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Mitochondrial import inner membrane translocase subunit

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 A0A077ZJM3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 90 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
1M38.8Very low58.2Low232 Ų232130.8 Ų130.8100%1.14371%0.711SS**  070.90-85.4173.1169.400105.4
2D43.4Very low60.3Low162 Ų162133.3 Ų133.387%0.86671%0.71SS**  trans-136.972-161.6-58.8-85.3000109.1
3D50.9Low62.2Low125 Ų125126 Ų12667%0.66867%0.67SS**  trans-150.469.1167.8-167-116.1000110H6D3-H6 IonicContact OD2-ND1 3.99Å
4F54.2Low64.1Low204 Ų204123.2 Ų123.290%0.89566%0.655SS**  trans-139.619.6170.2-121.9-85.4000113
5S53Low65.8Low106 Ų106120.5 Ų120.574%0.74166%0.657SS**  trans-108.834.8-174.3-154.90000114.2
6H61.7Low67.4Low149 Ų149122.4 Ų122.469%0.6966%0.657SS**  trans-102.1-6176-82.796.1000114.6D3D3-H6 IonicContact OD2-ND1 3.99Å
7S60.8Low68.9Low100 Ų100121 Ų12170%0.69965%0.645SS**G310 helixtrans-77-24.5179.9-52.80000113.7D9S7-D9 PolarHBondContact O-N 3.47Å
8A59.6Low70.1Confident73 Ų73119.4 Ų119.460%0.60363%0.629SS**G310 helixtrans-77.1-17.1-173.300000114.3
9D67.9Low71.3Confident83 Ų83118.3 Ų118.344%0.44462%0.624SS.*G310 helixtrans-95.5-6.9-173.5-116.2-83.1000114.5S7 N11 K12S7-D9 PolarHBondContact O-N 3.47Å; D9-N11 PolarHBondContact O-N 3Å; D9-K12 PolarHBondContact O-N 2.91Å; D9-K12 IonicContact OD2-NZ 3.59Å
10M71Confident72.4Confident66 Ų66116.4 Ų116.433%0.32561%0.614SS.*THydrogen-bonded Turntrans-56.1-30.9176-71.6-61.8-67.100112.9M13 R18 L21M10-M13 HydrophobicContact CE-CE 3.72Å; M10-M13 HydrophobicContact SD-CE 3.41Å; M10-M13 WeakPolarHBondContact SD-CE 3.37Å; M10-M13 HydrophobicContact SD-SD 4.49Å; M10-R18 PolarHBondContact O-NE 2.88Å; M10-R18 PolarHBondContact O-NH2 3.19Å; M10-L21 HydrophobicContact CE-CD2 3.98Å; M10-L21 HydrophobicContact SD-CD2 3.23Å; M10-L21 WeakPolarHBondContact SD-CD2 3.34Å
11N79.1Confident73.4Confident139 Ų139113 Ų11374%0.74360%0.596SS**THydrogen-bonded Turntrans-78.8-16.4-179.2-77.9-35.1000115.2D9 R18D9-N11 PolarHBondContact O-N 3Å; N11-R18 VanDerWaalsContact CA-NH2 3.35Å; N11-R18 PolarHBondContact OD1-NH2 3.49Å
12K83.8Confident76Confident161 Ų161104.7 Ų104.770%0.756%0.558SS**THydrogen-bonded Turntrans-95.9-9.7179.8-62.7-179.4-168.6159.30113.6D9D9-K12 PolarHBondContact O-N 2.91Å; D9-K12 IonicContact OD2-NZ 3.59Å
13M84Confident78.4Confident38 Ų3899.7 Ų99.719%0.18753%0.533CS..SBendtrans-79.2142.3178.8-64.9-173.9-35.400111.4M10 Q17 R18 L21M10-M13 HydrophobicContact CE-CE 3.72Å; M10-M13 HydrophobicContact SD-CE 3.41Å; M10-M13 WeakPolarHBondContact SD-CE 3.37Å; M10-M13 HydrophobicContact SD-SD 4.49Å; M13-Q17 HydrophobicContact CB-CB 3.88Å; M13-Q17 HydrophobicContact CG-CB 4.34Å; M13-Q17 HydrophobicContact SD-CB 4.47Å; M13-R18 HydrophobicContact CB-CG 3.82Å; M13-R18 HydrophobicContact CE-CB 4.19Å; M13-R18 HydrophobicContact CE-CG 3.48Å; M13-R18 VanDerWaalsContact CE-CG 3.48Å; M13-L21 HydrophobicContact CE-CB 4.42Å; M13-L21 HydrophobicContact CE-CD2 3.75Å; M13-L21 HydrophobicContact SD-CD2 4.16Å
14D89.4Confident80.3Confident87 Ų87101.3 Ų101.347%0.46553%0.53SS..  trans-67.9167.2169.572.462.9000111.7K16 Q17 R18D14-K16 PolarHBondContact O-N 3.22Å; D14-K16 WeakPolarHBondContact OD1-CA 3.26Å; D14-K16 VanDerWaalsContact OD1-CB 3.26Å; D14-K16 WeakPolarHBondContact OD1-CB 3.31Å; D14-K16 PolarHBondContact OD1-N 2.78Å; D14-Q17 PolarHBondContact O-N 3.13Å; D14-Q17 PolarHBondContact OD1-N 3.26Å; D14-Q17 WeakPolarHBondContact OD2-CG 3.37Å; D14-Q17 PolarHBondContact OD2-OE1 2.87Å; D14-R18 WeakPolarHBondContact O-CG 3.47Å; D14-R18 PolarHBondContact O-N 3.29Å
15A89.7Confident82.2Confident83 Ų8395 Ų9569%0.68651%0.508SS*.Hα-helixtrans-58.7-33.7-175.800000113.4D19A15-D19 PolarHBondContact O-N 3.03Å; A15-D19 VanDerWaalsContact O-N 3.11Å
16K91.8Very high84.2Confident151 Ų15196.1 Ų96.166%0.65750%0.5SS*.Hα-helixtrans-73.7-45.4179.2-175.3-176.8177.1-177.30110.9D14 R18 D19 D20D14-K16 PolarHBondContact O-N 3.22Å; D14-K16 WeakPolarHBondContact OD1-CA 3.26Å; D14-K16 VanDerWaalsContact OD1-CB 3.26Å; D14-K16 WeakPolarHBondContact OD1-CB 3.31Å; D14-K16 PolarHBondContact OD1-N 2.78Å; K16-R18 PolarHBondContact O-N 3.47Å; K16-D19 PolarHBondContact O-N 2.86Å; K16-D20 PolarHBondContact O-N 3.34Å
17Q92.5Very high85.8Confident98 Ų9895.3 Ų95.346%0.45850%0.496SS..Hα-helixtrans-58.5-38174.9-70.8179.3-60.200112.2M13 D14 L21M13-Q17 HydrophobicContact CB-CB 3.88Å; M13-Q17 HydrophobicContact CG-CB 4.34Å; M13-Q17 HydrophobicContact SD-CB 4.47Å; D14-Q17 PolarHBondContact O-N 3.13Å; D14-Q17 PolarHBondContact OD1-N 3.26Å; D14-Q17 WeakPolarHBondContact OD2-CG 3.37Å; D14-Q17 PolarHBondContact OD2-OE1 2.87Å; Q17-L21 WeakPolarHBondContact O-CB 3.25Å; Q17-L21 PolarHBondContact O-N 2.9Å
18R91.5Very high87.3Confident92 Ų9297.2 Ų97.235%0.34749%0.494SS..Hα-helixtrans-64-47174.6-73.9171.2149.2-178.3-14.9112.5M10 N11 M13 D14 K16 L21 V22M10-R18 PolarHBondContact O-NE 2.88Å; M10-R18 PolarHBondContact O-NH2 3.19Å; N11-R18 VanDerWaalsContact CA-NH2 3.35Å; N11-R18 PolarHBondContact OD1-NH2 3.49Å; M13-R18 HydrophobicContact CB-CG 3.82Å; M13-R18 HydrophobicContact CE-CB 4.19Å; M13-R18 HydrophobicContact CE-CG 3.48Å; M13-R18 VanDerWaalsContact CE-CG 3.48Å; D14-R18 WeakPolarHBondContact O-CG 3.47Å; D14-R18 PolarHBondContact O-N 3.29Å; K16-R18 PolarHBondContact O-N 3.47Å; R18-L21 PolarHBondContact O-N 3.47Å; R18-V22 VanDerWaalsContact O-CG2 3.32Å; R18-V22 WeakPolarHBondContact O-CG2 3.31Å; R18-V22 PolarHBondContact O-N 2.86Å
