 PolarHBondContact O-ND2 2.85Å; D50-N53 PolarHBondContact O-N 2.82Å; N53-T56 PolarHBondContact O-N 3.4Å; N53-K57 WeakPolarHBondContact O-CG 3.32Å; N53-K57 PolarHBondContact O-N 3.24Å
54N69.6Low59.4Low89 Ų8993.6 Ų93.648%0.47647%0.468SS..Hα-helixtrans-66.6-47.4176.2-166.356.9000111.2D50 E51 V52 T56 K57 E58D50-N54 VanDerWaalsContact O-CB 3.32Å; D50-N54 WeakPolarHBondContact O-CB 3.26Å; D50-N54 PolarHBondContact O-N 2.9Å; E51-N54 PolarHBondContact O-N 3.3Å; V52-N54 VanDerWaalsContact C-N 3.3Å; V52-N54 PolarHBondContact O-N 2.85Å; N54-T56 VanDerWaalsContact C-N 3.3Å; N54-T56 PolarHBondContact O-N 3.48Å; N54-K57 WeakPolarHBondContact O-CB 3.43Å; N54-K57 PolarHBondContact O-N 3.37Å; N54-E58 PolarHBondContact ND2-OE1 3.29Å; N54-E58 VanDerWaalsContact ND2-OE1 3.1Å; N54-E58 WeakPolarHBondContact O-CG 3.41Å; N54-E58 PolarHBondContact O-N 2.8Å
55L59.5Low58.7Low32 Ų3292.7 Ų92.717%0.16847%0.473CS..Hα-helixtrans-60.4-39.8174.2-72.1167.3000111.7E51 V52 K57 E58 V59E51-L55 HydrophobicContact CG-CD1 4.13Å; E51-L55 WeakPolarHBondContact O-CB 3.22Å; E51-L55 VanDerWaalsContact O-CG 3.22Å; E51-L55 WeakPolarHBondContact O-CG 3.37Å; E51-L55 PolarHBondContact O-N 3.35Å; V52-L55 PolarHBondContact O-N 3.36Å; L55-K57 VanDerWaalsContact C-N 3.34Å; L55-K57 PolarHBondContact O-N 2.93Å; L55-E58 PolarHBondContact O-N 3.47Å; L55-V59 VanDerWaalsContact O-CG2 3.26Å; L55-V59 WeakPolarHBondContact O-CG2 3.34Å; L55-V59 PolarHBondContact O-N 3.33Å
56T60.7Low58.6Low55 Ų5593.7 Ų93.734%0.33749%0.488SS..Hα-helixtrans-66.5-38178-57.80000111V52 N53 N54 V59 Q60V52-T56 VanDerWaalsContact O-CB 3.26Å; V52-T56 WeakPolarHBondContact O-CB 3.45Å; V52-T56 PolarHBondContact O-N 3.49Å; V52-T56 PolarHBondContact O-OG1 3.47Å; N53-T56 PolarHBondContact O-N 3.4Å; N54-T56 VanDerWaalsContact C-N 3.3Å; N54-T56 PolarHBondContact O-N 3.48Å; T56-V59 PolarHBondContact O-N 2.88Å; T56-Q60 WeakPolarHBondContact O-CB 3.21Å; T56-Q60 WeakPolarHBondContact O-CG 3.25Å; T56-Q60 PolarHBondContact O-N 2.88Å
