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Mitochondrial import inner membrane translocase subunit

Mitochondrial intermembrane chaperone that participates in the import and insertion of multi-pass transmembrane proteins into the mitochondrial inner membrane. May also be required for the transfer of beta-barrel precursors from the TOM complex to the sorting and assembly machinery (SAM complex) of the outer membrane. Acts as a chaperone-like protein that protects the hydrophobic precursors from aggregation and guide them through the mitochondrial intermembrane space. Mitochondrial intermembrane chaperone that participates in the import and insertion of some multi-pass transmembrane proteins into the mitochondrial inner membrane. Also required for the transfer of beta-barrel precursors from the TOM complex to the sorting and assembly machinery (SAM complex) of the outer membrane. Acts as a chaperone-like protein that protects the hydrophobic precursors from aggregation and guide them through the mitochondrial intermembrane space.

AlphaFold DB , UniProt , Accession G4V5G1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 86 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
1M56Low82.8Confident215 Ų215113.5 Ų113.5100%1.05959%0.592SS**  0-31.40-77.9154.879.300112.5T3M1-T3 PolarHBondContact O-N 3.42Å
2S63.6Low83.8Confident88 Ų88115.5 Ų115.562%0.61560%0.596SS**Hα-helixtrans-59.3-41-178.5-39.10000115.1K4 S5 D6S2-K4 VanDerWaalsContact C-N 3.29Å; S2-K4 PolarHBondContact O-N 3.18Å; S2-S5 WeakPolarHBondContact O-CB 3.42Å; S2-S5 PolarHBondContact O-N 3.35Å; S2-D6 PolarHBondContact O-N 3.18Å
3T74.4Confident84.6Confident102 Ų102116.3 Ų116.363%0.62660%0.598SS**Hα-helixtrans-64.9-24.8-175.258.20000115.3M1 D6 K7M1-T3 PolarHBondContact O-N 3.42Å; T3-D6 WeakPolarHBondContact CA-OD2 3.47Å; T3-K7 PolarHBondContact O-N 3.02Å
4K77.8Confident85.5Confident176 Ų176114.8 Ų114.877%0.76559%0.587SS**Hα-helixtrans-70.6-36.6174.3-79.6-169.3178.2-175.80111.1S2 A8S2-K4 VanDerWaalsContact C-N 3.29Å; S2-K4 PolarHBondContact O-N 3.18Å; K4-A8 PolarHBondContact O-N 2.92Å
5S84.6Confident86.2Confident74 Ų74116.2 Ų116.252%0.51759%0.592SS.*Hα-helixtrans-69.2-43.6176.4-59.40000110.9S2 K7 A8 V9S2-S5 WeakPolarHBondContact O-CB 3.42Å; S2-S5 PolarHBondContact O-N 3.35Å; S5-K7 PolarHBondContact O-N 3.14Å; S5-A8 WeakPolarHBondContact O-CB 3.4Å; S5-A8 PolarHBondContact O-N 3.32Å; S5-V9 WeakPolarHBondContact O-CG2 3.47Å; S5-V9 PolarHBondContact O-N 3.41Å
6D88.6Confident86.8Confident101 Ų101116.6 Ų116.654%0.5459%0.589SS.*Hα-helixtrans-57.6-46.5179.4-56.5-35.4000111.9S2 T3 A8 V9 E10S2-D6 PolarHBondContact O-N 3.18Å; T3-D6 WeakPolarHBondContact CA-OD2 3.47Å; D6-A8 VanDerWaalsContact C-N 3.32Å; D6-A8 PolarHBondContact O-N 2.93Å; D6-V9 PolarHBondContact O-N 3.04Å; D6-E10 PolarHBondContact O-N 3.24Å
7K91.9Very high87.4Confident131 Ų131116.9 Ų116.957%0.5759%0.588SS**Hα-helixtrans-66.2-30.9175.9-72.2-173.9176-174.40113.7T3 S5 R11T3-K7 PolarHBondContact O-N 3.02Å; S5-K7 PolarHBondContact O-N 3.14Å; K7-R11 WeakPolarHBondContact O-CG 3.41Å; K7-R11 PolarHBondContact O-N 3.36Å; K7-R11 VanDerWaalsContact O-N 3.14Å
8A92.6Very high88Confident45 Ų45116.8 Ų116.837%0.37259%0.588SS.*Hα-helixtrans-71.3-40.9176.800000110.8K4 S5 D6 R11 Q12K4-A8 PolarHBondContact O-N 2.92Å; S5-A8 WeakPolarHBondContact O-CB 3.4Å; S5-A8 PolarHBondContact O-N 3.32Å; D6-A8 VanDerWaalsContact C-N 3.32Å; D6-A8 PolarHBondContact O-N 2.93Å; A8-R11 PolarHBondContact O-N 3.21Å; A8-Q12 WeakPolarHBondContact O-CB 3.46Å; A8-Q12 PolarHBondContact O-N 2.99Å
9V92.5Very high88.5Confident67 Ų67116.4 Ų116.441%0.40658%0.584SS.*Hα-helixtrans-63.6-45.7173.9174.20000110.7S5 D6 R11 Q12 M13S5-V9 WeakPolarHBondContact O-CG2 3.47Å; S5-V9 PolarHBondContact O-N 3.41Å; D6-V9 PolarHBondContact O-N 3.04Å; V9-R11 PolarHBondContact O-N 3.4Å; V9-Q12 WeakPolarHBondContact O-CB 3.37Å; V9-Q12 PolarHBondContact O-N 2.93Å; V9-Q12 VanDerWaalsContact O-N 3.12Å; V9-M13 HydrophobicContact CG1-CE 3.66Å; V9-M13 HydrophobicContact CG1-SD 4.24Å; V9-M13 WeakPolarHBondContact O-CG 3.37Å; V9-M13 PolarHBondContact O-N 3.12Å
10E93.6Very high88.8Confident108 Ų108114.3 Ų114.351%0.50557%0.573SS.*Hα-helixtrans-57.6-47.6176.8-174.5-175.5175.500112D6 Q12 M13 Q14D6-E10 PolarHBondContact O-N 3.24Å; E10-Q12 VanDerWaalsContact C-N 3.3Å; E10-Q12 PolarHBondContact O-N 3.43Å; E10-M13 PolarHBondContact O-N 3.49Å; E10-Q14 WeakPolarHBondContact O-CG 3.3Å; E10-Q14 PolarHBondContact O-N 2.95Å
11R94.8Very high89.2Confident141 Ų141115 Ų11553%0.53258%0.576SS.*Hα-helixtrans-62.1-38.2175.5-75.5-167.9-61.2-97.4-1.1112.5K7 A8 V9 M13 Q14 M15K7-R11 WeakPolarHBondContact O-CG 3.41Å; K7-R11 PolarHBondContact O-N 3.36Å; K7-R11 VanDerWaalsContact O-N 3.14Å; A8-R11 PolarHBondContact O-N 3.21Å; V9-R11 PolarHBondContact O-N 3.4Å; R11-M13 VanDerWaalsContact C-N 3.34Å; R11-Q14 PolarHBondContact O-N 3.4Å; R11-M15 VanDerWaalsContact O-CG 3.3Å; R11-M15 WeakPolarHBondContact O-CG 3.37Å; R11-M15 PolarHBondContact O-N 2.94Å
