Z4YKY0_MOUSE Loading...

Coiled coil domain containing 88A

AlphaFold DB , UniProt , Accession Z4YKY0, Species MOUSE (Mus musculus, Mouse), Gene Ccdc88a, Length 117 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
1M47.8Very low69.1Low192 Ų192104.1 Ų104.195%0.94653%0.53SS*.  0-49.90-104.6-179.5-83.500112.5N3 E4M1-N3 PolarHBondContact O-N 2.88Å; M1-E4 PolarHBondContact O-N 3.44Å
2E51.2Low70.8Confident175 Ų175106.8 Ų106.882%0.81854%0.539SS*.Hα-helixtrans-63.7-38.8176.8-72.1-179.4162.600113.9E4 I5 F6E2-E4 VanDerWaalsContact C-N 3.29Å; E2-E4 PolarHBondContact O-N 3.03Å; E2-I5 PolarHBondContact O-N 3.39Å; E2-F6 PolarHBondContact O-N 3.42Å
3N50.2Low72.4Confident142 Ų142103.3 Ų103.376%0.75952%0.518SS*.Hα-helixtrans-66.9-22.9179.8-69.5-19.7000114.5M1M1-N3 PolarHBondContact O-N 2.88Å
4E55.1Low73.8Confident154 Ų15496.4 Ų96.472%0.7248%0.483SS*.Hα-helixtrans-83.7-24-179.5-68.4179.3161.700112.4M1 E2 P8M1-E4 PolarHBondContact O-N 3.44Å; E2-E4 VanDerWaalsContact C-N 3.29Å; E2-E4 PolarHBondContact O-N 3.03Å; E4-P8 WeakPolarHBondContact O-CD 3.35Å
5I61.8Low75Confident122 Ų12296.7 Ų96.763%0.62649%0.493SS*.Hα-helixtrans-87.2-30.2177.8-59.5171.1000110.8E2 T7 P8E2-I5 PolarHBondContact O-N 3.39Å; I5-T7 PolarHBondContact O-N 3.31Å; I5-P8 WeakPolarHBondContact O-CD 3.44Å
6F70.6Confident76.3Confident28 Ų2892.6 Ų92.612%0.12348%0.475CS..Hα-helixtrans-65.7-37.6-176.9-175.2-105.3000112.6E2 L9 L10 L36 Y39 F113E2-F6 PolarHBondContact O-N 3.42Å; F6-L9 PolarHBondContact O-N 3.44Å; F6-L10 HydrophobicContact CD1-CB 4.41Å; F6-L10 HydrophobicContact CE1-CB 4.06Å; F6-L10 HydrophobicContact CE1-CD1 4.34Å; F6-L10 HydrophobicContact CE1-CD2 3.88Å; F6-L10 HydrophobicContact CE1-CG 4.32Å; F6-L10 HydrophobicContact CZ-CB 4.19Å; F6-L10 HydrophobicContact CZ-CD1 4.15Å; F6-L10 WeakPolarHBondContact O-CB 3.45Å; F6-L10 PolarHBondContact O-N 3Å; F6-L36 HydrophobicContact CE1-CD1 4.34Å; F6-Y39 HydrophobicContact CZ-CD1 4.25Å; F6-Y39 AromaticContact CZ-CE1 3.94Å; F6-Y39 HydrophobicContact CZ-CE1 3.94Å; F6-F113 HydrophobicContact CD2-CB 4.31Å; F6-F113 WeakPolarHBondContact CD2-O 3.48Å; F6-F113 AromaticContact CE1-CD1 3.68Å; F6-F113 HydrophobicContact CE1-CD1 3.68Å; F6-F113 HydrophobicContact CE1-CE1 4.31Å; F6-F113 HydrophobicContact CE2-CB 4.09Å; F6-F113 HydrophobicContact CE2-CD1 4.04Å; F6-F113 HydrophobicContact CZ-CB 4.33Å; F6-F113 AromaticContact CZ-CD1 3.44Å; F6-F113 HydrophobicContact CZ-CD1 3.44Å; F6-F113 VanDerWaalsContact CZ-CD1 3.44Å; F6-F113 HydrophobicContact CZ-CE1 4.24Å; F6-F113 HydrophobicContact CZ-CG 4.36Å
7T76.8Confident77.4Confident70 Ų7093.8 Ų93.843%0.42949%0.491SS..Hα-helixtrans-65.7-48.6-174.5-52.10000113.8I5 L9 L10 E11I5-T7 PolarHBondContact O-N 3.31Å; T7-L9 VanDerWaalsContact C-N 3.33Å; T7-L9 PolarHBondContact O-N 3.31Å; T7-L10 WeakPolarHBondContact O-CB 3.18Å; T7-L10 PolarHBondContact O-N 2.87Å; T7-E11 WeakPolarHBondContact O-CG 3.5Å; T7-E11 PolarHBondContact O-N 2.91Å
8P82.4Confident78.4Confident78 Ų7895.2 Ų95.251%0.50650%0.498SS..Hα-helixtrans-63-38.5175-22.533.6000112.9E4 I5 L10 E11 Q12E4-P8 WeakPolarHBondContact O-CD 3.35Å; I5-P8 WeakPolarHBondContact O-CD 3.44Å; P8-L10 VanDerWaalsContact C-N 3.34Å; P8-E11 PolarHBondContact O-N 2.96Å; P8-Q12 PolarHBondContact O-N 2.87Å
9L85.8Confident79.2Confident67 Ų6790.5 Ų90.535%0.35147%0.474SS..Hα-helixtrans-67-38.3177.8-175.964.2000111.6F6 T7 Q12 F13F6-L9 PolarHBondContact O-N 3.44Å; T7-L9 VanDerWaalsContact C-N 3.33Å; T7-L9 PolarHBondContact O-N 3.31Å; L9-Q12 PolarHBondContact O-N 2.86Å; L9-F13 VanDerWaalsContact O-CB 3.25Å; L9-F13 WeakPolarHBondContact O-CB 3.37Å; L9-F13 PolarHBondContact O-N 3.07Å
10L88.4Confident79.9Confident12 Ų1289.7 Ų89.76%0.06347%0.473CS..Hα-helixtrans-61.8-48.8174.8172.365.8000110.7F6 T7 P8 Q12 F13 M14 N35 L36 Y39F6-L10 HydrophobicContact CD1-CB 4.41Å; F6-L10 HydrophobicContact CE1-CB 4.06Å; F6-L10 HydrophobicContact CE1-CD1 4.34Å; F6-L10 HydrophobicContact CE1-CD2 3.88Å; F6-L10 HydrophobicContact CE1-CG 4.32Å; F6-L10 HydrophobicContact CZ-CB 4.19Å; F6-L10 HydrophobicContact CZ-CD1 4.15Å; F6-L10 WeakPolarHBondContact O-CB 3.45Å; F6-L10 PolarHBondContact O-N 3Å; T7-L10 WeakPolarHBondContact O-CB 3.18Å; T7-L10 PolarHBondContact O-N 2.87Å; P8-L10 VanDerWaalsContact C-N 3.34Å; L10-Q12 VanDerWaalsContact C-N 3.34Å; L10-Q12 PolarHBondContact O-N 3.02Å; L10-F13 PolarHBondContact O-N 3.18Å; L10-M14 HydrophobicContact CD1-CG 3.83Å; L10-M14 HydrophobicContact CD1-SD 4.32Å; L10-M14 HydrophobicContact CG-CG 4.31Å; L10-M14 WeakPolarHBondContact O-CB 3.38Å; L10-M14 VanDerWaalsContact O-CG 3.24Å; L10-M14 WeakPolarHBondContact O-CG 3.36Å; L10-M14 PolarHBondContact O-N 3.49Å; L10-N35 HydrophobicContact CD2-CB 4.24Å; L10-N35 HydrophobicContact CG-CB 4.31Å; L10-L36 HydrophobicContact CD2-CB 4.33Å; L10-L36 HydrophobicContact CD2-CD1 4.43Å; L10-Y39 HydrophobicContact CD1-CD1 4.27Å; L10-Y39 HydrophobicContact CD1-CD2 3.59Å; L10-Y39 HydrophobicContact CD1-CE2 4.39Å; L10-Y39 HydrophobicContact CD1-CG 3.52Å
11E89.6Confident80.7Confident105 Ų10591.2 Ų91.249%0.49147%0.472SS..Hα-helixtrans-60-44.4178.2-71178.2-179.900111.8T7 P8 M14 T15T7-E11 WeakPolarHBondContact O-CG 3.5Å; T7-E11 PolarHBondContact O-N 2.91Å; P8-E11 PolarHBondContact O-N 2.96Å; E11-M14 PolarHBondContact O-N 3.3Å; E11-T15 WeakPolarHBondContact O-CG2 3.34Å; E11-T15 PolarHBondContact O-N 3.29Å; E11-T15 VanDerWaalsContact O-N 3.1Å; E11-T15 PolarHBondContact O-OG1 2.89Å
12Q90.4Very high82.9Confident136 Ų13682.7 Ų82.764%0.63643%0.431SS*.Hα-helixtrans-62.5-42.8174.8-175.1-176.9-6.900111.9P8 L9 L10 T15 S16P8-Q12 PolarHBondContact O-N 2.87Å; L9-Q12 PolarHBondContact O-N 2.86Å; L10-Q12 VanDerWaalsContact C-N 3.34Å; L10-Q12 PolarHBondContact O-N 3.02Å; Q12-T15 PolarHBondContact O-N 2.94Å; Q12-T15 PolarHBondContact O-OG1 3.36Å; Q12-T15 VanDerWaalsContact O-OG1 3.07Å; Q12-S16 PolarHBondContact O-N 3.39Å
13F90.9Very high84.9Confident62 Ų6276.1 Ų76.127%0.27240%0.4SS..Hα-helixtrans-62.9-46.3177.3174.3-98.4000111.5L9 L10 T15 S16 V19 Y39 L42L9-F13 VanDerWaalsContact O-CB 3.25Å; L9-F13 WeakPolarHBondContact O-CB 3.37Å; L9-F13 PolarHBondContact O-N 3.07Å; L10-F13 PolarHBondContact O-N 3.18Å; F13-T15 PolarHBondContact O-N 2.7Å; F13-S16 WeakPolarHBondContact O-CB 3.33Å; F13-S16 PolarHBondContact O-N 2.94Å; F13-S16 PolarHBondContact O-OG 2.96Å; F13-V19 HydrophobicContact CD1-CG2 4.11Å; F13-V19 HydrophobicContact CD2-CG2 4.42Å; F13-V19 HydrophobicContact CE1-CG2 3.63Å; F13-V19 HydrophobicContact CE2-CG2 3.98Å; F13-V19 HydrophobicContact CG-CG2 4.49Å; F13-V19 HydrophobicContact CZ-CG2 3.56Å; F13-V19 WeakPolarHBondContact O-CG2 3.43Å; F13-Y39 AromaticContact CD1-CD2 3.63Å; F13-Y39 HydrophobicContact CD1-CD2 3.63Å; F13-Y39 AromaticContact CD1-CE2 3.74Å; F13-Y39 HydrophobicContact CD1-CE2 3.74Å; F13-Y39 AromaticContact CE1-CD2 3.53Å; F13-Y39 HydrophobicContact CE1-CD2 3.53Å; F13-Y39 AromaticContact CE1-CE2 3.56Å; F13-Y39 HydrophobicContact CE1-CE2 3.56Å; F13-Y39 HydrophobicContact CZ-CE2 4.28Å; F13-L42 HydrophobicContact CE1-CD1 4.13Å
14M92.1Very high86.9Confident6 Ų673.8 Ų73.83%0.0339%0.391CS..Hα-helixtrans-66.2-24.6-179-68.3-50.5-61.700113.2L10 E11 V19 K23 N35 E38 Y39 L42L10-M14 HydrophobicContact CD1-CG 3.83Å; L10-M14 HydrophobicContact CD1-SD 4.32Å; L10-M14 HydrophobicContact CG-CG 4.31Å; L10-M14 WeakPolarHBondContact O-CB 3.38Å; L10-M14 VanDerWaalsContact O-CG 3.24Å; L10-M14 WeakPolarHBondContact O-CG 3.36Å; L10-M14 PolarHBondContact O-N 3.49Å; E11-M14 PolarHBondContact O-N 3.3Å; M14-V19 HydrophobicContact CE-CG1 3.79Å; M14-V19 HydrophobicContact SD-CG1 4.09Å; M14-K23 HydrophobicContact CE-CD 4.37Å; M14-N35 HydrophobicContact CG-CB 4.03Å; M14-E38 HydrophobicContact CE-CB 3.46Å; M14-E38 VanDerWaalsContact CE-CB 3.46Å; M14-E38 VanDerWaalsContact CE-OE2 3.3Å; M14-E38 WeakPolarHBondContact CE-OE2 3.3Å; M14-Y39 HydrophobicContact SD-CD2 4.14Å; M14-L42 HydrophobicContact CE-CD1 4.2Å; M14-L42 HydrophobicContact SD-CD1 4.15Å
15T92Very high88.5Confident102 Ų10268.7 Ų68.763%0.62637%0.366SS*.THydrogen-bonded Turntrans-92.8-0.2174.153.40000113.7E11 Q12 F13 T20E11-T15 WeakPolarHBondContact O-CG2 3.34Å; E11-T15 PolarHBondContact O-N 3.29Å; E11-T15 VanDerWaalsContact O-N 3.1Å; E11-T15 PolarHBondContact O-OG1 2.89Å; Q12-T15 PolarHBondContact O-N 2.94Å; Q12-T15 PolarHBondContact O-OG1 3.36Å; Q12-T15 VanDerWaalsContact O-OG1 3.07Å; F13-T15 PolarHBondContact O-N 2.7Å; T15-T20 PolarHBondContact O-OG1 3.21Å