57K61.4Low57.9Low139 Ų13993.5 Ų93.560%0.60450%0.496SS*.Hα-helixtrans-65.5-42.1172.3-75.3175.6178.5-179.10111.6N53 N54 L55 V59 Q60 V61N53-K57 WeakPolarHBondContact O-CG 3.32Å; N53-K57 PolarHBondContact O-N 3.24Å; N54-K57 WeakPolarHBondContact O-CB 3.43Å; N54-K57 PolarHBondContact O-N 3.37Å; L55-K57 VanDerWaalsContact C-N 3.34Å; L55-K57 PolarHBondContact O-N 2.93Å; K57-V59 VanDerWaalsContact C-N 3.29Å; K57-V59 PolarHBondContact O-N 3.36Å; K57-Q60 PolarHBondContact O-N 3.48Å; K57-V61 WeakPolarHBondContact O-CB 3.48Å; K57-V61 VanDerWaalsContact O-CG2 3.26Å; K57-V61 WeakPolarHBondContact O-CG2 3.26Å; K57-V61 PolarHBondContact O-N 3.38Å
58E57.3Low56.8Low113 Ų11386.9 Ų86.953%0.52848%0.477SS..Hα-helixtrans-60.2-39.2174.1-72.7174.2-169.100111.7N54 L55 G62N54-E58 PolarHBondContact ND2-OE1 3.29Å; N54-E58 VanDerWaalsContact ND2-OE1 3.1Å; N54-E58 WeakPolarHBondContact O-CG 3.41Å; N54-E58 PolarHBondContact O-N 2.8Å; L55-E58 PolarHBondContact O-N 3.47Å; E58-G62 PolarHBondContact O-N 3.35Å; E58-G62 VanDerWaalsContact O-N 3.11Å
59V51.2Low56Low36 Ų3689.6 Ų89.622%0.21849%0.492CS..Hα-helixtrans-69.6-38.6174.3174.10000112.8L55 T56 K57 V61 G62 I72L55-V59 VanDerWaalsContact O-CG2 3.26Å; L55-V59 WeakPolarHBondContact O-CG2 3.34Å; L55-V59 PolarHBondContact O-N 3.33Å; T56-V59 PolarHBondContact O-N 2.88Å; K57-V59 VanDerWaalsContact C-N 3.29Å; K57-V59 PolarHBondContact O-N 3.36Å; V59-V61 VanDerWaalsContact C-N 3.31Å; V59-G62 CarbonylContact O-C 3.57Å; V59-G62 PolarHBondContact O-N 2.9Å; V59-I72 HydrophobicContact CB-CD1 4.49Å; V59-I72 HydrophobicContact CG2-CD1 3Å; V59-I72 HydrophobicContact CG2-CG1 4.49Å
60Q50.9Low55.1Low156 Ų15692.6 Ų92.673%0.72951%0.505SS*.Hα-helixtrans-72.2-26179.3-76.6-178.62.400112.9T56 K57T56-Q60 WeakPolarHBondContact O-CB 3.21Å; T56-Q60 WeakPolarHBondContact O-CG 3.25Å; T56-Q60 PolarHBondContact O-N 2.88Å; K57-Q60 PolarHBondContact O-N 3.48Å
61V55.3Low53.9Low132 Ų13297 Ų9780%0.852%0.515SS*.Hα-helixtrans-87.9-20.9177.4178.30000111.7K57 V59K57-V61 WeakPolarHBondContact O-CB 3.48Å; K57-V61 VanDerWaalsContact O-CG2 3.26Å; K57-V61 WeakPolarHBondContact O-CG2 3.26Å; K57-V61 PolarHBondContact O-N 3.38Å; V59-V61 VanDerWaalsContact C-N 3.31Å
62G47.7Very low53.3Low24 Ų2495 Ų9525%0.24751%0.507CS..  trans-103.495.5173.600000112.5E58 V59 I64E58-G62 PolarHBondContact O-N 3.35Å; E58-G62 VanDerWaalsContact O-N 3.11Å; V59-G62 CarbonylContact O-C 3.57Å; V59-G62 PolarHBondContact O-N 2.9Å; G62-I64 PolarHBondContact O-N 2.96Å
63D44.1Very low52.9Low171 Ų171101 Ų10191%0.91453%0.527SS*.  trans-61.866.8168.2-166.920.2000111.9