12Q94.8Very high91.2Very high138 Ų138109.9 Ų109.965%0.64555%0.55SS*.Hα-helixtrans-64.9-40.4176.7-175.2172.251.400111.4A8 V9 E10 M15 F16A8-Q12 WeakPolarHBondContact O-CB 3.46Å; A8-Q12 PolarHBondContact O-N 2.99Å; V9-Q12 WeakPolarHBondContact O-CB 3.37Å; V9-Q12 PolarHBondContact O-N 2.93Å; V9-Q12 VanDerWaalsContact O-N 3.12Å; E10-Q12 VanDerWaalsContact C-N 3.3Å; E10-Q12 PolarHBondContact O-N 3.43Å; Q12-M15 PolarHBondContact O-N 3.38Å; Q12-F16 WeakPolarHBondContact O-CB 3.46Å; Q12-F16 PolarHBondContact O-N 2.89Å
13M95.2Very high92.8Very high126 Ų126111 Ų11162%0.62155%0.545SS*.Hα-helixtrans-63.7-42.8174.5-69.9177.217500111.8V9 E10 R11 F16 E17V9-M13 HydrophobicContact CG1-CE 3.66Å; V9-M13 HydrophobicContact CG1-SD 4.24Å; V9-M13 WeakPolarHBondContact O-CG 3.37Å; V9-M13 PolarHBondContact O-N 3.12Å; E10-M13 PolarHBondContact O-N 3.49Å; R11-M13 VanDerWaalsContact C-N 3.34Å; M13-F16 PolarHBondContact O-N 3.12Å; M13-E17 PolarHBondContact O-N 3.38Å
14Q96.3Very high93.9Very high95 Ų95107.3 Ų107.344%0.44452%0.522SS..Hα-helixtrans-61.3-44.4175.3-71.5171.9-23.300112E10 R11 F16 E17 I18E10-Q14 WeakPolarHBondContact O-CG 3.3Å; E10-Q14 PolarHBondContact O-N 2.95Å; R11-Q14 PolarHBondContact O-N 3.4Å; Q14-F16 VanDerWaalsContact C-N 3.31Å; Q14-F16 PolarHBondContact O-N 3.47Å; Q14-E17 PolarHBondContact O-N 2.93Å; Q14-I18 WeakPolarHBondContact O-CG1 3.41Å; Q14-I18 PolarHBondContact O-N 3.27Å; Q14-I18 VanDerWaalsContact O-N 3.12Å
15M96.4Very high94.9Very high136 Ų136104.6 Ų104.667%0.6751%0.511SS*.Hα-helixtrans-62.2-41.6176-73.9179.662.100111.8R11 Q12 I18 E19R11-M15 VanDerWaalsContact O-CG 3.3Å; R11-M15 WeakPolarHBondContact O-CG 3.37Å; R11-M15 PolarHBondContact O-N 2.94Å; Q12-M15 PolarHBondContact O-N 3.38Å; M15-I18 PolarHBondContact O-N 3.32Å; M15-E19 WeakPolarHBondContact O-CB 3.43Å; M15-E19 PolarHBondContact O-N 2.93Å
16F96.2Very high95.6Very high122 Ų122104.5 Ų104.554%0.53551%0.507SS..Hα-helixtrans-63.6-42.8177.7-178.9-108.1000112.1Q12 M13 Q14 I18 E19 M20Q12-F16 WeakPolarHBondContact O-CB 3.46Å; Q12-F16 PolarHBondContact O-N 2.89Å; M13-F16 PolarHBondContact O-N 3.12Å; Q14-F16 VanDerWaalsContact C-N 3.31Å; Q14-F16 PolarHBondContact O-N 3.47Å; F16-I18 VanDerWaalsContact C-N 3.35Å; F16-I18 PolarHBondContact O-N 3.17Å; F16-E19 PolarHBondContact O-N 3.27Å; F16-M20 HydrophobicContact CD1-CG 4.38Å; F16-M20 HydrophobicContact CD1-SD 3.82Å; F16-M20 HydrophobicContact CE1-CG 4.03Å; F16-M20 HydrophobicContact CE1-SD 3.17Å; F16-M20 WeakPolarHBondContact CE1-SD 3.35Å; F16-M20 HydrophobicContact CE2-CG 4.19Å; F16-M20 HydrophobicContact CE2-SD 4.31Å; F16-M20 HydrophobicContact CZ-CG 3.91Å; F16-M20 HydrophobicContact CZ-SD 3.46Å; F16-M20 WeakPolarHBondContact CZ-SD 3.46Å; F16-M20 WeakPolarHBondContact O-CG 3.46Å; F16-M20 PolarHBondContact O-N 2.92Å
17E96.5Very high96Very high123 Ų123103 Ų10358%0.57550%0.504SS*.Hα-helixtrans-58.5-46.3175.3-175.4177.8-17400111.6M13 Q14 M20 M21M13-E17 PolarHBondContact O-N 3.38Å; Q14-E17 PolarHBondContact O-N 2.93Å; E17-M20 PolarHBondContact O-N 3.25Å; E17-M21 WeakPolarHBondContact O-CG 3.17Å; E17-M21 PolarHBondContact O-N 2.92Å
18I97.6Very high96.3Very high115 Ų11598.3 Ų98.359%0.5949%0.485SS*.Hα-helixtrans-62.4-44.7177-66.6165.7000111.1Q14 M15 F16 M20 M21 Q22Q14-I18 WeakPolarHBondContact O-CG1 3.41Å; Q14-I18 PolarHBondContact O-N 3.27Å; Q14-I18 VanDerWaalsContact O-N 3.12Å; M15-I18 PolarHBondContact O-N 3.32Å; F16-I18 VanDerWaalsContact C-N 3.35Å; F16-I18 PolarHBondContact O-N 3.17Å; I18-M20 PolarHBondContact O-N 3.05Å; I18-M21 PolarHBondContact O-N 3.23Å; I18-Q22 WeakPolarHBondContact O-CB 3.36Å; I18-Q22 PolarHBondContact O-N 3.02Å
19E97.9Very high96.6Very high109 Ų10998.7 Ų98.751%0.50948%0.482SS..Hα-helixtrans-61.5-44.4179.4-172.9-179171.500111.4M15 F16 M21 Q22 Q23M15-E19 WeakPolarHBondContact O-CB 3.43Å; M15-E19 PolarHBondContact O-N 2.93Å; F16-E19 PolarHBondContact O-N 3.27Å; E19-M21 PolarHBondContact O-N 3.45Å; E19-Q22 PolarHBondContact O-N 3.05Å; E19-Q23 VanDerWaalsContact O-CG 3.29Å; E19-Q23 WeakPolarHBondContact O-CG 3.29Å; E19-Q23 PolarHBondContact O-N 3.37Å; E19-Q23 PolarHBondContact OE1-NE2 2.95Å
20M95.8Very high96.9Very high73 Ų7399.2 Ų99.236%0.3649%0.489SS..Hα-helixtrans-59.8-46.4175.4-72.6-1757200111.7F16 E17 I18 Q22 Q23 V24F16-M20 HydrophobicContact CD1-CG 4.38Å; F16-M20 HydrophobicContact CD1-SD 3.82Å; F16-M20 HydrophobicContact CE1-CG 4.03Å; F16-M20 HydrophobicContact CE1-SD 3.17Å; F16-M20 WeakPolarHBondContact CE1-SD 3.35Å; F16-M20 HydrophobicContact CE2-CG 4.19Å; F16-M20 HydrophobicContact CE2-SD 4.31Å; F16-M20 HydrophobicContact CZ-CG 3.91Å; F16-M20 HydrophobicContact CZ-SD 3.46Å; F16-M20 WeakPolarHBondContact CZ-SD 3.46Å; F16-M20 WeakPolarHBondContact O-CG 3.46Å; F16-M20 PolarHBondContact O-N 2.92Å; E17-M20 PolarHBondContact O-N 3.25Å; I18-M20 PolarHBondContact O-N 3.05Å; M20-Q22 VanDerWaalsContact C-N 3.31Å; M20-Q22 PolarHBondContact O-N 3.3Å; M20-Q23 PolarHBondContact O-N 2.89Å; M20-V24 WeakPolarHBondContact O-CG2 3.35Å; M20-V24 PolarHBondContact O-N 3.43Å
21M96.6Very high97.1Very high129 Ų12995.6 Ų95.664%0.63548%0.476SS*.Hα-helixtrans-60.7-42.3177-71.1-177.472.100111.6E17 I18 E19 Q23 V24 F25E17-M21 WeakPolarHBondContact O-CG 3.17Å; E17-M21 PolarHBondContact O-N 2.92Å; I18-M21 PolarHBondContact O-N 3.23Å; E19-M21 PolarHBondContact O-N 3.45Å; M21-Q23 PolarHBondContact O-N 3.48Å; M21-V24 PolarHBondContact O-N 3.28Å; M21-F25 WeakPolarHBondContact O-CB 3.37Å; M21-F25 PolarHBondContact O-N 3.48Å