19D92.5Very high89.1Confident99 Ų9997.1 Ų97.153%0.52949%0.486SS..Hα-helixtrans-64.9-44179.5-171.761.1000112.1A15 K16 L21 V22 T23A15-D19 PolarHBondContact O-N 3.03Å; A15-D19 VanDerWaalsContact O-N 3.11Å; K16-D19 PolarHBondContact O-N 2.86Å; D19-L21 VanDerWaalsContact C-N 3.32Å; D19-L21 PolarHBondContact O-N 3.47Å; D19-V22 PolarHBondContact O-N 3.15Å; D19-T23 WeakPolarHBondContact O-CB 3.02Å; D19-T23 PolarHBondContact O-N 3.39Å; D19-T23 PolarHBondContact O-OG1 3.45Å
20D93.1Very high90.3Very high80 Ų8097.6 Ų97.643%0.42849%0.491SS..Hα-helixtrans-58.5-44.6174.9-75.3-20.8000110.9K16 T23 R24K16-D20 PolarHBondContact O-N 3.34Å; D20-T23 PolarHBondContact O-N 3.33Å; D20-R24 WeakPolarHBondContact O-CG 3.25Å; D20-R24 PolarHBondContact O-N 3.36Å
21L92.4Very high91.5Very high46 Ų46100.1 Ų100.124%0.24151%0.506CS..Hα-helixtrans-65.8-46.3177.3-178.366.1000112.2M10 M13 Q17 R18 D19 T23 R24 V25M10-L21 HydrophobicContact CE-CD2 3.98Å; M10-L21 HydrophobicContact SD-CD2 3.23Å; M10-L21 WeakPolarHBondContact SD-CD2 3.34Å; M13-L21 HydrophobicContact CE-CB 4.42Å; M13-L21 HydrophobicContact CE-CD2 3.75Å; M13-L21 HydrophobicContact SD-CD2 4.16Å; Q17-L21 WeakPolarHBondContact O-CB 3.25Å; Q17-L21 PolarHBondContact O-N 2.9Å; R18-L21 PolarHBondContact O-N 3.47Å; D19-L21 VanDerWaalsContact C-N 3.32Å; D19-L21 PolarHBondContact O-N 3.47Å; L21-T23 PolarHBondContact O-N 3.38Å; L21-R24 PolarHBondContact O-N 3.19Å; L21-R24 VanDerWaalsContact O-N 3.15Å; L21-V25 HydrophobicContact CD1-CG2 4.28Å; L21-V25 HydrophobicContact CG-CG2 4.31Å; L21-V25 WeakPolarHBondContact O-CG2 3.27Å; L21-V25 PolarHBondContact O-N 2.04Å
22V93.3Very high92.3Very high57 Ų5795.9 Ų95.935%0.34549%0.49SS..Hα-helixtrans-58.2-40.1177.2167.10000110.5R18 D19 V25 K26R18-V22 VanDerWaalsContact O-CG2 3.32Å; R18-V22 WeakPolarHBondContact O-CG2 3.31Å; R18-V22 PolarHBondContact O-N 2.86Å; D19-V22 PolarHBondContact O-N 3.15Å; V22-V25 PolarHBondContact O-N 3.44Å; V22-K26 HydrophobicContact CG1-CD 4.09Å; V22-K26 HydrophobicContact CG1-CG 4.45Å; V22-K26 WeakPolarHBondContact O-CB 3.07Å; V22-K26 VanDerWaalsContact O-CG 3.29Å; V22-K26 WeakPolarHBondContact O-CG 3.18Å; V22-K26 PolarHBondContact O-N 2.95Å
23T94.3Very high92.8Very high57 Ų5792.5 Ų92.535%0.3548%0.48SS..Hα-helixtrans-63.1-45.8176.1-64.20000111.7D19 D20 L21 V25 K26 Q27D19-T23 WeakPolarHBondContact O-CB 3.02Å; D19-T23 PolarHBondContact O-N 3.39Å; D19-T23 PolarHBondContact O-OG1 3.45Å; D20-T23 PolarHBondContact O-N 3.33Å; L21-T23 PolarHBondContact O-N 3.38Å; T23-V25 PolarHBondContact O-N 3.42Å; T23-K26 PolarHBondContact O-N 3.22Å; T23-Q27 WeakPolarHBondContact O-CG 3.44Å; T23-Q27 PolarHBondContact O-N 2.82Å; T23-Q27 VanDerWaalsContact O-N 3.08Å
24R91.3Very high93.4Very high159 Ų15994.1 Ų94.160%0.649%0.491SS*.Hα-helixtrans-61.9-43.6175.1-70.3-159.7-61.1-127.93.7112.5D20 L21 K26 Q27 Q28D20-R24 WeakPolarHBondContact O-CG 3.25Å; D20-R24 PolarHBondContact O-N 3.36Å; L21-R24 PolarHBondContact O-N 3.19Å; L21-R24 VanDerWaalsContact O-N 3.15Å; R24-K26 PolarHBondContact O-N 3.48Å; R24-Q27 PolarHBondContact O-N 2.71Å; R24-Q28 PolarHBondContact O-N 3.43Å
25V94.9Very high93.8Very high70 Ų7095.3 Ų95.342%0.42449%0.494SS..Hα-helixtrans-61.5-45.2177.5171.10000110.5L21 V22 T23 Q27 Q28 V29L21-V25 HydrophobicContact CD1-CG2 4.28Å; L21-V25 HydrophobicContact CG-CG2 4.31Å; L21-V25 WeakPolarHBondContact O-CG2 3.27Å; L21-V25 PolarHBondContact O-N 2.04Å; V22-V25 PolarHBondContact O-N 3.44Å; T23-V25 PolarHBondContact O-N 3.42Å; V25-Q27 VanDerWaalsContact C-N 3.33Å; V25-Q27 PolarHBondContact O-N 3.42Å; V25-Q28 PolarHBondContact O-N 3.32Å; V25-V29 HydrophobicContact CG1-CG2 4.24Å; V25-V29 VanDerWaalsContact O-CG2 3.3Å; V25-V29 WeakPolarHBondContact O-CG2 3.26Å; V25-V29 PolarHBondContact O-N 3.39Å
26K94.3Very high94.1Very high131 Ų13196.7 Ų96.757%0.5749%0.486SS*.Hα-helixtrans-57.5-45.2176.3-76.5171.7178.9173.20112V22 T23 R24 V29 V30V22-K26 HydrophobicContact CG1-CD 4.09Å; V22-K26 HydrophobicContact CG1-CG 4.45Å; V22-K26 WeakPolarHBondContact O-CB 3.07Å; V22-K26 VanDerWaalsContact O-CG 3.29Å; V22-K26 WeakPolarHBondContact O-CG 3.18Å; V22-K26 PolarHBondContact O-N 2.95Å; T23-K26 PolarHBondContact O-N 3.22Å; R24-K26 PolarHBondContact O-N 3.48Å; K26-V29 PolarHBondContact O-N 2.88Å; K26-V30 WeakPolarHBondContact O-CG2 3.07Å; K26-V30 PolarHBondContact O-N 3.5Å
27Q94.3Very high94.4Very high131 Ų13192.6 Ų92.661%0.61247%0.471SS*.Hα-helixtrans-62.2-43.4177.6-71.4174.9-18.800111.9T23 R24 V25 V30 L31T23-Q27 WeakPolarHBondContact O-CG 3.44Å; T23-Q27 PolarHBondContact O-N 2.82Å; T23-Q27 VanDerWaalsContact O-N 3.08Å; R24-Q27 PolarHBondContact O-N 2.71Å; V25-Q27 VanDerWaalsContact C-N 3.33Å; V25-Q27 PolarHBondContact O-N 3.42Å; Q27-V30 PolarHBondContact O-N 2.92Å; Q27-L31 PolarHBondContact O-N 3.24Å
28Q94Very high94.6Very high140 Ų14092.8 Ų92.865%0.65448%0.475SS*.Hα-helixtrans-65.6-41.1178.7-171.6176.1300112.2R24 V25 L31 A32R24-Q28 PolarHBondContact O-N 3.43Å; V25-Q28 PolarHBondContact O-N 3.32Å; Q28-L31 PolarHBondContact O-N 2.84Å; Q28-A32 WeakPolarHBondContact O-CB 3.12Å; Q28-A32 PolarHBondContact O-N 3.21Å