64I48.7Very low52.2Low129 Ų129102.4 Ų102.466%0.66254%0.535SS*.  trans-14694.1-164.4-48.4175.6000111.9G62 S68G62-I64 PolarHBondContact O-N 2.96Å; I64-S68 PolarHBondContact O-OG 3.27Å
65G47.5Very low51.3Low52 Ų52104.7 Ų104.754%0.53654%0.537SS..  trans74.7126.9137.200000117.5S67 S68G65-S67 PolarHBondContact O-N 3Å; G65-S68 PolarHBondContact O-N 3.42Å; G65-S68 VanDerWaalsContact O-N 3.12Å; G65-S68 PolarHBondContact O-OG 2.86Å
66D52.8Low51Low163 Ų163105.9 Ų105.987%0.87254%0.543SS*.THydrogen-bonded Turntrans-46.8-5.5178.4-140.9-2.5000116.9
67S50Low50.8Low82 Ų82107.6 Ų107.657%0.57355%0.549SS*.THydrogen-bonded Turntrans-96.3-32.1-179.960.30000114.5G65 K70 Y71G65-S67 PolarHBondContact O-N 3Å; S67-K70 PolarHBondContact O-N 3.43Å; S67-Y71 PolarHBondContact O-N 3.11Å
68S45.4Very low50.3Low43 Ų43104 Ų10430%0.30154%0.539SS..Hα-helixtrans-71.4-42-175.6560000111.7I64 G65 K70 Y71 I72I64-S68 PolarHBondContact O-OG 3.27Å; G65-S68 PolarHBondContact O-N 3.42Å; G65-S68 VanDerWaalsContact O-N 3.12Å; G65-S68 PolarHBondContact O-OG 2.86Å; S68-K70 VanDerWaalsContact C-N 3.26Å; S68-K70 PolarHBondContact O-N 3.05Å; S68-Y71 PolarHBondContact O-N 2.89Å; S68-I72 PolarHBondContact O-N 3.42Å; S68-I72 VanDerWaalsContact O-N 3.12Å
69N44.9Very low50.1Low86 Ų86100.4 Ų100.446%0.4653%0.526SS..Hα-helixtrans-59.5-36.3174-106.7-5.8000112.7I72 Y73N69-I72 PolarHBondContact O-N 3.47Å; N69-Y73 PolarHBondContact O-N 3.41Å
70K46.6Very low50.3Low159 Ų159101.9 Ų101.969%0.69154%0.536SS*.Hα-helixtrans-70.3-38.4179.3-152.9173.9-172.8175.90111.6S67 S68 N74S67-K70 PolarHBondContact O-N 3.43Å; S68-K70 VanDerWaalsContact C-N 3.26Å; S68-K70 PolarHBondContact O-N 3.05Å; K70-N74 VanDerWaalsContact O-CB 3.29Å; K70-N74 WeakPolarHBondContact O-CB 3.46Å; K70-N74 PolarHBondContact O-N 2.88Å
71Y46.3Very low50.4Low189 Ų18997.1 Ų97.174%0.74152%0.515SS*.Hα-helixtrans-64.2-40.7174.9-97.7-82.9000112.3S67 S68 N74 R75S67-Y71 PolarHBondContact O-N 3.11Å; S68-Y71 PolarHBondContact O-N 2.89Å; Y71-N74 PolarHBondContact O-N 3.12Å; Y71-R75 VanDerWaalsContact O-CB 3.25Å; Y71-R75 WeakPolarHBondContact O-CB 3.35Å; Y71-R75 PolarHBondContact O-N 2.9Å