22Q98.2Very high97.3Very high109 Ų10989.3 Ų89.351%0.50945%0.453SS..Hα-helixtrans-63-42.2177.8-177.360.34200111.9I18 E19 M20 F25 T26I18-Q22 WeakPolarHBondContact O-CB 3.36Å; I18-Q22 PolarHBondContact O-N 3.02Å; E19-Q22 PolarHBondContact O-N 3.05Å; M20-Q22 VanDerWaalsContact C-N 3.31Å; M20-Q22 PolarHBondContact O-N 3.3Å; Q22-F25 PolarHBondContact O-N 2.88Å; Q22-T26 PolarHBondContact NE2-OG1 3.4Å; Q22-T26 VanDerWaalsContact O-CB 3.32Å; Q22-T26 WeakPolarHBondContact O-CB 3.34Å; Q22-T26 PolarHBondContact O-N 2.86Å; Q22-T26 PolarHBondContact O-OG1 3.4Å
23Q97.5Very high97.4Very high112 Ų11286.4 Ų86.452%0.52344%0.442SS..Hα-helixtrans-62.5-46177.5-73173.1-2.900111.4E19 M20 M21 T26 S27E19-Q23 VanDerWaalsContact O-CG 3.29Å; E19-Q23 WeakPolarHBondContact O-CG 3.29Å; E19-Q23 PolarHBondContact O-N 3.37Å; E19-Q23 PolarHBondContact OE1-NE2 2.95Å; M20-Q23 PolarHBondContact O-N 2.89Å; M21-Q23 PolarHBondContact O-N 3.48Å; Q23-T26 PolarHBondContact O-N 3.19Å; Q23-S27 VanDerWaalsContact O-CB 3.26Å; Q23-S27 WeakPolarHBondContact O-CB 3.47Å; Q23-S27 PolarHBondContact O-N 3.22Å
24V97.5Very high97.5Very high24 Ų2484.5 Ų84.515%0.14545%0.446CS..Hα-helixtrans-61.1-47.4176.6174.90000110.7M20 M21 S27 M28 F61 M62 Y65M20-V24 WeakPolarHBondContact O-CG2 3.35Å; M20-V24 PolarHBondContact O-N 3.43Å; M21-V24 PolarHBondContact O-N 3.28Å; V24-S27 PolarHBondContact O-N 2.87Å; V24-M28 VanDerWaalsContact O-CB 3.27Å; V24-M28 WeakPolarHBondContact O-CB 3.49Å; V24-M28 PolarHBondContact O-N 2.83Å; V24-F61 HydrophobicContact CG1-CE1 4.13Å; V24-M62 HydrophobicContact CG1-SD 4.19Å; V24-Y65 HydrophobicContact CG1-CD1 4.48Å; V24-Y65 HydrophobicContact CG1-CG 4.48Å; V24-Y65 HydrophobicContact CG2-CD2 4.02Å; V24-Y65 HydrophobicContact CG2-CE1 4.13Å; V24-Y65 HydrophobicContact CG2-CE2 3.37Å; V24-Y65 VanDerWaalsContact CG2-CZ 3.43Å
25F98.2Very high97.5Very high119 Ų11987 Ų8752%0.52246%0.456SS..Hα-helixtrans-62.6-46.1179.8-176.2-104.4000112.1M21 Q22 S27 M28 T29M21-F25 WeakPolarHBondContact O-CB 3.37Å; M21-F25 PolarHBondContact O-N 3.48Å; Q22-F25 PolarHBondContact O-N 2.88Å; F25-S27 PolarHBondContact O-N 3.1Å; F25-M28 HydrophobicContact CD2-CE 4.15Å; F25-M28 PolarHBondContact O-N 3.03Å; F25-T29 WeakPolarHBondContact O-CB 3.26Å; F25-T29 PolarHBondContact O-N 2.98Å; F25-T29 PolarHBondContact O-OG1 3.49Å
26T98.3Very high97.6Very high72 Ų7281.1 Ų81.144%0.44243%0.428SS..Hα-helixtrans-64.2-43.5-179.9-53.20000111.3Q22 Q23 S30Q22-T26 PolarHBondContact NE2-OG1 3.4Å; Q22-T26 VanDerWaalsContact O-CB 3.32Å; Q22-T26 WeakPolarHBondContact O-CB 3.34Å; Q22-T26 PolarHBondContact O-N 2.86Å; Q22-T26 PolarHBondContact O-OG1 3.4Å; Q23-T26 PolarHBondContact O-N 3.19Å; T26-S30 WeakPolarHBondContact O-CB 3.32Å; T26-S30 PolarHBondContact O-N 3.14Å
27S98.2Very high97.6Very high68 Ų6876.2 Ų76.248%0.47641%0.407SS..Hα-helixtrans-65-43.3177.3-177.10000112.1Q23 V24 F25 S31Q23-S27 VanDerWaalsContact O-CB 3.26Å; Q23-S27 WeakPolarHBondContact O-CB 3.47Å; Q23-S27 PolarHBondContact O-N 3.22Å; V24-S27 PolarHBondContact O-N 2.87Å; F25-S27 PolarHBondContact O-N 3.1Å; S27-S31 WeakPolarHBondContact O-CB 3.39Å; S27-S31 PolarHBondContact O-N 2.87Å
28M98.5Very high97.4Very high33 Ų3373.7 Ų73.716%0.16340%0.401CS..Hα-helixtrans-60.8-51.6176.1-175.5169.960.800111.4V24 F25 S30 S31 C32 A58 F61 M62V24-M28 VanDerWaalsContact O-CB 3.27Å; V24-M28 WeakPolarHBondContact O-CB 3.49Å; V24-M28 PolarHBondContact O-N 2.83Å; F25-M28 HydrophobicContact CD2-CE 4.15Å; F25-M28 PolarHBondContact O-N 3.03Å; M28-S30 PolarHBondContact O-N 2.92Å; M28-S31 PolarHBondContact O-N 3.39Å; M28-C32 WeakPolarHBondContact O-CB 3.27Å; M28-C32 PolarHBondContact O-N 3.49Å; M28-C32 PolarHBondContact O-SG 2.72Å; M28-A58 HydrophobicContact SD-CB 4.07Å; M28-F61 HydrophobicContact CB-CD1 3.53Å; M28-F61 HydrophobicContact CB-CD2 4.22Å; M28-F61 HydrophobicContact CB-CE1 3.52Å; M28-F61 HydrophobicContact CB-CE2 4.2Å; M28-F61 HydrophobicContact CB-CG 3.91Å; M28-F61 HydrophobicContact CB-CZ 3.86Å; M28-F61 HydrophobicContact CG-CB 4Å; M28-F61 HydrophobicContact CG-CD1 3.58Å; M28-F61 HydrophobicContact CG-CD2 4.28Å; M28-F61 HydrophobicContact CG-CE1 4.13Å; M28-F61 HydrophobicContact CG-CG 3.68Å; M28-F61 HydrophobicContact SD-CB 4.34Å; M28-F61 HydrophobicContact SD-CD1 3.86Å; M28-F61 HydrophobicContact SD-CG 4.31Å; M28-M62 HydrophobicContact SD-CG 4.2Å; M28-M62 HydrophobicContact SD-SD 4.2Å
29T98.2Very high97Very high53 Ų5373.1 Ų73.133%0.32541%0.407SS..Hα-helixtrans-58.9-49.1-180-64.50000110.8F25 S31 C32 L33F25-T29 WeakPolarHBondContact O-CB 3.26Å; F25-T29 PolarHBondContact O-N 2.98Å; F25-T29 PolarHBondContact O-OG1 3.49Å; T29-S31 VanDerWaalsContact C-N 3.35Å; T29-S31 PolarHBondContact O-N 3.42Å; T29-C32 PolarHBondContact O-N 3.46Å; T29-L33 HydrophobicContact CG2-CD1 3.71Å; T29-L33 HydrophobicContact CG2-CG 4.19Å; T29-L33 WeakPolarHBondContact O-CB 3.44Å; T29-L33 VanDerWaalsContact O-CG 3.24Å; T29-L33 WeakPolarHBondContact O-CG 3.34Å; T29-L33 PolarHBondContact O-N 2.97Å
