A0A060X4T9_ONCMY Loading...

Peroxisomal biogenesis factor 11 alpha

AlphaFold DB , UniProt , Accession A0A060X4T9, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene pex11a, Length 246 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

 

Download Structure   PDB   PAE   Table  
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
1M72.5Confident83.1Confident205 Ų20597 Ų97100%1.0150%0.5SS*.  0-480-151.9167.1-148.800111.4S3 F4 V5M1-S3 PolarHBondContact O-N 2.71Å; M1-F4 WeakPolarHBondContact O-CB 3.37Å; M1-F4 PolarHBondContact O-N 3.49Å; M1-F4 VanDerWaalsContact O-N 3.16Å; M1-V5 PolarHBondContact O-N 3.11Å; M1-V5 VanDerWaalsContact O-N 3.11Å
2E81.2Confident83.3Confident170 Ų17095.7 Ų95.779%0.79449%0.49SS*.Hα-helixtrans-57.2-44.1-179.1-62.8-176.9168.300115.2F4 V5 K6E2-F4 PolarHBondContact O-N 3.08Å; E2-V5 PolarHBondContact O-N 3.43Å; E2-V5 VanDerWaalsContact O-N 3.16Å; E2-K6 PolarHBondContact O-N 3.21Å
3S79.7Confident83.7Confident73 Ų7388.4 Ų88.451%0.5145%0.453SS..Hα-helixtrans-60-36.3177.6-50.90000112.7M1 F7M1-S3 PolarHBondContact O-N 2.71Å; S3-F7 WeakPolarHBondContact O-CB 3.38Å; S3-F7 PolarHBondContact O-N 3.43Å
4F81.3Confident84.2Confident114 Ų11490.1 Ų90.150%0.545%0.451SS..Hα-helixtrans-71.7-40.7176.9-174.4-101.1000111.4M1 E2 F7 T8 L238M1-F4 WeakPolarHBondContact O-CB 3.37Å; M1-F4 PolarHBondContact O-N 3.49Å; M1-F4 VanDerWaalsContact O-N 3.16Å; E2-F4 PolarHBondContact O-N 3.08Å; F4-F7 HydrophobicContact CD2-CD1 4.44Å; F4-F7 HydrophobicContact CE2-CD1 4.44Å; F4-F7 WeakPolarHBondContact O-CB 3.41Å; F4-F7 PolarHBondContact O-N 3.29Å; F4-T8 HydrophobicContact CD1-CG2 4.16Å; F4-T8 HydrophobicContact CE1-CG2 3.73Å; F4-T8 HydrophobicContact CE2-CG2 4.32Å; F4-T8 HydrophobicContact CZ-CG2 3.82Å; F4-T8 WeakPolarHBondContact O-CG2 3.45Å; F4-T8 PolarHBondContact O-N 2.86Å; F4-T8 PolarHBondContact O-OG1 3.34Å; F4-L238 HydrophobicContact CB-CD2 4.48Å; F4-L238 HydrophobicContact CD2-CD2 4.39Å
5V83.5Confident84.8Confident71 Ų7185.4 Ų85.443%0.4343%0.428SS..Hα-helixtrans-62.5-42.91741750000111.1M1 E2 F7 T8 N9M1-V5 PolarHBondContact O-N 3.11Å; M1-V5 VanDerWaalsContact O-N 3.11Å; E2-V5 PolarHBondContact O-N 3.43Å; E2-V5 VanDerWaalsContact O-N 3.16Å; V5-F7 VanDerWaalsContact C-N 3.3Å; V5-F7 PolarHBondContact O-N 2.73Å; V5-T8 PolarHBondContact O-N 2.93Å; V5-T8 PolarHBondContact O-OG1 2.96Å; V5-T8 VanDerWaalsContact O-OG1 3.06Å; V5-N9 WeakPolarHBondContact O-CB 3.4Å; V5-N9 VanDerWaalsContact O-CG 3.22Å; V5-N9 PolarHBondContact O-N 3.37Å; V5-N9 PolarHBondContact O-ND2 2.84Å
6K84.1Confident85.2Confident144 Ų14483.4 Ų83.463%0.62641%0.414SS*.Hα-helixtrans-62.9-38.7175.1-170.5175.9-176.5174.40111.8E2 Q10E2-K6 PolarHBondContact O-N 3.21Å; K6-Q10 WeakPolarHBondContact O-CG 3.48Å; K6-Q10 PolarHBondContact O-N 3.25Å
7F85.1Confident85.7Confident4 Ų481.7 Ų81.72%0.01841%0.406CS..Hα-helixtrans-64.6-48.3175.8170.1-99.8000112.1S3 F4 V5 N9 Q10 G13 R16 I17 I234 V237 L238S3-F7 WeakPolarHBondContact O-CB 3.38Å; S3-F7 PolarHBondContact O-N 3.43Å; F4-F7 HydrophobicContact CD2-CD1 4.44Å; F4-F7 HydrophobicContact CE2-CD1 4.44Å; F4-F7 WeakPolarHBondContact O-CB 3.41Å; F4-F7 PolarHBondContact O-N 3.29Å; V5-F7 VanDerWaalsContact C-N 3.3Å; V5-F7 PolarHBondContact O-N 2.73Å; F7-N9 VanDerWaalsContact C-N 3.26Å; F7-N9 PolarHBondContact O-N 3.09Å; F7-Q10 WeakPolarHBondContact O-CB 3.43Å; F7-Q10 PolarHBondContact O-N 3.31Å; F7-Q10 VanDerWaalsContact O-N 3.09Å; F7-G13 VanDerWaalsContact CZ-O 3.24Å; F7-G13 WeakPolarHBondContact CZ-O 3.3Å; F7-G13 WeakPolarHBondContact O-CA 3.16Å; F7-R16 HydrophobicContact CZ-CB 4.15Å; F7-I17 HydrophobicContact CD1-CD1 4.48Å; F7-I17 HydrophobicContact CE1-CD1 3.78Å; F7-I17 HydrophobicContact CE1-CG1 3.77Å; F7-I17 HydrophobicContact CZ-CG1 4.3Å; F7-I234 HydrophobicContact CE1-CG2 4.33Å; F7-I234 HydrophobicContact CE2-CG2 4.5Å; F7-I234 HydrophobicContact CZ-CB 4.4Å; F7-I234 HydrophobicContact CZ-CG1 3.87Å; F7-I234 HydrophobicContact CZ-CG2 4.07Å; F7-V237 HydrophobicContact CD2-CB 4.07Å; F7-V237 HydrophobicContact CD2-CG1 3.67Å; F7-V237 HydrophobicContact CE2-CB 4.24Å; F7-V237 HydrophobicContact CE2-CG1 4.24Å; F7-L238 HydrophobicContact CB-CD2 3.77Å; F7-L238 HydrophobicContact CG-CD2 4.07Å
8T86.4Confident86.3Confident33 Ų3380.5 Ų80.520%0.20240%0.398CS..Hα-helixtrans-70.2-22.5-18054.90000113.1F4 V5 Q10 R14 I17F4-T8 HydrophobicContact CD1-CG2 4.16Å; F4-T8 HydrophobicContact CE1-CG2 3.73Å; F4-T8 HydrophobicContact CE2-CG2 4.32Å; F4-T8 HydrophobicContact CZ-CG2 3.82Å; F4-T8 WeakPolarHBondContact O-CG2 3.45Å; F4-T8 PolarHBondContact O-N 2.86Å; F4-T8 PolarHBondContact O-OG1 3.34Å; V5-T8 PolarHBondContact O-N 2.93Å; V5-T8 PolarHBondContact O-OG1 2.96Å; V5-T8 VanDerWaalsContact O-OG1 3.06Å; T8-Q10 VanDerWaalsContact C-N 3.29Å; T8-R14 WeakPolarHBondContact O-CG 3.44Å; T8-R14 PolarHBondContact O-NE 2.96Å; T8-R14 PolarHBondContact O-NH2 3.3Å; T8-I17 HydrophobicContact CG2-CD1 4.07Å
9N87.6Confident86.7Confident112 Ų11277.9 Ų77.960%0.59938%0.383SS*.Hα-helixtrans-74.1-18171.5-75.1-18.5000113.3V5 F7V5-N9 WeakPolarHBondContact O-CB 3.4Å; V5-N9 VanDerWaalsContact O-CG 3.22Å; V5-N9 PolarHBondContact O-N 3.37Å; V5-N9 PolarHBondContact O-ND2 2.84Å; F7-N9 VanDerWaalsContact C-N 3.26Å; F7-N9 PolarHBondContact O-N 3.09Å
10Q86.3Confident87.2Confident75 Ų7575.1 Ų75.135%0.3537%0.371SS..SBendtrans-84.4134.4175.1-67.2169.222.600110.7K6 F7 T8 Q12 G13 R14K6-Q10 WeakPolarHBondContact O-CG 3.48Å; K6-Q10 PolarHBondContact O-N 3.25Å; F7-Q10 WeakPolarHBondContact O-CB 3.43Å; F7-Q10 PolarHBondContact O-N 3.31Å; F7-Q10 VanDerWaalsContact O-N 3.09Å; T8-Q10 VanDerWaalsContact C-N 3.29Å; Q10-Q12 PolarHBondContact O-N 3.14Å; Q10-G13 WeakPolarHBondContact O-CA 3.36Å; Q10-G13 PolarHBondContact O-N 3.3Å; Q10-R14 PolarHBondContact O-N 3.03Å; Q10-R14 VanDerWaalsContact O-N 3.13Å
11S86.6Confident87.6Confident66 Ų6673.8 Ų73.846%0.46237%0.367SS..Hα-helixtrans-55.2-40.7173.455.30000112.1G13 R14 D15S11-G13 VanDerWaalsContact C-N 3.3Å; S11-G13 PolarHBondContact O-N 3.44Å; S11-R14 PolarHBondContact O-N 3.28Å; S11-D15 PolarHBondContact O-N 3.47Å
12Q85.9Confident88.7Confident81 Ų8164.9 Ų64.938%0.37932%0.323SS..Hα-helixtrans-64.8-32.1175.4-65.2-171.54.700113.1Q10 R16Q10-Q12 PolarHBondContact O-N 3.14Å; Q12-R16 VanDerWaalsContact O-CG 3.28Å; Q12-R16 WeakPolarHBondContact O-CG 3.41Å; Q12-R16 PolarHBondContact O-N 3.4Å; Q12-R16 VanDerWaalsContact O-N 3.13Å
13G88.4Confident89.4Confident1 Ų157.9 Ų57.91%0.0129%0.289CS..Hα-helixtrans-68.2-42.4175.700000111.4F7 Q10 S11 R16 I17F7-G13 VanDerWaalsContact CZ-O 3.24Å; F7-G13 WeakPolarHBondContact CZ-O 3.3Å; F7-G13 WeakPolarHBondContact O-CA 3.16Å; Q10-G13 WeakPolarHBondContact O-CA 3.36Å; Q10-G13 PolarHBondContact O-N 3.3Å; S11-G13 VanDerWaalsContact C-N 3.3Å; S11-G13 PolarHBondContact O-N 3.44Å; G13-R16 PolarHBondContact O-N 2.85Å; G13-I17 WeakPolarHBondContact O-CG1 3.33Å; G13-I17 PolarHBondContact O-N 3Å
14R90.9Very high90.2Very high112 Ų11256 Ų5642%0.42328%0.278SS..Hα-helixtrans-62.9-43.8174.1-62.1-178.9-174.81780.9112.4T8 Q10 S11 R16 I17 F18 F59T8-R14 WeakPolarHBondContact O-CG 3.44Å; T8-R14 PolarHBondContact O-NE 2.96Å; T8-R14 PolarHBondContact O-NH2 3.3Å; Q10-R14 PolarHBondContact O-N 3.03Å; Q10-R14 VanDerWaalsContact O-N 3.13Å; S11-R14 PolarHBondContact O-N 3.28Å; R14-R16 VanDerWaalsContact C-N 3.29Å; R14-R16 PolarHBondContact O-N 2.98Å; R14-I17 PolarHBondContact O-N 3.12Å; R14-F18 VanDerWaalsContact O-CD1 3.28Å; R14-F18 WeakPolarHBondContact O-CD1 3.35Å; R14-F18 PolarHBondContact O-N 3.39Å; R14-F59 HydrophobicContact CB-CD1 4.28Å; R14-F59 HydrophobicContact CB-CD2 4.46Å; R14-F59 HydrophobicContact CB-CE1 3.97Å; R14-F59 HydrophobicContact CB-CE2 4.14Å; R14-F59 HydrophobicContact CB-CZ 3.89Å
15D92.4Very high90.8Very high20 Ų2051 Ų5111%0.10726%0.257CS..Hα-helixtrans-56.9-42.7174176.361.5000111.9S11 F18 R19 R56 F59S11-D15 PolarHBondContact O-N 3.47Å; D15-F18 PolarHBondContact O-N 3.03Å; D15-R19 WeakPolarHBondContact O-CB 3.44Å; D15-R19 PolarHBondContact O-N 3.21Å; D15-R56 VanDerWaalsContact OD1-CB 3.25Å; D15-R56 WeakPolarHBondContact OD1-CB 3.2Å; D15-R56 VanDerWaalsContact OD1-CG 3.3Å; D15-R56 WeakPolarHBondContact OD1-CG 3.45Å; D15-R56 IonicContact OD1-NE 3.1Å; D15-R56 PolarHBondContact OD1-NE 3.26Å; D15-F59 HydrophobicContact CB-CB 3.85Å
16R92.3Very high91.3Very high54 Ų5448.3 Ų48.320%0.20424%0.242CC..Hα-helixtrans-65.2-40.7178.1-72.5170.6-171.8-88.77.4112.5F7 Q12 G13 R14 F18 R19 T20 G233 I234F7-R16 HydrophobicContact CZ-CB 4.15Å; Q12-R16 VanDerWaalsContact O-CG 3.28Å; Q12-R16 WeakPolarHBondContact O-CG 3.41Å; Q12-R16 PolarHBondContact O-N 3.4Å; Q12-R16 VanDerWaalsContact O-N 3.13Å; G13-R16 PolarHBondContact O-N 2.85Å; R14-R16 VanDerWaalsContact C-N 3.29Å; R14-R16 PolarHBondContact O-N 2.98Å; R16-F18 VanDerWaalsContact C-N 3.34Å; R16-R19 WeakPolarHBondContact O-CB 3.41Å; R16-R19 PolarHBondContact O-N 2.95Å; R16-T20 PolarHBondContact O-N 3.34Å; R16-T20 PolarHBondContact O-OG1 3.13Å; R16-G233 PolarHBondContact NH1-O 3.24Å; R16-I234 HydrophobicContact CB-CG1 3.95Å
17I93.8Very high91.8Very high54 Ų5442.9 Ų42.928%0.27722%0.22SC..Hα-helixtrans-59.7-48.5173.9-66.5167.6000109.9F7 T8 G13 R14 R19 T20 T21F7-I17 HydrophobicContact CD1-CD1 4.48Å; F7-I17 HydrophobicContact CE1-CD1 3.78Å; F7-I17 HydrophobicContact CE1-CG1 3.77Å; F7-I17 HydrophobicContact CZ-CG1 4.3Å; T8-I17 HydrophobicContact CG2-CD1 4.07Å; G13-I17 WeakPolarHBondContact O-CG1 3.33Å; G13-I17 PolarHBondContact O-N 3Å; R14-I17 PolarHBondContact O-N 3.12Å; I17-R19 VanDerWaalsContact C-N 3.28Å; I17-R19 PolarHBondContact O-N 3.44Å; I17-T20 WeakPolarHBondContact O-CB 3.48Å; I17-T20 PolarHBondContact O-N 3.03Å; I17-T21 PolarHBondContact O-N 3.29Å; I17-T21 PolarHBondContact O-OG1 2.97Å