16S95.1Very high89.5Confident30 Ų3064.1 Ų64.121%0.2135%0.349CS..SBendtrans-64.4153.7178.572.60000111.9Q12 F13 L18 V19 T20Q12-S16 PolarHBondContact O-N 3.39Å; F13-S16 WeakPolarHBondContact O-CB 3.33Å; F13-S16 PolarHBondContact O-N 2.94Å; F13-S16 PolarHBondContact O-OG 2.96Å; S16-L18 VanDerWaalsContact C-N 3.32Å; S16-L18 PolarHBondContact O-N 3.36Å; S16-V19 PolarHBondContact O-N 3.17Å; S16-V19 WeakPolarHBondContact OG-CG2 3.18Å; S16-T20 WeakPolarHBondContact O-CB 3.38Å; S16-T20 PolarHBondContact O-N 3.03Å; S16-T20 PolarHBondContact O-OG1 3.48Å
17P96.4Very high89.8Confident114 Ų11467.8 Ų67.874%0.7438%0.376SS*.Hα-helixtrans-57.9-40.7-177-27.735.6000113.9W21P17-W21 WeakPolarHBondContact O-CB 3.36Å; P17-W21 PolarHBondContact O-N 3.43Å
18L94.8Very high89.9Confident118 Ų11865.6 Ų65.662%0.61836%0.361SS*.Hα-helixtrans-68-44.6-178.7-178.362000111.5S16 W21 V22S16-L18 VanDerWaalsContact C-N 3.32Å; S16-L18 PolarHBondContact O-N 3.36Å; L18-W21 HydrophobicContact CD1-CE3 3.92Å; L18-W21 HydrophobicContact CD1-CZ3 4.23Å; L18-W21 PolarHBondContact O-N 2.97Å; L18-V22 HydrophobicContact CD1-CG2 4.36Å; L18-V22 WeakPolarHBondContact O-CB 3.35Å; L18-V22 WeakPolarHBondContact O-CG2 3.49Å; L18-V22 PolarHBondContact O-N 3.29Å
19V93.8Very high89.4Confident7 Ų765.2 Ų65.24%0.04236%0.364CS..Hα-helixtrans-65.3-44.5177.5176.30000110.5F13 M14 S16 W21 V22 K23 L42F13-V19 HydrophobicContact CD1-CG2 4.11Å; F13-V19 HydrophobicContact CD2-CG2 4.42Å; F13-V19 HydrophobicContact CE1-CG2 3.63Å; F13-V19 HydrophobicContact CE2-CG2 3.98Å; F13-V19 HydrophobicContact CG-CG2 4.49Å; F13-V19 HydrophobicContact CZ-CG2 3.56Å; F13-V19 WeakPolarHBondContact O-CG2 3.43Å; M14-V19 HydrophobicContact CE-CG1 3.79Å; M14-V19 HydrophobicContact SD-CG1 4.09Å; S16-V19 PolarHBondContact O-N 3.17Å; S16-V19 WeakPolarHBondContact OG-CG2 3.18Å; V19-W21 VanDerWaalsContact C-N 3.31Å; V19-W21 PolarHBondContact O-N 2.83Å; V19-V22 PolarHBondContact O-N 3.32Å; V19-K23 HydrophobicContact CG1-CD 4.13Å; V19-K23 HydrophobicContact CG1-CG 4.34Å; V19-K23 VanDerWaalsContact O-CG 3.3Å; V19-K23 WeakPolarHBondContact O-CG 3.1Å; V19-K23 PolarHBondContact O-N 3.28Å; V19-L42 HydrophobicContact CG1-CD1 3.83Å; V19-L42 HydrophobicContact CG2-CD1 4.3Å
20T93.8Very high88.7Confident73 Ų7364.9 Ų64.945%0.44837%0.372SS..Hα-helixtrans-56.3-45.4176.1-58.50000111.7T15 S16 T24T15-T20 PolarHBondContact O-OG1 3.21Å; S16-T20 WeakPolarHBondContact O-CB 3.38Å; S16-T20 PolarHBondContact O-N 3.03Å; S16-T20 PolarHBondContact O-OG1 3.48Å; T20-T24 WeakPolarHBondContact O-CG2 3.38Å
21W95.3Very high88Confident123 Ų12366.3 Ų66.347%0.46639%0.389SS..Hα-helixtrans-65.8-46175.9172.478.5000112.3P17 L18 V19 K23 T24 F25 I55P17-W21 WeakPolarHBondContact O-CB 3.36Å; P17-W21 PolarHBondContact O-N 3.43Å; L18-W21 HydrophobicContact CD1-CE3 3.92Å; L18-W21 HydrophobicContact CD1-CZ3 4.23Å; L18-W21 PolarHBondContact O-N 2.97Å; V19-W21 VanDerWaalsContact C-N 3.31Å; V19-W21 PolarHBondContact O-N 2.83Å; W21-K23 VanDerWaalsContact C-N 3.26Å; W21-K23 PolarHBondContact O-N 3.2Å; W21-T24 PolarHBondContact O-N 3.28Å; W21-T24 VanDerWaalsContact O-N 3.09Å; W21-T24 PolarHBondContact O-OG1 3.43Å; W21-F25 AromaticContact CD2-CE2 3.96Å; W21-F25 HydrophobicContact CD2-CE2 3.96Å; W21-F25 AromaticContact CE2-CE2 3.48Å; W21-F25 VanDerWaalsContact CE2-CE2 3.48Å; W21-F25 AromaticContact CE2-CZ 3.88Å; W21-F25 HydrophobicContact CE3-CE2 4.34Å; W21-F25 AromaticContact CH2-CE2 3.91Å; W21-F25 HydrophobicContact CH2-CE2 3.91Å; W21-F25 AromaticContact CH2-CZ 3.97Å; W21-F25 HydrophobicContact CH2-CZ 3.97Å; W21-F25 AromaticContact CZ2-CE2 3.47Å; W21-F25 HydrophobicContact CZ2-CE2 3.47Å; W21-F25 VanDerWaalsContact CZ2-CE2 3.47Å; W21-F25 AromaticContact CZ2-CZ 3.45Å; W21-F25 HydrophobicContact CZ2-CZ 3.45Å; W21-F25 VanDerWaalsContact CZ2-CZ 3.45Å; W21-F25 HydrophobicContact CZ3-CE2 4.32Å; W21-F25 AromaticContact NE1-CE2 3.84Å; W21-I55 HydrophobicContact CH2-CD1 3.95Å
22V95.3Very high87.3Confident12 Ų1268.7 Ų68.77%0.07341%0.405CS..Hα-helixtrans-59.1-38178.7161.90000111.6L18 V19 T24 F25 L42 F47 L48 V51L18-V22 HydrophobicContact CD1-CG2 4.36Å; L18-V22 WeakPolarHBondContact O-CB 3.35Å; L18-V22 WeakPolarHBondContact O-CG2 3.49Å; L18-V22 PolarHBondContact O-N 3.29Å; V19-V22 PolarHBondContact O-N 3.32Å; V22-T24 PolarHBondContact O-N 3.24Å; V22-F25 PolarHBondContact O-N 3.07Å; V22-L42 HydrophobicContact CG1-CD2 3.73Å; V22-F47 HydrophobicContact CG1-CD1 4.15Å; V22-F47 HydrophobicContact CG1-CE1 3.66Å; V22-L48 HydrophobicContact CG1-CD2 3.77Å; V22-V51 HydrophobicContact CG1-CG2 4.39Å
23K91.8Very high86.8Confident38 Ų3864 Ų6417%0.16539%0.394CS..Hα-helixtrans-61.1-24.6178.8-73.2178.466170.30113.1M14 V19 W21 F25 L28 A29 E38M14-K23 HydrophobicContact CE-CD 4.37Å; V19-K23 HydrophobicContact CG1-CD 4.13Å; V19-K23 HydrophobicContact CG1-CG 4.34Å; V19-K23 VanDerWaalsContact O-CG 3.3Å; V19-K23 WeakPolarHBondContact O-CG 3.1Å; V19-K23 PolarHBondContact O-N 3.28Å; W21-K23 VanDerWaalsContact C-N 3.26Å; W21-K23 PolarHBondContact O-N 3.2Å; K23-F25 PolarHBondContact O-N 3.18Å; K23-L28 HydrophobicContact CB-CB 4.1Å; K23-L28 WeakPolarHBondContact CE-O 3.33Å; K23-L28 HydrophobicContact CG-CB 3.91Å; K23-L28 HydrophobicContact CG-CD1 4.38Å; K23-A29 WeakPolarHBondContact O-CA 3.41Å; K23-A29 WeakPolarHBondContact O-CB 3.48Å; K23-A29 PolarHBondContact O-N 3.09Å; K23-A29 VanDerWaalsContact O-N 3.07Å; K23-E38 WeakPolarHBondContact CE-OE1 3.4Å; K23-E38 WeakPolarHBondContact CE-OE2 3.43Å; K23-E38 IonicContact NZ-OE1 2.84Å; K23-E38 PolarHBondContact NZ-OE1 3.42Å; K23-E38 IonicContact NZ-OE2 2.62Å; K23-E38 PolarHBondContact NZ-OE2 2.82Å
24T92.1Very high86.8Confident93 Ų9364.8 Ų64.857%0.57140%0.404SS*.THydrogen-bonded Turntrans-69.4-13.3-179.374.40000113.8T20 W21 V22 G26T20-T24 WeakPolarHBondContact O-CG2 3.38Å; W21-T24 PolarHBondContact O-N 3.28Å; W21-T24 VanDerWaalsContact O-N 3.09Å; W21-T24 PolarHBondContact O-OG1 3.43Å; V22-T24 PolarHBondContact O-N 3.24Å; T24-G26 VanDerWaalsContact C-N 3.32Å; T24-G26 PolarHBondContact O-N 2.91Å
25F90.1Very high86.7Confident47 Ų4767.5 Ų67.521%0.20642%0.418CS..THydrogen-bonded Turntrans-82.8-1-175.7-77.1-99.1000114.8W21 V22 K23 F47 V51 Q54 I55W21-F25 AromaticContact CD2-CE2 3.96Å; W21-F25 HydrophobicContact CD2-CE2 3.96Å; W21-F25 AromaticContact CE2-CE2 3.48Å; W21-F25 VanDerWaalsContact CE2-CE2 3.48Å; W21-F25 AromaticContact CE2-CZ 3.88Å; W21-F25 HydrophobicContact CE3-CE2 4.34Å; W21-F25 AromaticContact CH2-CE2 3.91Å; W21-F25 HydrophobicContact CH2-CE2 3.91Å; W21-F25 AromaticContact CH2-CZ 3.97Å; W21-F25 HydrophobicContact CH2-CZ 3.97Å; W21-F25 AromaticContact CZ2-CE2 3.47Å; W21-F25 HydrophobicContact CZ2-CE2 3.47Å; W21-F25 VanDerWaalsContact CZ2-CE2 3.47Å; W21-F25 AromaticContact CZ2-CZ 3.45Å; W21-F25 HydrophobicContact CZ2-CZ 3.45Å; W21-F25 VanDerWaalsContact CZ2-CZ 3.45Å; W21-F25 HydrophobicContact CZ3-CE2 4.32Å; W21-F25 AromaticContact NE1-CE2 3.84Å; V22-F25 PolarHBondContact O-N 3.07Å; K23-F25 PolarHBondContact O-N 3.18Å; F25-F47 HydrophobicContact CB-CZ 4.34Å; F25-V51 HydrophobicContact CB-CG1 4.37Å; F25-V51 HydrophobicContact CB-CG2 3.7Å; F25-V51 HydrophobicContact CD1-CG1 3.92Å; F25-V51 HydrophobicContact CD2-CG1 4.05Å; F25-V51 HydrophobicContact CE1-CG1 4.19Å; F25-V51 HydrophobicContact CE2-CG1 4.32Å; F25-V51 HydrophobicContact CG-CB 4.48Å; F25-V51 HydrophobicContact CG-CG1 3.84Å; F25-V51 HydrophobicContact CG-CG2 4.11Å; F25-V51 HydrophobicContact CZ-CG1 4.38Å; F25-Q54 HydrophobicContact CD1-CB 4.18Å; F25-Q54 HydrophobicContact CE1-CB 4.44Å; F25-Q54 PolarHBondContact O-NE2 3.27Å; F25-I55 HydrophobicContact CE1-CG1 4.33Å
26G82.8Confident86.5Confident26 Ų2666.4 Ų66.427%0.26841%0.408SS..SBendtrans-176.3-155.3-176.200000114.7T24 L28 A29T24-G26 VanDerWaalsContact C-N 3.32Å; T24-G26 PolarHBondContact O-N 2.91Å; G26-L28 PolarHBondContact O-N 3.14Å; G26-A29 VanDerWaalsContact O-CB 3.29Å; G26-A29 WeakPolarHBondContact O-CB 3.29Å; G26-A29 PolarHBondContact O-N 3.28Å
27P75.7Confident86.3Confident105 Ų10569.4 Ų69.468%0.68242%0.422SS*.G310 helixtrans-65.9-16.1-16926.4-34.2000113.5A29 A30P27-A29 PolarHBondContact O-N 3.06Å; P27-A30 PolarHBondContact O-N 2.98Å