30S98.2Very high96.7Very high79 Ų7973.5 Ų73.555%0.55241%0.413SS*.Hα-helixtrans-58.4-45.3176.9-1800000112.2T26 M28 A34T26-S30 WeakPolarHBondContact O-CB 3.32Å; T26-S30 PolarHBondContact O-N 3.14Å; M28-S30 PolarHBondContact O-N 2.92Å; S30-A34 WeakPolarHBondContact O-CB 3.33Å; S30-A34 PolarHBondContact O-N 3.47Å; S30-A34 VanDerWaalsContact O-N 3.1Å
31S98.5Very high96.2Very high32 Ų3278 Ų7822%0.22443%0.427CS..Hα-helixtrans-64.2-43.4179-165.10000112.7S27 M28 T29 K35S27-S31 WeakPolarHBondContact O-CB 3.39Å; S27-S31 PolarHBondContact O-N 2.87Å; M28-S31 PolarHBondContact O-N 3.39Å; T29-S31 VanDerWaalsContact C-N 3.35Å; T29-S31 PolarHBondContact O-N 3.42Å; S31-K35 WeakPolarHBondContact O-CB 3.26Å; S31-K35 WeakPolarHBondContact O-CD 3.36Å; S31-K35 VanDerWaalsContact O-CG 3.26Å; S31-K35 WeakPolarHBondContact O-CG 3.39Å; S31-K35 PolarHBondContact O-N 2.9Å; S31-K35 VanDerWaalsContact O-N 3.16Å; S31-K35 PolarHBondContact OG-NZ 2.77Å
32C98.6Very high95.6Very high8 Ų879.2 Ų79.25%0.05444%0.436CS..Hα-helixtrans-76.8-36.2-176.6-66.10000112.7M28 T29 K35 C36 L54 C57M28-C32 WeakPolarHBondContact O-CB 3.27Å; M28-C32 PolarHBondContact O-N 3.49Å; M28-C32 PolarHBondContact O-SG 2.72Å; T29-C32 PolarHBondContact O-N 3.46Å; C32-K35 PolarHBondContact O-N 3.41Å; C32-C36 WeakPolarHBondContact O-CB 3.35Å; C32-C36 PolarHBondContact O-N 3.24Å; C32-L54 HydrophobicContact CB-CD2 4.05Å; C32-C57 WeakPolarHBondContact CA-SG 3.31Å; C32-C57 HydrophobicContact CB-CB 3.85Å; C32-C57 WeakPolarHBondContact CB-SG 3.24Å; C32-C57 VanDerWaalsContact SG-C 3.52Å; C32-C57 WeakPolarHBondContact SG-CB 3.46Å; C32-C57 CovalentContact SG-SG 2.05Å; C32-C57 PolarHBondContact SG-SG 2.91Å
33L96.8Very high94.9Very high78 Ų7879.3 Ų79.341%0.40844%0.44SS..Hα-helixtrans-60-48.3170.9-70.8176.3000110.8T29 K35 C36 I37T29-L33 HydrophobicContact CG2-CD1 3.71Å; T29-L33 HydrophobicContact CG2-CG 4.19Å; T29-L33 WeakPolarHBondContact O-CB 3.44Å; T29-L33 VanDerWaalsContact O-CG 3.24Å; T29-L33 WeakPolarHBondContact O-CG 3.34Å; T29-L33 PolarHBondContact O-N 2.97Å; L33-K35 VanDerWaalsContact C-N 3.26Å; L33-K35 PolarHBondContact O-N 3Å; L33-C36 PolarHBondContact O-N 3.16Å; L33-I37 HydrophobicContact CD2-CG1 3.77Å; L33-I37 WeakPolarHBondContact O-CB 3.35Å; L33-I37 PolarHBondContact O-N 2.85Å
34A97.1Very high94.5Very high86 Ų8677.8 Ų77.871%0.71146%0.455SS*.Hα-helixtrans-63.3-28.8179.300000113.9S30S30-A34 WeakPolarHBondContact O-CB 3.33Å; S30-A34 PolarHBondContact O-N 3.47Å; S30-A34 VanDerWaalsContact O-N 3.1Å
35K98Very high94.3Very high148 Ų14882.8 Ų82.864%0.64348%0.48SS*.Hα-helixtrans-88-35.7-179.5-75.6169-179.8159.20113.7S31 C32 L33S31-K35 WeakPolarHBondContact O-CB 3.26Å; S31-K35 WeakPolarHBondContact O-CD 3.36Å; S31-K35 VanDerWaalsContact O-CG 3.26Å; S31-K35 WeakPolarHBondContact O-CG 3.39Å; S31-K35 PolarHBondContact O-N 2.9Å; S31-K35 VanDerWaalsContact O-N 3.16Å; S31-K35 PolarHBondContact OG-NZ 2.77Å; C32-K35 PolarHBondContact O-N 3.41Å; L33-K35 VanDerWaalsContact C-N 3.26Å; L33-K35 PolarHBondContact O-N 3Å
36C97.9Very high94.1Very high12 Ų1282 Ų828%0.08148%0.481CS..Hα-helixtrans-109-26.2-166.7-63.70000113.3C32 L33 E50 C53 L54C32-C36 WeakPolarHBondContact O-CB 3.35Å; C32-C36 PolarHBondContact O-N 3.24Å; L33-C36 PolarHBondContact O-N 3.16Å; C36-E50 WeakPolarHBondContact O-CG 3.04Å; C36-C53 WeakPolarHBondContact CA-SG 3.44Å; C36-C53 HydrophobicContact CB-CB 3.64Å; C36-C53 WeakPolarHBondContact CB-SG 3.44Å; C36-C53 WeakPolarHBondContact SG-CB 3.25Å; C36-C53 PolarHBondContact SG-O 2.89Å; C36-C53 VanDerWaalsContact SG-O 3.38Å; C36-C53 CovalentContact SG-SG 2.05Å; C36-C53 PolarHBondContact SG-SG 2.8Å; C36-L54 HydrophobicContact CB-CD2 3.82Å; C36-L54 HydrophobicContact CB-CG 4.07Å
37I95.7Very high93.9Very high18 Ų1881.9 Ų81.99%0.09248%0.481CS..SBendtrans-108.8114-176.1-52-56.4000109.2L33 Y41 L46 E50 L54L33-I37 HydrophobicContact CD2-CG1 3.77Å; L33-I37 WeakPolarHBondContact O-CB 3.35Å; L33-I37 PolarHBondContact O-N 2.85Å; I37-Y41 HydrophobicContact CG2-CD1 4.28Å; I37-Y41 HydrophobicContact CG2-CE1 3.41Å; I37-Y41 VanDerWaalsContact CG2-CE1 3.41Å; I37-Y41 WeakPolarHBondContact CG2-OH 3.36Å; I37-L46 HydrophobicContact CD1-CD2 3.62Å; I37-E50 HydrophobicContact CD1-CB 3.93Å; I37-E50 HydrophobicContact CD1-CG 4Å; I37-L54 HydrophobicContact CD1-CD1 4.26Å
38P92.6Very high93.8Very high71 Ų7187.3 Ų87.346%0.46150%0.496SS..  trans-58.4147174.6-21.933.3000111.4N40 E50P38-N40 PolarHBondContact O-N 3.25Å; P38-E50 WeakPolarHBondContact CD-OE1 3.49Å
39S89.9Confident93.7Very high102 Ų10288.2 Ų88.271%0.71351%0.513SS*.SBendtrans-61.5-26.3175.359.50000113.1Y41S39-Y41 WeakPolarHBondContact O-CD2 3.35Å; S39-Y41 PolarHBondContact O-N 3.17Å
40N89.7Confident93.6Very high117 Ų11787.3 Ų87.363%0.62651%0.505SS*.SBendtrans-92.494.8178.3-62.9-11.5000108.7P38 N42P38-N40 PolarHBondContact O-N 3.25Å; N40-N42 PolarHBondContact O-N 2.94Å; N40-N42 PolarHBondContact O-ND2 3.39Å; N40-N42 VanDerWaalsContact O-ND2 3.07Å