29V95.6Very high94.9Very high71 Ų7194 Ų9443%0.4348%0.484SS..Hα-helixtrans-61.8-43.7175.7169.80000110.8V25 K26 L31 A32 N33V25-V29 HydrophobicContact CG1-CG2 4.24Å; V25-V29 VanDerWaalsContact O-CG2 3.3Å; V25-V29 WeakPolarHBondContact O-CG2 3.26Å; V25-V29 PolarHBondContact O-N 3.39Å; K26-V29 PolarHBondContact O-N 2.88Å; V29-L31 PolarHBondContact O-N 2.04Å; V29-A32 PolarHBondContact O-N 3.46Å; V29-N33 WeakPolarHBondContact O-CB 3.4Å; V29-N33 PolarHBondContact O-N 3.05Å; V29-N33 PolarHBondContact O-OD1 2.92Å
30V93.6Very high95.2Very high93 Ų9392 Ų9256%0.56447%0.474SS*.Hα-helixtrans-60.3-47176.4171.80000110.9K26 Q27 A32 N33 V34K26-V30 WeakPolarHBondContact O-CG2 3.07Å; K26-V30 PolarHBondContact O-N 3.5Å; Q27-V30 PolarHBondContact O-N 2.92Å; V30-A32 PolarHBondContact O-N 2.83Å; V30-N33 PolarHBondContact O-N 3.5Å; V30-V34 WeakPolarHBondContact O-CG2 3.07Å; V30-V34 PolarHBondContact O-N 2.99Å
31L95.6Very high95.4Very high120 Ų12089 Ų8963%0.62846%0.458SS*.Hα-helixtrans-61.8-45179-178.262.9000112Q27 Q28 V29 V34 Q35Q27-L31 PolarHBondContact O-N 3.24Å; Q28-L31 PolarHBondContact O-N 2.84Å; V29-L31 PolarHBondContact O-N 2.04Å; L31-V34 PolarHBondContact O-N 3.47Å; L31-Q35 WeakPolarHBondContact O-CB 3.28Å; L31-Q35 PolarHBondContact O-N 3.01Å
32A96.3Very high95.7Very high50 Ų5089.7 Ų89.741%0.41347%0.466SS..Hα-helixtrans-61.5-44.2177.800000111.7Q28 V29 V30 V34 Q35 E36Q28-A32 WeakPolarHBondContact O-CB 3.12Å; Q28-A32 PolarHBondContact O-N 3.21Å; V29-A32 PolarHBondContact O-N 3.46Å; V30-A32 PolarHBondContact O-N 2.83Å; A32-V34 VanDerWaalsContact C-N 3.35Å; A32-V34 PolarHBondContact O-N 2.92Å; A32-Q35 WeakPolarHBondContact O-CB 3.15Å; A32-Q35 PolarHBondContact O-N 2.94Å; A32-E36 PolarHBondContact O-N 3.35Å
33N95.1Very high95.9Very high90 Ų9090.6 Ų90.648%0.48147%0.469SS..Hα-helixtrans-64.1-39.1178.1-69.4-1.5000112V29 V30 L37V29-N33 WeakPolarHBondContact O-CB 3.4Å; V29-N33 PolarHBondContact O-N 3.05Å; V29-N33 PolarHBondContact O-OD1 2.92Å; V30-N33 PolarHBondContact O-N 3.5Å; N33-L37 WeakPolarHBondContact O-CB 3.34Å; N33-L37 PolarHBondContact O-N 3.32Å
34V96.1Very high96.1Very high72 Ų7292.7 Ų92.744%0.43647%0.473SS..Hα-helixtrans-65.3-42.4174.9171.80000110.7V30 L31 A32 L37 L38V30-V34 WeakPolarHBondContact O-CG2 3.07Å; V30-V34 PolarHBondContact O-N 2.99Å; L31-V34 PolarHBondContact O-N 3.47Å; A32-V34 VanDerWaalsContact C-N 3.35Å; A32-V34 PolarHBondContact O-N 2.92Å; V34-L37 PolarHBondContact O-N 2.69Å; V34-L38 HydrophobicContact CG1-CD1 4.14Å; V34-L38 HydrophobicContact CG1-CG 4.48Å; V34-L38 WeakPolarHBondContact O-CG 3.46Å; V34-L38 PolarHBondContact O-N 2.89Å
35Q97.6Very high96.4Very high112 Ų11285.2 Ų85.252%0.52345%0.446SS..Hα-helixtrans-62.3-44.7176.9-176.7175.1-4.600111.8L31 A32 L37 L38 Q39L31-Q35 WeakPolarHBondContact O-CB 3.28Å; L31-Q35 PolarHBondContact O-N 3.01Å; A32-Q35 WeakPolarHBondContact O-CB 3.15Å; A32-Q35 PolarHBondContact O-N 2.94Å; Q35-L37 VanDerWaalsContact C-N 3.35Å; Q35-L38 PolarHBondContact O-N 3.48Å; Q35-Q39 WeakPolarHBondContact O-CG 3.05Å; Q35-Q39 PolarHBondContact O-N 2.71Å
36E97.3Very high96.6Very high111 Ų11185.9 Ų85.952%0.51945%0.446SS..Hα-helixtrans-62.6-41.5175.5-179.7177.1-150.700111.7A32 L38 Q39 N40A32-E36 PolarHBondContact O-N 3.35Å; E36-L38 PolarHBondContact O-N 3.32Å; E36-Q39 PolarHBondContact O-N 3.06Å; E36-N40 WeakPolarHBondContact CG-ND2 3.3Å; E36-N40 WeakPolarHBondContact O-CB 3.32Å; E36-N40 PolarHBondContact O-N 3.32Å; E36-N40 PolarHBondContact O-ND2 3.33Å
37L96.6Very high96.7Very high65 Ų6586.8 Ų86.834%0.3445%0.45SS..Hα-helixtrans-59.7-47.7175.4178.863.9000111.2N33 V34 Q35 Q39 N40 I41 Y72N33-L37 WeakPolarHBondContact O-CB 3.34Å; N33-L37 PolarHBondContact O-N 3.32Å; V34-L37 PolarHBondContact O-N 2.69Å; Q35-L37 VanDerWaalsContact C-N 3.35Å; L37-Q39 PolarHBondContact O-N 3.45Å; L37-N40 PolarHBondContact O-N 3.22Å; L37-I41 HydrophobicContact CD1-CD1 3.97Å; L37-I41 HydrophobicContact CD1-CG1 4.33Å; L37-I41 HydrophobicContact CG-CD1 3.87Å; L37-I41 WeakPolarHBondContact O-CB 3.4Å; L37-I41 VanDerWaalsContact O-CG1 3.31Å; L37-I41 WeakPolarHBondContact O-CG1 3.19Å; L37-I41 PolarHBondContact O-N 2.93Å; L37-Y72 HydrophobicContact CD1-CD1 4.44Å; L37-Y72 HydrophobicContact CD1-CE1 3.9Å
38L97.7Very high96.9Very high102 Ų10286 Ų8653%0.53445%0.449SS..Hα-helixtrans-62.6-40.6178.1-71.9172.6000112.2V34 Q35 E36 S42V34-L38 HydrophobicContact CG1-CD1 4.14Å; V34-L38 HydrophobicContact CG1-CG 4.48Å; V34-L38 WeakPolarHBondContact O-CG 3.46Å; V34-L38 PolarHBondContact O-N 2.89Å; Q35-L38 PolarHBondContact O-N 3.48Å; E36-L38 PolarHBondContact O-N 3.32Å; L38-S42 VanDerWaalsContact O-CB 3.28Å; L38-S42 WeakPolarHBondContact O-CB 3.34Å; L38-S42 PolarHBondContact O-N 2.78Å; L38-S42 PolarHBondContact O-OG 3.5Å
39Q98.1Very high97.1Very high117 Ų11779.7 Ų79.755%0.54742%0.421SS..Hα-helixtrans-62.4-46.7175.4-75.6176.6-5.900111.5Q35 E36 L37 S42 D43Q35-Q39 WeakPolarHBondContact O-CG 3.05Å; Q35-Q39 PolarHBondContact O-N 2.71Å; E36-Q39 PolarHBondContact O-N 3.06Å; L37-Q39 PolarHBondContact O-N 3.45Å; Q39-S42 PolarHBondContact O-N 2.96Å; Q39-D43 WeakPolarHBondContact O-CB 3.28Å; Q39-D43 PolarHBondContact O-N 2.92Å