28L79.3Confident86Confident24 Ų2464.2 Ų64.213%0.12639%0.387CS..G310 helixtrans-65.2-18.8172.7-56.9-173.6000112.8K23 G26 A30 G31 E38 A41 L42 F47K23-L28 HydrophobicContact CB-CB 4.1Å; K23-L28 WeakPolarHBondContact CE-O 3.33Å; K23-L28 HydrophobicContact CG-CB 3.91Å; K23-L28 HydrophobicContact CG-CD1 4.38Å; G26-L28 PolarHBondContact O-N 3.14Å; L28-A30 PolarHBondContact O-N 3.23Å; L28-G31 PolarHBondContact O-N 2.99Å; L28-E38 HydrophobicContact CD2-CG 4.25Å; L28-A41 HydrophobicContact CD2-CB 4.44Å; L28-L42 HydrophobicContact CD1-CD2 4.37Å; L28-F47 HydrophobicContact CD1-CD1 3.56Å; L28-F47 HydrophobicContact CD1-CE1 3.49Å; L28-F47 VanDerWaalsContact CD1-CE1 3.49Å; L28-F47 HydrophobicContact CD1-CG 4.16Å; L28-F47 HydrophobicContact CD1-CZ 4.04Å; L28-F47 HydrophobicContact CG-CD1 4.44Å; L28-F47 HydrophobicContact CG-CE1 4.16Å; L28-F47 HydrophobicContact CG-CZ 4.21Å
29A72Confident85.9Confident69 Ų6958.7 Ų58.757%0.5736%0.358SS*.G310 helixtrans-63.8-26.8174.600000112.8K23 G26 P27 G31K23-A29 WeakPolarHBondContact O-CA 3.41Å; K23-A29 WeakPolarHBondContact O-CB 3.48Å; K23-A29 PolarHBondContact O-N 3.09Å; K23-A29 VanDerWaalsContact O-N 3.07Å; G26-A29 VanDerWaalsContact O-CB 3.29Å; G26-A29 WeakPolarHBondContact O-CB 3.29Å; G26-A29 PolarHBondContact O-N 3.28Å; P27-A29 PolarHBondContact O-N 3.06Å; A29-G31 VanDerWaalsContact C-N 3.26Å; A29-G31 PolarHBondContact O-N 3.08Å
30A72.1Confident85.8Confident61 Ų6161.3 Ų61.350%0.50437%0.374SS..G310 helixtrans-73.4-18-179.400000113P27 L28 N32P27-A30 PolarHBondContact O-N 2.98Å; L28-A30 PolarHBondContact O-N 3.23Å; A30-N32 PolarHBondContact O-N 3.28Å; A30-N32 PolarHBondContact O-OD1 3.01Å
31G72.2Confident85.7Confident42 Ų4259 Ų5943%0.43336%0.363SS..  trans6325.4179.300000114.2L28 A29 G33L28-G31 PolarHBondContact O-N 2.99Å; A29-G31 VanDerWaalsContact C-N 3.26Å; A29-G31 PolarHBondContact O-N 3.08Å; G31-G33 VanDerWaalsContact C-N 3.26Å; G31-G33 PolarHBondContact O-N 3.09Å
32N75.1Confident85.6Confident154 Ų15453.7 Ų53.782%0.82434%0.344SS*.  trans-78.9-4.5-173.8-68.6-11.7000114A30A30-N32 PolarHBondContact O-N 3.28Å; A30-N32 PolarHBondContact O-OD1 3.01Å
33G81Confident85.4Confident38 Ų3853.7 Ų53.739%0.39234%0.344SS..SBendtrans-114.1169-178.100000112.5G31G31-G33 VanDerWaalsContact C-N 3.26Å; G31-G33 PolarHBondContact O-N 3.09Å
34T89.9Confident85.5Confident79 Ų7953.5 Ų53.549%0.48534%0.344SS..  trans-72.2158171.569.70000110.5L36 D37 E38T34-L36 PolarHBondContact O-N 3.1Å; T34-L36 VanDerWaalsContact O-N 3.08Å; T34-L36 PolarHBondContact OG1-N 3.42Å; T34-D37 WeakPolarHBondContact CB-OD2 3.47Å; T34-D37 PolarHBondContact N-OD2 3.1Å; T34-D37 PolarHBondContact O-N 3.08Å; T34-D37 PolarHBondContact OG1-N 3.44Å; T34-D37 PolarHBondContact OG1-OD2 3.41Å; T34-E38 WeakPolarHBondContact O-CG 3.42Å; T34-E38 PolarHBondContact O-N 2.87Å
35N89.6Confident85.6Confident62 Ų6249 Ų4933%0.33232%0.317SS..Hα-helixtrans-52.9-31.6172.7-76.6-14.1000112.4L10 M14 Y39L10-N35 HydrophobicContact CD2-CB 4.24Å; L10-N35 HydrophobicContact CG-CB 4.31Å; M14-N35 HydrophobicContact CG-CB 4.03Å; N35-Y39 WeakPolarHBondContact O-CB 3.3Å; N35-Y39 PolarHBondContact O-N 3.33Å
36L89.6Confident85.9Confident79 Ų7947.7 Ų47.741%0.41431%0.313SS..Hα-helixtrans-70.5-43.5176.7-177.462.5000112F6 L10 T34 Y39 V40 F113F6-L36 HydrophobicContact CE1-CD1 4.34Å; L10-L36 HydrophobicContact CD2-CB 4.33Å; L10-L36 HydrophobicContact CD2-CD1 4.43Å; T34-L36 PolarHBondContact O-N 3.1Å; T34-L36 VanDerWaalsContact O-N 3.08Å; T34-L36 PolarHBondContact OG1-N 3.42Å; L36-Y39 PolarHBondContact O-N 3.2Å; L36-V40 HydrophobicContact CD1-CG2 4.44Å; L36-V40 WeakPolarHBondContact O-CB 3.37Å; L36-V40 VanDerWaalsContact O-CG2 3.28Å; L36-V40 WeakPolarHBondContact O-CG2 3.36Å; L36-V40 PolarHBondContact O-N 2.92Å; L36-F113 HydrophobicContact CD1-CE1 3.86Å; L36-F113 HydrophobicContact CD1-CZ 4.49Å
37D89.4Confident86.4Confident93 Ų9347.1 Ų47.150%0.49730%0.303SS..Hα-helixtrans-63.2-44.8178.5-59.3-47.5000111.1T34 Y39 V40 A41T34-D37 WeakPolarHBondContact CB-OD2 3.47Å; T34-D37 PolarHBondContact N-OD2 3.1Å; T34-D37 PolarHBondContact O-N 3.08Å; T34-D37 PolarHBondContact OG1-N 3.44Å; T34-D37 PolarHBondContact OG1-OD2 3.41Å; D37-Y39 VanDerWaalsContact C-N 3.35Å; D37-V40 PolarHBondContact O-N 3.36Å; D37-A41 PolarHBondContact O-N 3.18Å
38E91.5Very high87.4Confident5 Ų544 Ų442%0.02328%0.281CS..Hα-helixtrans-64.6-41177.4-63.8-175153.400111.5M14 K23 L28 T34 A41 L42M14-E38 HydrophobicContact CE-CB 3.46Å; M14-E38 VanDerWaalsContact CE-CB 3.46Å; M14-E38 VanDerWaalsContact CE-OE2 3.3Å; M14-E38 WeakPolarHBondContact CE-OE2 3.3Å; K23-E38 WeakPolarHBondContact CE-OE1 3.4Å; K23-E38 WeakPolarHBondContact CE-OE2 3.43Å; K23-E38 IonicContact NZ-OE1 2.84Å; K23-E38 PolarHBondContact NZ-OE1 3.42Å; K23-E38 IonicContact NZ-OE2 2.62Å; K23-E38 PolarHBondContact NZ-OE2 2.82Å; L28-E38 HydrophobicContact CD2-CG 4.25Å; T34-E38 WeakPolarHBondContact O-CG 3.42Å; T34-E38 PolarHBondContact O-N 2.87Å; E38-A41 WeakPolarHBondContact O-CB 3.3Å; E38-A41 PolarHBondContact O-N 2.94Å; E38-L42 WeakPolarHBondContact O-CG 3.48Å; E38-L42 PolarHBondContact O-N 3.28Å; E38-L42 VanDerWaalsContact O-N 3.16Å
39Y91.9Very high88.1Confident2 Ų243.3 Ų43.31%0.00828%0.277CS..Hα-helixtrans-61.3-45.8174.5179.6-97.7000112.5F6 L10 F13 M14 N35 L36 D37 A41 L42 V43 P112 F113 F117F6-Y39 HydrophobicContact CZ-CD1 4.25Å; F6-Y39 AromaticContact CZ-CE1 3.94Å; F6-Y39 HydrophobicContact CZ-CE1 3.94Å; L10-Y39 HydrophobicContact CD1-CD1 4.27Å; L10-Y39 HydrophobicContact CD1-CD2 3.59Å; L10-Y39 HydrophobicContact CD1-CE2 4.39Å; L10-Y39 HydrophobicContact CD1-CG 3.52Å; F13-Y39 AromaticContact CD1-CD2 3.63Å; F13-Y39 HydrophobicContact CD1-CD2 3.63Å; F13-Y39 AromaticContact CD1-CE2 3.74Å; F13-Y39 HydrophobicContact CD1-CE2 3.74Å; F13-Y39 AromaticContact CE1-CD2 3.53Å; F13-Y39 HydrophobicContact CE1-CD2 3.53Å; F13-Y39 AromaticContact CE1-CE2 3.56Å; F13-Y39 HydrophobicContact CE1-CE2 3.56Å; F13-Y39 HydrophobicContact CZ-CE2 4.28Å; M14-Y39 HydrophobicContact SD-CD2 4.14Å; N35-Y39 WeakPolarHBondContact O-CB 3.3Å; N35-Y39 PolarHBondContact O-N 3.33Å; L36-Y39 PolarHBondContact O-N 3.2Å; D37-Y39 VanDerWaalsContact C-N 3.35Å; Y39-A41 VanDerWaalsContact C-N 3.26Å; Y39-A41 PolarHBondContact O-N 3.03Å; Y39-L42 WeakPolarHBondContact O-CB 3.48Å; Y39-L42 PolarHBondContact O-N 3.43Å; Y39-V43 HydrophobicContact CD1-CG1 4.28Å; Y39-V43 HydrophobicContact CD1-CG2 4.47Å; Y39-V43 HydrophobicContact CE1-CG1 3.7Å; Y39-V43 HydrophobicContact CE1-CG2 4.28Å; Y39-V43 HydrophobicContact CE2-CG1 3.97Å; Y39-V43 WeakPolarHBondContact O-CG2 3.35Å; Y39-V43 PolarHBondContact O-N 3.35Å; Y39-P112 WeakPolarHBondContact CE1-O 3.41Å; Y39-P112 PolarHBondContact OH-O 3.38Å; Y39-F113 HydrophobicContact CD1-CD1 4.29Å; Y39-F113 AromaticContact CD1-CE1 3.87Å; Y39-F113 HydrophobicContact CD1-CE1 3.87Å; Y39-F113 AromaticContact CE1-CD1 3.82Å; Y39-F113 HydrophobicContact CE1-CD1 3.82Å; Y39-F113 AromaticContact CE1-CE1 3.77Å; Y39-F113 HydrophobicContact CE1-CE1 3.77Å; Y39-F117 HydrophobicContact CE2-CZ 4.32Å; Y39-F117 WeakPolarHBondContact OH-CE1 3.34Å; Y39-F117 WeakPolarHBondContact OH-CZ 3.23Å
40V91.3Very high89.2Confident62 Ų6244.5 Ų44.538%0.37627%0.271SS..Hα-helixtrans-58.8-40.4176.5169.30000110.9L36 D37 L42 V43 D44 F113L36-V40 HydrophobicContact CD1-CG2 4.44Å; L36-V40 WeakPolarHBondContact O-CB 3.37Å; L36-V40 VanDerWaalsContact O-CG2 3.28Å; L36-V40 WeakPolarHBondContact O-CG2 3.36Å; L36-V40 PolarHBondContact O-N 2.92Å; D37-V40 PolarHBondContact O-N 3.36Å; V40-L42 VanDerWaalsContact C-N 3.26Å; V40-L42 PolarHBondContact O-N 3.39Å; V40-V43 WeakPolarHBondContact O-CG2 3.42Å; V40-V43 PolarHBondContact O-N 2.62Å; V40-D44 WeakPolarHBondContact O-CB 3.33Å; V40-D44 PolarHBondContact O-N 3.18Å; V40-F113 HydrophobicContact CG2-CE1 4.44Å; V40-F113 HydrophobicContact CG2-CZ 4.19Å
41A91.3Very high90.3Very high26 Ų2641.9 Ų41.922%0.21525%0.248CC..Hα-helixtrans-66.4-23.7176.100000113.9L28 D37 E38 Y39 D44 F47L28-A41 HydrophobicContact CD2-CB 4.44Å; D37-A41 PolarHBondContact O-N 3.18Å; E38-A41 WeakPolarHBondContact O-CB 3.3Å; E38-A41 PolarHBondContact O-N 2.94Å; Y39-A41 VanDerWaalsContact C-N 3.26Å; Y39-A41 PolarHBondContact O-N 3.03Å; A41-D44 VanDerWaalsContact O-OD1 3.07Å; A41-F47 WeakPolarHBondContact O-CB 3.32Å