41Y86.1Confident93.6Very high168 Ų16885.2 Ų85.266%0.65949%0.493SS*.  trans-72.5111.4173.2-67.4-94.3000109.1I37 S39I37-Y41 HydrophobicContact CG2-CD1 4.28Å; I37-Y41 HydrophobicContact CG2-CE1 3.41Å; I37-Y41 VanDerWaalsContact CG2-CE1 3.41Å; I37-Y41 WeakPolarHBondContact CG2-OH 3.36Å; S39-Y41 WeakPolarHBondContact O-CD2 3.35Å; S39-Y41 PolarHBondContact O-N 3.17Å
42N83.7Confident93.6Very high155 Ų15586.8 Ų86.883%0.82950%0.501SS*.  trans-103.1-15.9177.6-60.6-69.9000112.4N40N40-N42 PolarHBondContact O-N 2.94Å; N40-N42 PolarHBondContact O-ND2 3.39Å; N40-N42 VanDerWaalsContact O-ND2 3.07Å
43D83.1Confident93.6Very high110 Ų11088.5 Ų88.559%0.58851%0.513SS*.  trans-139.7154.1-177.1-154.3-29.6000109.1D45D43-D45 PolarHBondContact OD1-N 3.22Å
44G89.6Confident93.7Very high81 Ų8186.9 Ų86.984%0.83550%0.504SS*.SBendtrans-84.1-20174.500000112.9
45D93.5Very high93.8Very high128 Ų12888.4 Ų88.468%0.68450%0.5SS*.SBendtrans-99.6150.1179.3-71.4-37.4000112.1D43 T47D43-D45 PolarHBondContact OD1-N 3.22Å; D45-T47 PolarHBondContact O-N 3.49Å
46L94Very high93.8Very high103 Ų10389.9 Ų89.954%0.53950%0.502SS..PPolyproline II helixtrans-70.9125.9171.7-66175.6000110.1I37 E50 L54I37-L46 HydrophobicContact CD1-CD2 3.62Å; L46-E50 HydrophobicContact CB-CB 4.46Å; L46-E50 HydrophobicContact CD2-CB 4.07Å; L46-L54 HydrophobicContact CD1-CD1 3.83Å; L46-L54 HydrophobicContact CD2-CD1 4.27Å
47T94.9Very high93.8Very high70 Ų7090 Ų9043%0.42950%0.503SS..PPolyproline II helixtrans-62.9157.2165.866.80000110.4D45 G49 E50 A51D45-T47 PolarHBondContact O-N 3.49Å; T47-G49 PolarHBondContact O-N 3Å; T47-G49 VanDerWaalsContact O-N 3.13Å; T47-E50 WeakPolarHBondContact CB-OE2 3.31Å; T47-E50 WeakPolarHBondContact CG2-OE2 3.05Å; T47-E50 PolarHBondContact N-OE2 3.24Å; T47-E50 PolarHBondContact O-N 2.9Å; T47-E50 VanDerWaalsContact O-N 3.12Å; T47-E50 VanDerWaalsContact OG1-CD 3.25Å; T47-E50 VanDerWaalsContact OG1-CG 3.25Å; T47-E50 WeakPolarHBondContact OG1-CG 3.36Å; T47-E50 PolarHBondContact OG1-N 2.67Å; T47-E50 PolarHBondContact OG1-OE2 3.48Å; T47-A51 PolarHBondContact O-N 3.38Å
48K96Very high94Very high182 Ų18290.8 Ų90.879%0.79151%0.511SS*.Hα-helixtrans-53.9-35173.4-176-179.7178.7-178.50112.3V52K48-V52 WeakPolarHBondContact O-CB 3.42Å; K48-V52 VanDerWaalsContact O-CG2 3.3Å; K48-V52 WeakPolarHBondContact O-CG2 3.37Å; K48-V52 PolarHBondContact O-N 2.67Å; K48-V52 VanDerWaalsContact O-N 3.16Å
49G96Very high94.3Very high51 Ų5190.4 Ų90.453%0.52651%0.511SS..Hα-helixtrans-66.8-46.5178.200000112.3T47 C53T47-G49 PolarHBondContact O-N 3Å; T47-G49 VanDerWaalsContact O-N 3.13Å; G49-C53 VanDerWaalsContact O-CB 3.29Å; G49-C53 WeakPolarHBondContact O-CB 3.45Å; G49-C53 PolarHBondContact O-N 3.43Å
50E96.7Very high94.7Very high34 Ų3492 Ų9216%0.15951%0.505CS..Hα-helixtrans-63.5-46.6177.9-70.8161.4149.500111.3C36 I37 P38 L46 T47 V52 C53 L54C36-E50 WeakPolarHBondContact O-CG 3.04Å; I37-E50 HydrophobicContact CD1-CB 3.93Å; I37-E50 HydrophobicContact CD1-CG 4Å; P38-E50 WeakPolarHBondContact CD-OE1 3.49Å; L46-E50 HydrophobicContact CB-CB 4.46Å; L46-E50 HydrophobicContact CD2-CB 4.07Å; T47-E50 WeakPolarHBondContact CB-OE2 3.31Å; T47-E50 WeakPolarHBondContact CG2-OE2 3.05Å; T47-E50 PolarHBondContact N-OE2 3.24Å; T47-E50 PolarHBondContact O-N 2.9Å; T47-E50 VanDerWaalsContact O-N 3.12Å; T47-E50 VanDerWaalsContact OG1-CD 3.25Å; T47-E50 VanDerWaalsContact OG1-CG 3.25Å; T47-E50 WeakPolarHBondContact OG1-CG 3.36Å; T47-E50 PolarHBondContact OG1-N 2.67Å; T47-E50 PolarHBondContact OG1-OE2 3.48Å; E50-V52 PolarHBondContact O-N 3.45Å; E50-C53 WeakPolarHBondContact O-CB 3.44Å; E50-C53 PolarHBondContact O-N 2.88Å; E50-L54 VanDerWaalsContact O-CG 3.31Å; E50-L54 WeakPolarHBondContact O-CG 3.45Å; E50-L54 PolarHBondContact O-N 2.87Å
51A97.2Very high95.1Very high36 Ų3688.1 Ų88.130%0.29848%0.483SS..Hα-helixtrans-57.4-50.8177.400000112.1T47 C53 L54 D55T47-A51 PolarHBondContact O-N 3.38Å; A51-C53 VanDerWaalsContact C-N 3.3Å; A51-C53 PolarHBondContact O-N 2.91Å; A51-L54 PolarHBondContact O-N 3.46Å; A51-D55 PolarHBondContact O-N 3.49Å; A51-D55 VanDerWaalsContact O-N 3.1Å
52V98.5Very high95.7Very high65 Ų6583.7 Ų83.739%0.39447%0.469SS..Hα-helixtrans-65.3-34.2178.6172.80000111.9K48 E50 R56K48-V52 WeakPolarHBondContact O-CB 3.42Å; K48-V52 VanDerWaalsContact O-CG2 3.3Å; K48-V52 WeakPolarHBondContact O-CG2 3.37Å; K48-V52 PolarHBondContact O-N 2.67Å; K48-V52 VanDerWaalsContact O-N 3.16Å; E50-V52 PolarHBondContact O-N 3.45Å; V52-R56 VanDerWaalsContact O-CG 3.31Å; V52-R56 WeakPolarHBondContact O-CG 3.3Å; V52-R56 PolarHBondContact O-N 3.26Å
53C98.6Very high96.4Very high44 Ų4479.6 Ų79.630%0.29744%0.444SS..Hα-helixtrans-64.2-47.3174.3-177.50000111.1C36 G49 E50 A51 D55 R56 C57C36-C53 WeakPolarHBondContact CA-SG 3.44Å; C36-C53 HydrophobicContact CB-CB 3.64Å; C36-C53 WeakPolarHBondContact CB-SG 3.44Å; C36-C53 WeakPolarHBondContact SG-CB 3.25Å; C36-C53 PolarHBondContact SG-O 2.89Å; C36-C53 VanDerWaalsContact SG-O 3.38Å; C36-C53 CovalentContact SG-SG 2.05Å; C36-C53 PolarHBondContact SG-SG 2.8Å; G49-C53 VanDerWaalsContact O-CB 3.29Å; G49-C53 WeakPolarHBondContact O-CB 3.45Å; G49-C53 PolarHBondContact O-N 3.43Å; E50-C53 WeakPolarHBondContact O-CB 3.44Å; E50-C53 PolarHBondContact O-N 2.88Å; A51-C53 VanDerWaalsContact C-N 3.3Å; A51-C53 PolarHBondContact O-N 2.91Å; C53-D55 PolarHBondContact O-N 3.02Å; C53-R56 PolarHBondContact O-N 3.47Å; C53-C57 WeakPolarHBondContact O-CB 3.45Å; C53-C57 PolarHBondContact O-N 3.39Å