72I54Low50.4Low36 Ų3695.5 Ų95.519%0.18550%0.501CS..Hα-helixtrans-71.1-44-179.2-68.4165.7000111.2V59 S68 N69 N74 R75 L76V59-I72 HydrophobicContact CB-CD1 4.49Å; V59-I72 HydrophobicContact CG2-CD1 3Å; V59-I72 HydrophobicContact CG2-CG1 4.49Å; S68-I72 PolarHBondContact O-N 3.42Å; S68-I72 VanDerWaalsContact O-N 3.12Å; N69-I72 PolarHBondContact O-N 3.47Å; I72-N74 VanDerWaalsContact C-N 3.32Å; I72-N74 PolarHBondContact O-N 3.33Å; I72-R75 PolarHBondContact O-N 2.96Å; I72-L76 VanDerWaalsContact O-CB 3.3Å; I72-L76 WeakPolarHBondContact O-CB 3.44Å; I72-L76 PolarHBondContact O-N 2.91Å
73Y50.1Low50.8Low161 Ų16196.4 Ų96.463%0.63150%0.502SS*.Hα-helixtrans-59.7-43.2173.8-101.5-84.9000112.2N69 L76 L77N69-Y73 PolarHBondContact O-N 3.41Å; Y73-L76 PolarHBondContact O-N 3.27Å; Y73-L77 WeakPolarHBondContact O-CB 3.22Å; Y73-L77 PolarHBondContact O-N 3.5Å
74N51.4Low51.3Low103 Ų10391.3 Ų91.355%0.55147%0.474SS*.Hα-helixtrans-68.2-41.4179.8-14939.5000111K70 Y71 I72 L76 L77 T78K70-N74 VanDerWaalsContact O-CB 3.29Å; K70-N74 WeakPolarHBondContact O-CB 3.46Å; K70-N74 PolarHBondContact O-N 2.88Å; Y71-N74 PolarHBondContact O-N 3.12Å; I72-N74 VanDerWaalsContact C-N 3.32Å; I72-N74 PolarHBondContact O-N 3.33Å; N74-L76 VanDerWaalsContact C-N 3.35Å; N74-L76 PolarHBondContact O-N 3.4Å; N74-L77 PolarHBondContact O-N 3.49Å; N74-T78 WeakPolarHBondContact O-CB 3.31Å; N74-T78 PolarHBondContact O-N 3.3Å; N74-T78 PolarHBondContact O-OG1 2.73Å
75R52.1Low51.4Low138 Ų13891.2 Ų91.252%0.52147%0.469SS..Hα-helixtrans-64-38.8175.9-168.5171.2179.1-107.7-10.3112E51 Y71 I72 T78 S79E51-R75 IonicContact OE1-CZ 3.21Å; E51-R75 IonicContact OE1-NH1 2.78Å; E51-R75 PolarHBondContact OE1-NH1 2.77Å; E51-R75 IonicContact OE1-NH2 2.78Å; E51-R75 PolarHBondContact OE1-NH2 2.95Å; Y71-R75 VanDerWaalsContact O-CB 3.25Å; Y71-R75 WeakPolarHBondContact O-CB 3.35Å; Y71-R75 PolarHBondContact O-N 2.9Å; I72-R75 PolarHBondContact O-N 2.96Å; R75-T78 PolarHBondContact O-N 2.84Å; R75-S79 VanDerWaalsContact O-CB 3.32Å; R75-S79 WeakPolarHBondContact O-CB 3.27Å; R75-S79 PolarHBondContact O-N 3.47Å
76L53.2Low51.3Low57 Ų5791.7 Ų91.730%0.29846%0.464SS..Hα-helixtrans-68.2-43.7177-173.857.1000112.2L48 V52 I72 Y73 N74 S79 T80L48-L76 HydrophobicContact CD1-CD1 4.37Å; L48-L76 HydrophobicContact CD2-CD1 4.36Å; L48-L76 HydrophobicContact CG-CD1 4.34Å; V52-L76 HydrophobicContact CG1-CD2 4.49Å; V52-L76 HydrophobicContact CG2-CD1 3.27Å; V52-L76 HydrophobicContact CG2-CD2 4.05Å; V52-L76 HydrophobicContact CG2-CG 4.24Å; I72-L76 VanDerWaalsContact O-CB 3.3Å; I72-L76 WeakPolarHBondContact O-CB 3.44Å; I72-L76 PolarHBondContact O-N 2.91Å; Y73-L76 PolarHBondContact O-N 3.27Å; N74-L76 VanDerWaalsContact C-N 3.35Å; N74-L76 PolarHBondContact O-N 3.4Å; L76-S79 PolarHBondContact O-N 2.9Å; L76-T80 WeakPolarHBondContact O-CB 3.49Å; L76-T80 PolarHBondContact O-N 3.45Å; L76-T80 PolarHBondContact O-OG1 3.31Å