42L93.1Very high91.4Very high10 Ų1040.4 Ų40.45%0.05223%0.23CC..Hα-helixtrans-78.4-51172.7-64.8170.3000110.9F13 M14 V19 V22 L28 E38 Y39 V40 D44 G45 F47 L48F13-L42 HydrophobicContact CE1-CD1 4.13Å; M14-L42 HydrophobicContact CE-CD1 4.2Å; M14-L42 HydrophobicContact SD-CD1 4.15Å; V19-L42 HydrophobicContact CG1-CD1 3.83Å; V19-L42 HydrophobicContact CG2-CD1 4.3Å; V22-L42 HydrophobicContact CG1-CD2 3.73Å; L28-L42 HydrophobicContact CD1-CD2 4.37Å; E38-L42 WeakPolarHBondContact O-CG 3.48Å; E38-L42 PolarHBondContact O-N 3.28Å; E38-L42 VanDerWaalsContact O-N 3.16Å; Y39-L42 WeakPolarHBondContact O-CB 3.48Å; Y39-L42 PolarHBondContact O-N 3.43Å; V40-L42 VanDerWaalsContact C-N 3.26Å; V40-L42 PolarHBondContact O-N 3.39Å; L42-D44 VanDerWaalsContact C-N 3.3Å; L42-D44 PolarHBondContact O-N 3.41Å; L42-G45 PolarHBondContact O-N 3.32Å; L42-F47 HydrophobicContact CD2-CD1 4.03Å; L42-L48 HydrophobicContact CD2-CD2 3.91Å; L42-L48 HydrophobicContact CD2-CG 4.47Å; L42-L48 VanDerWaalsContact O-CD1 3.31Å; L42-L48 WeakPolarHBondContact O-CD1 3.44Å
43V92.5Very high92.3Very high13 Ų1336.5 Ų36.58%0.07921%0.209CC..Hα-helixtrans-73.3-19.2-173.1-600000113.8Y39 V40 G45 I108 P112Y39-V43 HydrophobicContact CD1-CG1 4.28Å; Y39-V43 HydrophobicContact CD1-CG2 4.47Å; Y39-V43 HydrophobicContact CE1-CG1 3.7Å; Y39-V43 HydrophobicContact CE1-CG2 4.28Å; Y39-V43 HydrophobicContact CE2-CG1 3.97Å; Y39-V43 WeakPolarHBondContact O-CG2 3.35Å; Y39-V43 PolarHBondContact O-N 3.35Å; V40-V43 WeakPolarHBondContact O-CG2 3.42Å; V40-V43 PolarHBondContact O-N 2.62Å; V43-G45 PolarHBondContact O-N 2.84Å; V43-I108 HydrophobicContact CB-CG2 4.4Å; V43-I108 HydrophobicContact CG1-CG2 4.43Å; V43-P112 HydrophobicContact CB-CB 4.16Å; V43-P112 HydrophobicContact CG1-CB 4.41Å; V43-P112 HydrophobicContact CG2-CB 3.93Å
44D93.3Very high92.9Very high33 Ų3339.9 Ų39.918%0.17621%0.214CC..THydrogen-bonded Turntrans-71.1-13.3174.4832000113.7V40 A41 L42 V46 V68 N78V40-D44 WeakPolarHBondContact O-CB 3.33Å; V40-D44 PolarHBondContact O-N 3.18Å; A41-D44 VanDerWaalsContact O-OD1 3.07Å; L42-D44 VanDerWaalsContact C-N 3.3Å; L42-D44 PolarHBondContact O-N 3.41Å; D44-V46 PolarHBondContact O-N 3.47Å; D44-V46 WeakPolarHBondContact OD1-CB 3.31Å; D44-V46 PolarHBondContact OD1-N 2.95Å; D44-V68 HydrophobicContact CB-CB 4.25Å; D44-V68 HydrophobicContact CB-CG1 4.23Å; D44-V68 HydrophobicContact CB-CG2 4.08Å; D44-N78 WeakPolarHBondContact O-CB 3.48Å; D44-N78 PolarHBondContact O-ND2 3.42Å
45G94.1Very high93.1Very high0 Ų039 Ų390%021%0.206CC..SBendtrans75.1-5.7177.900000114.7L42 V43 N49L42-G45 PolarHBondContact O-N 3.32Å; V43-G45 PolarHBondContact O-N 2.84Å; G45-N49 PolarHBondContact O-N 2.98Å; G45-N49 PolarHBondContact O-ND2 3.32Å
46V95.2Very high93.3Very high19 Ų1936.4 Ų36.412%0.11519%0.192CC..Hα-helixtrans-68.5-52-177.2179.70000110.4D44 N49 Q50 V64 N65 V68 N78D44-V46 PolarHBondContact O-N 3.47Å; D44-V46 WeakPolarHBondContact OD1-CB 3.31Å; D44-V46 PolarHBondContact OD1-N 2.95Å; V46-N49 PolarHBondContact O-N 3.26Å; V46-Q50 WeakPolarHBondContact O-CG 3.46Å; V46-Q50 PolarHBondContact O-N 3.3Å; V46-V64 HydrophobicContact CB-CG1 4.36Å; V46-V64 HydrophobicContact CG1-CG1 4.36Å; V46-V64 HydrophobicContact CG2-CG1 4.06Å; V46-N65 VanDerWaalsContact CG2-O 3.22Å; V46-N65 WeakPolarHBondContact CG2-O 3.15Å; V46-V68 HydrophobicContact CG2-CG2 3.84Å; V46-N78 WeakPolarHBondContact CG2-ND2 3.46Å
47F94.9Very high93.4Very high14 Ų1437.3 Ų37.36%0.06120%0.203CC..Hα-helixtrans-64.3-44-179-178.6-114.5000111.4V22 F25 L28 A41 L42 N49 Q50 V51V22-F47 HydrophobicContact CG1-CD1 4.15Å; V22-F47 HydrophobicContact CG1-CE1 3.66Å; F25-F47 HydrophobicContact CB-CZ 4.34Å; L28-F47 HydrophobicContact CD1-CD1 3.56Å; L28-F47 HydrophobicContact CD1-CE1 3.49Å; L28-F47 VanDerWaalsContact CD1-CE1 3.49Å; L28-F47 HydrophobicContact CD1-CG 4.16Å; L28-F47 HydrophobicContact CD1-CZ 4.04Å; L28-F47 HydrophobicContact CG-CD1 4.44Å; L28-F47 HydrophobicContact CG-CE1 4.16Å; L28-F47 HydrophobicContact CG-CZ 4.21Å; A41-F47 WeakPolarHBondContact O-CB 3.32Å; L42-F47 HydrophobicContact CD2-CD1 4.03Å; F47-N49 VanDerWaalsContact C-N 3.31Å; F47-N49 PolarHBondContact O-N 2.96Å; F47-Q50 WeakPolarHBondContact O-CA 3.43Å; F47-Q50 VanDerWaalsContact O-CB 3.31Å; F47-Q50 WeakPolarHBondContact O-CB 3.25Å; F47-Q50 PolarHBondContact O-N 3.04Å; F47-V51 HydrophobicContact CD1-CG2 4.2Å; F47-V51 HydrophobicContact CE1-CG2 3.82Å; F47-V51 HydrophobicContact CE2-CG2 4.3Å; F47-V51 HydrophobicContact CZ-CG2 3.87Å; F47-V51 WeakPolarHBondContact O-CG2 3.24Å; F47-V51 PolarHBondContact O-N 3Å
48L95.5Very high93.2Very high40 Ų4042.3 Ų42.321%0.20922%0.22CC..Hα-helixtrans-61.7-36.6179.9-64.9179.5000113.1V22 L42 Q50 V51 M52 L82V22-L48 HydrophobicContact CG1-CD2 3.77Å; L42-L48 HydrophobicContact CD2-CD2 3.91Å; L42-L48 HydrophobicContact CD2-CG 4.47Å; L42-L48 VanDerWaalsContact O-CD1 3.31Å; L42-L48 WeakPolarHBondContact O-CD1 3.44Å; L48-Q50 VanDerWaalsContact C-N 3.31Å; L48-Q50 PolarHBondContact O-N 3.42Å; L48-V51 PolarHBondContact O-N 3.32Å; L48-M52 PolarHBondContact O-N 2.9Å; L48-L82 HydrophobicContact CB-CD1 4.22Å; L48-L82 HydrophobicContact CB-CD2 3.51Å; L48-L82 HydrophobicContact CB-CG 4.48Å; L48-L82 HydrophobicContact CD1-CD2 3.79Å; L48-L82 HydrophobicContact CG-CD2 4.29Å
49N95.6Very high92.7Very high8 Ų842.7 Ų42.74%0.04322%0.223CC..Hα-helixtrans-65.4-34172.7-83.8-78000112.2G45 V46 F47 M52 L53 V64 N78 I81 L82 Q85G45-N49 PolarHBondContact O-N 2.98Å; G45-N49 PolarHBondContact O-ND2 3.32Å; V46-N49 PolarHBondContact O-N 3.26Å; F47-N49 VanDerWaalsContact C-N 3.31Å; F47-N49 PolarHBondContact O-N 2.96Å; N49-M52 PolarHBondContact O-N 3.38Å; N49-L53 PolarHBondContact O-N 3.42Å; N49-V64 HydrophobicContact CB-CG2 3.68Å; N49-N78 PolarHBondContact ND2-O 2.79Å; N49-I81 VanDerWaalsContact OD1-CG2 3.23Å; N49-I81 WeakPolarHBondContact OD1-CG2 3.35Å; N49-L82 PolarHBondContact OD1-N 3.36Å; N49-Q85 PolarHBondContact OD1-OE1 3.19Å
50Q94Very high91.9Very high95 Ų9550.4 Ų50.444%0.44426%0.259SS..Hα-helixtrans-67.6-40.8174.2-63.9170.4500111.4V46 F47 L48 M52 L53 Q54V46-Q50 WeakPolarHBondContact O-CG 3.46Å; V46-Q50 PolarHBondContact O-N 3.3Å; F47-Q50 WeakPolarHBondContact O-CA 3.43Å; F47-Q50 VanDerWaalsContact O-CB 3.31Å; F47-Q50 WeakPolarHBondContact O-CB 3.25Å; F47-Q50 PolarHBondContact O-N 3.04Å; L48-Q50 VanDerWaalsContact C-N 3.31Å; L48-Q50 PolarHBondContact O-N 3.42Å; Q50-M52 VanDerWaalsContact C-N 3.33Å; Q50-L53 PolarHBondContact O-N 3.39Å; Q50-Q54 PolarHBondContact O-N 3.06Å; Q50-Q54 VanDerWaalsContact O-N 3.09Å
51V95.3Very high90.9Very high6 Ų652.2 Ų52.24%0.03628%0.275CS..Hα-helixtrans-59.4-46.2173.5176.50000110.3V22 F25 F47 L48 L53 Q54 I55V22-V51 HydrophobicContact CG1-CG2 4.39Å; F25-V51 HydrophobicContact CB-CG1 4.37Å; F25-V51 HydrophobicContact CB-CG2 3.7Å; F25-V51 HydrophobicContact CD1-CG1 3.92Å; F25-V51 HydrophobicContact CD2-CG1 4.05Å; F25-V51 HydrophobicContact CE1-CG1 4.19Å; F25-V51 HydrophobicContact CE2-CG1 4.32Å; F25-V51 HydrophobicContact CG-CB 4.48Å; F25-V51 HydrophobicContact CG-CG1 3.84Å; F25-V51 HydrophobicContact CG-CG2 4.11Å; F25-V51 HydrophobicContact CZ-CG1 4.38Å; F47-V51 HydrophobicContact CD1-CG2 4.2Å; F47-V51 HydrophobicContact CE1-CG2 3.82Å; F47-V51 HydrophobicContact CE2-CG2 4.3Å; F47-V51 HydrophobicContact CZ-CG2 3.87Å; F47-V51 WeakPolarHBondContact O-CG2 3.24Å; F47-V51 PolarHBondContact O-N 3Å; L48-V51 PolarHBondContact O-N 3.32Å; V51-L53 VanDerWaalsContact C-N 3.28Å; V51-L53 PolarHBondContact O-N 3.27Å; V51-Q54 WeakPolarHBondContact O-CB 3.45Å; V51-Q54 PolarHBondContact O-N 2.84Å; V51-Q54 VanDerWaalsContact O-N 3.08Å; V51-I55 HydrophobicContact CG1-CD1 3.97Å; V51-I55 WeakPolarHBondContact O-CG1 3.17Å; V51-I55 PolarHBondContact O-N 3.48Å
52M95.4Very high90.5Very high11 Ų1154.3 Ų54.35%0.05428%0.28CS..Hα-helixtrans-61.7-35.9178-169.162.6-139.700112.7L48 N49 Q50 I55 N56 L82 Q85 I86 Y89L48-M52 PolarHBondContact O-N 2.9Å; N49-M52 PolarHBondContact O-N 3.38Å; Q50-M52 VanDerWaalsContact C-N 3.33Å; M52-I55 HydrophobicContact CE-CB 4.42Å; M52-I55 HydrophobicContact CE-CG2 4.14Å; M52-I55 PolarHBondContact O-N 3.41Å; M52-I55 HydrophobicContact SD-CD1 4.49Å; M52-N56 HydrophobicContact CE-CB 3.89Å; M52-N56 PolarHBondContact O-N 3.42Å; M52-L82 HydrophobicContact CB-CD1 3.81Å; M52-L82 HydrophobicContact CG-CD1 4.3Å; M52-Q85 HydrophobicContact CG-CB 3.8Å; M52-I86 HydrophobicContact SD-CG1 3.71Å; M52-Y89 HydrophobicContact CE-CD1 4.19Å; M52-Y89 HydrophobicContact CE-CD2 4.32Å; M52-Y89 HydrophobicContact CE-CG 3.78Å