54L98.5Very high97.1Very high43 Ų4376.6 Ų76.623%0.22544%0.435CS..Hα-helixtrans-58.7-46.8179.8-72.3173000111.5C32 C36 I37 L46 E50 A51 R56 C57 A58C32-L54 HydrophobicContact CB-CD2 4.05Å; C36-L54 HydrophobicContact CB-CD2 3.82Å; C36-L54 HydrophobicContact CB-CG 4.07Å; I37-L54 HydrophobicContact CD1-CD1 4.26Å; L46-L54 HydrophobicContact CD1-CD1 3.83Å; L46-L54 HydrophobicContact CD2-CD1 4.27Å; E50-L54 VanDerWaalsContact O-CG 3.31Å; E50-L54 WeakPolarHBondContact O-CG 3.45Å; E50-L54 PolarHBondContact O-N 2.87Å; A51-L54 PolarHBondContact O-N 3.46Å; L54-R56 PolarHBondContact O-N 3.47Å; L54-C57 PolarHBondContact O-N 2.98Å; L54-A58 WeakPolarHBondContact O-CB 3.43Å; L54-A58 PolarHBondContact O-N 2.95Å
55D98.6Very high97.5Very high119 Ų11976.5 Ų76.564%0.63641%0.41SS*.Hα-helixtrans-58.7-47.3177.3-71.1-25.9000112.2A51 C53 S59A51-D55 PolarHBondContact O-N 3.49Å; A51-D55 VanDerWaalsContact O-N 3.1Å; C53-D55 PolarHBondContact O-N 3.02Å; D55-S59 WeakPolarHBondContact O-CB 3.45Å; D55-S59 PolarHBondContact O-N 2.88Å; D55-S59 VanDerWaalsContact O-N 3.12Å
56R98.8Very high97.6Very high179 Ų17975.7 Ų75.768%0.67540%0.404SS*.Hα-helixtrans-66-40.5177.9-71.8176.2-177.7-94.6-0.6111.6V52 C53 L54 S59 K60V52-R56 VanDerWaalsContact O-CG 3.31Å; V52-R56 WeakPolarHBondContact O-CG 3.3Å; V52-R56 PolarHBondContact O-N 3.26Å; C53-R56 PolarHBondContact O-N 3.47Å; L54-R56 PolarHBondContact O-N 3.47Å; R56-S59 PolarHBondContact O-N 3.32Å; R56-K60 WeakPolarHBondContact O-CB 3.22Å; R56-K60 WeakPolarHBondContact O-CG 3.28Å; R56-K60 PolarHBondContact O-N 3.45Å
57C98.8Very high97.8Very high14 Ų1477.2 Ų77.210%0.09541%0.408CS..Hα-helixtrans-63-49.9179.7179.20000110.9C32 C53 L54 S59 K60 F61C32-C57 WeakPolarHBondContact CA-SG 3.31Å; C32-C57 HydrophobicContact CB-CB 3.85Å; C32-C57 WeakPolarHBondContact CB-SG 3.24Å; C32-C57 VanDerWaalsContact SG-C 3.52Å; C32-C57 WeakPolarHBondContact SG-CB 3.46Å; C32-C57 CovalentContact SG-SG 2.05Å; C32-C57 PolarHBondContact SG-SG 2.91Å; C53-C57 WeakPolarHBondContact O-CB 3.45Å; C53-C57 PolarHBondContact O-N 3.39Å; L54-C57 PolarHBondContact O-N 2.98Å; C57-S59 PolarHBondContact O-N 3.34Å; C57-K60 PolarHBondContact O-N 3.49Å; C57-F61 VanDerWaalsContact O-CB 3.31Å; C57-F61 WeakPolarHBondContact O-CB 3.26Å; C57-F61 PolarHBondContact O-N 3.4Å
58A98.7Very high97.8Very high34 Ų3478.3 Ų78.328%0.28142%0.415SS..Hα-helixtrans-59.5-45.5177.700000111.6M28 L54 K60 F61 M62M28-A58 HydrophobicContact SD-CB 4.07Å; L54-A58 WeakPolarHBondContact O-CB 3.43Å; L54-A58 PolarHBondContact O-N 2.95Å; A58-K60 PolarHBondContact O-N 3.1Å; A58-F61 PolarHBondContact O-N 2.9Å; A58-M62 WeakPolarHBondContact O-CG 3.37Å; A58-M62 PolarHBondContact O-N 2.78Å
59S98.6Very high97.7Very high64 Ų6472.3 Ų72.345%0.44839%0.393SS..Hα-helixtrans-58.7-44.7176.3-1760000112.5D55 R56 C57 Q63D55-S59 WeakPolarHBondContact O-CB 3.45Å; D55-S59 PolarHBondContact O-N 2.88Å; D55-S59 VanDerWaalsContact O-N 3.12Å; R56-S59 PolarHBondContact O-N 3.32Å; C57-S59 PolarHBondContact O-N 3.34Å; S59-Q63 VanDerWaalsContact O-CG 3.3Å; S59-Q63 WeakPolarHBondContact O-CG 3.43Å; S59-Q63 PolarHBondContact O-N 2.95Å; S59-Q63 VanDerWaalsContact O-N 3.09Å; S59-Q63 PolarHBondContact O-NE2 3.07Å; S59-Q63 PolarHBondContact OG-NE2 2.87Å; S59-Q63 VanDerWaalsContact OG-NE2 3.09Å
60K98.8Very high97.6Very high134 Ų13477.1 Ų77.158%0.58340%0.4SS*.Hα-helixtrans-71.4-37.1178.4-73-65.6-179-171.30112.8R56 C57 A58 M62 Q63 A64R56-K60 WeakPolarHBondContact O-CB 3.22Å; R56-K60 WeakPolarHBondContact O-CG 3.28Å; R56-K60 PolarHBondContact O-N 3.45Å; C57-K60 PolarHBondContact O-N 3.49Å; A58-K60 PolarHBondContact O-N 3.1Å; K60-M62 VanDerWaalsContact C-N 3.35Å; K60-Q63 PolarHBondContact O-N 2.99Å; K60-A64 WeakPolarHBondContact O-CB 3.37Å; K60-A64 PolarHBondContact O-N 2.9Å
61F98.8Very high97.6Very high37 Ų3781.6 Ų81.616%0.16242%0.419CS..Hα-helixtrans-59.5-48175.4-174.3-83.4000110.4V24 M28 C57 A58 Q63 A64 Y65V24-F61 HydrophobicContact CG1-CE1 4.13Å; M28-F61 HydrophobicContact CB-CD1 3.53Å; M28-F61 HydrophobicContact CB-CD2 4.22Å; M28-F61 HydrophobicContact CB-CE1 3.52Å; M28-F61 HydrophobicContact CB-CE2 4.2Å; M28-F61 HydrophobicContact CB-CG 3.91Å; M28-F61 HydrophobicContact CB-CZ 3.86Å; M28-F61 HydrophobicContact CG-CB 4Å; M28-F61 HydrophobicContact CG-CD1 3.58Å; M28-F61 HydrophobicContact CG-CD2 4.28Å; M28-F61 HydrophobicContact CG-CE1 4.13Å; M28-F61 HydrophobicContact CG-CG 3.68Å; M28-F61 HydrophobicContact SD-CB 4.34Å; M28-F61 HydrophobicContact SD-CD1 3.86Å; M28-F61 HydrophobicContact SD-CG 4.31Å; C57-F61 VanDerWaalsContact O-CB 3.31Å; C57-F61 WeakPolarHBondContact O-CB 3.26Å; C57-F61 PolarHBondContact O-N 3.4Å; A58-F61 PolarHBondContact O-N 2.9Å; F61-Q63 PolarHBondContact O-N 3.44Å; F61-A64 PolarHBondContact O-N 3.23Å; F61-Y65 WeakPolarHBondContact O-CB 3.46Å; F61-Y65 PolarHBondContact O-N 3.49Å