40N98Very high97.2Very high58 Ų5878 Ų7831%0.3141%0.409SS..Hα-helixtrans-64.3-43.1179-80.6-51.5000112.9E36 L37 S42 K44 Y72E36-N40 WeakPolarHBondContact CG-ND2 3.3Å; E36-N40 WeakPolarHBondContact O-CB 3.32Å; E36-N40 PolarHBondContact O-N 3.32Å; E36-N40 PolarHBondContact O-ND2 3.33Å; L37-N40 PolarHBondContact O-N 3.22Å; N40-S42 VanDerWaalsContact C-N 3.35Å; N40-K44 WeakPolarHBondContact O-CB 3.29Å; N40-K44 WeakPolarHBondContact O-CG 3.32Å; N40-K44 PolarHBondContact O-N 3.02Å; N40-Y72 WeakPolarHBondContact CB-OH 3Å
41I98.1Very high97.3Very high17 Ų1782.8 Ų82.89%0.08742%0.422CS..Hα-helixtrans-59.9-48.9174.4-74.1169.8000109.8L37 D43 K44 C45 V69 Y72 I73L37-I41 HydrophobicContact CD1-CD1 3.97Å; L37-I41 HydrophobicContact CD1-CG1 4.33Å; L37-I41 HydrophobicContact CG-CD1 3.87Å; L37-I41 WeakPolarHBondContact O-CB 3.4Å; L37-I41 VanDerWaalsContact O-CG1 3.31Å; L37-I41 WeakPolarHBondContact O-CG1 3.19Å; L37-I41 PolarHBondContact O-N 2.93Å; I41-D43 PolarHBondContact O-N 2.93Å; I41-K44 PolarHBondContact O-N 3.32Å; I41-C45 WeakPolarHBondContact O-CB 3.17Å; I41-C45 PolarHBondContact O-N 2.95Å; I41-C45 PolarHBondContact O-SG 3.31Å; I41-V69 HydrophobicContact CG2-CB 4.47Å; I41-V69 HydrophobicContact CG2-CG1 4.44Å; I41-V69 HydrophobicContact CG2-CG2 3.69Å; I41-Y72 HydrophobicContact CB-CD1 4.5Å; I41-Y72 HydrophobicContact CD1-CD1 3.96Å; I41-Y72 HydrophobicContact CD1-CE1 4.4Å; I41-Y72 HydrophobicContact CG1-CD1 3.25Å; I41-Y72 HydrophobicContact CG1-CE1 3.56Å; I41-Y72 HydrophobicContact CG1-CG 4Å; I41-I73 HydrophobicContact CD1-CD1 4.42Å; I41-I73 HydrophobicContact CD1-CG1 4.12Å
42S97.7Very high97.2Very high60 Ų6085.2 Ų85.242%0.4243%0.428SS..Hα-helixtrans-59.6-50.7-179.4-59.60000110.8L38 Q39 N40 K44 L46L38-S42 VanDerWaalsContact O-CB 3.28Å; L38-S42 WeakPolarHBondContact O-CB 3.34Å; L38-S42 PolarHBondContact O-N 2.78Å; L38-S42 PolarHBondContact O-OG 3.5Å; Q39-S42 PolarHBondContact O-N 2.96Å; N40-S42 VanDerWaalsContact C-N 3.35Å; S42-K44 PolarHBondContact O-N 3.45Å; S42-L46 WeakPolarHBondContact O-CB 3.46Å; S42-L46 WeakPolarHBondContact O-CD1 3.33Å; S42-L46 WeakPolarHBondContact O-CG 3.24Å; S42-L46 PolarHBondContact O-N 3.01Å
43D97.8Very high97.1Very high76 Ų7688.2 Ų88.241%0.40644%0.443SS..Hα-helixtrans-58.9-48.5-179-174.153.2000111.9Q39 I41 K47Q39-D43 WeakPolarHBondContact O-CB 3.28Å; Q39-D43 PolarHBondContact O-N 2.92Å; I41-D43 PolarHBondContact O-N 2.93Å; D43-K47 VanDerWaalsContact O-CB 3.3Å; D43-K47 WeakPolarHBondContact O-CB 2.95Å; D43-K47 VanDerWaalsContact O-CD 3.32Å; D43-K47 WeakPolarHBondContact O-CD 3.5Å; D43-K47 WeakPolarHBondContact O-CG 3.42Å; D43-K47 PolarHBondContact O-N 3.25Å; D43-K47 WeakPolarHBondContact OD1-CE 3.34Å; D43-K47 IonicContact OD1-NZ 2.78Å; D43-K47 PolarHBondContact OD1-NZ 3.41Å; D43-K47 IonicContact OD2-NZ 2.69Å; D43-K47 PolarHBondContact OD2-NZ 2.99Å
44K98.1Very high97Very high102 Ų10286.8 Ų86.844%0.44345%0.45SS..Hα-helixtrans-72.8-46.5-176.3-68.1172.4-170.6-61.90112.4N40 I41 S42 L48 Y72N40-K44 WeakPolarHBondContact O-CB 3.29Å; N40-K44 WeakPolarHBondContact O-CG 3.32Å; N40-K44 PolarHBondContact O-N 3.02Å; I41-K44 PolarHBondContact O-N 3.32Å; S42-K44 PolarHBondContact O-N 3.45Å; K44-L48 WeakPolarHBondContact O-CB 3.5Å; K44-L48 PolarHBondContact O-N 3Å; K44-Y72 HydrophobicContact CD-CD2 3.96Å; K44-Y72 HydrophobicContact CD-CE2 3.21Å
45C98.6Very high97Very high2 Ų293.8 Ų93.81%0.01447%0.474CS..Hα-helixtrans-73.9-35.1-175.9-67.30000112.4I41 L48 C49 L65 C68I41-C45 WeakPolarHBondContact O-CB 3.17Å; I41-C45 PolarHBondContact O-N 2.95Å; I41-C45 PolarHBondContact O-SG 3.31Å; C45-L48 PolarHBondContact O-N 3.38Å; C45-C49 WeakPolarHBondContact O-CB 3.42Å; C45-C49 PolarHBondContact O-N 2.94Å; C45-C49 PolarHBondContact O-SG 3.34Å; C45-L65 HydrophobicContact CB-CD2 3.87Å; C45-C68 WeakPolarHBondContact CA-SG 3.33Å; C45-C68 HydrophobicContact CB-CB 3.75Å; C45-C68 WeakPolarHBondContact CB-SG 3.44Å; C45-C68 WeakPolarHBondContact SG-CB 3.31Å; C45-C68 CovalentContact SG-SG 2.04Å; C45-C68 PolarHBondContact SG-SG 2.85Å
46L97.8Very high96.9Very high84 Ų8493.9 Ų93.944%0.4448%0.483SS..Hα-helixtrans-67.4-44.9174.7-65.2171.9000111.2S42 L48 C49 I50 L65S42-L46 WeakPolarHBondContact O-CB 3.46Å; S42-L46 WeakPolarHBondContact O-CD1 3.33Å; S42-L46 WeakPolarHBondContact O-CG 3.24Å; S42-L46 PolarHBondContact O-N 3.01Å; L46-L48 PolarHBondContact O-N 3.3Å; L46-C49 PolarHBondContact O-N 3.35Å; L46-I50 HydrophobicContact CB-CG1 4.37Å; L46-I50 HydrophobicContact CD2-CG1 3.76Å; L46-I50 WeakPolarHBondContact O-CB 3.38Å; L46-I50 PolarHBondContact O-N 3.08Å; L46-L65 HydrophobicContact CD2-CD2 4.14Å
47K97.7Very high96.9Very high149 Ų14992.3 Ų92.365%0.64848%0.477SS*.Hα-helixtrans-59-36.6174.9-76.1172.4179.41630112.7D43D43-K47 VanDerWaalsContact O-CB 3.3Å; D43-K47 WeakPolarHBondContact O-CB 2.95Å; D43-K47 VanDerWaalsContact O-CD 3.32Å; D43-K47 WeakPolarHBondContact O-CD 3.5Å; D43-K47 WeakPolarHBondContact O-CG 3.42Å; D43-K47 PolarHBondContact O-N 3.25Å; D43-K47 WeakPolarHBondContact OD1-CE 3.34Å; D43-K47 IonicContact OD1-NZ 2.78Å; D43-K47 PolarHBondContact OD1-NZ 3.41Å; D43-K47 IonicContact OD2-NZ 2.69Å; D43-K47 PolarHBondContact OD2-NZ 2.99Å
48L98.1Very high96.8Very high114 Ų11493 Ų9360%0.59748%0.482SS*.Hα-helixtrans-76.9-43.6-179.6-176.466000112.6K44 C45 L46K44-L48 WeakPolarHBondContact O-CB 3.5Å; K44-L48 PolarHBondContact O-N 3Å; C45-L48 PolarHBondContact O-N 3.38Å; L46-L48 PolarHBondContact O-N 3.3Å