53L93.6Very high90.3Very high71 Ų7165 Ų6537%0.37232%0.32SS..Hα-helixtrans-66.9-35174.6-174.763.9000112.5N49 Q50 V51 N56 P57N49-L53 PolarHBondContact O-N 3.42Å; Q50-L53 PolarHBondContact O-N 3.39Å; V51-L53 VanDerWaalsContact C-N 3.28Å; V51-L53 PolarHBondContact O-N 3.27Å; L53-N56 CarbonylContact O-C 3.29Å; L53-N56 VanDerWaalsContact O-C 3.26Å; L53-P57 VanDerWaalsContact O-CA 3.3Å; L53-P57 WeakPolarHBondContact O-CA 3.42Å; L53-P57 VanDerWaalsContact O-N 3.14Å
54Q93.6Very high90.4Very high109 Ų10966.2 Ų66.251%0.50933%0.327SS..Hα-helixtrans-68-37.4172.7-67.3-175.549.300111.8F25 Q50 V51F25-Q54 HydrophobicContact CD1-CB 4.18Å; F25-Q54 HydrophobicContact CE1-CB 4.44Å; F25-Q54 PolarHBondContact O-NE2 3.27Å; Q50-Q54 PolarHBondContact O-N 3.06Å; Q50-Q54 VanDerWaalsContact O-N 3.09Å; V51-Q54 WeakPolarHBondContact O-CB 3.45Å; V51-Q54 PolarHBondContact O-N 2.84Å; V51-Q54 VanDerWaalsContact O-N 3.08Å
55I94.6Very high90.6Very high60 Ų6067.3 Ų67.331%0.30833%0.333SS..Hα-helixtrans-67.3-44.2176.3-66.1166.8000111.1W21 F25 V51 M52 Y89W21-I55 HydrophobicContact CH2-CD1 3.95Å; F25-I55 HydrophobicContact CE1-CG1 4.33Å; V51-I55 HydrophobicContact CG1-CD1 3.97Å; V51-I55 WeakPolarHBondContact O-CG1 3.17Å; V51-I55 PolarHBondContact O-N 3.48Å; M52-I55 HydrophobicContact CE-CB 4.42Å; M52-I55 HydrophobicContact CE-CG2 4.14Å; M52-I55 PolarHBondContact O-N 3.41Å; M52-I55 HydrophobicContact SD-CD1 4.49Å; I55-Y89 HydrophobicContact CG2-CE1 4.14Å
56N93.9Very high90.5Very high9 Ų975.7 Ų75.75%0.04837%0.369CS..  trans-129.483.1179.7-174.717.9000112.3M52 L53 K58 S59 Y89M52-N56 HydrophobicContact CE-CB 3.89Å; M52-N56 PolarHBondContact O-N 3.42Å; L53-N56 CarbonylContact O-C 3.29Å; L53-N56 VanDerWaalsContact O-C 3.26Å; N56-K58 PolarHBondContact O-N 3.02Å; N56-K58 VanDerWaalsContact O-N 3.08Å; N56-K58 PolarHBondContact OD1-N 3.3Å; N56-S59 WeakPolarHBondContact O-CB 3.19Å; N56-S59 PolarHBondContact O-N 3.05Å; N56-S59 VanDerWaalsContact O-N 3.1Å; N56-Y89 HydrophobicContact CB-CD2 3.56Å; N56-Y89 HydrophobicContact CB-CE2 3.88Å; N56-Y89 HydrophobicContact CB-CG 4.37Å
57P90.8Very high90.5Very high98 Ų9882.9 Ų82.964%0.63640%0.399SS*.THydrogen-bonded Turntrans-63.9-16.6-179.6-23.634.4000114.3L53 S59L53-P57 VanDerWaalsContact O-CA 3.3Å; L53-P57 WeakPolarHBondContact O-CA 3.42Å; L53-P57 VanDerWaalsContact O-N 3.14Å; P57-S59 VanDerWaalsContact C-N 3.32Å
58K85.2Confident90.3Very high198 Ų19882.5 Ų82.586%0.86140%0.398SS*.THydrogen-bonded Turntrans-83-9.4179.4-60.3-179.7-177.9177.40113N56N56-K58 PolarHBondContact O-N 3.02Å; N56-K58 VanDerWaalsContact O-N 3.08Å; N56-K58 PolarHBondContact OD1-N 3.3Å
59S82.1Confident90Very high12 Ų1287.6 Ų87.68%0.08443%0.426CS..SBendtrans-60.8139.3176.8176.80000110.5N56 P57 S61 Q85N56-S59 WeakPolarHBondContact O-CB 3.19Å; N56-S59 PolarHBondContact O-N 3.05Å; N56-S59 VanDerWaalsContact O-N 3.1Å; P57-S59 VanDerWaalsContact C-N 3.32Å; S59-S61 PolarHBondContact O-N 3.08Å; S59-Q85 PolarHBondContact OG-NE2 2.92Å
60E75.8Confident89.5Confident164 Ų16492.6 Ų92.677%0.76645%0.452SS*.  trans-56130.8167-73.2-172.9169.700109.9Q62E60-Q62 PolarHBondContact O-N 3.47Å
61S69.2Low89.6Confident100 Ų10091.6 Ų91.670%0.69945%0.45SS*.  trans-73.893.5178-68.40000109.5S59S59-S61 PolarHBondContact O-N 3.08Å
62Q82.1Confident89.6Confident71 Ų7192.8 Ų92.833%0.33246%0.46SS..  trans-74.5143.4169.3-60.6-156.4-71.500110.1E60 V64 I81E60-Q62 PolarHBondContact O-N 3.47Å; Q62-V64 PolarHBondContact O-N 2.98Å; Q62-I81 HydrophobicContact CB-CD1 4.24Å; Q62-I81 HydrophobicContact CB-CG1 4.34Å; Q62-I81 HydrophobicContact CB-CG2 3.71Å; Q62-I81 HydrophobicContact CG-CG2 4.36Å
63R90.4Very high89.6Confident233 Ų23396.4 Ų96.488%0.87949%0.487SS*.  trans-75.3106.8-176.9-71.9-175.7179-179.10.4110.9I81R63-I81 WeakPolarHBondContact O-CD1 3.5Å
64V94.6Very high89.8Confident39 Ų3995.4 Ų95.424%0.23648%0.482CS..  trans-82.5140.3173.1177.80000110.6V46 N49 Q62 K66 N78 I81V46-V64 HydrophobicContact CB-CG1 4.36Å; V46-V64 HydrophobicContact CG1-CG1 4.36Å; V46-V64 HydrophobicContact CG2-CG1 4.06Å; N49-V64 HydrophobicContact CB-CG2 3.68Å; Q62-V64 PolarHBondContact O-N 2.98Å; V64-K66 PolarHBondContact O-N 2.9Å; V64-N78 HydrophobicContact CG1-CB 4.37Å; V64-I81 HydrophobicContact CG2-CD1 4.35Å
65N96.1Very high89.9Confident56 Ų5690.8 Ų90.830%0.29946%0.46SS..  trans-78.4106.7175.1-65.4-70.8000110.4V46 V68 L74 H77 N78V46-N65 VanDerWaalsContact CG2-O 3.22Å; V46-N65 WeakPolarHBondContact CG2-O 3.15Å; N65-V68 VanDerWaalsContact O-CG2 3.22Å; N65-V68 WeakPolarHBondContact O-CG2 3.42Å; N65-L74 HydrophobicContact CB-CB 4.4Å; N65-L74 HydrophobicContact CB-CD2 4.34Å; N65-H77 PolarHBondContact ND2-CD2 3.16Å; N65-N78 WeakPolarHBondContact CB-OD1 3.43Å; N65-N78 PolarHBondContact N-OD1 3.37Å; N65-N78 PolarHBondContact ND2-OD1 3.11Å; N65-N78 PolarHBondContact O-ND2 3.23Å
66K93.6Very high90Very high176 Ų17689.5 Ų89.577%0.76545%0.453SS*.SBendtrans-75.4-26-178.1-62-175.7179.8-177.20114.2V64V64-K66 PolarHBondContact O-N 2.9Å
67K93.3Very high90.1Very high170 Ų17093.4 Ų93.474%0.73947%0.471SS*.  trans-107.574.3-178.8-66.9-173.9179.1-176.20109.6
68V92Very high90.4Very high7 Ų788.7 Ų88.74%0.04244%0.44CS..  trans-72.7-33.4-175-177.90000111.7D44 V46 N65 N70 D71 L74 R75 N78D44-V68 HydrophobicContact CB-CB 4.25Å; D44-V68 HydrophobicContact CB-CG1 4.23Å; D44-V68 HydrophobicContact CB-CG2 4.08Å; V46-V68 HydrophobicContact CG2-CG2 3.84Å; N65-V68 VanDerWaalsContact O-CG2 3.22Å; N65-V68 WeakPolarHBondContact O-CG2 3.42Å; V68-N70 PolarHBondContact O-N 3.35Å; V68-D71 VanDerWaalsContact O-CB 3.23Å; V68-D71 WeakPolarHBondContact O-CB 3.49Å; V68-D71 PolarHBondContact O-N 3.04Å; V68-L74 HydrophobicContact CG1-CB 4.1Å; V68-R75 HydrophobicContact CG1-CG 3.47Å; V68-R75 VanDerWaalsContact CG1-CG 3.47Å; V68-N78 WeakPolarHBondContact CG2-ND2 3.15Å
69N89.8Confident91Very high147 Ų14779.8 Ų79.879%0.78640%0.402SS*.THydrogen-bonded Turntrans47.837.9175.5-60.8-21.6000114.1D71N69-D71 PolarHBondContact O-N 3.41Å
70N85Confident91.7Very high113 Ų11382 Ų8260%0.60442%0.418SS*.THydrogen-bonded Turntrans61.115.3-175.7-160.131.2000115.5V68 A72 R75V68-N70 PolarHBondContact O-N 3.35Å; N70-A72 PolarHBondContact O-N 3.34Å; N70-R75 VanDerWaalsContact CA-NH1 3.35Å; N70-R75 PolarHBondContact O-NH1 3.5Å; N70-R75 PolarHBondContact OD1-NH1 2.66Å
71D94.8Very high92.6Very high73 Ų7374.6 Ų74.639%0.3938%0.383SS..  trans-73.1121175.2-173.9-67.4000111.1V68 N69 S73 L74 R75V68-D71 VanDerWaalsContact O-CB 3.23Å; V68-D71 WeakPolarHBondContact O-CB 3.49Å; V68-D71 PolarHBondContact O-N 3.04Å; N69-D71 PolarHBondContact O-N 3.41Å; D71-S73 PolarHBondContact O-N 3.03Å; D71-S73 WeakPolarHBondContact OD1-CA 3.31Å; D71-S73 VanDerWaalsContact OD1-CB 3.26Å; D71-S73 WeakPolarHBondContact OD1-CB 3.41Å; D71-S73 PolarHBondContact OD1-N 2.99Å; D71-L74 HydrophobicContact CB-CB 4.11Å; D71-L74 HydrophobicContact CB-CD1 3.93Å; D71-L74 HydrophobicContact CB-CG 3.88Å; D71-L74 PolarHBondContact O-N 3.36Å; D71-L74 PolarHBondContact OD1-N 3.18Å; D71-R75 PolarHBondContact O-N 3.48Å
72A95.1Very high93.9Very high31 Ų3170.8 Ų70.826%0.25636%0.355SS..Hα-helixtrans-63.8-37.9-177.900000112.9N70 R75 I76N70-A72 PolarHBondContact O-N 3.34Å; A72-R75 PolarHBondContact O-N 3.29Å; A72-I76 WeakPolarHBondContact O-CB 3.48Å; A72-I76 WeakPolarHBondContact O-CD1 3.4Å; A72-I76 WeakPolarHBondContact O-CG1 3.38Å; A72-I76 PolarHBondContact O-N 2.92Å
73S96.4Very high94.6Very high87 Ų8768.4 Ų68.461%0.60835%0.345SS*.Hα-helixtrans-67.6-39.9-179.5-54.20000110.8D71 I76 H77D71-S73 PolarHBondContact O-N 3.03Å; D71-S73 WeakPolarHBondContact OD1-CA 3.31Å; D71-S73 VanDerWaalsContact OD1-CB 3.26Å; D71-S73 WeakPolarHBondContact OD1-CB 3.41Å; D71-S73 PolarHBondContact OD1-N 2.99Å; S73-I76 PolarHBondContact O-N 3.19Å; S73-H77 WeakPolarHBondContact O-CB 3.41Å; S73-H77 PolarHBondContact O-N 3.05Å
74L96.9Very high94.8Very high51 Ų5163.2 Ų63.227%0.26733%0.329SS..Hα-helixtrans-66.7-40.4175.8-61-174.6000112N65 V68 D71 H77 N78N65-L74 HydrophobicContact CB-CB 4.4Å; N65-L74 HydrophobicContact CB-CD2 4.34Å; V68-L74 HydrophobicContact CG1-CB 4.1Å; D71-L74 HydrophobicContact CB-CB 4.11Å; D71-L74 HydrophobicContact CB-CD1 3.93Å; D71-L74 HydrophobicContact CB-CG 3.88Å; D71-L74 PolarHBondContact O-N 3.36Å; D71-L74 PolarHBondContact OD1-N 3.18Å; L74-H77 PolarHBondContact O-N 3.29Å; L74-N78 PolarHBondContact O-N 3.36Å