62M98.3Very high97.4Very high74 Ų7485 Ų8537%0.36543%0.431SS..Hα-helixtrans-65.5-39.8178.1-68.1-56.5-65.800112.6V24 M28 A58 K60 A64 Y65 M66V24-M62 HydrophobicContact CG1-SD 4.19Å; M28-M62 HydrophobicContact SD-CG 4.2Å; M28-M62 HydrophobicContact SD-SD 4.2Å; A58-M62 WeakPolarHBondContact O-CG 3.37Å; A58-M62 PolarHBondContact O-N 2.78Å; K60-M62 VanDerWaalsContact C-N 3.35Å; M62-A64 VanDerWaalsContact C-N 3.35Å; M62-A64 PolarHBondContact O-N 2.05Å; M62-Y65 HydrophobicContact CE-CD1 4.32Å; M62-Y65 PolarHBondContact O-N 3.3Å; M62-M66 WeakPolarHBondContact O-CB 3.36Å; M62-M66 VanDerWaalsContact O-CG 3.31Å; M62-M66 WeakPolarHBondContact O-CG 3.43Å; M62-M66 PolarHBondContact O-N 3.4Å
63Q98.4Very high97.1Very high69 Ų6985 Ų8532%0.32244%0.435SS..Hα-helixtrans-57.7-47.4172.4-74.9167.253.500111.5S59 K60 F61 Q67S59-Q63 VanDerWaalsContact O-CG 3.3Å; S59-Q63 WeakPolarHBondContact O-CG 3.43Å; S59-Q63 PolarHBondContact O-N 2.95Å; S59-Q63 VanDerWaalsContact O-N 3.09Å; S59-Q63 PolarHBondContact O-NE2 3.07Å; S59-Q63 PolarHBondContact OG-NE2 2.87Å; S59-Q63 VanDerWaalsContact OG-NE2 3.09Å; K60-Q63 PolarHBondContact O-N 2.99Å; F61-Q63 PolarHBondContact O-N 3.44Å; Q63-Q67 WeakPolarHBondContact O-CB 3.31Å; Q63-Q67 VanDerWaalsContact O-CG 3.25Å; Q63-Q67 WeakPolarHBondContact O-CG 3.22Å; Q63-Q67 PolarHBondContact O-N 3.43Å
64A97.9Very high96.8Very high48 Ų4886.1 Ų86.140%0.39744%0.44SS..Hα-helixtrans-64.6-45.9178.100000111.6K60 F61 M62 M66 Q67 T68K60-A64 WeakPolarHBondContact O-CB 3.37Å; K60-A64 PolarHBondContact O-N 2.9Å; F61-A64 PolarHBondContact O-N 3.23Å; M62-A64 VanDerWaalsContact C-N 3.35Å; M62-A64 PolarHBondContact O-N 2.05Å; A64-M66 PolarHBondContact O-N 3.35Å; A64-Q67 PolarHBondContact O-N 3.19Å; A64-T68 WeakPolarHBondContact O-CB 3.47Å; A64-T68 PolarHBondContact O-N 3.24Å; A64-T68 PolarHBondContact O-OG1 3.46Å; A64-T68 VanDerWaalsContact O-OG1 3.07Å
65Y97.1Very high96.5Very high78 Ų7887.7 Ų87.731%0.30645%0.447SS..Hα-helixtrans-57-47.4176.9173-103.2000112V24 F61 M62 T68 T69V24-Y65 HydrophobicContact CG1-CD1 4.48Å; V24-Y65 HydrophobicContact CG1-CG 4.48Å; V24-Y65 HydrophobicContact CG2-CD2 4.02Å; V24-Y65 HydrophobicContact CG2-CE1 4.13Å; V24-Y65 HydrophobicContact CG2-CE2 3.37Å; V24-Y65 VanDerWaalsContact CG2-CZ 3.43Å; F61-Y65 WeakPolarHBondContact O-CB 3.46Å; F61-Y65 PolarHBondContact O-N 3.49Å; M62-Y65 HydrophobicContact CE-CD1 4.32Å; M62-Y65 PolarHBondContact O-N 3.3Å; Y65-T68 PolarHBondContact O-N 3.19Å; Y65-T69 WeakPolarHBondContact O-CB 3.34Å; Y65-T69 PolarHBondContact O-N 3.09Å; Y65-T69 PolarHBondContact O-OG1 2.92Å
66M96.6Very high96.1Very high112 Ų11285.3 Ų85.355%0.55244%0.444SS*.Hα-helixtrans-64.2-42.3177.4-72.3-173.6-66.700112.3M62 A64 T69 K70M62-M66 WeakPolarHBondContact O-CB 3.36Å; M62-M66 VanDerWaalsContact O-CG 3.31Å; M62-M66 WeakPolarHBondContact O-CG 3.43Å; M62-M66 PolarHBondContact O-N 3.4Å; A64-M66 PolarHBondContact O-N 3.35Å; M66-T69 PolarHBondContact O-N 3.48Å; M66-K70 VanDerWaalsContact O-CB 3.26Å; M66-K70 WeakPolarHBondContact O-CB 3.47Å; M66-K70 PolarHBondContact O-N 3.31Å
67Q96.9Very high95.3Very high135 Ų13581.7 Ų81.763%0.63145%0.446SS*.Hα-helixtrans-64.6-44.7178.1-74.5175.93.900111.8Q63 A64 K70 K71Q63-Q67 WeakPolarHBondContact O-CB 3.31Å; Q63-Q67 VanDerWaalsContact O-CG 3.25Å; Q63-Q67 WeakPolarHBondContact O-CG 3.22Å; Q63-Q67 PolarHBondContact O-N 3.43Å; A64-Q67 PolarHBondContact O-N 3.19Å; Q67-K70 PolarHBondContact O-N 2.8Å; Q67-K71 WeakPolarHBondContact O-CB 3.46Å; Q67-K71 PolarHBondContact O-N 2.87Å
68T95.4Very high94Very high93 Ų9384.2 Ų84.257%0.57146%0.464SS*.Hα-helixtrans-62.3-46.7175.8-62.90000111A64 Y65 K70 K71 L72A64-T68 WeakPolarHBondContact O-CB 3.47Å; A64-T68 PolarHBondContact O-N 3.24Å; A64-T68 PolarHBondContact O-OG1 3.46Å; A64-T68 VanDerWaalsContact O-OG1 3.07Å; Y65-T68 PolarHBondContact O-N 3.19Å; T68-K70 PolarHBondContact O-N 2.74Å; T68-K71 PolarHBondContact O-N 2.93Å; T68-L72 WeakPolarHBondContact O-CB 3.25Å; T68-L72 PolarHBondContact O-N 2.78Å
69T93.8Very high92.1Very high55 Ų5587 Ų8734%0.33747%0.474SS..Hα-helixtrans-61.1-47.3178.5-570000110.8Y65 M66 K71 L72 S73Y65-T69 WeakPolarHBondContact O-CB 3.34Å; Y65-T69 PolarHBondContact O-N 3.09Å; Y65-T69 PolarHBondContact O-OG1 2.92Å; M66-T69 PolarHBondContact O-N 3.48Å; T69-K71 VanDerWaalsContact C-N 3.35Å; T69-K71 PolarHBondContact O-N 3.25Å; T69-L72 PolarHBondContact O-N 2.86Å; T69-S73 PolarHBondContact O-N 3.31Å; T69-S73 PolarHBondContact O-OG 3.16Å
70K95.5Very high90Very high153 Ų15389 Ų8967%0.66549%0.488SS*.Hα-helixtrans-57.5-47.4175.5-179.2176.8-178.2175.50111.5M66 Q67 T68 L72 S73 T74M66-K70 VanDerWaalsContact O-CB 3.26Å; M66-K70 WeakPolarHBondContact O-CB 3.47Å; M66-K70 PolarHBondContact O-N 3.31Å; Q67-K70 PolarHBondContact O-N 2.8Å; T68-K70 PolarHBondContact O-N 2.74Å; K70-L72 VanDerWaalsContact C-N 3.34Å; K70-L72 PolarHBondContact O-N 3.42Å; K70-S73 PolarHBondContact O-N 3.46Å; K70-T74 WeakPolarHBondContact O-CG2 3.04Å; K70-T74 PolarHBondContact O-N 3.1Å; K70-T74 PolarHBondContact O-OG1 3.23Å