18F95.3Very high92.3Very high60 Ų6045.6 Ų45.626%0.26324%0.237SC..Hα-helixtrans-62.6-37.9179.5-81.944.5000111.4R14 D15 R16 T21 Q22 M52 R56 F59R14-F18 VanDerWaalsContact O-CD1 3.28Å; R14-F18 WeakPolarHBondContact O-CD1 3.35Å; R14-F18 PolarHBondContact O-N 3.39Å; D15-F18 PolarHBondContact O-N 3.03Å; R16-F18 VanDerWaalsContact C-N 3.34Å; F18-T21 PolarHBondContact O-N 3.3Å; F18-Q22 VanDerWaalsContact O-CB 3.26Å; F18-Q22 WeakPolarHBondContact O-CB 3.29Å; F18-Q22 PolarHBondContact O-N 2.88Å; F18-M52 HydrophobicContact CB-SD 4.32Å; F18-M52 HydrophobicContact CD1-SD 4.32Å; F18-M52 HydrophobicContact CD2-SD 3.68Å; F18-M52 HydrophobicContact CE2-SD 3.97Å; F18-M52 HydrophobicContact CG-SD 3.86Å; F18-M52 HydrophobicContact CZ-SD 4.4Å; F18-R56 HydrophobicContact CB-CG 3.51Å; F18-R56 HydrophobicContact CG-CG 4.49Å; F18-F59 HydrophobicContact CD1-CE2 4.3Å; F18-F59 HydrophobicContact CD2-CD2 4.49Å; F18-F59 HydrophobicContact CD2-CE2 4.12Å; F18-F59 HydrophobicContact CE1-CE2 4.06Å; F18-F59 AromaticContact CE2-CE2 3.88Å; F18-F59 HydrophobicContact CE2-CE2 3.88Å; F18-F59 HydrophobicContact CG-CE2 4.34Å; F18-F59 AromaticContact CZ-CE2 3.85Å; F18-F59 HydrophobicContact CZ-CE2 3.85Å; F18-F59 HydrophobicContact CZ-CZ 4.5Å
19R95.1Very high92.6Very high31 Ų3146 Ų4612%0.11724%0.236CC..Hα-helixtrans-61.7-47.5174.3-169.2-176.9175.8118.1-1.4111.2D15 R16 I17 Q22 Y23 R56 D204 I207 S230D15-R19 WeakPolarHBondContact O-CB 3.44Å; D15-R19 PolarHBondContact O-N 3.21Å; R16-R19 WeakPolarHBondContact O-CB 3.41Å; R16-R19 PolarHBondContact O-N 2.95Å; I17-R19 VanDerWaalsContact C-N 3.28Å; I17-R19 PolarHBondContact O-N 3.44Å; R19-Q22 WeakPolarHBondContact O-CB 3.49Å; R19-Q22 PolarHBondContact O-N 3.29Å; R19-Y23 HydrophobicContact CG-CD2 3.7Å; R19-Y23 HydrophobicContact CG-CE2 3.62Å; R19-Y23 VanDerWaalsContact O-CD2 3.28Å; R19-Y23 WeakPolarHBondContact O-CD2 3.38Å; R19-Y23 PolarHBondContact O-N 3.28Å; R19-R56 VanDerWaalsContact NH1-NH2 3.18Å; R19-D204 IonicContact CZ-OD1 3.1Å; R19-D204 IonicContact CZ-OD2 2.65Å; R19-D204 IonicContact NH2-OD1 3.88Å; R19-D204 PolarHBondContact NH2-OD1 3.32Å; R19-D204 IonicContact NH2-OD2 3.63Å; R19-D204 PolarHBondContact NH2-OD2 3.02Å; R19-I207 VanDerWaalsContact NH2-CD1 3.29Å; R19-S230 WeakPolarHBondContact CD-OG 3.37Å; R19-S230 WeakPolarHBondContact CG-OG 3.42Å; R19-S230 PolarHBondContact NE-OG 2.89Å
20T96.1Very high92.8Very high22 Ų2243 Ų4314%0.13522%0.217CC..Hα-helixtrans-58.5-49.2176.6-600000110.9R16 I17 Q22 Y23 A24 L227 S230 L231 I234R16-T20 PolarHBondContact O-N 3.34Å; R16-T20 PolarHBondContact O-OG1 3.13Å; I17-T20 WeakPolarHBondContact O-CB 3.48Å; I17-T20 PolarHBondContact O-N 3.03Å; T20-Q22 PolarHBondContact O-N 2.93Å; T20-Y23 PolarHBondContact O-N 3.01Å; T20-A24 VanDerWaalsContact O-CB 3.26Å; T20-A24 WeakPolarHBondContact O-CB 3.44Å; T20-A24 PolarHBondContact O-N 3.47Å; T20-L227 HydrophobicContact CG2-CD1 3.71Å; T20-S230 VanDerWaalsContact OG1-CB 3.23Å; T20-S230 WeakPolarHBondContact OG1-CB 3.39Å; T20-L231 HydrophobicContact CG2-CD2 3.83Å; T20-L231 HydrophobicContact CG2-CG 4.37Å; T20-I234 WeakPolarHBondContact OG1-CD1 3.39Å
21T95.6Very high93.1Very high47 Ų4745.2 Ų45.229%0.28823%0.23SC..Hα-helixtrans-62.5-42.2178.1-55.20000111.8I17 F18 A24 C25 M52I17-T21 PolarHBondContact O-N 3.29Å; I17-T21 PolarHBondContact O-OG1 2.97Å; F18-T21 PolarHBondContact O-N 3.3Å; T21-A24 PolarHBondContact O-N 2.86Å; T21-C25 WeakPolarHBondContact O-CB 3.41Å; T21-C25 PolarHBondContact O-N 3.37Å; T21-C25 PolarHBondContact O-SG 3.45Å; T21-M52 HydrophobicContact CG2-CE 4.48Å; T21-M52 HydrophobicContact CG2-CG 4.02Å; T21-M52 HydrophobicContact CG2-SD 4.28Å
22Q96.3Very high93.4Very high19 Ų1942.9 Ų42.99%0.08921%0.213CC..Hα-helixtrans-57.8-52.5177-176.5-167.2-19.200111.3F18 R19 T20 C25 A26 E49 M52 R56F18-Q22 VanDerWaalsContact O-CB 3.26Å; F18-Q22 WeakPolarHBondContact O-CB 3.29Å; F18-Q22 PolarHBondContact O-N 2.88Å; R19-Q22 WeakPolarHBondContact O-CB 3.49Å; R19-Q22 PolarHBondContact O-N 3.29Å; T20-Q22 PolarHBondContact O-N 2.93Å; Q22-C25 WeakPolarHBondContact O-CB 3.49Å; Q22-C25 PolarHBondContact O-N 3.44Å; Q22-A26 PolarHBondContact O-N 3.46Å; Q22-E49 HydrophobicContact CG-CG 3.71Å; Q22-M52 HydrophobicContact CB-CB 3.98Å; Q22-R56 VanDerWaalsContact OE1-CD 3.25Å
23Y95.7Very high93.4Very high22 Ų2245.6 Ų45.69%0.08622%0.219CC..Hα-helixtrans-73.2-29.9-177.8-75.7-67.8000113.1R19 T20 A26 L27 I207 V222 G226R19-Y23 HydrophobicContact CG-CD2 3.7Å; R19-Y23 HydrophobicContact CG-CE2 3.62Å; R19-Y23 VanDerWaalsContact O-CD2 3.28Å; R19-Y23 WeakPolarHBondContact O-CD2 3.38Å; R19-Y23 PolarHBondContact O-N 3.28Å; T20-Y23 PolarHBondContact O-N 3.01Å; Y23-A26 PolarHBondContact O-N 3.35Å; Y23-L27 WeakPolarHBondContact O-CB 3.36Å; Y23-L27 PolarHBondContact O-N 3.49Å; Y23-I207 HydrophobicContact CE1-CD1 4.49Å; Y23-I207 VanDerWaalsContact OH-CD1 3.28Å; Y23-I207 WeakPolarHBondContact OH-CD1 3.43Å; Y23-V222 HydrophobicContact CE1-CG1 4.43Å; Y23-G226 WeakPolarHBondContact CD2-O 3.44Å
24A95.9Very high93.4Very high33 Ų3352.4 Ų52.427%0.27326%0.255SS..Hα-helixtrans-61.2-45.5168.600000111.2T20 T21 A26 L27 V28 L227T20-A24 VanDerWaalsContact O-CB 3.26Å; T20-A24 WeakPolarHBondContact O-CB 3.44Å; T20-A24 PolarHBondContact O-N 3.47Å; T21-A24 PolarHBondContact O-N 2.86Å; A24-A26 PolarHBondContact O-N 2.94Å; A24-L27 PolarHBondContact O-N 3.2Å; A24-V28 VanDerWaalsContact O-CG2 3.31Å; A24-V28 WeakPolarHBondContact O-CG2 3.45Å; A24-V28 PolarHBondContact O-N 3.22Å; A24-L227 HydrophobicContact CB-CD1 4.06Å
25C94.6Very high93.2Very high9 Ų949.9 Ų49.96%0.06125%0.25CS..Hα-helixtrans-61.1-44.8174.6-66.10000111.3T21 Q22 L27 V28 K29 L45 L48 E49T21-C25 WeakPolarHBondContact O-CB 3.41Å; T21-C25 PolarHBondContact O-N 3.37Å; T21-C25 PolarHBondContact O-SG 3.45Å; Q22-C25 WeakPolarHBondContact O-CB 3.49Å; Q22-C25 PolarHBondContact O-N 3.44Å; C25-L27 VanDerWaalsContact C-N 3.33Å; C25-L27 PolarHBondContact O-N 2.86Å; C25-V28 PolarHBondContact O-N 3.04Å; C25-K29 WeakPolarHBondContact O-CB 3.33Å; C25-K29 PolarHBondContact O-N 3.03Å; C25-L45 HydrophobicContact CB-CD2 4.31Å; C25-L48 VanDerWaalsContact SG-CD2 3.58Å; C25-E49 HydrophobicContact CB-CB 4.09Å
26A93.6Very high92.5Very high15 Ų1553.5 Ų53.512%0.12428%0.277CS..Hα-helixtrans-59.7-42.5178.400000112.2Q22 Y23 A24 Y30Q22-A26 PolarHBondContact O-N 3.46Å; Y23-A26 PolarHBondContact O-N 3.35Å; A24-A26 PolarHBondContact O-N 2.94Å; A26-Y30 WeakPolarHBondContact O-CB 3.11Å; A26-Y30 PolarHBondContact O-N 3.3Å
27L95Very high92Very high31 Ų3155.3 Ų55.316%0.16230%0.303CS..Hα-helixtrans-67.4-48.9177.7-178.760.8000112Y23 A24 C25 K29 Y30 L31 F224 L227Y23-L27 WeakPolarHBondContact O-CB 3.36Å; Y23-L27 PolarHBondContact O-N 3.49Å; A24-L27 PolarHBondContact O-N 3.2Å; C25-L27 VanDerWaalsContact C-N 3.33Å; C25-L27 PolarHBondContact O-N 2.86Å; L27-K29 VanDerWaalsContact C-N 3.32Å; L27-K29 PolarHBondContact O-N 3.17Å; L27-Y30 WeakPolarHBondContact O-CB 3.46Å; L27-Y30 PolarHBondContact O-N 3.43Å; L27-Y30 VanDerWaalsContact O-N 3.14Å; L27-L31 HydrophobicContact CG-CD1 4.34Å; L27-L31 WeakPolarHBondContact O-CG 3.43Å; L27-L31 PolarHBondContact O-N 3.12Å; L27-F224 HydrophobicContact CD1-CB 4.1Å; L27-F224 HydrophobicContact CD2-CB 4.4Å; L27-F224 HydrophobicContact CD2-CD2 4.14Å; L27-L227 HydrophobicContact CD2-CD2 4.03Å
28V94.1Very high91.7Very high60 Ų6058.3 Ų58.336%0.36431%0.311SS..Hα-helixtrans-62.2-42.3178.5175.50000110.6A24 C25 Y30 L31 L32 L45A24-V28 VanDerWaalsContact O-CG2 3.31Å; A24-V28 WeakPolarHBondContact O-CG2 3.45Å; A24-V28 PolarHBondContact O-N 3.22Å; C25-V28 PolarHBondContact O-N 3.04Å; V28-Y30 VanDerWaalsContact C-N 3.28Å; V28-Y30 PolarHBondContact O-N 3.06Å; V28-L31 PolarHBondContact O-N 3.49Å; V28-L32 HydrophobicContact CG1-CD1 3.7Å; V28-L32 HydrophobicContact CG1-CG 4.15Å; V28-L32 WeakPolarHBondContact O-CB 3.5Å; V28-L32 VanDerWaalsContact O-CG 3.28Å; V28-L32 WeakPolarHBondContact O-CG 3.45Å; V28-L32 PolarHBondContact O-N 2.93Å; V28-L45 HydrophobicContact CB-CD1 4.22Å; V28-L45 HydrophobicContact CG1-CD1 3.65Å
29K93.4Very high91.3Very high42 Ų4262.4 Ų62.418%0.18333%0.329CS..Hα-helixtrans-56.6-42.9174.7-172.9-174.568.7-173.40111.3C25 L27 L32 R33 V42 L45 Q46 E49C25-K29 WeakPolarHBondContact O-CB 3.33Å; C25-K29 PolarHBondContact O-N 3.03Å; L27-K29 VanDerWaalsContact C-N 3.32Å; L27-K29 PolarHBondContact O-N 3.17Å; K29-L32 PolarHBondContact O-N 3.28Å; K29-R33 PolarHBondContact O-N 2.95Å; K29-V42 HydrophobicContact CG-CG1 3.96Å; K29-L45 HydrophobicContact CB-CB 4.44Å; K29-Q46 HydrophobicContact CD-CB 4.28Å; K29-E49 WeakPolarHBondContact CE-OE2 3.32Å; K29-E49 IonicContact NZ-OE1 3.96Å; K29-E49 IonicContact NZ-OE2 2.64Å; K29-E49 PolarHBondContact NZ-OE2 3.23Å
30Y92.7Very high91.1Very high49 Ų4967.2 Ų67.219%0.19235%0.353CS..Hα-helixtrans-64.7-45.2175.7175.6-92.9000112.6A26 L27 V28 L32 R33 N218 P219 G220A26-Y30 WeakPolarHBondContact O-CB 3.11Å; A26-Y30 PolarHBondContact O-N 3.3Å; L27-Y30 WeakPolarHBondContact O-CB 3.46Å; L27-Y30 PolarHBondContact O-N 3.43Å; L27-Y30 VanDerWaalsContact O-N 3.14Å; V28-Y30 VanDerWaalsContact C-N 3.28Å; V28-Y30 PolarHBondContact O-N 3.06Å; Y30-L32 VanDerWaalsContact C-N 3.26Å; Y30-L32 PolarHBondContact O-N 2.91Å; Y30-R33 VanDerWaalsContact O-CD 3.32Å; Y30-R33 WeakPolarHBondContact O-CD 3.38Å; Y30-R33 WeakPolarHBondContact O-CG 3.36Å; Y30-R33 PolarHBondContact O-N 3.45Å; Y30-R33 PolarHBondContact OH-NH2 3.41Å; Y30-N218 WeakPolarHBondContact CE2-OD1 3.42Å; Y30-N218 PolarHBondContact OH-ND2 2.91Å; Y30-N218 PolarHBondContact OH-OD1 3.24Å; Y30-P219 HydrophobicContact CD2-CB 4.14Å; Y30-G220 VanDerWaalsContact CD1-CA 3.45Å; Y30-G220 VanDerWaalsContact CD2-N 3.33Å; Y30-G220 VanDerWaalsContact CG-CA 3.41Å