75R96.2Very high94.8Very high12 Ų1262 Ų625%0.04532%0.32CS..Hα-helixtrans-59.2-51.9171.7-73.7-160.3-67.3-86-4.4112V68 N70 D71 A72 H77 N78 L79 G109V68-R75 HydrophobicContact CG1-CG 3.47Å; V68-R75 VanDerWaalsContact CG1-CG 3.47Å; N70-R75 VanDerWaalsContact CA-NH1 3.35Å; N70-R75 PolarHBondContact O-NH1 3.5Å; N70-R75 PolarHBondContact OD1-NH1 2.66Å; D71-R75 PolarHBondContact O-N 3.48Å; A72-R75 PolarHBondContact O-N 3.29Å; R75-H77 PolarHBondContact O-N 3.45Å; R75-N78 PolarHBondContact O-N 3.26Å; R75-N78 VanDerWaalsContact O-N 3.16Å; R75-L79 WeakPolarHBondContact O-CB 3.3Å; R75-L79 VanDerWaalsContact O-CG 3.3Å; R75-L79 WeakPolarHBondContact O-CG 3.49Å; R75-L79 PolarHBondContact O-N 3.37Å; R75-G109 PolarHBondContact NE-O 3.06Å; R75-G109 PolarHBondContact NH2-O 3.03Å
76I96.7Very high94.7Very high32 Ų3262 Ų6216%0.16432%0.32CS..Hα-helixtrans-57.4-41.8179.6-68.1163.9000110.2A72 S73 L79 S80 I105 L106 K110A72-I76 WeakPolarHBondContact O-CB 3.48Å; A72-I76 WeakPolarHBondContact O-CD1 3.4Å; A72-I76 WeakPolarHBondContact O-CG1 3.38Å; A72-I76 PolarHBondContact O-N 2.92Å; S73-I76 PolarHBondContact O-N 3.19Å; I76-L79 PolarHBondContact O-N 3Å; I76-S80 VanDerWaalsContact O-CB 3.26Å; I76-S80 WeakPolarHBondContact O-CB 3.5Å; I76-S80 PolarHBondContact O-N 3.47Å; I76-I105 HydrophobicContact CG2-CD1 4.31Å; I76-L106 HydrophobicContact CD1-CD2 4.07Å; I76-L106 HydrophobicContact CG1-CD2 4.48Å; I76-L106 HydrophobicContact CG2-CD2 4.06Å; I76-K110 HydrophobicContact CD1-CG 4.07Å
77H96.7Very high94.7Very high91 Ų9157.5 Ų57.542%0.42130%0.301SS..Hα-helixtrans-61.6-49.8176.8-174.880.2000112.2N65 S73 L74 R75 L79 S80 I81N65-H77 PolarHBondContact ND2-CD2 3.16Å; S73-H77 WeakPolarHBondContact O-CB 3.41Å; S73-H77 PolarHBondContact O-N 3.05Å; L74-H77 PolarHBondContact O-N 3.29Å; R75-H77 PolarHBondContact O-N 3.45Å; H77-L79 VanDerWaalsContact C-N 3.35Å; H77-L79 PolarHBondContact O-N 2.86Å; H77-S80 WeakPolarHBondContact O-CB 3.43Å; H77-S80 PolarHBondContact O-N 2.79Å; H77-I81 WeakPolarHBondContact O-CG1 3.5Å; H77-I81 PolarHBondContact O-N 3.03Å; H77-I81 VanDerWaalsContact O-N 3.09Å
78N97.3Very high94.8Very high0 Ų054.3 Ų54.30%029%0.287CS..Hα-helixtrans-60.7-43.3178.3-71.2-6.8000111.9D44 V46 N49 V64 N65 V68 L74 R75 S80 I81 L82D44-N78 WeakPolarHBondContact O-CB 3.48Å; D44-N78 PolarHBondContact O-ND2 3.42Å; V46-N78 WeakPolarHBondContact CG2-ND2 3.46Å; N49-N78 PolarHBondContact ND2-O 2.79Å; V64-N78 HydrophobicContact CG1-CB 4.37Å; N65-N78 WeakPolarHBondContact CB-OD1 3.43Å; N65-N78 PolarHBondContact N-OD1 3.37Å; N65-N78 PolarHBondContact ND2-OD1 3.11Å; N65-N78 PolarHBondContact O-ND2 3.23Å; V68-N78 WeakPolarHBondContact CG2-ND2 3.15Å; L74-N78 PolarHBondContact O-N 3.36Å; R75-N78 PolarHBondContact O-N 3.26Å; R75-N78 VanDerWaalsContact O-N 3.16Å; N78-S80 VanDerWaalsContact C-N 3.35Å; N78-I81 WeakPolarHBondContact O-CB 3.23Å; N78-I81 PolarHBondContact O-N 2.73Å; N78-L82 PolarHBondContact O-N 3.31Å; N78-L82 VanDerWaalsContact O-N 3.11Å
79L96.4Very high94.9Very high10 Ų1056.4 Ų56.45%0.05229%0.294CS..Hα-helixtrans-67.7-34.1177.6-66.3172000112.3R75 I76 H77 L82 V83 I105 I108R75-L79 WeakPolarHBondContact O-CB 3.3Å; R75-L79 VanDerWaalsContact O-CG 3.3Å; R75-L79 WeakPolarHBondContact O-CG 3.49Å; R75-L79 PolarHBondContact O-N 3.37Å; I76-L79 PolarHBondContact O-N 3Å; H77-L79 VanDerWaalsContact C-N 3.35Å; H77-L79 PolarHBondContact O-N 2.86Å; L79-L82 HydrophobicContact CD2-CD2 4.47Å; L79-L82 WeakPolarHBondContact O-CB 3.3Å; L79-L82 PolarHBondContact O-N 3.36Å; L79-V83 WeakPolarHBondContact O-CG2 3.42Å; L79-V83 PolarHBondContact O-N 3.17Å; L79-I105 HydrophobicContact CB-CB 3.97Å; L79-I105 HydrophobicContact CB-CG2 3.8Å; L79-I105 HydrophobicContact CD1-CB 4.5Å; L79-I108 HydrophobicContact CD1-CB 4.03Å; L79-I108 HydrophobicContact CD1-CG2 3.63Å
80S96.3Very high95.2Very high60 Ų6053.8 Ų53.842%0.4227%0.274SS..Hα-helixtrans-62.8-43.4173.9-179.30000111.8I76 H77 N78 L82 V83 K84I76-S80 VanDerWaalsContact O-CB 3.26Å; I76-S80 WeakPolarHBondContact O-CB 3.5Å; I76-S80 PolarHBondContact O-N 3.47Å; H77-S80 WeakPolarHBondContact O-CB 3.43Å; H77-S80 PolarHBondContact O-N 2.79Å; N78-S80 VanDerWaalsContact C-N 3.35Å; S80-L82 VanDerWaalsContact C-N 3.34Å; S80-L82 PolarHBondContact O-N 3.22Å; S80-V83 PolarHBondContact O-N 3.06Å; S80-K84 WeakPolarHBondContact O-CB 3.3Å; S80-K84 PolarHBondContact O-N 3.41Å
81I96.6Very high95.7Very high8 Ų852.9 Ų52.94%0.04127%0.266CS..Hα-helixtrans-57.8-49.8172.8-66168.9000109.9N49 Q62 R63 V64 H77 N78 V83 K84 Q85N49-I81 VanDerWaalsContact OD1-CG2 3.23Å; N49-I81 WeakPolarHBondContact OD1-CG2 3.35Å; Q62-I81 HydrophobicContact CB-CD1 4.24Å; Q62-I81 HydrophobicContact CB-CG1 4.34Å; Q62-I81 HydrophobicContact CB-CG2 3.71Å; Q62-I81 HydrophobicContact CG-CG2 4.36Å; R63-I81 WeakPolarHBondContact O-CD1 3.5Å; V64-I81 HydrophobicContact CG2-CD1 4.35Å; H77-I81 WeakPolarHBondContact O-CG1 3.5Å; H77-I81 PolarHBondContact O-N 3.03Å; H77-I81 VanDerWaalsContact O-N 3.09Å; N78-I81 WeakPolarHBondContact O-CB 3.23Å; N78-I81 PolarHBondContact O-N 2.73Å; I81-V83 PolarHBondContact O-N 2.5Å; I81-K84 WeakPolarHBondContact O-CB 3.42Å; I81-K84 PolarHBondContact O-N 2.9Å; I81-Q85 HydrophobicContact CG2-CG 4.34Å; I81-Q85 WeakPolarHBondContact O-CG 3.33Å; I81-Q85 PolarHBondContact O-N 3.15Å
82L96.1Very high95.6Very high19 Ų1954.8 Ų54.810%0.09927%0.273CS..Hα-helixtrans-57.8-50.5-179177.865.6000111.9L48 N49 M52 N78 L79 S80 K84 Q85 I86L48-L82 HydrophobicContact CB-CD1 4.22Å; L48-L82 HydrophobicContact CB-CD2 3.51Å; L48-L82 HydrophobicContact CB-CG 4.48Å; L48-L82 HydrophobicContact CD1-CD2 3.79Å; L48-L82 HydrophobicContact CG-CD2 4.29Å; N49-L82 PolarHBondContact OD1-N 3.36Å; M52-L82 HydrophobicContact CB-CD1 3.81Å; M52-L82 HydrophobicContact CG-CD1 4.3Å; N78-L82 PolarHBondContact O-N 3.31Å; N78-L82 VanDerWaalsContact O-N 3.11Å; L79-L82 HydrophobicContact CD2-CD2 4.47Å; L79-L82 WeakPolarHBondContact O-CB 3.3Å; L79-L82 PolarHBondContact O-N 3.36Å; S80-L82 VanDerWaalsContact C-N 3.34Å; S80-L82 PolarHBondContact O-N 3.22Å; L82-K84 VanDerWaalsContact C-N 3.28Å; L82-K84 PolarHBondContact O-N 3.17Å; L82-Q85 PolarHBondContact O-N 2.82Å; L82-I86 HydrophobicContact CD1-CD1 4.02Å; L82-I86 HydrophobicContact CD1-CG1 4.34Å; L82-I86 HydrophobicContact CG-CD1 3.89Å; L82-I86 WeakPolarHBondContact O-CG1 3.47Å; L82-I86 PolarHBondContact O-N 3.13Å
83V95.6Very high95.6Very high21 Ų2156.8 Ų56.813%0.12728%0.282CS..Hα-helixtrans-60.9-39.8179169.90000111L79 S80 I81 K87 L102 I105L79-V83 WeakPolarHBondContact O-CG2 3.42Å; L79-V83 PolarHBondContact O-N 3.17Å; S80-V83 PolarHBondContact O-N 3.06Å; I81-V83 PolarHBondContact O-N 2.5Å; V83-K87 HydrophobicContact CG1-CD 4.32Å; V83-K87 VanDerWaalsContact O-CG 3.32Å; V83-K87 WeakPolarHBondContact O-CG 3.43Å; V83-K87 PolarHBondContact O-N 3.24Å; V83-L102 HydrophobicContact CG1-CD2 4.47Å; V83-I105 HydrophobicContact CG2-CG2 3.69Å
84K94.5Very high95.6Very high124 Ų12455.7 Ų55.754%0.53927%0.269SS..Hα-helixtrans-62.9-44.6175.9-174-175.8175.3-170.60111.6S80 I81 L82 K87 F88S80-K84 WeakPolarHBondContact O-CB 3.3Å; S80-K84 PolarHBondContact O-N 3.41Å; I81-K84 WeakPolarHBondContact O-CB 3.42Å; I81-K84 PolarHBondContact O-N 2.9Å; L82-K84 VanDerWaalsContact C-N 3.28Å; L82-K84 PolarHBondContact O-N 3.17Å; K84-K87 PolarHBondContact O-N 3.47Å; K84-F88 WeakPolarHBondContact O-CB 3.28Å; K84-F88 PolarHBondContact O-N 2.98Å
85Q94.7Very high95.6Very high13 Ų1360.4 Ų60.46%0.06129%0.29CS..Hα-helixtrans-66-41.1179.1-73-178.6-27.100112.4N49 M52 S59 I81 L82 F88 Y89N49-Q85 PolarHBondContact OD1-OE1 3.19Å; M52-Q85 HydrophobicContact CG-CB 3.8Å; S59-Q85 PolarHBondContact OG-NE2 2.92Å; I81-Q85 HydrophobicContact CG2-CG 4.34Å; I81-Q85 WeakPolarHBondContact O-CG 3.33Å; I81-Q85 PolarHBondContact O-N 3.15Å; L82-Q85 PolarHBondContact O-N 2.82Å; Q85-F88 PolarHBondContact O-N 3.44Å; Q85-Y89 WeakPolarHBondContact O-CB 3.46Å; Q85-Y89 PolarHBondContact O-N 2.89Å
86I94.9Very high95.6Very high57 Ų5765.1 Ų65.129%0.29231%0.312SS..Hα-helixtrans-59.9-52174.8-68.9168.1000109.5M52 L82 F88 Y89 Y90 I98M52-I86 HydrophobicContact SD-CG1 3.71Å; L82-I86 HydrophobicContact CD1-CD1 4.02Å; L82-I86 HydrophobicContact CD1-CG1 4.34Å; L82-I86 HydrophobicContact CG-CD1 3.89Å; L82-I86 WeakPolarHBondContact O-CG1 3.47Å; L82-I86 PolarHBondContact O-N 3.13Å; I86-F88 VanDerWaalsContact C-N 3.32Å; I86-F88 PolarHBondContact O-N 3.22Å; I86-Y89 PolarHBondContact O-N 3.32Å; I86-Y89 VanDerWaalsContact O-N 3.17Å; I86-Y90 HydrophobicContact CG2-CD2 3.85Å; I86-Y90 HydrophobicContact CG2-CE2 3.85Å; I86-Y90 WeakPolarHBondContact O-CD2 3.26Å; I86-Y90 PolarHBondContact O-N 2.86Å; I86-I98 HydrophobicContact CG2-CD1 4.23Å