77L55.7Low51Low90 Ų9086.9 Ų86.947%0.47144%0.438SS..Hα-helixtrans-61.6-45.8173.1-87.9160.7000111.3Y73 N74 T80 L81Y73-L77 WeakPolarHBondContact O-CB 3.22Å; Y73-L77 PolarHBondContact O-N 3.5Å; N74-L77 PolarHBondContact O-N 3.49Å; L77-T80 PolarHBondContact O-N 3.47Å; L77-L81 WeakPolarHBondContact O-CB 3.26Å; L77-L81 VanDerWaalsContact O-CG 3.24Å; L77-L81 WeakPolarHBondContact O-CG 3.4Å; L77-L81 PolarHBondContact O-N 2.82Å
78T51.4Low51Low64 Ų6486.2 Ų86.239%0.39343%0.427SS..Hα-helixtrans-63.4-41.9176.8-58.70000111.6N74 R75 T80 L81 I82N74-T78 WeakPolarHBondContact O-CB 3.31Å; N74-T78 PolarHBondContact O-N 3.3Å; N74-T78 PolarHBondContact O-OG1 2.73Å; R75-T78 PolarHBondContact O-N 2.84Å; T78-T80 PolarHBondContact O-N 3.02Å; T78-L81 PolarHBondContact O-N 3.01Å; T78-I82 HydrophobicContact CG2-CD1 3.73Å; T78-I82 HydrophobicContact CG2-CG1 4.25Å; T78-I82 WeakPolarHBondContact O-CB 3.24Å; T78-I82 WeakPolarHBondContact O-CG1 3.29Å; T78-I82 PolarHBondContact O-N 3.3Å
79S52.2Low50.8Low37 Ų3790.1 Ų90.126%0.25944%0.444SS..Hα-helixtrans-63.7-40.9176.8-171.10000112.2L48 R75 L76 I82 T83L48-S79 VanDerWaalsContact CD1-OG 3.29Å; L48-S79 WeakPolarHBondContact CD1-OG 3.32Å; R75-S79 VanDerWaalsContact O-CB 3.32Å; R75-S79 WeakPolarHBondContact O-CB 3.27Å; R75-S79 PolarHBondContact O-N 3.47Å; L76-S79 PolarHBondContact O-N 2.9Å; S79-I82 PolarHBondContact O-N 3.02Å; S79-T83 WeakPolarHBondContact O-CB 3.25Å; S79-T83 PolarHBondContact O-N 3.19Å; S79-T83 PolarHBondContact O-OG1 3.32Å
80T55.7Low50.6Low67 Ų6793.4 Ų93.441%0.41146%0.46SS..Hα-helixtrans-65.4-43175.2-51.80000111.2L76 L77 T78 T83 L84L76-T80 WeakPolarHBondContact O-CB 3.49Å; L76-T80 PolarHBondContact O-N 3.45Å; L76-T80 PolarHBondContact O-OG1 3.31Å; L77-T80 PolarHBondContact O-N 3.47Å; T78-T80 PolarHBondContact O-N 3.02Å; T80-T83 PolarHBondContact O-N 3.12Å; T80-L84 PolarHBondContact O-N 3.03Å