49C98.5Very high96.8Very high8 Ų890.7 Ų90.75%0.05448%0.482CS..Hα-helixtrans-97.5-31.4-166.7-660000114.1C45 L46 K51 C64 L65C45-C49 WeakPolarHBondContact O-CB 3.42Å; C45-C49 PolarHBondContact O-N 2.94Å; C45-C49 PolarHBondContact O-SG 3.34Å; L46-C49 PolarHBondContact O-N 3.35Å; C49-K51 PolarHBondContact O-N 2.99Å; C49-C64 WeakPolarHBondContact CA-SG 3.39Å; C49-C64 HydrophobicContact CB-CB 3.61Å; C49-C64 WeakPolarHBondContact CB-SG 3.46Å; C49-C64 WeakPolarHBondContact SG-CB 3.27Å; C49-C64 PolarHBondContact SG-O 2.66Å; C49-C64 VanDerWaalsContact SG-O 3.38Å; C49-C64 CovalentContact SG-SG 2.04Å; C49-C64 PolarHBondContact SG-SG 3.35Å; C49-L65 HydrophobicContact CB-CD2 3.83Å; C49-L65 HydrophobicContact CB-CG 3.97Å; C49-L65 PolarHBondContact SG-N 3.5Å
50I97.9Very high96.8Very high37 Ų3789.4 Ų89.419%0.1949%0.486CS..  trans-93.493.2-175.7-50.7-53.3000109.6L46 P53 L57 E61 L65L46-I50 HydrophobicContact CB-CG1 4.37Å; L46-I50 HydrophobicContact CD2-CG1 3.76Å; L46-I50 WeakPolarHBondContact O-CB 3.38Å; L46-I50 PolarHBondContact O-N 3.08Å; I50-P53 HydrophobicContact CG2-CG 4.39Å; I50-L57 HydrophobicContact CD1-CD2 3.4Å; I50-L57 HydrophobicContact CG1-CD2 4.5Å; I50-E61 HydrophobicContact CD1-CB 3.86Å; I50-E61 HydrophobicContact CD1-CG 3.97Å; I50-L65 HydrophobicContact CD1-CD1 4.2Å
51K94.9Very high96.8Very high192 Ų19287.3 Ų87.384%0.83548%0.475SS*.SBendtrans-85.8-29.1178.8-63.1-178.7-1781780112.5C49C49-K51 PolarHBondContact O-N 2.99Å
52K93.1Very high96.8Very high172 Ų17292 Ų9275%0.74850%0.496SS*.SBendtrans-13196.2178.3-177-175.9175-177.80109.1G54K52-G54 PolarHBondContact O-N 3.21Å
53P94.5Very high96.8Very high112 Ų11295.4 Ų95.473%0.72750%0.503SS*.  trans-53.5129.5175.5-2634.8000111.5I50I50-P53 HydrophobicContact CG2-CG 4.39Å
54G93.5Very high96.8Very high61 Ų6193.8 Ų93.863%0.62950%0.498SS*.  trans-142.9178.6-17800000111.7K52 T56K52-G54 PolarHBondContact O-N 3.21Å; G54-T56 PolarHBondContact O-N 3.05Å
55K95.5Very high96.9Very high219 Ų21990.4 Ų90.495%0.95248%0.484SS*.SBendtrans-74.1-18.2175.9-64.6-177.3179.2-178.60112.8
56T96.1Very high96.9Very high114 Ų11493.6 Ų93.670%0.69951%0.507SS*.SBendtrans-141149.3-175.655.50000108.8G54G54-T56 PolarHBondContact O-N 3.05Å
57L96.3Very high96.9Very high77 Ų7796.2 Ų96.240%0.40351%0.511SS..  trans-78.2129168.9-60.1174.1000109.1I50 E61 Q62 L65I50-L57 HydrophobicContact CD1-CD2 3.4Å; I50-L57 HydrophobicContact CG1-CD2 4.5Å; L57-E61 WeakPolarHBondContact CA-OE2 3.34Å; L57-E61 HydrophobicContact CB-CB 4.36Å; L57-E61 HydrophobicContact CD2-CB 4.34Å; L57-Q62 HydrophobicContact CB-CG 3.65Å; L57-Q62 HydrophobicContact CD1-CG 4.33Å; L57-L65 HydrophobicContact CD1-CD1 3.7Å; L57-L65 HydrophobicContact CD2-CD1 4.16Å
58D95.9Very high97Very high81 Ų8190 Ų9043%0.43349%0.486SS..  trans-75.3168.217077.441.2000111.7S60 E61 Q62D58-S60 PolarHBondContact O-N 3.29Å; D58-S60 VanDerWaalsContact OD1-CA 3.31Å; D58-S60 WeakPolarHBondContact OD1-CA 3.44Å; D58-S60 VanDerWaalsContact OD1-CB 3.26Å; D58-S60 WeakPolarHBondContact OD1-CB 3.24Å; D58-S60 PolarHBondContact OD1-N 3.49Å; D58-E61 PolarHBondContact N-OE2 3.36Å; D58-E61 PolarHBondContact O-N 3.39Å; D58-E61 PolarHBondContact OD1-N 3.41Å; D58-Q62 WeakPolarHBondContact O-CG 3.5Å; D58-Q62 PolarHBondContact O-N 3.04Å
59G97.1Very high97Very high53 Ų5386.7 Ų86.755%0.54647%0.471SS..Hα-helixtrans-61.9-27.9-177.100000114.1K63G59-K63 VanDerWaalsContact O-CB 3.25Å; G59-K63 WeakPolarHBondContact O-CB 3.37Å; G59-K63 PolarHBondContact O-N 3.49Å; G59-K63 VanDerWaalsContact O-N 3.13Å
60S97.3Very high97Very high90 Ų9090.3 Ų90.363%0.62949%0.49SS*.Hα-helixtrans-75.9-41.1176.5-55.30000111D58 K63 C64D58-S60 PolarHBondContact O-N 3.29Å; D58-S60 VanDerWaalsContact OD1-CA 3.31Å; D58-S60 WeakPolarHBondContact OD1-CA 3.44Å; D58-S60 VanDerWaalsContact OD1-CB 3.26Å; D58-S60 WeakPolarHBondContact OD1-CB 3.24Å; D58-S60 PolarHBondContact OD1-N 3.49Å; S60-K63 PolarHBondContact O-N 3.39Å; S60-C64 VanDerWaalsContact O-CB 3.27Å; S60-C64 WeakPolarHBondContact O-CB 3.43Å; S60-C64 PolarHBondContact O-N 2.9Å
61E98Very high97Very high14 Ų1495.6 Ų95.67%0.06551%0.507CS..Hα-helixtrans-62.9-47174.7-68.3179143.700111.2I50 L57 D58 K63 C64 L65I50-E61 HydrophobicContact CD1-CB 3.86Å; I50-E61 HydrophobicContact CD1-CG 3.97Å; L57-E61 WeakPolarHBondContact CA-OE2 3.34Å; L57-E61 HydrophobicContact CB-CB 4.36Å; L57-E61 HydrophobicContact CD2-CB 4.34Å; D58-E61 PolarHBondContact N-OE2 3.36Å; D58-E61 PolarHBondContact O-N 3.39Å; D58-E61 PolarHBondContact OD1-N 3.41Å; E61-K63 PolarHBondContact O-N 3.47Å; E61-C64 PolarHBondContact O-N 3.32Å; E61-L65 WeakPolarHBondContact O-CB 3.42Å; E61-L65 VanDerWaalsContact O-CG 3.31Å; E61-L65 WeakPolarHBondContact O-CG 3.35Å; E61-L65 PolarHBondContact O-N 3.36Å
62Q98Very high97.2Very high114 Ų11488.2 Ų88.253%0.53348%0.475SS..Hα-helixtrans-58.4-48.2176.1-71.4179.6-30.800111.9L57 D58 L65 S66L57-Q62 HydrophobicContact CB-CG 3.65Å; L57-Q62 HydrophobicContact CD1-CG 4.33Å; D58-Q62 WeakPolarHBondContact O-CG 3.5Å; D58-Q62 PolarHBondContact O-N 3.04Å; Q62-L65 PolarHBondContact O-N 3.26Å; Q62-S66 PolarHBondContact O-N 2.92Å