71K94.7Very high87.8Confident127 Ų12791.1 Ų91.155%0.55250%0.497SS*.Hα-helixtrans-61.9-44.4179.2-177.760.3179.3176.40110.8Q67 T68 T69 S73 T74 M75Q67-K71 WeakPolarHBondContact O-CB 3.46Å; Q67-K71 PolarHBondContact O-N 2.87Å; T68-K71 PolarHBondContact O-N 2.93Å; T69-K71 VanDerWaalsContact C-N 3.35Å; T69-K71 PolarHBondContact O-N 3.25Å; K71-S73 PolarHBondContact O-N 3.29Å; K71-T74 WeakPolarHBondContact CA-OG1 3.3Å; K71-T74 PolarHBondContact O-N 3.2Å; K71-T74 PolarHBondContact O-OG1 3.38Å; K71-M75 HydrophobicContact CD-CG 4.41Å; K71-M75 HydrophobicContact CD-SD 4.43Å; K71-M75 HydrophobicContact CG-CE 4.07Å; K71-M75 HydrophobicContact CG-SD 4.23Å; K71-M75 WeakPolarHBondContact O-CG 3.09Å; K71-M75 PolarHBondContact O-N 3.49Å
72L93.7Very high85.8Confident107 Ų10794.6 Ų94.656%0.5652%0.521SS*.Hα-helixtrans-59.9-46.1176.6-176.360.1000111.9T68 T69 K70 T74 M75 A76T68-L72 WeakPolarHBondContact O-CB 3.25Å; T68-L72 PolarHBondContact O-N 2.78Å; T69-L72 PolarHBondContact O-N 2.86Å; K70-L72 VanDerWaalsContact C-N 3.34Å; K70-L72 PolarHBondContact O-N 3.42Å; L72-T74 VanDerWaalsContact C-N 3.32Å; L72-T74 PolarHBondContact O-N 3.46Å; L72-M75 HydrophobicContact CD1-CE 4.21Å; L72-M75 PolarHBondContact O-N 3.12Å; L72-M75 VanDerWaalsContact O-N 3.17Å; L72-A76 WeakPolarHBondContact O-CB 3.31Å; L72-A76 PolarHBondContact O-N 3.44Å
73S92.6Very high84Confident67 Ų6797.3 Ų97.347%0.46954%0.542SS..Hα-helixtrans-60.5-39.7175.5-53.60000112.6T69 K70 K71 S77T69-S73 PolarHBondContact O-N 3.31Å; T69-S73 PolarHBondContact O-OG 3.16Å; K70-S73 PolarHBondContact O-N 3.46Å; K71-S73 PolarHBondContact O-N 3.29Å; S73-S77 PolarHBondContact O-N 3.37Å; S73-S77 VanDerWaalsContact O-N 3.16Å; S73-S77 PolarHBondContact O-OG 3.29Å
74T93.1Very high81.7Confident67 Ų6799 Ų9941%0.41156%0.557SS.*Hα-helixtrans-66.6-38.2175.660.20000112.3K70 K71 L72 S77 S78K70-T74 WeakPolarHBondContact O-CG2 3.04Å; K70-T74 PolarHBondContact O-N 3.1Å; K70-T74 PolarHBondContact O-OG1 3.23Å; K71-T74 WeakPolarHBondContact CA-OG1 3.3Å; K71-T74 PolarHBondContact O-N 3.2Å; K71-T74 PolarHBondContact O-OG1 3.38Å; L72-T74 VanDerWaalsContact C-N 3.32Å; L72-T74 PolarHBondContact O-N 3.46Å; T74-S77 PolarHBondContact O-N 3.2Å; T74-S78 PolarHBondContact O-N 2.05Å; T74-S78 PolarHBondContact O-OG 3Å
75M91.9Very high79.3Confident76 Ų76100.2 Ų100.237%0.37457%0.574SS.*Hα-helixtrans-68.7-46177.6-69.5-176.2-53.200111.3K71 L72 S77 S78 D79K71-M75 HydrophobicContact CD-CG 4.41Å; K71-M75 HydrophobicContact CD-SD 4.43Å; K71-M75 HydrophobicContact CG-CE 4.07Å; K71-M75 HydrophobicContact CG-SD 4.23Å; K71-M75 WeakPolarHBondContact O-CG 3.09Å; K71-M75 PolarHBondContact O-N 3.49Å; L72-M75 HydrophobicContact CD1-CE 4.21Å; L72-M75 PolarHBondContact O-N 3.12Å; L72-M75 VanDerWaalsContact O-N 3.17Å; M75-S77 PolarHBondContact O-N 3.09Å; M75-S77 VanDerWaalsContact O-N 3.14Å; M75-S78 WeakPolarHBondContact CA-OG 3.49Å; M75-S78 CarbonylContact O-C 3.53Å; M75-S78 WeakPolarHBondContact O-CA 3.29Å; M75-S78 PolarHBondContact O-N 3.07Å; M75-S78 PolarHBondContact O-OG 3.24Å; M75-D79 PolarHBondContact O-N 2.97Å
76A88.8Confident77.2Confident69 Ų69107.8 Ų107.857%0.5762%0.62SS**Hα-helixtrans-58-31175.300000113L72L72-A76 WeakPolarHBondContact O-CB 3.31Å; L72-A76 PolarHBondContact O-N 3.44Å
77S83.3Confident76.2Confident102 Ų102107.6 Ų107.671%0.71362%0.623SS**Hα-helixtrans-80.2-18.2175.3-52.40000113.4S73 T74 M75S73-S77 PolarHBondContact O-N 3.37Å; S73-S77 VanDerWaalsContact O-N 3.16Å; S73-S77 PolarHBondContact O-OG 3.29Å; T74-S77 PolarHBondContact O-N 3.2Å; M75-S77 PolarHBondContact O-N 3.09Å; M75-S77 VanDerWaalsContact O-N 3.14Å
78S71.5Confident75.1Confident68 Ų68106.2 Ų106.248%0.47662%0.623SS.*Hα-helixtrans-105.5-13.6-178.239.50000114.3T74 M75 S80 K81T74-S78 PolarHBondContact O-N 2.05Å; T74-S78 PolarHBondContact O-OG 3Å; M75-S78 WeakPolarHBondContact CA-OG 3.49Å; M75-S78 CarbonylContact O-C 3.53Å; M75-S78 WeakPolarHBondContact O-CA 3.29Å; M75-S78 PolarHBondContact O-N 3.07Å; M75-S78 PolarHBondContact O-OG 3.24Å; S78-S80 PolarHBondContact O-N 3.13Å; S78-S80 VanDerWaalsContact O-N 3.1Å; S78-K81 PolarHBondContact O-N 3.2Å
79D59.3Low74Confident92 Ų92106.9 Ų106.949%0.49263%0.626SS.*THydrogen-bonded Turntrans-67-5.9178.1-87.2-35.6000115M75 K81M75-D79 PolarHBondContact O-N 2.97Å; D79-K81 PolarHBondContact O-N 3.12Å
80S53.7Low72.8Confident107 Ų107109.9 Ų109.975%0.74864%0.643SS**THydrogen-bonded Turntrans-63.1-14.1163.6-58.60000113.4S78S78-S80 PolarHBondContact O-N 3.13Å; S78-S80 VanDerWaalsContact O-N 3.1Å
81K51.9Low71.4Confident177 Ų177107.3 Ų107.377%0.7764%0.641SS**THydrogen-bonded Turntrans-106.9-19.2179.8-90.1-177.8177.3-75.20115.9S78 D79S78-K81 PolarHBondContact O-N 3.2Å; D79-K81 PolarHBondContact O-N 3.12Å
82V58.2Low69.9Low110 Ų110105.9 Ų105.967%0.66765%0.647SS**THydrogen-bonded Turntrans-85.5-26-176.5-177.80000112.1T84V82-T84 PolarHBondContact O-N 3.16Å
83V59.5Low68.2Low132 Ų132105.9 Ų105.980%0.865%0.653SS**SBendtrans-76.90.5179.6104.20000114.5
84T50.2Low66.3Low105 Ų105108.8 Ų108.864%0.64467%0.668SS**  trans-125.463.3168.760.60000109.1V82 N86V82-T84 PolarHBondContact O-N 3.16Å; T84-N86 PolarHBondContact O-N 2.92Å
85G48Very low64.1Low72 Ų72112.3 Ų112.374%0.74269%0.689SS**  trans-67.695.2164.100000109.9
86N52.3Low61.5Low238 Ų238115.6 Ų115.6100%1.27372%0.718SS**  trans-128.20156.3-108.341.8000107.7T84T84-N86 PolarHBondContact O-N 2.92Å

Retrieved 86 of 86 residues in 25.9 ms (Link to these results)