81L53.6Low50.3Low56 Ų5693 Ų9329%0.29347%0.466SS..Hα-helixtrans-66.2-40.7176.7-75168.4000112.5L77 T78 L84 F85L77-L81 WeakPolarHBondContact O-CB 3.26Å; L77-L81 VanDerWaalsContact O-CG 3.24Å; L77-L81 WeakPolarHBondContact O-CG 3.4Å; L77-L81 PolarHBondContact O-N 2.82Å; T78-L81 PolarHBondContact O-N 3.01Å; L81-L84 PolarHBondContact O-N 3.43Å; L81-F85 WeakPolarHBondContact O-CB 3.3Å; L81-F85 PolarHBondContact O-N 3.31Å
82I54.2Low50.5Low99 Ų9988.3 Ų88.351%0.50845%0.452SS..Hα-helixtrans-61.7-46.7174.9-72165.7000109.7T78 S79 L84 F85 S86T78-I82 HydrophobicContact CG2-CD1 3.73Å; T78-I82 HydrophobicContact CG2-CG1 4.25Å; T78-I82 WeakPolarHBondContact O-CB 3.24Å; T78-I82 WeakPolarHBondContact O-CG1 3.29Å; T78-I82 PolarHBondContact O-N 3.3Å; S79-I82 PolarHBondContact O-N 3.02Å; I82-L84 VanDerWaalsContact C-N 3.32Å; I82-L84 PolarHBondContact O-N 3.21Å; I82-F85 PolarHBondContact O-N 3.48Å; I82-S86 WeakPolarHBondContact O-CB 3.44Å; I82-S86 PolarHBondContact O-N 3.38Å; I82-S86 PolarHBondContact O-OG 3.12Å; I82-S86 VanDerWaalsContact O-OG 3.08Å
83T56.4Low50.3Low43 Ų4391 Ų9126%0.26447%0.466SS..Hα-helixtrans-60.5-43.2178.5-54.10000111L41 S79 T80 S86 L87L41-T83 HydrophobicContact CD1-CG2 4.4Å; S79-T83 WeakPolarHBondContact O-CB 3.25Å; S79-T83 PolarHBondContact O-N 3.19Å; S79-T83 PolarHBondContact O-OG1 3.32Å; T80-T83 PolarHBondContact O-N 3.12Å; T83-S86 PolarHBondContact O-N 3.25Å; T83-L87 HydrophobicContact CG2-CD1 4.44Å; T83-L87 WeakPolarHBondContact O-CD1 3.48Å; T83-L87 PolarHBondContact O-N 3.03Å; T83-L87 VanDerWaalsContact O-N 3.1Å
84L55.1Low50.3Low63 Ų6387.1 Ų87.133%0.3346%0.457SS..Hα-helixtrans-64.4-40.6175.2-124.2101.8000112.5T80 L81 I82 L87 I88T80-L84 PolarHBondContact O-N 3.03Å; L81-L84 PolarHBondContact O-N 3.43Å; I82-L84 VanDerWaalsContact C-N 3.32Å; I82-L84 PolarHBondContact O-N 3.21Å; L84-L87 WeakPolarHBondContact O-CB 3.29Å; L84-L87 PolarHBondContact O-N 2.7Å; L84-I88 WeakPolarHBondContact O-CG1 3.35Å; L84-I88 PolarHBondContact O-N 3.29Å
85F49.8Very low50.2Low128 Ų12886.2 Ų86.256%0.56145%0.451SS*.Hα-helixtrans-67.2-40.8177.3-109.3-85.4000112.2L81 I82 L87 I88 I89L81-F85 WeakPolarHBondContact O-CB 3.3Å; L81-F85 PolarHBondContact O-N 3.31Å; I82-F85 PolarHBondContact O-N 3.48Å; F85-L87 VanDerWaalsContact C-N 3.26Å; F85-L87 PolarHBondContact O-N 3.31Å; F85-I88 PolarHBondContact O-N 3.3Å; F85-I88 VanDerWaalsContact O-N 3.14Å; F85-I89 HydrophobicContact CD1-CD1 3.97Å; F85-I89 WeakPolarHBondContact O-CG1 3.49Å; F85-I89 PolarHBondContact O-N 3.02Å