31L92.3Very high90.8Very high121 Ų12169.8 Ų69.863%0.63437%0.366SS*.Hα-helixtrans-64.5-30.9178.8-66.7174.3000112.6L27 V28L27-L31 HydrophobicContact CG-CD1 4.34Å; L27-L31 WeakPolarHBondContact O-CG 3.43Å; L27-L31 PolarHBondContact O-N 3.12Å; V28-L31 PolarHBondContact O-N 3.49Å
32L92.1Very high90.6Very high18 Ų1869.2 Ų69.29%0.09436%0.362CS..Hα-helixtrans-90.6-5.2-178.2-65.5-176.3000114.5V28 K29 Y30 N34 N35 R38 L41 V42 L45V28-L32 HydrophobicContact CG1-CD1 3.7Å; V28-L32 HydrophobicContact CG1-CG 4.15Å; V28-L32 WeakPolarHBondContact O-CB 3.5Å; V28-L32 VanDerWaalsContact O-CG 3.28Å; V28-L32 WeakPolarHBondContact O-CG 3.45Å; V28-L32 PolarHBondContact O-N 2.93Å; K29-L32 PolarHBondContact O-N 3.28Å; Y30-L32 VanDerWaalsContact C-N 3.26Å; Y30-L32 PolarHBondContact O-N 2.91Å; L32-N34 PolarHBondContact O-N 2.9Å; L32-N34 VanDerWaalsContact O-N 3.14Å; L32-N35 WeakPolarHBondContact O-CB 3.42Å; L32-N35 PolarHBondContact O-N 3.42Å; L32-R38 VanDerWaalsContact CD2-CZ 3.44Å; L32-L41 HydrophobicContact CD1-CD2 3.67Å; L32-L41 HydrophobicContact CD1-CG 4.29Å; L32-V42 HydrophobicContact CB-CG2 4.04Å; L32-L45 HydrophobicContact CD1-CD1 4.25Å
33R87Confident90.5Very high138 Ų13873.3 Ų73.352%0.52139%0.388SS..THydrogen-bonded Turntrans-59.2-30.9-17176.7-170.8175.7165.6-4.2114.6K29 Y30K29-R33 PolarHBondContact O-N 2.95Å; Y30-R33 VanDerWaalsContact O-CD 3.32Å; Y30-R33 WeakPolarHBondContact O-CD 3.38Å; Y30-R33 WeakPolarHBondContact O-CG 3.36Å; Y30-R33 PolarHBondContact O-N 3.45Å; Y30-R33 PolarHBondContact OH-NH2 3.41Å
34N87.1Confident90.4Very high143 Ų14378.2 Ų78.277%0.76541%0.409SS*.THydrogen-bonded Turntrans-88.4-4.8-178.5-69.9-8.2000112.9L32 S36L32-N34 PolarHBondContact O-N 2.9Å; L32-N34 VanDerWaalsContact O-N 3.14Å; N34-S36 PolarHBondContact O-N 2.9Å
35N87.5Confident90.3Very high60 Ų6077.7 Ų77.732%0.32140%0.402SS..  trans-94100-176.4-165.5-44000110.3L32 A37 R38L32-N35 WeakPolarHBondContact O-CB 3.42Å; L32-N35 PolarHBondContact O-N 3.42Å; N35-A37 PolarHBondContact O-N 2.98Å; N35-A37 WeakPolarHBondContact OD1-CB 3.47Å; N35-A37 PolarHBondContact OD1-N 2.98Å; N35-R38 PolarHBondContact ND2-NH2 3.06Å; N35-R38 PolarHBondContact O-N 3.19Å; N35-R38 VanDerWaalsContact O-N 3.09Å
36S77.1Confident90.2Very high95 Ų9581.4 Ų81.466%0.66442%0.418SS*.G310 helixtrans-60.1-28-177.853.40000113.7N34 R38 K39N34-S36 PolarHBondContact O-N 2.9Å; S36-R38 VanDerWaalsContact C-N 3.29Å; S36-R38 PolarHBondContact O-N 3.1Å; S36-K39 WeakPolarHBondContact O-CG 3.32Å
37A81.6Confident90.3Very high92 Ų9283.7 Ų83.776%0.7643%0.433SS*.G310 helixtrans-74.2-16.5178.400000113.5N35N35-A37 PolarHBondContact O-N 2.98Å; N35-A37 WeakPolarHBondContact OD1-CB 3.47Å; N35-A37 PolarHBondContact OD1-N 2.98Å
38R87Confident90.2Very high117 Ų11785.5 Ų85.544%0.44244%0.443SS..G310 helixtrans-11321.9-175.4-65.3-162.9-77.9-145.62.7114.1L32 N35 S36 E40 L41 V42L32-R38 VanDerWaalsContact CD2-CZ 3.44Å; N35-R38 PolarHBondContact ND2-NH2 3.06Å; N35-R38 PolarHBondContact O-N 3.19Å; N35-R38 VanDerWaalsContact O-N 3.09Å; S36-R38 VanDerWaalsContact C-N 3.29Å; S36-R38 PolarHBondContact O-N 3.1Å; R38-E40 VanDerWaalsContact C-N 3.3Å; R38-E40 PolarHBondContact O-N 3.16Å; R38-L41 HydrophobicContact CB-CB 4.43Å; R38-L41 WeakPolarHBondContact O-CB 3.48Å; R38-L41 PolarHBondContact O-N 2.95Å; R38-L41 VanDerWaalsContact O-N 3.13Å; R38-V42 PolarHBondContact O-N 3.42Å; R38-V42 VanDerWaalsContact O-N 3.11Å
39K88.1Confident90.2Very high146 Ų14684.2 Ų84.264%0.63543%0.433SS*.Hα-helixtrans-56.4-40.7178.3-73.7-179.3-178.6-1770113.1S36 L41 V42 V43S36-K39 WeakPolarHBondContact O-CG 3.32Å; K39-L41 VanDerWaalsContact C-N 3.33Å; K39-L41 PolarHBondContact O-N 2.95Å; K39-V42 WeakPolarHBondContact O-CB 3.26Å; K39-V42 PolarHBondContact O-N 2.82Å; K39-V43 PolarHBondContact O-N 3.45Å; K39-V43 VanDerWaalsContact O-N 3.14Å
40E90.1Very high90.2Very high133 Ų13385.2 Ų85.262%0.62145%0.445SS*.Hα-helixtrans-61.9-41.9177.8-167.6-165.3145.500111.8R38 V42 V43 K44R38-E40 VanDerWaalsContact C-N 3.3Å; R38-E40 PolarHBondContact O-N 3.16Å; E40-V42 VanDerWaalsContact C-N 3.33Å; E40-V42 PolarHBondContact O-N 2.98Å; E40-V43 PolarHBondContact O-N 2.87Å; E40-K44 PolarHBondContact O-N 2.96Å; E40-K44 VanDerWaalsContact OE1-CE 3.22Å; E40-K44 WeakPolarHBondContact OE1-CE 3.23Å; E40-K44 IonicContact OE1-NZ 2.98Å; E40-K44 PolarHBondContact OE1-NZ 2.86Å
41L90.9Very high90.2Very high76 Ų7687.4 Ų87.440%0.39846%0.46SS..Hα-helixtrans-63.9-38.7176.6-17861.1000111.6L32 R38 K39 V43 K44 L45L32-L41 HydrophobicContact CD1-CD2 3.67Å; L32-L41 HydrophobicContact CD1-CG 4.29Å; R38-L41 HydrophobicContact CB-CB 4.43Å; R38-L41 WeakPolarHBondContact O-CB 3.48Å; R38-L41 PolarHBondContact O-N 2.95Å; R38-L41 VanDerWaalsContact O-N 3.13Å; K39-L41 VanDerWaalsContact C-N 3.33Å; K39-L41 PolarHBondContact O-N 2.95Å; L41-V43 VanDerWaalsContact C-N 3.32Å; L41-V43 PolarHBondContact O-N 3.22Å; L41-K44 PolarHBondContact O-N 2.93Å; L41-L45 HydrophobicContact CD1-CG 4.42Å; L41-L45 HydrophobicContact CG-CD1 4.14Å; L41-L45 HydrophobicContact CG-CG 4.45Å; L41-L45 WeakPolarHBondContact O-CB 3.45Å; L41-L45 VanDerWaalsContact O-CG 3.28Å; L41-L45 WeakPolarHBondContact O-CG 3.43Å; L41-L45 PolarHBondContact O-N 3.3Å
42V91.6Very high90.3Very high35 Ų3583.5 Ų83.521%0.21244%0.439CS..Hα-helixtrans-60-42.4175.2168.90000111.2K29 L32 R38 K39 E40 L45 Q46K29-V42 HydrophobicContact CG-CG1 3.96Å; L32-V42 HydrophobicContact CB-CG2 4.04Å; R38-V42 PolarHBondContact O-N 3.42Å; R38-V42 VanDerWaalsContact O-N 3.11Å; K39-V42 WeakPolarHBondContact O-CB 3.26Å; K39-V42 PolarHBondContact O-N 2.82Å; E40-V42 VanDerWaalsContact C-N 3.33Å; E40-V42 PolarHBondContact O-N 2.98Å; V42-L45 PolarHBondContact O-N 3.21Å; V42-Q46 WeakPolarHBondContact O-CB 3.48Å; V42-Q46 PolarHBondContact O-N 2.94Å
43V92.6Very high90.2Very high104 Ų10484.4 Ų84.463%0.6345%0.447SS*.Hα-helixtrans-65.9-43.4176.5176.30000111.2K39 E40 L41 L45 Q46 S47K39-V43 PolarHBondContact O-N 3.45Å; K39-V43 VanDerWaalsContact O-N 3.14Å; E40-V43 PolarHBondContact O-N 2.87Å; L41-V43 VanDerWaalsContact C-N 3.32Å; L41-V43 PolarHBondContact O-N 3.22Å; V43-L45 PolarHBondContact O-N 3.49Å; V43-Q46 WeakPolarHBondContact O-CB 3.49Å; V43-Q46 PolarHBondContact O-N 3.21Å; V43-S47 PolarHBondContact O-N 2.96Å
44K93.3Very high90.3Very high125 Ų12580.7 Ų80.754%0.54344%0.442SS..Hα-helixtrans-59.1-45.1174.9-73.6174.9172.1168.10111.7E40 L41 Q46 S47 L48E40-K44 PolarHBondContact O-N 2.96Å; E40-K44 VanDerWaalsContact OE1-CE 3.22Å; E40-K44 WeakPolarHBondContact OE1-CE 3.23Å; E40-K44 IonicContact OE1-NZ 2.98Å; E40-K44 PolarHBondContact OE1-NZ 2.86Å; L41-K44 PolarHBondContact O-N 2.93Å; K44-Q46 PolarHBondContact O-N 3.49Å; K44-S47 PolarHBondContact O-N 3.36Å; K44-L48 PolarHBondContact O-N 3.05Å
45L93.8Very high90.5Very high22 Ų2274.5 Ų74.512%0.11541%0.413CS..Hα-helixtrans-63.6-38.9176.5-72.1169.6000112.3C25 V28 K29 L32 L41 V42 V43 L48 E49C25-L45 HydrophobicContact CB-CD2 4.31Å; V28-L45 HydrophobicContact CB-CD1 4.22Å; V28-L45 HydrophobicContact CG1-CD1 3.65Å; K29-L45 HydrophobicContact CB-CB 4.44Å; L32-L45 HydrophobicContact CD1-CD1 4.25Å; L41-L45 HydrophobicContact CD1-CG 4.42Å; L41-L45 HydrophobicContact CG-CD1 4.14Å; L41-L45 HydrophobicContact CG-CG 4.45Å; L41-L45 WeakPolarHBondContact O-CB 3.45Å; L41-L45 VanDerWaalsContact O-CG 3.28Å; L41-L45 WeakPolarHBondContact O-CG 3.43Å; L41-L45 PolarHBondContact O-N 3.3Å; V42-L45 PolarHBondContact O-N 3.21Å; V43-L45 PolarHBondContact O-N 3.49Å; L45-L48 PolarHBondContact O-N 3.38Å; L45-E49 WeakPolarHBondContact O-CB 3.33Å; L45-E49 PolarHBondContact O-N 3.4Å
46Q94.4Very high90.7Very high87 Ų8772.3 Ų72.341%0.40740%0.4SS..Hα-helixtrans-63.7-41.5176.2-17961.263.100112.2K29 V42 V43 K44 S50K29-Q46 HydrophobicContact CD-CB 4.28Å; V42-Q46 WeakPolarHBondContact O-CB 3.48Å; V42-Q46 PolarHBondContact O-N 2.94Å; V43-Q46 WeakPolarHBondContact O-CB 3.49Å; V43-Q46 PolarHBondContact O-N 3.21Å; K44-Q46 PolarHBondContact O-N 3.49Å; Q46-S50 WeakPolarHBondContact O-CB 3.26Å; Q46-S50 PolarHBondContact O-N 3.12Å; Q46-S50 VanDerWaalsContact O-N 3.09Å
47S94.4Very high91.4Very high63 Ų6369.4 Ų69.444%0.44138%0.375SS..Hα-helixtrans-63.7-46.6174.7-179.30000111.1V43 K44 E49 S50 N51V43-S47 PolarHBondContact O-N 2.96Å; K44-S47 PolarHBondContact O-N 3.36Å; S47-E49 PolarHBondContact O-N 3.12Å; S47-S50 PolarHBondContact O-N 3.42Å; S47-N51 VanDerWaalsContact O-CG 3.29Å; S47-N51 PolarHBondContact O-N 3.13Å; S47-N51 PolarHBondContact O-ND2 3.13Å
48L94.2Very high91.7Very high69 Ų6969.5 Ų69.536%0.36136%0.362SS..Hα-helixtrans-60.6-45.1177.7-174.458.5000112C25 K44 L45 S50 N51 M52C25-L48 VanDerWaalsContact SG-CD2 3.58Å; K44-L48 PolarHBondContact O-N 3.05Å; L45-L48 PolarHBondContact O-N 3.38Å; L48-S50 PolarHBondContact O-N 3.36Å; L48-N51 PolarHBondContact O-N 3.41Å; L48-M52 HydrophobicContact CD1-CE 3.61Å; L48-M52 HydrophobicContact CD1-CG 4.34Å; L48-M52 WeakPolarHBondContact O-CB 3.39Å; L48-M52 VanDerWaalsContact O-CG 3.24Å; L48-M52 WeakPolarHBondContact O-CG 3.4Å; L48-M52 PolarHBondContact O-N 3.34Å
49E93.8Very high91.8Very high34 Ų3466.4 Ų66.416%0.15935%0.352CS..Hα-helixtrans-58.2-45.4175.9-176.4-169.3149.100112Q22 C25 K29 L45 S47 M52 S53Q22-E49 HydrophobicContact CG-CG 3.71Å; C25-E49 HydrophobicContact CB-CB 4.09Å; K29-E49 WeakPolarHBondContact CE-OE2 3.32Å; K29-E49 IonicContact NZ-OE1 3.96Å; K29-E49 IonicContact NZ-OE2 2.64Å; K29-E49 PolarHBondContact NZ-OE2 3.23Å; L45-E49 WeakPolarHBondContact O-CB 3.33Å; L45-E49 PolarHBondContact O-N 3.4Å; S47-E49 PolarHBondContact O-N 3.12Å; E49-M52 PolarHBondContact O-N 3.33Å; E49-S53 WeakPolarHBondContact O-CB 3.46Å; E49-S53 PolarHBondContact O-N 2.95Å