63K98.5Very high97.4Very high132 Ų13283.3 Ų83.357%0.57446%0.456SS*.Hα-helixtrans-61.9-44.6177.9-177.1171.4-178.7177.20111.4G59 S60 E61 S66 Y67G59-K63 VanDerWaalsContact O-CB 3.25Å; G59-K63 WeakPolarHBondContact O-CB 3.37Å; G59-K63 PolarHBondContact O-N 3.49Å; G59-K63 VanDerWaalsContact O-N 3.13Å; S60-K63 PolarHBondContact O-N 3.39Å; E61-K63 PolarHBondContact O-N 3.47Å; K63-S66 PolarHBondContact O-N 3.47Å; K63-Y67 HydrophobicContact CD-CE2 4.11Å; K63-Y67 HydrophobicContact CG-CD2 3.87Å; K63-Y67 HydrophobicContact CG-CE2 3.44Å; K63-Y67 VanDerWaalsContact CG-CE2 3.44Å; K63-Y67 WeakPolarHBondContact O-CD2 3.37Å; K63-Y67 PolarHBondContact O-N 3.44Å
64C98.7Very high97.6Very high43 Ų4382.8 Ų82.829%0.29144%0.443SS..Hα-helixtrans-60.3-46.5176.4-178.50000111.7C49 S60 E61 S66 Y67 C68C49-C64 WeakPolarHBondContact CA-SG 3.39Å; C49-C64 HydrophobicContact CB-CB 3.61Å; C49-C64 WeakPolarHBondContact CB-SG 3.46Å; C49-C64 WeakPolarHBondContact SG-CB 3.27Å; C49-C64 PolarHBondContact SG-O 2.66Å; C49-C64 VanDerWaalsContact SG-O 3.38Å; C49-C64 CovalentContact SG-SG 2.04Å; C49-C64 PolarHBondContact SG-SG 3.35Å; S60-C64 VanDerWaalsContact O-CB 3.27Å; S60-C64 WeakPolarHBondContact O-CB 3.43Å; S60-C64 PolarHBondContact O-N 2.9Å; E61-C64 PolarHBondContact O-N 3.32Å; C64-S66 PolarHBondContact O-N 2.89Å; C64-Y67 PolarHBondContact O-N 2.89Å; C64-C68 VanDerWaalsContact O-CB 3.26Å; C64-C68 WeakPolarHBondContact O-CB 3.47Å; C64-C68 PolarHBondContact O-N 3.36Å
65L98.5Very high97.8Very high31 Ų3183 Ų8316%0.16243%0.433CS..Hα-helixtrans-60.9-45.3179.5-73.7172.4000111.6C45 L46 C49 I50 L57 E61 Q62 Y67 C68 V69C45-L65 HydrophobicContact CB-CD2 3.87Å; L46-L65 HydrophobicContact CD2-CD2 4.14Å; C49-L65 HydrophobicContact CB-CD2 3.83Å; C49-L65 HydrophobicContact CB-CG 3.97Å; C49-L65 PolarHBondContact SG-N 3.5Å; I50-L65 HydrophobicContact CD1-CD1 4.2Å; L57-L65 HydrophobicContact CD1-CD1 3.7Å; L57-L65 HydrophobicContact CD2-CD1 4.16Å; E61-L65 WeakPolarHBondContact O-CB 3.42Å; E61-L65 VanDerWaalsContact O-CG 3.31Å; E61-L65 WeakPolarHBondContact O-CG 3.35Å; E61-L65 PolarHBondContact O-N 3.36Å; Q62-L65 PolarHBondContact O-N 3.26Å; L65-Y67 PolarHBondContact O-N 3.03Å; L65-C68 PolarHBondContact O-N 3.4Å; L65-V69 VanDerWaalsContact O-CG2 3.25Å; L65-V69 WeakPolarHBondContact O-CG2 3.22Å; L65-V69 PolarHBondContact O-N 2.88Å
66S98.5Very high97.9Very high69 Ų6976.4 Ų76.448%0.48341%0.406SS..Hα-helixtrans-54.7-53.4176.4-169.80000111.3Q62 K63 C64 C68 V69 D70Q62-S66 PolarHBondContact O-N 2.92Å; K63-S66 PolarHBondContact O-N 3.47Å; C64-S66 PolarHBondContact O-N 2.89Å; S66-C68 VanDerWaalsContact C-N 3.34Å; S66-C68 PolarHBondContact O-N 3.29Å; S66-V69 PolarHBondContact O-N 3.48Å; S66-D70 PolarHBondContact O-N 2.95Å; S66-D70 VanDerWaalsContact O-N 3.15Å
67Y98.6Very high98Very high138 Ų13876 Ų7654%0.54140%0.4SS..Hα-helixtrans-64.8-37.9178.7-71.2-60000113.1K63 C64 L65 D70 R71K63-Y67 HydrophobicContact CD-CE2 4.11Å; K63-Y67 HydrophobicContact CG-CD2 3.87Å; K63-Y67 HydrophobicContact CG-CE2 3.44Å; K63-Y67 VanDerWaalsContact CG-CE2 3.44Å; K63-Y67 WeakPolarHBondContact O-CD2 3.37Å; K63-Y67 PolarHBondContact O-N 3.44Å; C64-Y67 PolarHBondContact O-N 2.89Å; L65-Y67 PolarHBondContact O-N 3.03Å; Y67-D70 PolarHBondContact O-N 2.86Å; Y67-R71 VanDerWaalsContact O-CB 3.28Å; Y67-R71 WeakPolarHBondContact O-CB 3.3Å; Y67-R71 VanDerWaalsContact O-CG 3.24Å; Y67-R71 WeakPolarHBondContact O-CG 3.29Å; Y67-R71 PolarHBondContact O-N 2.9Å
68C98.8Very high98.1Very high18 Ų1877.8 Ų77.812%0.12241%0.409CS..Hα-helixtrans-62.7-44.6179.8-179.80000111.1C45 C64 L65 S66 Y72C45-C68 WeakPolarHBondContact CA-SG 3.33Å; C45-C68 HydrophobicContact CB-CB 3.75Å; C45-C68 WeakPolarHBondContact CB-SG 3.44Å; C45-C68 WeakPolarHBondContact SG-CB 3.31Å; C45-C68 CovalentContact SG-SG 2.04Å; C45-C68 PolarHBondContact SG-SG 2.85Å; C64-C68 VanDerWaalsContact O-CB 3.26Å; C64-C68 WeakPolarHBondContact O-CB 3.47Å; C64-C68 PolarHBondContact O-N 3.36Å; L65-C68 PolarHBondContact O-N 3.4Å; S66-C68 VanDerWaalsContact C-N 3.34Å; S66-C68 PolarHBondContact O-N 3.29Å; C68-Y72 WeakPolarHBondContact O-CB 3.47Å; C68-Y72 PolarHBondContact O-N 2.94Å
69V98.5Very high98.2Very high46 Ų4678 Ų7828%0.27941%0.414SS..Hα-helixtrans-61.9-49.7177.7174.60000110.6I41 L65 S66 R71 Y72 I73I41-V69 HydrophobicContact CG2-CB 4.47Å; I41-V69 HydrophobicContact CG2-CG1 4.44Å; I41-V69 HydrophobicContact CG2-CG2 3.69Å; L65-V69 VanDerWaalsContact O-CG2 3.25Å; L65-V69 WeakPolarHBondContact O-CG2 3.22Å; L65-V69 PolarHBondContact O-N 2.88Å; S66-V69 PolarHBondContact O-N 3.48Å; V69-R71 PolarHBondContact O-N 3.15Å; V69-Y72 PolarHBondContact O-N 3.01Å; V69-I73 HydrophobicContact CG1-CD1 3.84Å; V69-I73 WeakPolarHBondContact O-CG1 3.29Å; V69-I73 PolarHBondContact O-N 3.33Å
70D98.6Very high98.1Very high83 Ų8377.3 Ų77.344%0.44440%0.402SS..Hα-helixtrans-57.2-51.8179-66.7-26000110.9S66 Y67 Y72 I73 E74S66-D70 PolarHBondContact O-N 2.95Å; S66-D70 VanDerWaalsContact O-N 3.15Å; Y67-D70 PolarHBondContact O-N 2.86Å; D70-Y72 VanDerWaalsContact C-N 3.3Å; D70-Y72 PolarHBondContact O-N 3.4Å; D70-I73 PolarHBondContact O-N 3.45Å; D70-E74 WeakPolarHBondContact O-CG 3.33Å; D70-E74 PolarHBondContact O-N 3.41Å