87K94.2Very high95.4Very high82 Ų8269.2 Ų69.236%0.35733%0.334SS..Hα-helixtrans-54.6-49.1177.2-76176.1175.4-173.60112.4V83 K84 Y89 Y90 Q91 I98 L102V83-K87 HydrophobicContact CG1-CD 4.32Å; V83-K87 VanDerWaalsContact O-CG 3.32Å; V83-K87 WeakPolarHBondContact O-CG 3.43Å; V83-K87 PolarHBondContact O-N 3.24Å; K84-K87 PolarHBondContact O-N 3.47Å; K87-Y89 VanDerWaalsContact C-N 3.3Å; K87-Y89 PolarHBondContact O-N 3.05Å; K87-Y90 PolarHBondContact O-N 2.99Å; K87-Q91 WeakPolarHBondContact O-CB 3.42Å; K87-Q91 WeakPolarHBondContact O-CG 3.41Å; K87-Q91 PolarHBondContact O-N 3.09Å; K87-I98 HydrophobicContact CG-CD1 4.29Å; K87-L102 HydrophobicContact CD-CD1 4.43Å; K87-L102 HydrophobicContact CG-CD2 4.35Å
88F93.7Very high95.2Very high102 Ų10266.9 Ų66.945%0.44732%0.324SS..Hα-helixtrans-59.9-42.4-179.8-175.3-89.7000111.4K84 Q85 I86 Q91 E92K84-F88 WeakPolarHBondContact O-CB 3.28Å; K84-F88 PolarHBondContact O-N 2.98Å; Q85-F88 PolarHBondContact O-N 3.44Å; I86-F88 VanDerWaalsContact C-N 3.32Å; I86-F88 PolarHBondContact O-N 3.22Å; F88-Q91 PolarHBondContact O-N 3.3Å; F88-E92 HydrophobicContact CD1-CB 4.36Å; F88-E92 HydrophobicContact CD1-CG 4.32Å; F88-E92 HydrophobicContact CD2-CG 3.77Å; F88-E92 HydrophobicContact CE1-CB 4.04Å; F88-E92 HydrophobicContact CE1-CG 4.08Å; F88-E92 HydrophobicContact CE2-CB 4.37Å; F88-E92 HydrophobicContact CE2-CG 3.53Å; F88-E92 HydrophobicContact CG-CG 4.18Å; F88-E92 HydrophobicContact CZ-CB 4.06Å; F88-E92 HydrophobicContact CZ-CG 3.69Å; F88-E92 WeakPolarHBondContact O-CB 3.49Å; F88-E92 PolarHBondContact O-N 2.87Å
89Y95.4Very high94.9Very high52 Ų5274.6 Ų74.620%0.20436%0.362CS..Iπ-helixtrans-62-47176.8-178.9-108.6000112.4M52 I55 N56 Q85 I86 K87 Q91 T93 L94M52-Y89 HydrophobicContact CE-CD1 4.19Å; M52-Y89 HydrophobicContact CE-CD2 4.32Å; M52-Y89 HydrophobicContact CE-CG 3.78Å; I55-Y89 HydrophobicContact CG2-CE1 4.14Å; N56-Y89 HydrophobicContact CB-CD2 3.56Å; N56-Y89 HydrophobicContact CB-CE2 3.88Å; N56-Y89 HydrophobicContact CB-CG 4.37Å; Q85-Y89 WeakPolarHBondContact O-CB 3.46Å; Q85-Y89 PolarHBondContact O-N 2.89Å; I86-Y89 PolarHBondContact O-N 3.32Å; I86-Y89 VanDerWaalsContact O-N 3.17Å; K87-Y89 VanDerWaalsContact C-N 3.3Å; K87-Y89 PolarHBondContact O-N 3.05Å; Y89-Q91 PolarHBondContact O-N 3.01Å; Y89-T93 HydrophobicContact CD2-CG2 3.89Å; Y89-T93 HydrophobicContact CE2-CG2 3.53Å; Y89-T93 WeakPolarHBondContact O-CA 3.3Å; Y89-T93 WeakPolarHBondContact O-CB 3.48Å; Y89-T93 PolarHBondContact O-N 3.16Å; Y89-L94 HydrophobicContact CD1-CD1 4.03Å; Y89-L94 HydrophobicContact CD1-CG 4.14Å; Y89-L94 HydrophobicContact CE1-CD1 3.67Å; Y89-L94 HydrophobicContact CE1-CD2 4Å; Y89-L94 HydrophobicContact CE1-CG 3.77Å; Y89-L94 PolarHBondContact O-N 3.43Å
90Y95.9Very high94.7Very high91 Ų9180.9 Ų80.936%0.35739%0.393SS..Iπ-helixtrans-59.9-47.5176.7-87.5-88.6000111.9I86 K87 L94 Q95 Q96 I98I86-Y90 HydrophobicContact CG2-CD2 3.85Å; I86-Y90 HydrophobicContact CG2-CE2 3.85Å; I86-Y90 WeakPolarHBondContact O-CD2 3.26Å; I86-Y90 PolarHBondContact O-N 2.86Å; K87-Y90 PolarHBondContact O-N 2.99Å; Y90-L94 HydrophobicContact CD1-CD1 3.94Å; Y90-L94 HydrophobicContact CE1-CD1 4.06Å; Y90-L94 HydrophobicContact CG-CD1 4.36Å; Y90-L94 CarbonylContact O-C 3.26Å; Y90-L94 WeakPolarHBondContact O-CB 3.42Å; Y90-L94 PolarHBondContact O-N 3.17Å; Y90-Q95 PolarHBondContact O-N 3.3Å; Y90-Q96 CarbonylContact C-O 3.5Å; Y90-Q96 VanDerWaalsContact C-O 3.29Å; Y90-Q96 HydrophobicContact CD1-CB 4.19Å; Y90-Q96 PolarHBondContact O-N 3.03Å; Y90-Q96 VanDerWaalsContact O-O 3.14Å; Y90-I98 HydrophobicContact CD1-CG1 4.06Å; Y90-I98 HydrophobicContact CD2-CD1 3.67Å; Y90-I98 HydrophobicContact CD2-CG1 3.99Å; Y90-I98 HydrophobicContact CE2-CD1 4.27Å; Y90-I98 HydrophobicContact CG-CD1 3.87Å; Y90-I98 HydrophobicContact CG-CG1 3.71Å
91Q94.5Very high94.4Very high94 Ų9483.7 Ų83.744%0.43941%0.409SS..Iπ-helixtrans-72.4-54.5-175.5-68.5-179.5-52.800112.1K87 F88 Y89 Q95K87-Q91 WeakPolarHBondContact O-CB 3.42Å; K87-Q91 WeakPolarHBondContact O-CG 3.41Å; K87-Q91 PolarHBondContact O-N 3.09Å; F88-Q91 PolarHBondContact O-N 3.3Å; Y89-Q91 PolarHBondContact O-N 3.01Å; Q91-Q95 WeakPolarHBondContact O-CA 3.39Å; Q91-Q95 PolarHBondContact O-N 3.47Å; Q91-Q95 PolarHBondContact O-NE2 3.41Å
92E93.9Very high94.1Very high114 Ų11486.7 Ų86.753%0.53343%0.425SS..Iπ-helixtrans-85.9-35-170.2-59.5-58.2138.100112.7F88 Q95F88-E92 HydrophobicContact CD1-CB 4.36Å; F88-E92 HydrophobicContact CD1-CG 4.32Å; F88-E92 HydrophobicContact CD2-CG 3.77Å; F88-E92 HydrophobicContact CE1-CB 4.04Å; F88-E92 HydrophobicContact CE1-CG 4.08Å; F88-E92 HydrophobicContact CE2-CB 4.37Å; F88-E92 HydrophobicContact CE2-CG 3.53Å; F88-E92 HydrophobicContact CG-CG 4.18Å; F88-E92 HydrophobicContact CZ-CB 4.06Å; F88-E92 HydrophobicContact CZ-CG 3.69Å; F88-E92 WeakPolarHBondContact O-CB 3.49Å; F88-E92 PolarHBondContact O-N 2.87Å; E92-Q95 PolarHBondContact O-NE2 3.3Å
93T94.2Very high93.8Very high72 Ų7289.3 Ų89.344%0.44244%0.443SS..Iπ-helixtrans-93.9-47.1-176.2-49.80000112.4Y89Y89-T93 HydrophobicContact CD2-CG2 3.89Å; Y89-T93 HydrophobicContact CE2-CG2 3.53Å; Y89-T93 WeakPolarHBondContact O-CA 3.3Å; Y89-T93 WeakPolarHBondContact O-CB 3.48Å; Y89-T93 PolarHBondContact O-N 3.16Å
94L96.3Very high93.6Very high65 Ų6591.7 Ų91.734%0.3446%0.455SS..SBendtrans-88.7-14.9-178.2-58.2-177.3000113.5Y89 Y90 Q96Y89-L94 HydrophobicContact CD1-CD1 4.03Å; Y89-L94 HydrophobicContact CD1-CG 4.14Å; Y89-L94 HydrophobicContact CE1-CD1 3.67Å; Y89-L94 HydrophobicContact CE1-CD2 4Å; Y89-L94 HydrophobicContact CE1-CG 3.77Å; Y89-L94 PolarHBondContact O-N 3.43Å; Y90-L94 HydrophobicContact CD1-CD1 3.94Å; Y90-L94 HydrophobicContact CE1-CD1 4.06Å; Y90-L94 HydrophobicContact CG-CD1 4.36Å; Y90-L94 CarbonylContact O-C 3.26Å; Y90-L94 WeakPolarHBondContact O-CB 3.42Å; Y90-L94 PolarHBondContact O-N 3.17Å; L94-Q96 VanDerWaalsContact C-N 3.27Å; L94-Q96 HydrophobicContact CB-CB 4.25Å; L94-Q96 HydrophobicContact CB-CG 4.2Å; L94-Q96 PolarHBondContact O-N 2.88Å
95Q97.2Very high93.5Very high150 Ų15087.5 Ų87.570%0.70144%0.438SS*.  trans56.941.7-173.5-58.6-67.1-45.900111.9Y90 Q91 E92Y90-Q95 PolarHBondContact O-N 3.3Å; Q91-Q95 WeakPolarHBondContact O-CA 3.39Å; Q91-Q95 PolarHBondContact O-N 3.47Å; Q91-Q95 PolarHBondContact O-NE2 3.41Å; E92-Q95 PolarHBondContact O-NE2 3.3Å
96Q96Very high93.4Very high110 Ų11091.1 Ų91.151%0.51446%0.458SS..  trans-127.6146.8-176.6-72.6178.6-5.400111.9Y90 L94Y90-Q96 CarbonylContact C-O 3.5Å; Y90-Q96 VanDerWaalsContact C-O 3.29Å; Y90-Q96 HydrophobicContact CD1-CB 4.19Å; Y90-Q96 PolarHBondContact O-N 3.03Å; Y90-Q96 VanDerWaalsContact O-O 3.14Å; L94-Q96 VanDerWaalsContact C-N 3.27Å; L94-Q96 HydrophobicContact CB-CB 4.25Å; L94-Q96 HydrophobicContact CB-CG 4.2Å; L94-Q96 PolarHBondContact O-N 2.88Å
97L92.2Very high93.2Very high118 Ų11891.4 Ų91.462%0.61846%0.459SS*.  trans-99.4131.3175.6-17462.8000110.9M99L97-M99 HydrophobicContact CB-SD 4.44Å; L97-M99 HydrophobicContact CD2-SD 3.51Å; L97-M99 VanDerWaalsContact CD2-SD 3.51Å; L97-M99 HydrophobicContact CG-SD 3.86Å; L97-M99 PolarHBondContact O-N 2.94Å
98I92.8Very high92.9Very high42 Ų4288.6 Ų88.622%0.21545%0.448CS..  trans-78.1109.2171.5-56176.4000108.1I86 K87 Y90 M100 L102I86-I98 HydrophobicContact CG2-CD1 4.23Å; K87-I98 HydrophobicContact CG-CD1 4.29Å; Y90-I98 HydrophobicContact CD1-CG1 4.06Å; Y90-I98 HydrophobicContact CD2-CD1 3.67Å; Y90-I98 HydrophobicContact CD2-CG1 3.99Å; Y90-I98 HydrophobicContact CE2-CD1 4.27Å; Y90-I98 HydrophobicContact CG-CD1 3.87Å; Y90-I98 HydrophobicContact CG-CG1 3.71Å; I98-M100 HydrophobicContact CG2-CG 3.65Å; I98-L102 HydrophobicContact CD1-CD2 4.3Å; I98-L102 HydrophobicContact CG2-CD2 4.2Å
99M92.3Very high92.8Very high162 Ų16283.7 Ų83.780%0.79843%0.426SS*.  trans-91.8-13.4-179-63.7-61-70.300113.7L97L97-M99 HydrophobicContact CB-SD 4.44Å; L97-M99 HydrophobicContact CD2-SD 3.51Å; L97-M99 VanDerWaalsContact CD2-SD 3.51Å; L97-M99 HydrophobicContact CG-SD 3.86Å; L97-M99 PolarHBondContact O-N 2.94Å
100M91.7Very high92.6Very high142 Ų14287.3 Ų87.370%0.744%0.443SS*.SBendtrans-85.8153.5179.160.7-170-71.200111.6I98I98-M100 HydrophobicContact CG2-CG 3.65Å
101P89.8Confident92.1Very high119 Ų11987.7 Ų87.777%0.77345%0.452SS*.PPolyproline II helixtrans-59.3142.1170.826.6-34.4000110.1