50S92.1Very high91.9Very high62 Ų6260.1 Ų60.143%0.43433%0.325SS..Hα-helixtrans-63.9-42.8178.6-173.80000112.3Q46 S47 L48 S53 S54Q46-S50 WeakPolarHBondContact O-CB 3.26Å; Q46-S50 PolarHBondContact O-N 3.12Å; Q46-S50 VanDerWaalsContact O-N 3.09Å; S47-S50 PolarHBondContact O-N 3.42Å; L48-S50 PolarHBondContact O-N 3.36Å; S50-S53 PolarHBondContact O-N 3.43Å; S50-S54 WeakPolarHBondContact O-CB 3.34Å; S50-S54 PolarHBondContact O-N 3.3Å; S50-S54 PolarHBondContact O-OG 2.78Å
51N93.2Very high91.7Very high96 Ų9657 Ų5751%0.51331%0.312SS..Hα-helixtrans-64.6-44.4177.5-70.9-17.5000111.3S47 L48 S54 G55S47-N51 VanDerWaalsContact O-CG 3.29Å; S47-N51 PolarHBondContact O-N 3.13Å; S47-N51 PolarHBondContact O-ND2 3.13Å; L48-N51 PolarHBondContact O-N 3.41Å; N51-S54 PolarHBondContact O-N 3.37Å; N51-G55 PolarHBondContact O-N 2.8Å
52M93.6Very high91.5Very high38 Ų3855.5 Ų55.519%0.18731%0.314CS..Hα-helixtrans-62.3-45175.5-68-61.8150.100111F18 T21 Q22 L48 E49 S54 G55 R56F18-M52 HydrophobicContact CB-SD 4.32Å; F18-M52 HydrophobicContact CD1-SD 4.32Å; F18-M52 HydrophobicContact CD2-SD 3.68Å; F18-M52 HydrophobicContact CE2-SD 3.97Å; F18-M52 HydrophobicContact CG-SD 3.86Å; F18-M52 HydrophobicContact CZ-SD 4.4Å; T21-M52 HydrophobicContact CG2-CE 4.48Å; T21-M52 HydrophobicContact CG2-CG 4.02Å; T21-M52 HydrophobicContact CG2-SD 4.28Å; Q22-M52 HydrophobicContact CB-CB 3.98Å; L48-M52 HydrophobicContact CD1-CE 3.61Å; L48-M52 HydrophobicContact CD1-CG 4.34Å; L48-M52 WeakPolarHBondContact O-CB 3.39Å; L48-M52 VanDerWaalsContact O-CG 3.24Å; L48-M52 WeakPolarHBondContact O-CG 3.4Å; L48-M52 PolarHBondContact O-N 3.34Å; E49-M52 PolarHBondContact O-N 3.33Å; M52-S54 VanDerWaalsContact C-N 3.31Å; M52-S54 PolarHBondContact O-N 2.95Å; M52-G55 PolarHBondContact O-N 3.45Å; M52-R56 VanDerWaalsContact O-CG 3.26Å; M52-R56 WeakPolarHBondContact O-CG 3.11Å; M52-R56 PolarHBondContact O-N 2.97Å
53S91.1Very high91.4Very high38 Ų3854.5 Ų54.527%0.26631%0.308SS..Hα-helixtrans-58.6-41.6176.3-172.60000112.6E49 S50 R56 K57E49-S53 WeakPolarHBondContact O-CB 3.46Å; E49-S53 PolarHBondContact O-N 2.95Å; S50-S53 PolarHBondContact O-N 3.43Å; S53-R56 PolarHBondContact O-N 3.37Å; S53-K57 PolarHBondContact O-N 3.15Å
54S88.8Confident91.4Very high59 Ų5950.3 Ų50.341%0.41328%0.283SS..Hα-helixtrans-67.9-44.1177.5-60.30000111.9S50 N51 M52 R56 K57S50-S54 WeakPolarHBondContact O-CB 3.34Å; S50-S54 PolarHBondContact O-N 3.3Å; S50-S54 PolarHBondContact O-OG 2.78Å; N51-S54 PolarHBondContact O-N 3.37Å; M52-S54 VanDerWaalsContact C-N 3.31Å; M52-S54 PolarHBondContact O-N 2.95Å; S54-R56 VanDerWaalsContact C-N 3.28Å; S54-R56 PolarHBondContact O-N 3.34Å; S54-K57 WeakPolarHBondContact O-CB 3.4Å; S54-K57 PolarHBondContact O-N 2.91Å; S54-K57 VanDerWaalsContact O-N 3.12Å
55G91.1Very high91.4Very high14 Ų1449.2 Ų49.214%0.14429%0.286CS..Hα-helixtrans-59.1-37.8175.200000112.9N51 M52 K57 L58 F59N51-G55 PolarHBondContact O-N 2.8Å; M52-G55 PolarHBondContact O-N 3.45Å; G55-K57 VanDerWaalsContact C-N 3.31Å; G55-K57 PolarHBondContact O-N 3.12Å; G55-L58 WeakPolarHBondContact O-CB 3.11Å; G55-L58 PolarHBondContact O-N 2.95Å; G55-L58 VanDerWaalsContact O-N 3.15Å; G55-F59 WeakPolarHBondContact O-CD2 3.43Å; G55-F59 PolarHBondContact O-N 2.92Å
56R92.6Very high91.3Very high14 Ų1452 Ų525%0.05330%0.301CS..Hα-helixtrans-61.8-34.4175.3-70.6176.668.5-152.3-6.6113.8D15 F18 R19 Q22 M52 S53 S54 L58 F59 R60D15-R56 VanDerWaalsContact OD1-CB 3.25Å; D15-R56 WeakPolarHBondContact OD1-CB 3.2Å; D15-R56 VanDerWaalsContact OD1-CG 3.3Å; D15-R56 WeakPolarHBondContact OD1-CG 3.45Å; D15-R56 IonicContact OD1-NE 3.1Å; D15-R56 PolarHBondContact OD1-NE 3.26Å; F18-R56 HydrophobicContact CB-CG 3.51Å; F18-R56 HydrophobicContact CG-CG 4.49Å; R19-R56 VanDerWaalsContact NH1-NH2 3.18Å; Q22-R56 VanDerWaalsContact OE1-CD 3.25Å; M52-R56 VanDerWaalsContact O-CG 3.26Å; M52-R56 WeakPolarHBondContact O-CG 3.11Å; M52-R56 PolarHBondContact O-N 2.97Å; S53-R56 PolarHBondContact O-N 3.37Å; S54-R56 VanDerWaalsContact C-N 3.28Å; S54-R56 PolarHBondContact O-N 3.34Å; R56-L58 VanDerWaalsContact C-N 3.26Å; R56-L58 PolarHBondContact O-N 3.04Å; R56-F59 PolarHBondContact O-N 3.23Å; R56-R60 WeakPolarHBondContact O-CB 3.39Å; R56-R60 VanDerWaalsContact O-CG 3.23Å; R56-R60 WeakPolarHBondContact O-CG 3.38Å; R56-R60 PolarHBondContact O-N 3.25Å; R56-R60 VanDerWaalsContact O-N 3.13Å; R56-R60 PolarHBondContact O-NE 3.4Å; R56-R60 VanDerWaalsContact O-NE 3.12Å
57K90.2Very high91.2Very high33 Ų3348.3 Ų48.314%0.14329%0.285CS..Hα-helixtrans-60.3-40.8175.8-70.9-177.6175.4-160.60110.8S53 S54 G55 R60 L61 W104 N107S53-K57 PolarHBondContact O-N 3.15Å; S54-K57 WeakPolarHBondContact O-CB 3.4Å; S54-K57 PolarHBondContact O-N 2.91Å; S54-K57 VanDerWaalsContact O-N 3.12Å; G55-K57 VanDerWaalsContact C-N 3.31Å; G55-K57 PolarHBondContact O-N 3.12Å; K57-R60 VanDerWaalsContact CG-NH2 3.26Å; K57-R60 PolarHBondContact O-N 3.25Å; K57-L61 PolarHBondContact O-N 3.28Å; K57-W104 HydrophobicContact CB-CB 4.48Å; K57-W104 HydrophobicContact CB-CG 4.45Å; K57-W104 HydrophobicContact CD-CB 4.34Å; K57-N107 PolarHBondContact NZ-ND2 2.87Å
58L88.7Confident91.2Very high94 Ų9449 Ų4949%0.49228%0.282SS..Hα-helixtrans-64.4-45.5178.1-62.7173.9000112.2G55 R56 R60 L61 W104G55-L58 WeakPolarHBondContact O-CB 3.11Å; G55-L58 PolarHBondContact O-N 2.95Å; G55-L58 VanDerWaalsContact O-N 3.15Å; R56-L58 VanDerWaalsContact C-N 3.26Å; R56-L58 PolarHBondContact O-N 3.04Å; L58-R60 PolarHBondContact O-N 3.47Å; L58-L61 HydrophobicContact CD2-CD1 4.2Å; L58-L61 WeakPolarHBondContact O-CB 3.5Å; L58-L61 WeakPolarHBondContact O-CG 3.38Å; L58-L61 PolarHBondContact O-N 2.86Å; L58-W104 HydrophobicContact CD2-CZ2 3.73Å; L58-W104 VanDerWaalsContact CD2-NE1 3.26Å
59F90Very high91.2Very high53 Ų5348.9 Ų48.923%0.23228%0.283CS..Hα-helixtrans-68.1-17.9177.6-68.5-60.9000113.9R14 D15 F18 G55 R56R14-F59 HydrophobicContact CB-CD1 4.28Å; R14-F59 HydrophobicContact CB-CD2 4.46Å; R14-F59 HydrophobicContact CB-CE1 3.97Å; R14-F59 HydrophobicContact CB-CE2 4.14Å; R14-F59 HydrophobicContact CB-CZ 3.89Å; D15-F59 HydrophobicContact CB-CB 3.85Å; F18-F59 HydrophobicContact CD1-CE2 4.3Å; F18-F59 HydrophobicContact CD2-CD2 4.49Å; F18-F59 HydrophobicContact CD2-CE2 4.12Å; F18-F59 HydrophobicContact CE1-CE2 4.06Å; F18-F59 AromaticContact CE2-CE2 3.88Å; F18-F59 HydrophobicContact CE2-CE2 3.88Å; F18-F59 HydrophobicContact CG-CE2 4.34Å; F18-F59 AromaticContact CZ-CE2 3.85Å; F18-F59 HydrophobicContact CZ-CE2 3.85Å; F18-F59 HydrophobicContact CZ-CZ 4.5Å; G55-F59 WeakPolarHBondContact O-CD2 3.43Å; G55-F59 PolarHBondContact O-N 2.92Å; R56-F59 PolarHBondContact O-N 3.23Å
60R88.6Confident91.1Very high14 Ų1448.8 Ų48.85%0.05329%0.287CS..Hα-helixtrans-89.1-10.4177.7-70.5179.8-61.4132.33113.4R56 K57 L58 G62 N63 Y96 F97 D100R56-R60 WeakPolarHBondContact O-CB 3.39Å; R56-R60 VanDerWaalsContact O-CG 3.23Å; R56-R60 WeakPolarHBondContact O-CG 3.38Å; R56-R60 PolarHBondContact O-N 3.25Å; R56-R60 VanDerWaalsContact O-N 3.13Å; R56-R60 PolarHBondContact O-NE 3.4Å; R56-R60 VanDerWaalsContact O-NE 3.12Å; K57-R60 VanDerWaalsContact CG-NH2 3.26Å; K57-R60 PolarHBondContact O-N 3.25Å; L58-R60 PolarHBondContact O-N 3.47Å; R60-G62 PolarHBondContact O-N 3.23Å; R60-N63 WeakPolarHBondContact CA-ND2 3.4Å; R60-N63 VanDerWaalsContact O-CB 3.26Å; R60-N63 WeakPolarHBondContact O-CB 3.49Å; R60-N63 PolarHBondContact O-N 3.42Å; R60-Y96 PolarHBondContact NH1-OH 3.45Å; R60-F97 HydrophobicContact CB-CD1 4.24Å; R60-F97 HydrophobicContact CB-CE1 3.97Å; R60-F97 HydrophobicContact CG-CE1 4.04Å; R60-D100 IonicContact CZ-OD1 4Å; R60-D100 IonicContact CZ-OD2 2.95Å; R60-D100 IonicContact NE-OD2 2.78Å; R60-D100 IonicContact NH1-OD1 2.8Å; R60-D100 PolarHBondContact NH1-OD1 3.14Å; R60-D100 IonicContact NH1-OD2 3.39Å; R60-D100 PolarHBondContact NH1-OD2 3.32Å; R60-D100 VanDerWaalsContact NH1-OD2 3.1Å; R60-D100 IonicContact NH2-OD1 3.33Å; R60-D100 PolarHBondContact NH2-OD1 2.7Å; R60-D100 IonicContact NH2-OD2 3.18Å; R60-D100 PolarHBondContact NH2-OD2 3.19Å
61L87.6Confident91.1Very high68 Ų6846.3 Ų46.336%0.35627%0.271SS..THydrogen-bonded Turntrans-56134.6170.8-64176.1000109.8K57 L58 N63 N101 W104K57-L61 PolarHBondContact O-N 3.28Å; L58-L61 HydrophobicContact CD2-CD1 4.2Å; L58-L61 WeakPolarHBondContact O-CB 3.5Å; L58-L61 WeakPolarHBondContact O-CG 3.38Å; L58-L61 PolarHBondContact O-N 2.86Å; L61-N63 VanDerWaalsContact C-N 3.28Å; L61-N63 PolarHBondContact O-N 2.85Å; L61-N101 WeakPolarHBondContact CD2-OD1 3.43Å; L61-W104 HydrophobicContact CD1-CH2 4.26Å; L61-W104 HydrophobicContact CD1-CZ2 4.26Å; L61-W104 HydrophobicContact CD1-CZ3 4.45Å; L61-W104 HydrophobicContact CD2-CD2 4.29Å; L61-W104 HydrophobicContact CD2-CE3 4.02Å; L61-W104 HydrophobicContact CD2-CZ3 4.38Å
62G86.1Confident91.1Very high43 Ų4348.2 Ų48.244%0.44328%0.275SS..THydrogen-bonded Turntrans83.1-12.3-176.300000115.3R60 T64 V65R60-G62 PolarHBondContact O-N 3.23Å; G62-T64 PolarHBondContact O-N 3.42Å; G62-T64 VanDerWaalsContact O-N 3.13Å; G62-V65 WeakPolarHBondContact O-CB 3.38Å; G62-V65 PolarHBondContact O-N 3.27Å
63N90.3Very high91.1Very high14 Ų1453.8 Ų53.88%0.07529%0.293CS..Hα-helixtrans-66-15.7176.2-77.6-20.9000114R60 L61 V65 N66 S67 F97R60-N63 WeakPolarHBondContact CA-ND2 3.4Å; R60-N63 VanDerWaalsContact O-CB 3.26Å; R60-N63 WeakPolarHBondContact O-CB 3.49Å; R60-N63 PolarHBondContact O-N 3.42Å; L61-N63 VanDerWaalsContact C-N 3.28Å; L61-N63 PolarHBondContact O-N 2.85Å; N63-V65 VanDerWaalsContact C-N 3.28Å; N63-V65 PolarHBondContact O-N 3.31Å; N63-N66 PolarHBondContact O-N 3.47Å; N63-N66 PolarHBondContact OD1-ND2 2.89Å; N63-S67 WeakPolarHBondContact O-CB 3.41Å; N63-S67 PolarHBondContact O-N 3.39Å; N63-S67 PolarHBondContact O-OG 2.97Å; N63-F97 HydrophobicContact CB-CD1 3.94Å; N63-F97 HydrophobicContact CB-CD2 3.77Å; N63-F97 HydrophobicContact CB-CE1 3.76Å; N63-F97 HydrophobicContact CB-CE2 3.57Å; N63-F97 HydrophobicContact CB-CG 3.97Å; N63-F97 HydrophobicContact CB-CZ 3.58Å