71R98.3Very high98.2Very high149 Ų14975 Ų7556%0.56239%0.388SS*.Hα-helixtrans-63.8-34.5179-70.8-58.9-57.3170.9-5.6112.7Y67 V69 E74 T75Y67-R71 VanDerWaalsContact O-CB 3.28Å; Y67-R71 WeakPolarHBondContact O-CB 3.3Å; Y67-R71 VanDerWaalsContact O-CG 3.24Å; Y67-R71 WeakPolarHBondContact O-CG 3.29Å; Y67-R71 PolarHBondContact O-N 2.9Å; V69-R71 PolarHBondContact O-N 3.15Å; R71-E74 WeakPolarHBondContact CD-OE2 3.47Å; R71-E74 IonicContact CZ-OE2 2.71Å; R71-E74 IonicContact NE-OE2 3.78Å; R71-E74 IonicContact NH1-OE2 3.51Å; R71-E74 PolarHBondContact NH1-OE2 3.46Å; R71-T75 VanDerWaalsContact O-CB 3.24Å; R71-T75 WeakPolarHBondContact O-CB 3.37Å; R71-T75 PolarHBondContact O-N 2.89Å; R71-T75 PolarHBondContact O-OG1 3.19Å
72Y98.5Very high98.2Very high37 Ų3776.2 Ų76.215%0.14540%0.397CS..Hα-helixtrans-65.9-48.3177.8-172.5-92.5000111L37 N40 I41 K44 C68 V69 D70 T75 M76L37-Y72 HydrophobicContact CD1-CD1 4.44Å; L37-Y72 HydrophobicContact CD1-CE1 3.9Å; N40-Y72 WeakPolarHBondContact CB-OH 3Å; I41-Y72 HydrophobicContact CB-CD1 4.5Å; I41-Y72 HydrophobicContact CD1-CD1 3.96Å; I41-Y72 HydrophobicContact CD1-CE1 4.4Å; I41-Y72 HydrophobicContact CG1-CD1 3.25Å; I41-Y72 HydrophobicContact CG1-CE1 3.56Å; I41-Y72 HydrophobicContact CG1-CG 4Å; K44-Y72 HydrophobicContact CD-CD2 3.96Å; K44-Y72 HydrophobicContact CD-CE2 3.21Å; C68-Y72 WeakPolarHBondContact O-CB 3.47Å; C68-Y72 PolarHBondContact O-N 2.94Å; V69-Y72 PolarHBondContact O-N 3.01Å; D70-Y72 VanDerWaalsContact C-N 3.3Å; D70-Y72 PolarHBondContact O-N 3.4Å; Y72-T75 PolarHBondContact O-N 3Å; Y72-M76 HydrophobicContact CD1-CG 3.8Å; Y72-M76 HydrophobicContact CE1-CG 3.44Å; Y72-M76 VanDerWaalsContact CE1-CG 3.44Å; Y72-M76 HydrophobicContact CE1-SD 4.16Å; Y72-M76 HydrophobicContact CE2-CG 4.37Å; Y72-M76 HydrophobicContact CG-CG 4.48Å; Y72-M76 WeakPolarHBondContact O-CB 3.42Å; Y72-M76 VanDerWaalsContact O-CG 3.27Å; Y72-M76 WeakPolarHBondContact O-CG 3.37Å; Y72-M76 PolarHBondContact O-N 2.89Å
73I98Very high98.1Very high68 Ų6877.4 Ų77.435%0.34940%0.398SS..Hα-helixtrans-63.9-46179.7-66.3168.3000110.6I41 V69 D70 T75 M76 N77I41-I73 HydrophobicContact CD1-CD1 4.42Å; I41-I73 HydrophobicContact CD1-CG1 4.12Å; V69-I73 HydrophobicContact CG1-CD1 3.84Å; V69-I73 WeakPolarHBondContact O-CG1 3.29Å; V69-I73 PolarHBondContact O-N 3.33Å; D70-I73 PolarHBondContact O-N 3.45Å; I73-T75 VanDerWaalsContact C-N 3.32Å; I73-T75 PolarHBondContact O-N 2.98Å; I73-M76 PolarHBondContact O-N 3.02Å; I73-N77 WeakPolarHBondContact O-CB 3.25Å; I73-N77 VanDerWaalsContact O-CG 3.29Å; I73-N77 PolarHBondContact O-N 3.4Å; I73-N77 PolarHBondContact O-ND2 2.82Å
74E98.2Very high98.1Very high101 Ų10177.9 Ų77.947%0.47240%0.396SS..Hα-helixtrans-55.5-47.8174.4-74.5177.2174.200111.8D70 R71 N77 L78D70-E74 WeakPolarHBondContact O-CG 3.33Å; D70-E74 PolarHBondContact O-N 3.41Å; R71-E74 WeakPolarHBondContact CD-OE2 3.47Å; R71-E74 IonicContact CZ-OE2 2.71Å; R71-E74 IonicContact NE-OE2 3.78Å; R71-E74 IonicContact NH1-OE2 3.51Å; R71-E74 PolarHBondContact NH1-OE2 3.46Å; E74-N77 PolarHBondContact O-N 2.83Å; E74-L78 WeakPolarHBondContact O-CB 3.23Å; E74-L78 PolarHBondContact O-N 3.38Å
75T98.1Very high98Very high65 Ų6581.1 Ų81.140%0.39941%0.407SS..Hα-helixtrans-65-45.1-179.4-57.80000111.3R71 Y72 I73 N77 L78 V79R71-T75 VanDerWaalsContact O-CB 3.24Å; R71-T75 WeakPolarHBondContact O-CB 3.37Å; R71-T75 PolarHBondContact O-N 2.89Å; R71-T75 PolarHBondContact O-OG1 3.19Å; Y72-T75 PolarHBondContact O-N 3Å; I73-T75 VanDerWaalsContact C-N 3.32Å; I73-T75 PolarHBondContact O-N 2.98Å; T75-N77 VanDerWaalsContact C-N 3.33Å; T75-N77 PolarHBondContact O-N 3.03Å; T75-L78 PolarHBondContact O-N 3.31Å; T75-V79 HydrophobicContact CG2-CG2 4.27Å; T75-V79 WeakPolarHBondContact O-CB 3.26Å; T75-V79 VanDerWaalsContact O-CG2 3.29Å; T75-V79 WeakPolarHBondContact O-CG2 3.37Å; T75-V79 PolarHBondContact O-N 3.19Å
76M97.2Very high97.9Very high82 Ų8287.6 Ų87.640%0.40443%0.429SS..Hα-helixtrans-59.5-43.6176.9-77-63.6-64.500111.7Y72 I73 V79 A80Y72-M76 HydrophobicContact CD1-CG 3.8Å; Y72-M76 HydrophobicContact CE1-CG 3.44Å; Y72-M76 VanDerWaalsContact CE1-CG 3.44Å; Y72-M76 HydrophobicContact CE1-SD 4.16Å; Y72-M76 HydrophobicContact CE2-CG 4.37Å; Y72-M76 HydrophobicContact CG-CG 4.48Å; Y72-M76 WeakPolarHBondContact O-CB 3.42Å; Y72-M76 VanDerWaalsContact O-CG 3.27Å; Y72-M76 WeakPolarHBondContact O-CG 3.37Å; Y72-M76 PolarHBondContact O-N 2.89Å; I73-M76 PolarHBondContact O-N 3.02Å; M76-V79 PolarHBondContact O-N 2.9Å; M76-A80 VanDerWaalsContact O-CB 3.22Å; M76-A80 WeakPolarHBondContact O-CB 3.38Å; M76-A80 PolarHBondContact O-N 3.06Å
77N97.6Very high97.8Very high104 Ų10489.2 Ų89.256%0.55643%0.432SS*.Hα-helixtrans-62.7-44.5177.2-74.6-28.5000112I73 E74 T75 A80 A81I73-N77 WeakPolarHBondContact O-CB 3.25Å; I73-N77 VanDerWaalsContact O-CG 3.29Å; I73-N77 PolarHBondContact O-N 3.4Å; I73-N77 PolarHBondContact O-ND2 2.82Å; E74-N77 PolarHBondContact O-N 2.83Å; T75-N77 VanDerWaalsContact C-N 3.33Å; T75-N77 PolarHBondContact O-N 3.03Å; N77-A80 PolarHBondContact O-N 2.97Å; N77-A81 WeakPolarHBondContact O-CB 3.32Å; N77-A81 PolarHBondContact O-N 3.27Å
78L98.4Very high97.6Very high115 Ų11590.4 Ų90.460%0.60244%0.442SS*.Hα-helixtrans-61.2-51.7176.6177.561.6000111.3E74 T75 A80 A81 T82E74-L78 WeakPolarHBondContact O-CB 3.23Å; E74-L78 PolarHBondContact O-N 3.38Å; T75-L78 PolarHBondContact O-N 3.31Å; L78-A80 VanDerWaalsContact C-N 3.32Å; L78-A80 PolarHBondContact O-N 3.08Å; L78-A81 PolarHBondContact O-N 3.39Å; L78-T82 PolarHBondContact O-N 3.29Å; L78-T82 PolarHBondContact O-OG1 3.02Å; L78-T82 VanDerWaalsContact O-OG1 3.06Å