102L89.6Confident91.6Very high72 Ų7283.5 Ų83.538%0.37743%0.432SS..PPolyproline II helixtrans-83.7157.7178.1-60.9151.9000109.7V83 K87 I98 D104V83-L102 HydrophobicContact CG1-CD2 4.47Å; K87-L102 HydrophobicContact CD-CD1 4.43Å; K87-L102 HydrophobicContact CG-CD2 4.35Å; I98-L102 HydrophobicContact CD1-CD2 4.3Å; I98-L102 HydrophobicContact CG2-CD2 4.2Å; L102-D104 PolarHBondContact O-N 2.74Å
103P90Very high91.1Very high73 Ų7382.4 Ų82.447%0.47443%0.426SS..PPolyproline II helixtrans-55135.5175.1-24.233.6000111.9I105 I108P103-I105 PolarHBondContact O-N 2.71Å; P103-I108 HydrophobicContact CB-CD1 4.11Å
104D91.7Very high90.2Very high71 Ų7181.4 Ų81.438%0.3842%0.422SS..  trans-77.792.6173.5-170.3-29000109.9L102 L106 I107 I108L102-D104 PolarHBondContact O-N 2.74Å; D104-L106 PolarHBondContact O-N 3.39Å; D104-L106 WeakPolarHBondContact OD1-CA 3.48Å; D104-L106 WeakPolarHBondContact OD1-CB 3.43Å; D104-L106 PolarHBondContact OD1-N 2.93Å; D104-I107 HydrophobicContact CB-CB 4.23Å; D104-I107 HydrophobicContact CB-CD1 3.92Å; D104-I107 HydrophobicContact CB-CG1 4.12Å; D104-I107 PolarHBondContact O-N 2.96Å; D104-I107 PolarHBondContact OD1-N 2.9Å; D104-I107 VanDerWaalsContact OD1-N 3.13Å; D104-I107 VanDerWaalsContact OD2-CD1 3.3Å; D104-I107 WeakPolarHBondContact OD2-CD1 3.47Å; D104-I107 WeakPolarHBondContact OD2-CG1 3.47Å; D104-I108 WeakPolarHBondContact O-CG1 3.46Å; D104-I108 PolarHBondContact O-N 3.45Å; D104-I108 VanDerWaalsContact O-N 3.15Å
105I93.4Very high88.7Confident36 Ų3679.7 Ų79.719%0.18542%0.42CS..Hα-helixtrans-64.3-19.8-17966172.1000113.2I76 L79 V83 P103 G109I76-I105 HydrophobicContact CG2-CD1 4.31Å; L79-I105 HydrophobicContact CB-CB 3.97Å; L79-I105 HydrophobicContact CB-CG2 3.8Å; L79-I105 HydrophobicContact CD1-CB 4.5Å; V83-I105 HydrophobicContact CG2-CG2 3.69Å; P103-I105 PolarHBondContact O-N 2.71Å; I105-G109 WeakPolarHBondContact O-CA 3.22Å; I105-G109 PolarHBondContact O-N 3.19Å
106L92.3Very high87.1Confident89 Ų8979.7 Ų79.747%0.46642%0.418SS..Hα-helixtrans-76.5-40.2177.3-62.7179.1000110.7I76 D104 K110I76-L106 HydrophobicContact CD1-CD2 4.07Å; I76-L106 HydrophobicContact CG1-CD2 4.48Å; I76-L106 HydrophobicContact CG2-CD2 4.06Å; D104-L106 PolarHBondContact O-N 3.39Å; D104-L106 WeakPolarHBondContact OD1-CA 3.48Å; D104-L106 WeakPolarHBondContact OD1-CB 3.43Å; D104-L106 PolarHBondContact OD1-N 2.93Å; L106-K110 VanDerWaalsContact O-CB 3.27Å; L106-K110 WeakPolarHBondContact O-CB 3.48Å; L106-K110 WeakPolarHBondContact O-CG 3.22Å; L106-K110 PolarHBondContact O-N 3.07Å
107I90.1Very high85.4Confident63 Ų6380.6 Ų80.632%0.32342%0.42SS..Hα-helixtrans-64.2-52.5174.9-65.9175.7000109.6D104 G109 N111 K116D104-I107 HydrophobicContact CB-CB 4.23Å; D104-I107 HydrophobicContact CB-CD1 3.92Å; D104-I107 HydrophobicContact CB-CG1 4.12Å; D104-I107 PolarHBondContact O-N 2.96Å; D104-I107 PolarHBondContact OD1-N 2.9Å; D104-I107 VanDerWaalsContact OD1-N 3.13Å; D104-I107 VanDerWaalsContact OD2-CD1 3.3Å; D104-I107 WeakPolarHBondContact OD2-CD1 3.47Å; D104-I107 WeakPolarHBondContact OD2-CG1 3.47Å; I107-G109 VanDerWaalsContact C-N 3.33Å; I107-G109 PolarHBondContact O-N 2.84Å; I107-N111 CarbonylContact O-C 3.44Å; I107-N111 WeakPolarHBondContact O-CA 3.27Å; I107-N111 PolarHBondContact O-N 3.44Å; I107-K116 HydrophobicContact CG2-CB 4.08Å; I107-K116 VanDerWaalsContact CG2-O 3.3Å; I107-K116 WeakPolarHBondContact CG2-O 3.26Å
108I88.8Confident85.1Confident23 Ų2378.8 Ų78.812%0.11841%0.41CS..Hα-helixtrans-60.7-45.4-179.9-60167.5000110.5V43 L79 P103 D104 P112 F117V43-I108 HydrophobicContact CB-CG2 4.4Å; V43-I108 HydrophobicContact CG1-CG2 4.43Å; L79-I108 HydrophobicContact CD1-CB 4.03Å; L79-I108 HydrophobicContact CD1-CG2 3.63Å; P103-I108 HydrophobicContact CB-CD1 4.11Å; D104-I108 WeakPolarHBondContact O-CG1 3.46Å; D104-I108 PolarHBondContact O-N 3.45Å; D104-I108 VanDerWaalsContact O-N 3.15Å; I108-P112 VanDerWaalsContact O-CA 3.3Å; I108-P112 WeakPolarHBondContact O-CA 3.35Å; I108-P112 WeakPolarHBondContact O-CB 3.48Å; I108-P112 WeakPolarHBondContact O-CD 3.36Å; I108-F117 HydrophobicContact CG1-CD1 4.4Å
109G90.1Very high84.7Confident0 Ų080.7 Ų80.70%042%0.421CS..Hα-helixtrans-69.1-42.1-176.600000113.7R75 I105 I107R75-G109 PolarHBondContact NE-O 3.06Å; R75-G109 PolarHBondContact NH2-O 3.03Å; I105-G109 WeakPolarHBondContact O-CA 3.22Å; I105-G109 PolarHBondContact O-N 3.19Å; I107-G109 VanDerWaalsContact C-N 3.33Å; I107-G109 PolarHBondContact O-N 2.84Å
110K91.1Very high84.2Confident127 Ų12776.2 Ų76.255%0.55240%0.4SS*.Hα-helixtrans-81.2-41.8-179.2-68.2-178.6177177.70112.6I76 L106 P112I76-K110 HydrophobicContact CD1-CG 4.07Å; L106-K110 VanDerWaalsContact O-CB 3.27Å; L106-K110 WeakPolarHBondContact O-CB 3.48Å; L106-K110 WeakPolarHBondContact O-CG 3.22Å; L106-K110 PolarHBondContact O-N 3.07Å; K110-P112 VanDerWaalsContact C-CD 3.49Å; K110-P112 WeakPolarHBondContact O-CD 3.17Å
111N87.1Confident83.8Confident100 Ų10072.3 Ų72.354%0.53538%0.382SS..  trans-129.666.6-172.5-59.9-40.9000110.9I107 F113 S114I107-N111 CarbonylContact O-C 3.44Å; I107-N111 WeakPolarHBondContact O-CA 3.27Å; I107-N111 PolarHBondContact O-N 3.44Å; N111-F113 PolarHBondContact O-N 3.38Å; N111-S114 WeakPolarHBondContact O-CB 3.38Å; N111-S114 PolarHBondContact O-N 2.96Å; N111-S114 PolarHBondContact O-OG 3.43Å
112P83.8Confident83.4Confident6 Ų669.4 Ų69.44%0.03936%0.358CS..THydrogen-bonded Turntrans-61.5-17.9-176.424.6-34.2000113Y39 V43 I108 K110Y39-P112 WeakPolarHBondContact CE1-O 3.41Å; Y39-P112 PolarHBondContact OH-O 3.38Å; V43-P112 HydrophobicContact CB-CB 4.16Å; V43-P112 HydrophobicContact CG1-CB 4.41Å; V43-P112 HydrophobicContact CG2-CB 3.93Å; I108-P112 VanDerWaalsContact O-CA 3.3Å; I108-P112 WeakPolarHBondContact O-CA 3.35Å; I108-P112 WeakPolarHBondContact O-CB 3.48Å; I108-P112 WeakPolarHBondContact O-CD 3.36Å; K110-P112 VanDerWaalsContact C-CD 3.49Å; K110-P112 WeakPolarHBondContact O-CD 3.17Å
113F83.4Confident83Confident91 Ų9169.2 Ų69.240%0.39936%0.356SS..THydrogen-bonded Turntrans-103.310.5-179.6-52.5-65.9000113.7F6 L36 Y39 V40 N111 G115F6-F113 HydrophobicContact CD2-CB 4.31Å; F6-F113 WeakPolarHBondContact CD2-O 3.48Å; F6-F113 AromaticContact CE1-CD1 3.68Å; F6-F113 HydrophobicContact CE1-CD1 3.68Å; F6-F113 HydrophobicContact CE1-CE1 4.31Å; F6-F113 HydrophobicContact CE2-CB 4.09Å; F6-F113 HydrophobicContact CE2-CD1 4.04Å; F6-F113 HydrophobicContact CZ-CB 4.33Å; F6-F113 AromaticContact CZ-CD1 3.44Å; F6-F113 HydrophobicContact CZ-CD1 3.44Å; F6-F113 VanDerWaalsContact CZ-CD1 3.44Å; F6-F113 HydrophobicContact CZ-CE1 4.24Å; F6-F113 HydrophobicContact CZ-CG 4.36Å; L36-F113 HydrophobicContact CD1-CE1 3.86Å; L36-F113 HydrophobicContact CD1-CZ 4.49Å; Y39-F113 HydrophobicContact CD1-CD1 4.29Å; Y39-F113 AromaticContact CD1-CE1 3.87Å; Y39-F113 HydrophobicContact CD1-CE1 3.87Å; Y39-F113 AromaticContact CE1-CD1 3.82Å; Y39-F113 HydrophobicContact CE1-CD1 3.82Å; Y39-F113 AromaticContact CE1-CE1 3.77Å; Y39-F113 HydrophobicContact CE1-CE1 3.77Å; V40-F113 HydrophobicContact CG2-CE1 4.44Å; V40-F113 HydrophobicContact CG2-CZ 4.19Å; N111-F113 PolarHBondContact O-N 3.38Å; F113-G115 VanDerWaalsContact C-N 3.26Å; F113-G115 PolarHBondContact O-N 2.93Å
114S75.4Confident82.5Confident50 Ų5068.9 Ų68.935%0.3535%0.348SS..SBendtrans-73.3-12.2-175.259.90000115N111 K116N111-S114 WeakPolarHBondContact O-CB 3.38Å; N111-S114 PolarHBondContact O-N 2.96Å; N111-S114 PolarHBondContact O-OG 3.43Å; S114-K116 PolarHBondContact O-N 2.77Å
115G64.4Low81.8Confident30 Ų3068.8 Ų68.831%0.30935%0.346SS..SBendtrans66.59.3-174.100000114.3F113F113-G115 VanDerWaalsContact C-N 3.26Å; F113-G115 PolarHBondContact O-N 2.93Å
116K64.1Low80.8Confident150 Ų15071.5 Ų71.565%0.65236%0.359SS*.  trans-105113.4176.6-63.2-178.1-178.5179.50108.2I107 S114I107-K116 HydrophobicContact CG2-CB 4.08Å; I107-K116 VanDerWaalsContact CG2-O 3.3Å; I107-K116 WeakPolarHBondContact CG2-O 3.26Å; S114-K116 PolarHBondContact O-N 2.77Å
117F59.4Low79.8Confident129 Ų12969.9 Ų69.957%0.56635%0.349SS*.  trans-127.30-179.4-51.8-73.7000110.3Y39 I108Y39-F117 HydrophobicContact CE2-CZ 4.32Å; Y39-F117 WeakPolarHBondContact OH-CE1 3.34Å; Y39-F117 WeakPolarHBondContact OH-CZ 3.23Å; I108-F117 HydrophobicContact CG1-CD1 4.4Å

Retrieved 117 of 117 residues in 70.6 ms (Link to these results)

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