64T91.9Very high91.1Very high17 Ų1752.4 Ų52.410%0.10428%0.283CS..Hα-helixtrans-55.5-45.4167.7-51.10000110.8G62 S67 I68 A94 F97 I98 N101G62-T64 PolarHBondContact O-N 3.42Å; G62-T64 VanDerWaalsContact O-N 3.13Å; T64-S67 PolarHBondContact O-N 2.97Å; T64-I68 HydrophobicContact CG2-CD1 3.99Å; T64-I68 WeakPolarHBondContact O-CG1 3.38Å; T64-I68 PolarHBondContact O-N 2.75Å; T64-A94 HydrophobicContact CG2-CB 4.4Å; T64-F97 WeakPolarHBondContact OG1-CB 3.46Å; T64-I98 HydrophobicContact CG2-CD1 3.98Å; T64-I98 HydrophobicContact CG2-CG1 3.61Å; T64-N101 PolarHBondContact OG1-ND2 3.25Å
65V92.7Very high91.2Very high101 Ų10154.2 Ų54.261%0.61229%0.288SS*.Hα-helixtrans-65.2-44.8179.8-177.60000110.5G62 N63 S67 I68 D69G62-V65 WeakPolarHBondContact O-CB 3.38Å; G62-V65 PolarHBondContact O-N 3.27Å; N63-V65 VanDerWaalsContact C-N 3.28Å; N63-V65 PolarHBondContact O-N 3.31Å; V65-S67 PolarHBondContact O-N 2.91Å; V65-I68 PolarHBondContact O-N 2.88Å; V65-D69 PolarHBondContact O-N 3.28Å
66N92.3Very high91.1Very high82 Ų8261.3 Ų61.344%0.43932%0.317SS..Hα-helixtrans-57.7-38.9175.4-66.8-28.8000112N63 A70N63-N66 PolarHBondContact O-N 3.47Å; N63-N66 PolarHBondContact OD1-ND2 2.89Å; N66-A70 VanDerWaalsContact O-CB 3.32Å; N66-A70 WeakPolarHBondContact O-CB 3.44Å; N66-A70 PolarHBondContact O-N 3.44Å
67S92.5Very high91Very high8 Ų861.9 Ų61.96%0.05632%0.321CS..Hα-helixtrans-73.1-36.7179.9-56.30000112.2N63 T64 V65 A70 A71 F97N63-S67 WeakPolarHBondContact O-CB 3.41Å; N63-S67 PolarHBondContact O-N 3.39Å; N63-S67 PolarHBondContact O-OG 2.97Å; T64-S67 PolarHBondContact O-N 2.97Å; V65-S67 PolarHBondContact O-N 2.91Å; S67-A70 PolarHBondContact O-N 3.27Å; S67-A71 WeakPolarHBondContact O-CB 3.45Å; S67-A71 PolarHBondContact O-N 3.4Å; S67-F97 WeakPolarHBondContact OG-CD2 3.43Å; S67-F97 WeakPolarHBondContact OG-CE2 3.33Å
68I93.3Very high90.9Very high77 Ų7766 Ų6640%0.39535%0.354SS..Hα-helixtrans-67.6-44.1174.1-67.6166.9000110.6T64 V65 A70 A71 K72 A94T64-I68 HydrophobicContact CG2-CD1 3.99Å; T64-I68 WeakPolarHBondContact O-CG1 3.38Å; T64-I68 PolarHBondContact O-N 2.75Å; V65-I68 PolarHBondContact O-N 2.88Å; I68-A70 VanDerWaalsContact C-N 3.33Å; I68-A70 PolarHBondContact O-N 3.26Å; I68-A71 WeakPolarHBondContact O-CB 3.49Å; I68-A71 PolarHBondContact O-N 3.01Å; I68-K72 WeakPolarHBondContact O-CG 3.46Å; I68-K72 PolarHBondContact O-N 3.1Å; I68-A94 HydrophobicContact CG1-CB 3.98Å
69D94.5Very high91Very high68 Ų6863.2 Ų63.236%0.36434%0.34SS..Hα-helixtrans-60.5-44.4175.2-173.161.4000111.1V65 A71 K72 R73V65-D69 PolarHBondContact O-N 3.28Å; D69-A71 VanDerWaalsContact C-N 3.34Å; D69-A71 PolarHBondContact O-N 3.47Å; D69-K72 PolarHBondContact O-N 3.28Å; D69-K72 VanDerWaalsContact O-N 3.16Å; D69-R73 WeakPolarHBondContact O-CG 3.38Å; D69-R73 PolarHBondContact O-N 3.29Å; D69-R73 IonicContact OD1-NE 2.72Å; D69-R73 IonicContact OD2-CZ 3.22Å; D69-R73 IonicContact OD2-NE 3.8Å; D69-R73 PolarHBondContact OD2-NE 3Å; D69-R73 IonicContact OD2-NH2 3.96Å; D69-R73 PolarHBondContact OD2-NH2 3Å
70A91.9Very high91.1Very high31 Ų3165.1 Ų65.126%0.25636%0.357SS..Hα-helixtrans-59.9-42.4174.400000112.3N66 S67 I68 K72 R73 T74 N90N66-A70 VanDerWaalsContact O-CB 3.32Å; N66-A70 WeakPolarHBondContact O-CB 3.44Å; N66-A70 PolarHBondContact O-N 3.44Å; S67-A70 PolarHBondContact O-N 3.27Å; I68-A70 VanDerWaalsContact C-N 3.33Å; I68-A70 PolarHBondContact O-N 3.26Å; A70-K72 VanDerWaalsContact C-N 3.32Å; A70-K72 PolarHBondContact O-N 3.25Å; A70-R73 PolarHBondContact O-N 2.89Å; A70-T74 VanDerWaalsContact O-CG2 3.29Å; A70-T74 WeakPolarHBondContact O-CG2 3.25Å; A70-T74 PolarHBondContact O-N 3.26Å; A70-T74 PolarHBondContact O-OG1 3.33Å; A70-N90 HydrophobicContact CB-CB 4.45Å
71A93.1Very high91.2Very high11 Ų1167.3 Ų67.39%0.09137%0.372CS..Hα-helixtrans-63.1-36.6175.600000112.6S67 I68 D69 T74 N90 I91S67-A71 WeakPolarHBondContact O-CB 3.45Å; S67-A71 PolarHBondContact O-N 3.4Å; I68-A71 WeakPolarHBondContact O-CB 3.49Å; I68-A71 PolarHBondContact O-N 3.01Å; D69-A71 VanDerWaalsContact C-N 3.34Å; D69-A71 PolarHBondContact O-N 3.47Å; A71-T74 WeakPolarHBondContact CA-OG1 3.38Å; A71-T74 PolarHBondContact O-OG1 3.24Å; A71-N90 HydrophobicContact CB-CB 3.76Å; A71-I91 HydrophobicContact CB-CG1 4.14Å
72K93.3Very high91.4Very high136 Ų13665.4 Ų65.459%0.59136%0.362SS*.Hα-helixtrans-67.1-42.8175.3-72.6179.4178.8-176.60111.9I68 D69 A70 T74 L75I68-K72 WeakPolarHBondContact O-CG 3.46Å; I68-K72 PolarHBondContact O-N 3.1Å; D69-K72 PolarHBondContact O-N 3.28Å; D69-K72 VanDerWaalsContact O-N 3.16Å; A70-K72 VanDerWaalsContact C-N 3.32Å; A70-K72 PolarHBondContact O-N 3.25Å; K72-T74 VanDerWaalsContact C-N 3.31Å; K72-T74 PolarHBondContact O-N 3.29Å; K72-L75 WeakPolarHBondContact O-CB 3.34Å; K72-L75 PolarHBondContact O-N 3.17Å
73R92.4Very high91.8Very high155 Ų15567.9 Ų67.959%0.58536%0.358SS*.Hα-helixtrans-62.9-38.2177.2-67.7179.2-165-142.12.4111.8D69 A70 L75 Q76D69-R73 WeakPolarHBondContact O-CG 3.38Å; D69-R73 PolarHBondContact O-N 3.29Å; D69-R73 IonicContact OD1-NE 2.72Å; D69-R73 IonicContact OD2-CZ 3.22Å; D69-R73 IonicContact OD2-NE 3.8Å; D69-R73 PolarHBondContact OD2-NE 3Å; D69-R73 IonicContact OD2-NH2 3.96Å; D69-R73 PolarHBondContact OD2-NH2 3Å; A70-R73 PolarHBondContact O-N 2.89Å; R73-L75 PolarHBondContact O-N 2.92Å; R73-Q76 WeakPolarHBondContact O-CB 3.28Å; R73-Q76 PolarHBondContact O-N 3.44Å; R73-Q76 VanDerWaalsContact O-N 3.1Å
74T91.2Very high91.9Very high8 Ų872.4 Ų72.45%0.04938%0.381CS..Hα-helixtrans-66.8-23.2-179.353.20000113.1A70 A71 K72 Q76 L77 R83 L86 T87A70-T74 VanDerWaalsContact O-CG2 3.29Å; A70-T74 WeakPolarHBondContact O-CG2 3.25Å; A70-T74 PolarHBondContact O-N 3.26Å; A70-T74 PolarHBondContact O-OG1 3.33Å; A71-T74 WeakPolarHBondContact CA-OG1 3.38Å; A71-T74 PolarHBondContact O-OG1 3.24Å; K72-T74 VanDerWaalsContact C-N 3.31Å; K72-T74 PolarHBondContact O-N 3.29Å; T74-Q76 PolarHBondContact O-N 3.04Å; T74-L77 HydrophobicContact CG2-CD1 4.21Å; T74-L77 WeakPolarHBondContact O-CB 3.3Å; T74-L77 WeakPolarHBondContact O-CG 3.26Å; T74-L77 PolarHBondContact O-N 2.83Å; T74-R83 WeakPolarHBondContact O-CG 3.5Å; T74-L86 HydrophobicContact CG2-CB 3.53Å; T74-L86 HydrophobicContact CG2-CD1 4.13Å; T74-L86 HydrophobicContact CG2-CG 4.47Å; T74-T87 WeakPolarHBondContact OG1-CA 3.39Å; T74-T87 PolarHBondContact OG1-OG1 3.36Å
75L90.2Very high92Very high98 Ų9871.9 Ų71.951%0.51338%0.379SS..THydrogen-bonded Turntrans-64.2-23173.8-67.5173.2000113.3K72 R73 L77 R83 T87K72-L75 WeakPolarHBondContact O-CB 3.34Å; K72-L75 PolarHBondContact O-N 3.17Å; R73-L75 PolarHBondContact O-N 2.92Å; L75-L77 VanDerWaalsContact C-N 3.31Å; L75-R83 PolarHBondContact O-NE 3.4Å; L75-T87 HydrophobicContact CD2-CG2 3.93Å; L75-T87 HydrophobicContact CG-CG2 4.44Å
76Q90.5Very high92.1Very high163 Ų16368 Ų6876%0.76236%0.355SS*.THydrogen-bonded Turntrans-83.6-6.7-179.6-60.9178.3-12.800112.9R73 T74R73-Q76 WeakPolarHBondContact O-CB 3.28Å; R73-Q76 PolarHBondContact O-N 3.44Å; R73-Q76 VanDerWaalsContact O-N 3.1Å; T74-Q76 PolarHBondContact O-N 3.04Å
77L89.1Confident92.2Very high26 Ų2665 Ų6514%0.13634%0.339CS..  trans-68.6133-178.8-65.5173.7000111.3T74 L75 D79 L82 R83 L86 P246T74-L77 HydrophobicContact CG2-CD1 4.21Å; T74-L77 WeakPolarHBondContact O-CB 3.3Å; T74-L77 WeakPolarHBondContact O-CG 3.26Å; T74-L77 PolarHBondContact O-N 2.83Å; L75-L77 VanDerWaalsContact C-N 3.31Å; L77-D79 PolarHBondContact O-N 3.32Å; L77-L82 HydrophobicContact CD1-CD2 4.09Å; L77-L82 HydrophobicContact CD1-CG 3.96Å; L77-R83 HydrophobicContact CB-CB 4.34Å; L77-R83 PolarHBondContact O-NE 3.37Å; L77-R83 PolarHBondContact O-NH2 3.34Å; L77-L86 HydrophobicContact CD1-CD1 3.7Å; L77-P246 WeakPolarHBondContact CD2-OXT 3.24Å
78S88.1Confident92.3Very high118 Ų11866.8 Ų66.883%0.82535%0.35SS*.SBendtrans-65.6-38-178.2-54.40000113.3
79D91.6Very high92.4Very high37 Ų3763.2 Ų63.220%0.19833%0.331CS..  trans-74.5118.9-179.1-175.3-39.7000110.7L77 V81 L82 R83 Y140 Q144L77-D79 PolarHBondContact O-N 3.32Å; D79-V81 PolarHBondContact O-N 3.33Å; D79-V81 PolarHBondContact OD1-N 3.45Å; D79-L82 HydrophobicContact CB-CB 3.86Å; D79-L82 PolarHBondContact O-N 2.9Å; D79-L82 PolarHBondContact OD1-N 3Å; D79-R83 WeakPolarHBondContact O-CB 3.39Å; D79-R83 PolarHBondContact O-N 3.28Å; D79-Y140 VanDerWaalsContact OD2-CE1 3.31Å; D79-Y140 WeakPolarHBondContact OD2-CE1 3.47Å; D79-Y140 PolarHBondContact OD2-OH 3.43Å; D79-Q144 PolarHBondContact OD2-NE2 3.24Å
80P91.6Very high92.5Very high93 Ų9360.9 Ų60.960%0.60432%0.319SS*.Hα-helixtrans-68-33.1-175.227.7-34.6000113.3L84P80-L84 WeakPolarHBondContact O-CB 3.39Å; P80-L84 PolarHBondContact O-N 3.09Å
81V92.2Very high92.7Very high59 Ų5963.5 Ų63.536%0.35833%0.328SS..Hα-helixtrans-70.9-47.7179.7-179.60000109D79 R83 L84 C85 Y140D79-V81 PolarHBondContact O-N 3.33Å; D79-V81 PolarHBondContact OD1-N 3.45Å; V81-R83 VanDerWaalsContact C-N 3.34Å; V81-R83 PolarHBondContact O-N 3.44Å; V81-L84 PolarHBondContact O-N 3.02Å; V81-C85 PolarHBondContact O-N 3.24Å; V81-C85 PolarHBondContact O-SG 3.45Å; V81-C85 VanDerWaalsContact O-SG 3.41Å; V81-Y140 HydrophobicContact CB-CD2 4.47Å; V81-Y140 HydrophobicContact CB-CE1 4.09Å; V81-Y140 HydrophobicContact CB-CE2 4.01Å; V81-Y140 HydrophobicContact CG1-CD1 4.26Å; V81-Y140 HydrophobicContact CG1-CD2 3.83Å; V81-Y140 HydrophobicContact CG1-CE1 4.26Å; V81-Y140 HydrophobicContact CG1-CE2 3.84Å; V81-Y140 HydrophobicContact CG1-CG 4.03Å; V81-Y140 HydrophobicContact CG2-CE2 4.13Å