79V97.9Very high97.2Very high87 Ų8796.5 Ų96.553%0.52747%0.469SS..Hα-helixtrans-59.4-44.9179.4171.30000110.7T75 M76 A81 T82 Y83T75-V79 HydrophobicContact CG2-CG2 4.27Å; T75-V79 WeakPolarHBondContact O-CB 3.26Å; T75-V79 VanDerWaalsContact O-CG2 3.29Å; T75-V79 WeakPolarHBondContact O-CG2 3.37Å; T75-V79 PolarHBondContact O-N 3.19Å; M76-V79 PolarHBondContact O-N 2.9Å; V79-A81 VanDerWaalsContact C-N 3.35Å; V79-A81 PolarHBondContact O-N 3.28Å; V79-T82 PolarHBondContact O-N 3.11Å; V79-Y83 VanDerWaalsContact O-CB 3.25Å; V79-Y83 WeakPolarHBondContact O-CB 3.46Å; V79-Y83 PolarHBondContact O-N 3.32Å
80A96.6Very high96.2Very high37 Ų37100.2 Ų100.231%0.30652%0.516SS..Hα-helixtrans-62.1-41.6177.900000112M76 N77 L78 R84M76-A80 VanDerWaalsContact O-CB 3.22Å; M76-A80 WeakPolarHBondContact O-CB 3.38Å; M76-A80 PolarHBondContact O-N 3.06Å; N77-A80 PolarHBondContact O-N 2.97Å; L78-A80 VanDerWaalsContact C-N 3.32Å; L78-A80 PolarHBondContact O-N 3.08Å; A80-R84 WeakPolarHBondContact O-CG 3.44Å; A80-R84 PolarHBondContact O-N 3.21Å; A80-R84 PolarHBondContact O-NH1 3.23Å
81A97.7Very high96.1Very high41 Ų41101.1 Ų101.134%0.33952%0.52SS..Hα-helixtrans-65-47.4176.100000112.1N77 L78 V79 Y83 R84 Q85N77-A81 WeakPolarHBondContact O-CB 3.32Å; N77-A81 PolarHBondContact O-N 3.27Å; L78-A81 PolarHBondContact O-N 3.39Å; V79-A81 VanDerWaalsContact C-N 3.35Å; V79-A81 PolarHBondContact O-N 3.28Å; A81-Y83 VanDerWaalsContact C-N 3.31Å; A81-Y83 PolarHBondContact O-N 3.33Å; A81-R84 PolarHBondContact O-N 3.46Å; A81-Q85 PolarHBondContact O-N 3.42Å
82T98.2Very high96Very high41 Ų4198.5 Ų98.525%0.25252%0.518SS..Hα-helixtrans-61.3-40.6176.7-56.90000111.7L78 V79 Q85 R86L78-T82 PolarHBondContact O-N 3.29Å; L78-T82 PolarHBondContact O-OG1 3.02Å; L78-T82 VanDerWaalsContact O-OG1 3.06Å; V79-T82 PolarHBondContact O-N 3.11Å; T82-Q85 PolarHBondContact O-N 2.85Å; T82-R86 WeakPolarHBondContact O-CG 3.41Å; T82-R86 PolarHBondContact O-N 3.32Å
83Y97.5Very high95.8Very high138 Ų138101.9 Ų101.954%0.54154%0.538SS..Hα-helixtrans-63.5-46.7177.4-176.8-109000111.5V79 A81 Q85 R86 L87V79-Y83 VanDerWaalsContact O-CB 3.25Å; V79-Y83 WeakPolarHBondContact O-CB 3.46Å; V79-Y83 PolarHBondContact O-N 3.32Å; A81-Y83 VanDerWaalsContact C-N 3.31Å; A81-Y83 PolarHBondContact O-N 3.33Å; Y83-Q85 VanDerWaalsContact C-N 3.31Å; Y83-Q85 PolarHBondContact O-N 3.46Å; Y83-R86 PolarHBondContact O-N 3.06Å; Y83-L87 HydrophobicContact CD1-CD1 4Å; Y83-L87 HydrophobicContact CD1-CG 4.49Å; Y83-L87 HydrophobicContact CE1-CD1 3.49Å; Y83-L87 VanDerWaalsContact CE1-CD1 3.49Å; Y83-L87 HydrophobicContact CE1-CG 4.13Å; Y83-L87 PolarHBondContact O-N 3.35Å; Y83-L87 VanDerWaalsContact O-N 3.08Å
84R97.1Very high95.7Very high142 Ų142103.9 Ų103.954%0.53655%0.55SS..Hα-helixtrans-57.9-42.7174.1-74.2-171.3-59.1-90.23.6112.3A80 A81 R86 L87 Q88A80-R84 WeakPolarHBondContact O-CG 3.44Å; A80-R84 PolarHBondContact O-N 3.21Å; A80-R84 PolarHBondContact O-NH1 3.23Å; A81-R84 PolarHBondContact O-N 3.46Å; R84-R86 VanDerWaalsContact C-N 3.34Å; R84-R86 PolarHBondContact O-N 3.05Å; R84-L87 PolarHBondContact O-N 3.06Å; R84-Q88 WeakPolarHBondContact O-CG 3.37Å; R84-Q88 PolarHBondContact O-N 2.73Å
85Q97.3Very high95.5Very high111 Ų111104.1 Ų104.152%0.51955%0.554SS.*Hα-helixtrans-61.3-42.1178.1-177.4-178-16.300111.8A81 T82 Y83 Q88 Q89A81-Q85 PolarHBondContact O-N 3.42Å; T82-Q85 PolarHBondContact O-N 2.85Å; Y83-Q85 VanDerWaalsContact C-N 3.31Å; Y83-Q85 PolarHBondContact O-N 3.46Å; Q85-Q88 PolarHBondContact O-N 3.33Å; Q85-Q89 WeakPolarHBondContact O-CG 3.43Å
86R97.1Very high95.4Very high168 Ų168106.7 Ų106.763%0.63457%0.565SS**Hα-helixtrans-66-39177.7-71.8177.3-178145.61.1112.6T82 Y83 R84 Q88 Q89T82-R86 WeakPolarHBondContact O-CG 3.41Å; T82-R86 PolarHBondContact O-N 3.32Å; Y83-R86 PolarHBondContact O-N 3.06Å; R84-R86 VanDerWaalsContact C-N 3.34Å; R84-R86 PolarHBondContact O-N 3.05Å; R86-Q88 PolarHBondContact O-N 3.15Å; R86-Q89 PolarHBondContact O-N 2.98Å; R86-Q89 VanDerWaalsContact O-N 3.15Å
87L96.4Very high95.2Very high102 Ų102108.5 Ų108.553%0.53458%0.576SS.*Hα-helixtrans-63.9-26.2177.1-71.9-179.8000113.3Y83 R84 Q89Y83-L87 HydrophobicContact CD1-CD1 4Å; Y83-L87 HydrophobicContact CD1-CG 4.49Å; Y83-L87 HydrophobicContact CE1-CD1 3.49Å; Y83-L87 VanDerWaalsContact CE1-CD1 3.49Å; Y83-L87 HydrophobicContact CE1-CG 4.13Å; Y83-L87 PolarHBondContact O-N 3.35Å; Y83-L87 VanDerWaalsContact O-N 3.08Å; R84-L87 PolarHBondContact O-N 3.06Å; L87-Q89 VanDerWaalsContact C-N 3.34Å
88Q94.1Very high95.1Very high164 Ų164108.8 Ų108.877%0.76658%0.578SS**THydrogen-bonded Turntrans-83.2-11.7177.2-68.4174.1-9.700113.4R84 Q85 R86R84-Q88 WeakPolarHBondContact O-CG 3.37Å; R84-Q88 PolarHBondContact O-N 2.73Å; Q85-Q88 PolarHBondContact O-N 3.33Å; R86-Q88 PolarHBondContact O-N 3.15Å
89Q89.2Confident94.8Very high145 Ų145108.3 Ų108.368%0.67858%0.576SS**THydrogen-bonded Turntrans-96.1-11.6-178.4-70.6178-13.300113.5Q85 R86 L87Q85-Q89 WeakPolarHBondContact O-CG 3.43Å; R86-Q89 PolarHBondContact O-N 2.98Å; R86-Q89 VanDerWaalsContact O-N 3.15Å; L87-Q89 VanDerWaalsContact C-N 3.34Å
90G78.2Confident94.5Very high124 Ų124110.3 Ų110.3100%1.27858%0.58SS**  trans-103.80173.900000111

Retrieved 90 of 90 residues in 204.7 ms (Link to these results)