86S46Very low50.1Low61 Ų6182.9 Ų82.943%0.42745%0.447SS..Hα-helixtrans-62.9-34.1174.6-61.40000111.9I82 T83 L90I82-S86 WeakPolarHBondContact O-CB 3.44Å; I82-S86 PolarHBondContact O-N 3.38Å; I82-S86 PolarHBondContact O-OG 3.12Å; I82-S86 VanDerWaalsContact O-OG 3.08Å; T83-S86 PolarHBondContact O-N 3.25Å; S86-L90 WeakPolarHBondContact O-CB 3.32Å; S86-L90 WeakPolarHBondContact O-CD1 3.3Å; S86-L90 PolarHBondContact O-N 3.47Å
87L47.4Very low49.9Very low63 Ų6384.7 Ų84.733%0.3346%0.457SS..Hα-helixtrans-67.6-30.6172.8-94.1152.4000114I37 L41 T83 L84 F85 N91I37-L87 HydrophobicContact CG2-CD2 4.1Å; L41-L87 HydrophobicContact CD1-CD1 3.67Å; L41-L87 HydrophobicContact CD1-CG 4.47Å; T83-L87 HydrophobicContact CG2-CD1 4.44Å; T83-L87 WeakPolarHBondContact O-CD1 3.48Å; T83-L87 PolarHBondContact O-N 3.03Å; T83-L87 VanDerWaalsContact O-N 3.1Å; L84-L87 WeakPolarHBondContact O-CB 3.29Å; L84-L87 PolarHBondContact O-N 2.7Å; F85-L87 VanDerWaalsContact C-N 3.26Å; F85-L87 PolarHBondContact O-N 3.31Å; L87-N91 PolarHBondContact O-ND2 3.21Å
88I49.9Very low49.5Very low67 Ų6784.3 Ų84.334%0.34446%0.456SS..Hα-helixtrans-83.2-36.1179.4-66.9163.5000111.4F17 L84 F85F17-I88 HydrophobicContact CD1-CD1 3.7Å; F17-I88 HydrophobicContact CD1-CG1 4.46Å; F17-I88 HydrophobicContact CE1-CD1 3.81Å; F17-I88 HydrophobicContact CG-CD1 4.18Å; F17-I88 HydrophobicContact CZ-CD1 4.36Å; L84-I88 WeakPolarHBondContact O-CG1 3.35Å; L84-I88 PolarHBondContact O-N 3.29Å; F85-I88 PolarHBondContact O-N 3.3Å; F85-I88 VanDerWaalsContact O-N 3.14Å
89I40.7Very low49.3Very low126 Ų12685.8 Ų85.865%0.64646%0.461SS*.Hα-helixtrans-79.9-23.2-176.5-67.6167.7000112.7F85F85-I89 HydrophobicContact CD1-CD1 3.97Å; F85-I89 WeakPolarHBondContact O-CG1 3.49Å; F85-I89 PolarHBondContact O-N 3.02Å
90L40.8Very low49.1Very low155 Ų15589.9 Ų89.981%0.81248%0.478SS*.THydrogen-bonded Turntrans-91.1-1.3177-92.1123.2000114.5S86S86-L90 WeakPolarHBondContact O-CB 3.32Å; S86-L90 WeakPolarHBondContact O-CD1 3.3Å; S86-L90 PolarHBondContact O-N 3.47Å
91N39.8Very low48.5Very low151 Ų15192 Ų9281%0.80748%0.484SS*.  trans-105.60168.1-87.1-50.7000110.5L87L87-N91 PolarHBondContact O-ND2 3.21Å

Retrieved 91 of 91 residues in 238.5 ms (Link to these results)