82L91.6Very high92.9Very high28 Ų2864.3 Ų64.315%0.14733%0.33CS..Hα-helixtrans-60.7-44.7176.7-17561.6000111.5L77 D79 L84 L86 R137L77-L82 HydrophobicContact CD1-CD2 4.09Å; L77-L82 HydrophobicContact CD1-CG 3.96Å; D79-L82 HydrophobicContact CB-CB 3.86Å; D79-L82 PolarHBondContact O-N 2.9Å; D79-L82 PolarHBondContact OD1-N 3Å; L82-L84 PolarHBondContact O-N 3.49Å; L82-L86 HydrophobicContact CD1-CD1 3.55Å; L82-L86 HydrophobicContact CD1-CG 3.91Å; L82-L86 HydrophobicContact CG-CD1 3.82Å; L82-L86 HydrophobicContact CG-CG 4.43Å; L82-L86 WeakPolarHBondContact O-CB 3.41Å; L82-L86 WeakPolarHBondContact O-CG 3.47Å; L82-L86 PolarHBondContact O-N 2.87Å; L82-R137 HydrophobicContact CD1-CG 3.22Å
83R93.2Very high93Very high96 Ų9660.6 Ų60.636%0.36231%0.313SS..Hα-helixtrans-55.4-51.2175.6-179.1-173.6-56.9176.62111T74 L75 L77 D79 V81 T87T74-R83 WeakPolarHBondContact O-CG 3.5Å; L75-R83 PolarHBondContact O-NE 3.4Å; L77-R83 HydrophobicContact CB-CB 4.34Å; L77-R83 PolarHBondContact O-NE 3.37Å; L77-R83 PolarHBondContact O-NH2 3.34Å; D79-R83 WeakPolarHBondContact O-CB 3.39Å; D79-R83 PolarHBondContact O-N 3.28Å; V81-R83 VanDerWaalsContact C-N 3.34Å; V81-R83 PolarHBondContact O-N 3.44Å; R83-T87 WeakPolarHBondContact O-CB 3.29Å; R83-T87 PolarHBondContact O-N 3.01Å; R83-T87 PolarHBondContact O-OG1 2.99Å
84L93.9Very high93.1Very high108 Ų10853.6 Ų53.657%0.56529%0.288SS*.Hα-helixtrans-64.6-52-178.1-176.4136.9000111.3P80 V81 L82 L86 T87 V88P80-L84 WeakPolarHBondContact O-CB 3.39Å; P80-L84 PolarHBondContact O-N 3.09Å; V81-L84 PolarHBondContact O-N 3.02Å; L82-L84 PolarHBondContact O-N 3.49Å; L84-L86 PolarHBondContact O-N 3.46Å; L84-T87 PolarHBondContact O-N 2.98Å; L84-V88 HydrophobicContact CG-CG2 4.45Å; L84-V88 WeakPolarHBondContact O-CB 3.48Å; L84-V88 VanDerWaalsContact O-CG2 3.26Å; L84-V88 WeakPolarHBondContact O-CG2 3.46Å; L84-V88 PolarHBondContact O-N 2.91Å
85C93.5Very high93.4Very high7 Ų756.8 Ų56.85%0.04730%0.304CS..Hα-helixtrans-58.3-49.3-178.8-69.90000111.9V81 A89 R137V81-C85 PolarHBondContact O-N 3.24Å; V81-C85 PolarHBondContact O-SG 3.45Å; V81-C85 VanDerWaalsContact O-SG 3.41Å; C85-A89 WeakPolarHBondContact O-CB 3.4Å; C85-A89 PolarHBondContact O-N 3.13Å; C85-R137 HydrophobicContact CB-CB 3.98Å
86L93.6Very high93.6Very high20 Ų2053.9 Ų53.911%0.10529%0.287CS..Hα-helixtrans-71.2-37-177.7-68.7178.5000112.9T74 L77 L82 L84 A89 N90 R137T74-L86 HydrophobicContact CG2-CB 3.53Å; T74-L86 HydrophobicContact CG2-CD1 4.13Å; T74-L86 HydrophobicContact CG2-CG 4.47Å; L77-L86 HydrophobicContact CD1-CD1 3.7Å; L82-L86 HydrophobicContact CD1-CD1 3.55Å; L82-L86 HydrophobicContact CD1-CG 3.91Å; L82-L86 HydrophobicContact CG-CD1 3.82Å; L82-L86 HydrophobicContact CG-CG 4.43Å; L82-L86 WeakPolarHBondContact O-CB 3.41Å; L82-L86 WeakPolarHBondContact O-CG 3.47Å; L82-L86 PolarHBondContact O-N 2.87Å; L84-L86 PolarHBondContact O-N 3.46Å; L86-A89 PolarHBondContact O-N 3.28Å; L86-N90 WeakPolarHBondContact O-CB 3.25Å; L86-N90 PolarHBondContact O-N 3.28Å; L86-N90 PolarHBondContact O-ND2 2.97Å; L86-R137 HydrophobicContact CD2-CB 4.41Å; L86-R137 HydrophobicContact CD2-CG 3.88Å; L86-R137 HydrophobicContact CG-CG 4.04Å
87T94.3Very high93.8Very high17 Ų1747.1 Ų47.110%0.10426%0.255CS..Hα-helixtrans-64.8-48.5177.6-58.60000110.2T74 L75 R83 L84 A89 N90 I91T74-T87 WeakPolarHBondContact OG1-CA 3.39Å; T74-T87 PolarHBondContact OG1-OG1 3.36Å; L75-T87 HydrophobicContact CD2-CG2 3.93Å; L75-T87 HydrophobicContact CG-CG2 4.44Å; R83-T87 WeakPolarHBondContact O-CB 3.29Å; R83-T87 PolarHBondContact O-N 3.01Å; R83-T87 PolarHBondContact O-OG1 2.99Å; L84-T87 PolarHBondContact O-N 2.98Å; T87-A89 VanDerWaalsContact C-N 3.32Å; T87-A89 PolarHBondContact O-N 3.41Å; T87-N90 PolarHBondContact O-N 3Å; T87-I91 HydrophobicContact CG2-CD1 3.82Å; T87-I91 HydrophobicContact CG2-CG1 4.45Å; T87-I91 VanDerWaalsContact O-CG1 3.29Å; T87-I91 WeakPolarHBondContact O-CG1 3.33Å; T87-I91 PolarHBondContact O-N 3.23Å
88V95.9Very high94Very high47 Ų4749.3 Ų49.329%0.28527%0.266SS..Hα-helixtrans-64.1-39.2177.2178.80000110.8L84 N90 N92 M133L84-V88 HydrophobicContact CG-CG2 4.45Å; L84-V88 WeakPolarHBondContact O-CB 3.48Å; L84-V88 VanDerWaalsContact O-CG2 3.26Å; L84-V88 WeakPolarHBondContact O-CG2 3.46Å; L84-V88 PolarHBondContact O-N 2.91Å; V88-N90 PolarHBondContact O-N 3.29Å; V88-N92 WeakPolarHBondContact CG1-ND2 3.45Å; V88-N92 WeakPolarHBondContact O-CB 3.19Å; V88-N92 PolarHBondContact O-N 3.39Å; V88-N92 PolarHBondContact O-ND2 3.05Å; V88-M133 HydrophobicContact CB-CG 4.27Å; V88-M133 HydrophobicContact CB-SD 4.25Å; V88-M133 HydrophobicContact CG1-CE 3.94Å; V88-M133 HydrophobicContact CG1-CG 3.87Å; V88-M133 HydrophobicContact CG1-SD 4.07Å
89A95.6Very high94.3Very high1 Ų144.2 Ų44.21%0.00823%0.23CC..Hα-helixtrans-60.2-45175.400000112.3C85 L86 T87 R93 S130 M133C85-A89 WeakPolarHBondContact O-CB 3.4Å; C85-A89 PolarHBondContact O-N 3.13Å; L86-A89 PolarHBondContact O-N 3.28Å; T87-A89 VanDerWaalsContact C-N 3.32Å; T87-A89 PolarHBondContact O-N 3.41Å; A89-R93 WeakPolarHBondContact O-CB 3.23Å; A89-R93 PolarHBondContact O-N 3.42Å; A89-S130 WeakPolarHBondContact O-CB 3.5Å; A89-S130 PolarHBondContact O-OG 2.9Å; A89-M133 HydrophobicContact CB-CB 3.79Å
90N95.4Very high94.3Very high20 Ų2043 Ų4311%0.10722%0.224CC..Hα-helixtrans-74.5-34.7-178.4-75.1-36.5000113A70 A71 L86 T87 V88 R93 A94A70-N90 HydrophobicContact CB-CB 4.45Å; A71-N90 HydrophobicContact CB-CB 3.76Å; L86-N90 WeakPolarHBondContact O-CB 3.25Å; L86-N90 PolarHBondContact O-N 3.28Å; L86-N90 PolarHBondContact O-ND2 2.97Å; T87-N90 PolarHBondContact O-N 3Å; V88-N90 PolarHBondContact O-N 3.29Å; N90-R93 WeakPolarHBondContact O-CB 3.49Å; N90-R93 PolarHBondContact O-N 3.48Å; N90-R93 PolarHBondContact OD1-NH1 3.46Å; N90-A94 PolarHBondContact O-N 2.91Å
91I96.6Very high94.3Very high85 Ų8540.4 Ų40.444%0.43621%0.205SC..Hα-helixtrans-62.5-49.3171.9-70.2169.6000110.2A71 T87 R93 A94 L95A71-I91 HydrophobicContact CB-CG1 4.14Å; T87-I91 HydrophobicContact CG2-CD1 3.82Å; T87-I91 HydrophobicContact CG2-CG1 4.45Å; T87-I91 VanDerWaalsContact O-CG1 3.29Å; T87-I91 WeakPolarHBondContact O-CG1 3.33Å; T87-I91 PolarHBondContact O-N 3.23Å; I91-R93 PolarHBondContact O-N 3.47Å; I91-A94 WeakPolarHBondContact O-CB 3.39Å; I91-A94 PolarHBondContact O-N 2.78Å; I91-L95 HydrophobicContact CG2-CD1 4.41Å; I91-L95 WeakPolarHBondContact O-CG 3.21Å; I91-L95 PolarHBondContact O-N 3.07Å
92N96.7Very high94.3Very high28 Ų2839.1 Ų39.115%0.1520%0.197CC..Hα-helixtrans-60.1-35176.2-80.7-51.7000112.1V88 L95 Y96 C126 M129V88-N92 WeakPolarHBondContact CG1-ND2 3.45Å; V88-N92 WeakPolarHBondContact O-CB 3.19Å; V88-N92 PolarHBondContact O-N 3.39Å; V88-N92 PolarHBondContact O-ND2 3.05Å; N92-L95 PolarHBondContact O-N 3.22Å; N92-Y96 WeakPolarHBondContact O-CB 3.43Å; N92-Y96 PolarHBondContact O-N 3.26Å; N92-C126 WeakPolarHBondContact CB-O 3.41Å; N92-M129 HydrophobicContact CB-CB 4.49Å
93R95.4Very high94.3Very high59 Ų5938.3 Ų38.322%0.22319%0.193CC..Hα-helixtrans-67.2-38.5174.4-164.1161.4-67.1135.2-1.9112.5A89 N90 I91 Y96 F97 S130 S134A89-R93 WeakPolarHBondContact O-CB 3.23Å; A89-R93 PolarHBondContact O-N 3.42Å; N90-R93 WeakPolarHBondContact O-CB 3.49Å; N90-R93 PolarHBondContact O-N 3.48Å; N90-R93 PolarHBondContact OD1-NH1 3.46Å; I91-R93 PolarHBondContact O-N 3.47Å; R93-Y96 WeakPolarHBondContact O-CB 3.08Å; R93-Y96 PolarHBondContact O-N 3.27Å; R93-F97 HydrophobicContact CG-CD2 4.15Å; R93-F97 HydrophobicContact CG-CE2 3.67Å; R93-F97 WeakPolarHBondContact O-CD2 3.35Å; R93-F97 PolarHBondContact O-N 3.05Å; R93-S130 PolarHBondContact NE-OG 3.26Å; R93-S130 PolarHBondContact NH2-OG 3.15Å; R93-S134 PolarHBondContact NH2-OG 2.86Å
94A95.9Very high94.2Very high7 Ų737 Ų376%0.05819%0.188CC..Hα-helixtrans-63.2-45.9172.800000111.4T64 I68 N90 I91 Y96 F97 I98T64-A94 HydrophobicContact CG2-CB 4.4Å; I68-A94 HydrophobicContact CG1-CB 3.98Å; N90-A94 PolarHBondContact O-N 2.91Å; I91-A94 WeakPolarHBondContact O-CB 3.39Å; I91-A94 PolarHBondContact O-N 2.78Å; A94-Y96 VanDerWaalsContact C-N 3.33Å; A94-Y96 PolarHBondContact O-N 3.1Å; A94-F97 PolarHBondContact O-N 3.01Å; A94-I98 WeakPolarHBondContact O-CG1 3.28Å; A94-I98 PolarHBondContact O-N 3.48Å
95L95.7Very high94.1Very high76 Ų7632.6 Ų32.640%0.39817%0.167SC..Hα-helixtrans-60.5-41.4175.9-67.7176.2000112.1I91 N92 I98 C99 C126I91-L95 HydrophobicContact CG2-CD1 4.41Å; I91-L95 WeakPolarHBondContact O-CG 3.21Å; I91-L95 PolarHBondContact O-N 3.07Å; N92-L95 PolarHBondContact O-N 3.22Å; L95-I98 HydrophobicContact CD2-CD1 4.46Å; L95-I98 PolarHBondContact O-N 3.06Å; L95-C99 PolarHBondContact O-N 3.3Å; L95-C99 PolarHBondContact O-SG 2.97Å; L95-C126 HydrophobicContact CB-CB 4.3Å
96Y95.3Very high93.9Very high36 Ų3635.7 Ų35.714%0.14118%0.178CC..Hα-helixtrans-56.6-49.7172.5163.6-104.4000112R60 N92 R93 A94 I98 C99 D100 A123 Y127R60-Y96 PolarHBondContact NH1-OH 3.45Å; N92-Y96 WeakPolarHBondContact O-CB 3.43Å; N92-Y96 PolarHBondContact O-N 3.26Å; R93-Y96 WeakPolarHBondContact O-CB 3.08Å; R93-Y96 PolarHBondContact O-N 3.27Å; A94-Y96 VanDerWaalsContact C-N 3.33Å; A94-Y96 PolarHBondContact O-N 3.1Å; Y96-I98 VanDerWaalsContact C-N 3.32Å; Y96-I98 PolarHBondContact O-N 3.29Å; Y96-C99 PolarHBondContact O-N 2.63Å; Y96-D100 PolarHBondContact O-N 3.41Å; Y96-A123 HydrophobicContact CD2-CB 4.06Å; Y96-A123 WeakPolarHBondContact CD2-O 3.26Å; Y96-A123 HydrophobicContact CE2-CB 4.39Å; Y96-Y127 HydrophobicContact CD2-CG 4.45Å; Y96-Y127 HydrophobicContact CE2-CG 4.41Å; Y96-Y127 HydrophobicContact CG-CD2 4.49Å
97F94.4Very high93.6Very high21 Ų2138.9 Ų38.99%0.09220%0.195CC..Hα-helixtrans-65.7-34.4179-73.3-57.7000112.7R60 N63 T64 S67 R93 A94 D100 N101R60-F97 HydrophobicContact CB-CD1 4.24Å; R60-F97 HydrophobicContact CB-CE1 3.97Å; R60-F97 HydrophobicContact CG-CE1 4.04Å; N63-F97 HydrophobicContact CB-CD1 3.94Å; N63-F97 HydrophobicContact CB-CD2 3.77Å; N63-F97 HydrophobicContact CB-CE1 3.76Å; N63-F97 HydrophobicContact CB-CE2 3.57Å; N63-F97 HydrophobicContact CB-CG 3.97Å; N63-F97 HydrophobicContact CB-CZ 3.58Å; T64-F97 WeakPolarHBondContact OG1-CB 3.46Å; S67-F97 WeakPolarHBondContact OG-CD2 3.43Å; S67-F97 WeakPolarHBondContact OG-CE2 3.33Å; R93-F97 HydrophobicContact CG-CD2 4.15Å; R93-F97 HydrophobicContact CG-CE2 3.67Å; R93-F97 WeakPolarHBondContact O-CD2 3.35Å; R93-F97 PolarHBondContact O-N 3.05Å; A94-F97 PolarHBondContact O-N 3.01Å; F97-D100 PolarHBondContact O-N 3.46Å; F97-N101 WeakPolarHBondContact O-CB 3.29Å; F97-N101 PolarHBondContact O-N 3.5Å; F97-N101 PolarHBondContact O-ND2 2.89Å; F97-N101 PolarHBondContact O-OD1 2.96Å
98I94.1Very high93.3Very high72 Ų7242.2 Ų42.237%0.36922%0.215SC..Hα-helixtrans-60-48.2172.5-68.5165.2000110.1T64 A94 L95 Y96 D100 N101 V102T64-I98 HydrophobicContact CG2-CD1 3.98Å; T64-I98 HydrophobicContact CG2-CG1 3.61Å; A94-I98 WeakPolarHBondContact O-CG1 3.28Å; A94-I98 PolarHBondContact O-N 3.48Å; L95-I98 HydrophobicContact CD2-CD1 4.46Å; L95-I98 PolarHBondContact O-N 3.06Å; Y96-I98 VanDerWaalsContact C-N 3.32Å; Y96-I98 PolarHBondContact O-N 3.29Å; I98-D100 VanDerWaalsContact C-N 3.34Å; I98-D100 PolarHBondContact O-N 3.08Å; I98-N101 PolarHBondContact O-N 2.68Å; I98-V102 WeakPolarHBondContact O-CG2 3.46Å; I98-V102 PolarHBondContact O-N 3.08Å
99C93.1Very high92.9Very high12 Ų1242.4 Ų42.48%0.08123%0.226CC..Hα-helixtrans-63.2-40.2177.3-61.30000112L95 Y96 V102 L103 W119 A123L95-C99 PolarHBondContact O-N 3.3Å; L95-C99 PolarHBondContact O-SG 2.97Å; Y96-C99 PolarHBondContact O-N 2.63Å; C99-V102 PolarHBondContact O-N 3.22Å; C99-L103 WeakPolarHBondContact O-CB 3.43Å; C99-L103 VanDerWaalsContact O-CG 3.3Å; C99-L103 WeakPolarHBondContact O-CG 3.22Å; C99-L103 PolarHBondContact O-N 3.45Å; C99-W119 HydrophobicContact CB-CE3 4.12Å; C99-A123 HydrophobicContact CB-CB 3.61Å
100D92.1Very high92.6Very high11 Ų1148 Ų486%0.05926%0.255CS..Hα-helixtrans-63.4-40177.1-166.280.5000111.7R60 Y96 F97 I98 L103 W104R60-D100 IonicContact CZ-OD1 4Å; R60-D100 IonicContact CZ-OD2 2.95Å; R60-D100 IonicContact NE-OD2 2.78Å; R60-D100 IonicContact NH1-OD1 2.8Å; R60-D100 PolarHBondContact NH1-OD1 3.14Å; R60-D100 IonicContact NH1-OD2 3.39Å; R60-D100 PolarHBondContact NH1-OD2 3.32Å; R60-D100 VanDerWaalsContact NH1-OD2 3.1Å; R60-D100 IonicContact NH2-OD1 3.33Å; R60-D100 PolarHBondContact NH2-OD1 2.7Å; R60-D100 IonicContact NH2-OD2 3.18Å; R60-D100 PolarHBondContact NH2-OD2 3.19Å; Y96-D100 PolarHBondContact O-N 3.41Å; F97-D100 PolarHBondContact O-N 3.46Å; I98-D100 VanDerWaalsContact C-N 3.34Å; I98-D100 PolarHBondContact O-N 3.08Å; D100-L103 PolarHBondContact O-N 3.43Å; D100-W104 WeakPolarHBondContact O-CB 3.45Å; D100-W104 PolarHBondContact O-N 3.07Å
101N92.6Very high92.1Very high39 Ų3949.8 Ų49.821%0.20927%0.267CS..Hα-helixtrans-65.2-41.7175.6-65.3-15.6000111.6L61 T64 F97 I98 W104 A105L61-N101 WeakPolarHBondContact CD2-OD1 3.43Å; T64-N101 PolarHBondContact OG1-ND2 3.25Å; F97-N101 WeakPolarHBondContact O-CB 3.29Å; F97-N101 PolarHBondContact O-N 3.5Å; F97-N101 PolarHBondContact O-ND2 2.89Å; F97-N101 PolarHBondContact O-OD1 2.96Å; I98-N101 PolarHBondContact O-N 2.68Å; N101-W104 PolarHBondContact O-N 2.83Å; N101-A105 WeakPolarHBondContact O-CB 3.09Å; N101-A105 PolarHBondContact O-N 3.49Å
102V92.1Very high91.3Very high31 Ų3150.8 Ų50.819%0.18828%0.279CS..Hα-helixtrans-63.1-44.6175.2170.50000110.9I98 C99 W104 A105 R106 I114 W119I98-V102 WeakPolarHBondContact O-CG2 3.46Å; I98-V102 PolarHBondContact O-N 3.08Å; C99-V102 PolarHBondContact O-N 3.22Å; V102-W104 VanDerWaalsContact C-N 3.31Å; V102-W104 PolarHBondContact O-N 2.72Å; V102-A105 PolarHBondContact O-N 3.14Å; V102-R106 PolarHBondContact O-N 3Å; V102-I114 HydrophobicContact CG1-CD1 3.46Å; V102-I114 VanDerWaalsContact CG1-CD1 3.46Å; V102-I114 HydrophobicContact CG1-CG2 4.21Å; V102-W119 HydrophobicContact CB-CE3 3.98Å; V102-W119 HydrophobicContact CB-CZ3 4Å; V102-W119 HydrophobicContact CG1-CD2 3.86Å; V102-W119 HydrophobicContact CG1-CE3 3.8Å; V102-W119 HydrophobicContact CG1-CG 4.47Å; V102-W119 HydrophobicContact CG1-CH2 4.22Å; V102-W119 HydrophobicContact CG1-CZ2 4.28Å; V102-W119 HydrophobicContact CG1-CZ3 4Å; V102-W119 HydrophobicContact CG2-CE3 4.32Å; V102-W119 HydrophobicContact CG2-CH2 4.13Å; V102-W119 HydrophobicContact CG2-CZ3 3.82Å
103L91.2Very high90.7Very high12 Ų1253.1 Ų53.16%0.06331%0.309CS..Hα-helixtrans-64.2-35.8175.9-72.7167.7000112.4C99 D100 N107 K116 W119 A123C99-L103 WeakPolarHBondContact O-CB 3.43Å; C99-L103 VanDerWaalsContact O-CG 3.3Å; C99-L103 WeakPolarHBondContact O-CG 3.22Å; C99-L103 PolarHBondContact O-N 3.45Å; D100-L103 PolarHBondContact O-N 3.43Å; L103-N107 VanDerWaalsContact O-CG 3.28Å; L103-N107 PolarHBondContact O-N 2.95Å; L103-N107 VanDerWaalsContact O-N 3.14Å; L103-K116 HydrophobicContact CD2-CG 4.15Å; L103-K116 WeakPolarHBondContact CD2-O 3.14Å; L103-W119 HydrophobicContact CD2-CB 3.8Å; L103-W119 HydrophobicContact CG-CB 4.12Å; L103-A123 HydrophobicContact CD1-CB 4.47Å
104W90.9Very high90.4Very high69 Ų6951.9 Ų51.926%0.26131%0.307SS..Hα-helixtrans-66.3-48.2172.9172.680.3000111.5K57 L58 L61 D100 N101 V102 R106 N107 V108K57-W104 HydrophobicContact CB-CB 4.48Å; K57-W104 HydrophobicContact CB-CG 4.45Å; K57-W104 HydrophobicContact CD-CB 4.34Å; L58-W104 HydrophobicContact CD2-CZ2 3.73Å; L58-W104 VanDerWaalsContact CD2-NE1 3.26Å; L61-W104 HydrophobicContact CD1-CH2 4.26Å; L61-W104 HydrophobicContact CD1-CZ2 4.26Å; L61-W104 HydrophobicContact CD1-CZ3 4.45Å; L61-W104 HydrophobicContact CD2-CD2 4.29Å; L61-W104 HydrophobicContact CD2-CE3 4.02Å; L61-W104 HydrophobicContact CD2-CZ3 4.38Å; D100-W104 WeakPolarHBondContact O-CB 3.45Å; D100-W104 PolarHBondContact O-N 3.07Å; N101-W104 PolarHBondContact O-N 2.83Å; V102-W104 VanDerWaalsContact C-N 3.31Å; V102-W104 PolarHBondContact O-N 2.72Å; W104-R106 VanDerWaalsContact C-N 3.29Å; W104-R106 PolarHBondContact O-N 3.3Å; W104-N107 WeakPolarHBondContact O-CB 3.48Å; W104-N107 PolarHBondContact O-N 3.46Å; W104-V108 HydrophobicContact CD2-CG2 4.43Å; W104-V108 HydrophobicContact CZ2-CG2 4.06Å; W104-V108 PolarHBondContact O-N 2.65Å; W104-V108 VanDerWaalsContact O-N 3.12Å
105A90.8Very high90.1Very high15 Ų1555.7 Ų55.712%0.12433%0.326CS..Hα-helixtrans-59.6-39.6178.200000112N101 V102 V108 G109 L110 V111N101-A105 WeakPolarHBondContact O-CB 3.09Å; N101-A105 PolarHBondContact O-N 3.49Å; V102-A105 PolarHBondContact O-N 3.14Å; A105-V108 PolarHBondContact O-N 3.22Å; A105-G109 PolarHBondContact O-N 3.44Å; A105-L110 HydrophobicContact CB-CB 4.27Å; A105-L110 HydrophobicContact CB-CD1 4.33Å; A105-L110 WeakPolarHBondContact O-CB 3.28Å; A105-L110 PolarHBondContact O-N 3.32Å; A105-V111 HydrophobicContact CB-CG2 4.3Å
106R90.3Very high89.9Confident72 Ų7257.7 Ų57.727%0.27233%0.332SS..Hα-helixtrans-59-47.9170.8175.1177179.876.3-9.5112.1V102 W104 V108 G109 P112 I114V102-R106 PolarHBondContact O-N 3Å; W104-R106 VanDerWaalsContact C-N 3.29Å; W104-R106 PolarHBondContact O-N 3.3Å; R106-V108 PolarHBondContact O-N 3.41Å; R106-G109 PolarHBondContact O-N 3.28Å; R106-P112 VanDerWaalsContact NH1-C 3.31Å; R106-P112 PolarHBondContact NH1-O 2.93Å; R106-I114 WeakPolarHBondContact CD-O 3.16Å; R106-I114 PolarHBondContact NE-O 3.49Å; R106-I114 VanDerWaalsContact NE-O 3.09Å; R106-I114 PolarHBondContact NH1-O 3.34Å; R106-I114 PolarHBondContact NH2-O 2.94Å
107N86.9Confident89.7Confident87 Ų8762.1 Ų62.147%0.46535%0.354SS..Hα-helixtrans-62.8-28.1-178.3-77.7-6.2000112.9K57 L103 W104 G109K57-N107 PolarHBondContact NZ-ND2 2.87Å; L103-N107 VanDerWaalsContact O-CG 3.28Å; L103-N107 PolarHBondContact O-N 2.95Å; L103-N107 VanDerWaalsContact O-N 3.14Å; W104-N107 WeakPolarHBondContact O-CB 3.48Å; W104-N107 PolarHBondContact O-N 3.46Å; N107-G109 VanDerWaalsContact C-N 3.32Å
108V88.1Confident89.6Confident87 Ų8769.1 Ų69.153%0.52738%0.38SS..Hα-helixtrans-83.6-10.5175.6178.70000112.1W104 A105 R106 L110W104-V108 HydrophobicContact CD2-CG2 4.43Å; W104-V108 HydrophobicContact CZ2-CG2 4.06Å; W104-V108 PolarHBondContact O-N 2.65Å; W104-V108 VanDerWaalsContact O-N 3.12Å; A105-V108 PolarHBondContact O-N 3.22Å; R106-V108 PolarHBondContact O-N 3.41Å; V108-L110 HydrophobicContact CG1-CG 4.29Å
109G87.5Confident89.5Confident50 Ų5069.8 Ų69.852%0.51538%0.378SS..THydrogen-bonded Turntrans91.16.1-179.700000114.7A105 R106 N107 V111A105-G109 PolarHBondContact O-N 3.44Å; R106-G109 PolarHBondContact O-N 3.28Å; N107-G109 VanDerWaalsContact C-N 3.32Å; G109-V111 VanDerWaalsContact C-N 3.34Å; G109-V111 PolarHBondContact O-N 3.45Å
110L88.6Confident89.5Confident119 Ų11970.1 Ų70.162%0.62338%0.38SS*.SBendtrans-70.1-30.2178.8-62.8175.1000112.6A105 V108A105-L110 HydrophobicContact CB-CB 4.27Å; A105-L110 HydrophobicContact CB-CD1 4.33Å; A105-L110 WeakPolarHBondContact O-CB 3.28Å; A105-L110 PolarHBondContact O-N 3.32Å; V108-L110 HydrophobicContact CG1-CG 4.29Å
111V86.5Confident89.6Confident58 Ų5872.6 Ų72.635%0.35239%0.393SS..  trans-13582.3180-161.70000111.4A105 G109 G113 I114A105-V111 HydrophobicContact CB-CG2 4.3Å; G109-V111 VanDerWaalsContact C-N 3.34Å; G109-V111 PolarHBondContact O-N 3.45Å; V111-G113 PolarHBondContact O-N 3.12Å; V111-I114 HydrophobicContact CB-CD1 4.06Å; V111-I114 HydrophobicContact CG1-CD1 3.38Å; V111-I114 HydrophobicContact CG1-CG1 3.67Å
112P78.4Confident89.6Confident105 Ų10575 Ų7568%0.68241%0.406SS*.THydrogen-bonded Turntrans-76-17.3-171.528.5-34.2000114.4R106R106-P112 VanDerWaalsContact NH1-C 3.31Å; R106-P112 PolarHBondContact NH1-O 2.93Å
113G84.6Confident89.7Confident77 Ų7773.8 Ų73.879%0.79440%0.399SS*.THydrogen-bonded Turntrans-85.2-1.9-175.700000116.5V111V111-G113 PolarHBondContact O-N 3.12Å
114I88.6Confident89.9Confident34 Ų3474.1 Ų74.117%0.17440%0.402CS..SBendtrans-87.6133.9-171.6-75179.1000113.1V102 R106 V111 K116 W119V102-I114 HydrophobicContact CG1-CD1 3.46Å; V102-I114 VanDerWaalsContact CG1-CD1 3.46Å; V102-I114 HydrophobicContact CG1-CG2 4.21Å; R106-I114 WeakPolarHBondContact CD-O 3.16Å; R106-I114 PolarHBondContact NE-O 3.49Å; R106-I114 VanDerWaalsContact NE-O 3.09Å; R106-I114 PolarHBondContact NH1-O 3.34Å; R106-I114 PolarHBondContact NH2-O 2.94Å; V111-I114 HydrophobicContact CB-CD1 4.06Å; V111-I114 HydrophobicContact CG1-CD1 3.38Å; V111-I114 HydrophobicContact CG1-CG1 3.67Å; I114-K116 PolarHBondContact O-N 3.45Å; I114-K116 VanDerWaalsContact O-N 3.08Å; I114-W119 HydrophobicContact CG2-CB 4.48Å; I114-W119 HydrophobicContact CG2-CD2 4.26Å; I114-W119 HydrophobicContact CG2-CG 3.73Å; I114-W119 VanDerWaalsContact CG2-NE1 3.31Å
115D91Very high90.1Very high87 Ų8773.4 Ų73.447%0.46541%0.407SS..  trans-64.4111.4171.8-174.2-21.6000112.2E117 R118 W119D115-E117 VanDerWaalsContact C-N 3.32Å; D115-E117 PolarHBondContact O-N 3.41Å; D115-E117 PolarHBondContact OD1-N 3.45Å; D115-R118 HydrophobicContact CB-CB 3.95Å; D115-R118 PolarHBondContact OD1-N 3.25Å; D115-R118 VanDerWaalsContact OD1-N 3.11Å; D115-W119 PolarHBondContact O-N 2.87Å
116K89.9Confident90.4Very high117 Ų11773.6 Ų73.651%0.50941%0.408SS..Hα-helixtrans-62.5-39.7179.6-175.6178.4175.1-178.70112.2L103 I114 S120L103-K116 HydrophobicContact CD2-CG 4.15Å; L103-K116 WeakPolarHBondContact CD2-O 3.14Å; I114-K116 PolarHBondContact O-N 3.45Å; I114-K116 VanDerWaalsContact O-N 3.08Å; K116-S120 WeakPolarHBondContact O-CB 3.5Å; K116-S120 PolarHBondContact O-N 2.91Å
117E91.3Very high90.6Very high130 Ų13071.5 Ų71.561%0.60740%0.4SS*.Hα-helixtrans-73-49.2-173.3-173.5168.9-175.900110D115 W119 S120 L121D115-E117 VanDerWaalsContact C-N 3.32Å; D115-E117 PolarHBondContact O-N 3.41Å; D115-E117 PolarHBondContact OD1-N 3.45Å; E117-W119 PolarHBondContact O-N 3.26Å; E117-S120 WeakPolarHBondContact O-CB 3.47Å; E117-S120 PolarHBondContact O-N 3.11Å; E117-S120 VanDerWaalsContact O-N 3.13Å; E117-L121 HydrophobicContact CG-CD1 4.22Å; E117-L121 WeakPolarHBondContact O-CG 3.39Å; E117-L121 PolarHBondContact O-N 3.13Å
118R92.3Very high91.1Very high168 Ų16869.7 Ų69.763%0.63439%0.388SS*.Hα-helixtrans-58-47.1177.5-172.6175.2179.6179.3-0.2112.5D115 S120 L121 N122D115-R118 HydrophobicContact CB-CB 3.95Å; D115-R118 PolarHBondContact OD1-N 3.25Å; D115-R118 VanDerWaalsContact OD1-N 3.11Å; R118-S120 VanDerWaalsContact C-N 3.33Å; R118-S120 PolarHBondContact O-N 3.32Å; R118-L121 PolarHBondContact O-N 3.19Å; R118-N122 PolarHBondContact O-N 3.13Å; R118-N122 PolarHBondContact O-OD1 2.64Å
119W93.3Very high91.4Very high86 Ų8669.6 Ų69.633%0.32638%0.383SS..Hα-helixtrans-67.8-33.6178-79.679.2000112.6C99 V102 L103 I114 D115 E117 A123C99-W119 HydrophobicContact CB-CE3 4.12Å; V102-W119 HydrophobicContact CB-CE3 3.98Å; V102-W119 HydrophobicContact CB-CZ3 4Å; V102-W119 HydrophobicContact CG1-CD2 3.86Å; V102-W119 HydrophobicContact CG1-CE3 3.8Å; V102-W119 HydrophobicContact CG1-CG 4.47Å; V102-W119 HydrophobicContact CG1-CH2 4.22Å; V102-W119 HydrophobicContact CG1-CZ2 4.28Å; V102-W119 HydrophobicContact CG1-CZ3 4Å; V102-W119 HydrophobicContact CG2-CE3 4.32Å; V102-W119 HydrophobicContact CG2-CH2 4.13Å; V102-W119 HydrophobicContact CG2-CZ3 3.82Å; L103-W119 HydrophobicContact CD2-CB 3.8Å; L103-W119 HydrophobicContact CG-CB 4.12Å; I114-W119 HydrophobicContact CG2-CB 4.48Å; I114-W119 HydrophobicContact CG2-CD2 4.26Å; I114-W119 HydrophobicContact CG2-CG 3.73Å; I114-W119 VanDerWaalsContact CG2-NE1 3.31Å; D115-W119 PolarHBondContact O-N 2.87Å; E117-W119 PolarHBondContact O-N 3.26Å; W119-A123 WeakPolarHBondContact O-CB 3.47Å; W119-A123 PolarHBondContact O-N 3.18Å
120S92.4Very high91.8Very high19 Ų1967.2 Ų67.213%0.13336%0.358CS..Hα-helixtrans-66.1-40.8172.9179.80000112.3K116 E117 R118 A123 S124 R211K116-S120 WeakPolarHBondContact O-CB 3.5Å; K116-S120 PolarHBondContact O-N 2.91Å; E117-S120 WeakPolarHBondContact O-CB 3.47Å; E117-S120 PolarHBondContact O-N 3.11Å; E117-S120 VanDerWaalsContact O-N 3.13Å; R118-S120 VanDerWaalsContact C-N 3.33Å; R118-S120 PolarHBondContact O-N 3.32Å; S120-A123 PolarHBondContact O-N 3.36Å; S120-S124 PolarHBondContact O-N 3.29Å; S120-S124 PolarHBondContact O-OG 2.83Å; S120-R211 PolarHBondContact OG-NE 2.7Å; S120-R211 VanDerWaalsContact OG-NE 3.12Å; S120-R211 PolarHBondContact OG-NH2 3.16Å
121L93.9Very high92.2Very high63 Ų6361.6 Ų61.633%0.3333%0.329SS..Hα-helixtrans-66.8-45177.3-72.2172.3000111E117 R118 A123 S124 C125 L212E117-L121 HydrophobicContact CG-CD1 4.22Å; E117-L121 WeakPolarHBondContact O-CG 3.39Å; E117-L121 PolarHBondContact O-N 3.13Å; R118-L121 PolarHBondContact O-N 3.19Å; L121-A123 VanDerWaalsContact C-N 3.34Å; L121-A123 PolarHBondContact O-N 3.3Å; L121-S124 PolarHBondContact O-N 3.17Å; L121-S124 VanDerWaalsContact O-N 3.17Å; L121-C125 PolarHBondContact O-N 2.93Å; L121-L212 HydrophobicContact CD2-CD2 4.48Å
122N94.1Very high92.6Very high89 Ų8961.1 Ų61.148%0.47633%0.326SS..Hα-helixtrans-60.4-42.4175.1-84.841.1000112R118 S124 C125 C126R118-N122 PolarHBondContact O-N 3.13Å; R118-N122 PolarHBondContact O-OD1 2.64Å; N122-S124 VanDerWaalsContact C-N 3.35Å; N122-S124 PolarHBondContact O-N 3.05Å; N122-C125 PolarHBondContact O-N 3.01Å; N122-C126 PolarHBondContact O-N 3Å; N122-C126 PolarHBondContact O-SG 3.47Å
123A94.1Very high93.5Very high5 Ų558.6 Ų58.64%0.04131%0.306CS..Hα-helixtrans-58.7-47.2174.100000111Y96 C99 L103 W119 S120 L121 C125 C126 Y127Y96-A123 HydrophobicContact CD2-CB 4.06Å; Y96-A123 WeakPolarHBondContact CD2-O 3.26Å; Y96-A123 HydrophobicContact CE2-CB 4.39Å; C99-A123 HydrophobicContact CB-CB 3.61Å; L103-A123 HydrophobicContact CD1-CB 4.47Å; W119-A123 WeakPolarHBondContact O-CB 3.47Å; W119-A123 PolarHBondContact O-N 3.18Å; S120-A123 PolarHBondContact O-N 3.36Å; L121-A123 VanDerWaalsContact C-N 3.34Å; L121-A123 PolarHBondContact O-N 3.3Å; A123-C125 VanDerWaalsContact C-N 3.34Å; A123-C125 PolarHBondContact O-N 3.42Å; A123-C126 PolarHBondContact O-N 3.06Å; A123-Y127 WeakPolarHBondContact O-CB 3.48Å; A123-Y127 PolarHBondContact O-N 3.36Å
124S94.4Very high93.9Very high19 Ų1955.1 Ų55.113%0.13327%0.269CS..Hα-helixtrans-62.7-38.1177.7-69.70000113S120 L121 N122 Y127 F128 P208 R211S120-S124 PolarHBondContact O-N 3.29Å; S120-S124 PolarHBondContact O-OG 2.83Å; L121-S124 PolarHBondContact O-N 3.17Å; L121-S124 VanDerWaalsContact O-N 3.17Å; N122-S124 VanDerWaalsContact C-N 3.35Å; N122-S124 PolarHBondContact O-N 3.05Å; S124-Y127 PolarHBondContact O-N 3.09Å; S124-F128 WeakPolarHBondContact O-CB 3.28Å; S124-F128 PolarHBondContact O-N 2.98Å; S124-P208 WeakPolarHBondContact O-CB 3.28Å; S124-R211 WeakPolarHBondContact OG-CG 3.26Å
125C95.6Very high94.2Very high54 Ų5454.9 Ų54.937%0.36527%0.268SS..Hα-helixtrans-64.8-47.2175-173.70000111.6L121 N122 A123 Y127 F128 M129 L212L121-C125 PolarHBondContact O-N 2.93Å; N122-C125 PolarHBondContact O-N 3.01Å; A123-C125 VanDerWaalsContact C-N 3.34Å; A123-C125 PolarHBondContact O-N 3.42Å; C125-Y127 VanDerWaalsContact C-N 3.31Å; C125-Y127 PolarHBondContact O-N 3.23Å; C125-F128 WeakPolarHBondContact O-CB 3.46Å; C125-F128 PolarHBondContact O-N 2.85Å; C125-M129 WeakPolarHBondContact O-CG 3.44Å; C125-M129 PolarHBondContact O-N 3Å; C125-L212 HydrophobicContact CB-CD2 4.22Å
126C95.7Very high94.4Very high20 Ų2053.9 Ų53.914%0.13527%0.265CS..Hα-helixtrans-60.3-42.5175.5-64.20000111.3N92 L95 N122 A123 M129 S130N92-C126 WeakPolarHBondContact CB-O 3.41Å; L95-C126 HydrophobicContact CB-CB 4.3Å; N122-C126 PolarHBondContact O-N 3Å; N122-C126 PolarHBondContact O-SG 3.47Å; A123-C126 PolarHBondContact O-N 3.06Å; C126-M129 PolarHBondContact O-N 2.84Å; C126-S130 WeakPolarHBondContact O-CB 3.49Å; C126-S130 PolarHBondContact O-N 3.37Å
127Y95.8Very high94.6Very high27 Ų2749.4 Ų49.411%0.10625%0.245CC..Hα-helixtrans-63.5-43.7176.7-173.2-120.6000111.9Y96 A123 S124 C125 S130 L131 D204 P208Y96-Y127 HydrophobicContact CD2-CG 4.45Å; Y96-Y127 HydrophobicContact CE2-CG 4.41Å; Y96-Y127 HydrophobicContact CG-CD2 4.49Å; A123-Y127 WeakPolarHBondContact O-CB 3.48Å; A123-Y127 PolarHBondContact O-N 3.36Å; S124-Y127 PolarHBondContact O-N 3.09Å; C125-Y127 VanDerWaalsContact C-N 3.31Å; C125-Y127 PolarHBondContact O-N 3.23Å; Y127-S130 WeakPolarHBondContact O-CB 3.45Å; Y127-S130 PolarHBondContact O-N 3.19Å; Y127-L131 HydrophobicContact CD1-CD1 4.07Å; Y127-L131 HydrophobicContact CE1-CD1 3.66Å; Y127-L131 HydrophobicContact CE1-CG 4.3Å; Y127-L131 HydrophobicContact CE2-CD2 4.49Å; Y127-L131 HydrophobicContact CE2-CG 4.44Å; Y127-L131 WeakPolarHBondContact O-CG 3.45Å; Y127-L131 PolarHBondContact O-N 3.17Å; Y127-D204 PolarHBondContact OH-OD2 2.98Å; Y127-D204 VanDerWaalsContact OH-OD2 3.08Å; Y127-P208 HydrophobicContact CD1-CB 4.1Å; Y127-P208 HydrophobicContact CD1-CG 3.85Å; Y127-P208 HydrophobicContact CE1-CG 4.31Å
128F96.3Very high94.6Very high50 Ų5043.2 Ų43.222%0.21922%0.216CC..Hα-helixtrans-58.7-51.1175.4-179.5-110.6000112.1S124 C125 S130 L131 V132 I205 P208 L209 L212S124-F128 WeakPolarHBondContact O-CB 3.28Å; S124-F128 PolarHBondContact O-N 2.98Å; C125-F128 WeakPolarHBondContact O-CB 3.46Å; C125-F128 PolarHBondContact O-N 2.85Å; F128-S130 VanDerWaalsContact C-N 3.25Å; F128-S130 PolarHBondContact O-N 3.39Å; F128-L131 WeakPolarHBondContact O-CB 3.22Å; F128-L131 PolarHBondContact O-N 2.89Å; F128-V132 HydrophobicContact CD1-CG2 4.27Å; F128-V132 HydrophobicContact CD2-CG2 4.37Å; F128-V132 HydrophobicContact CE1-CG2 3.86Å; F128-V132 HydrophobicContact CE2-CG2 3.97Å; F128-V132 HydrophobicContact CZ-CG2 3.69Å; F128-V132 WeakPolarHBondContact O-CG2 3.33Å; F128-V132 PolarHBondContact O-N 3.32Å; F128-I205 HydrophobicContact CD2-CG1 4.25Å; F128-I205 HydrophobicContact CE2-CD1 4.14Å; F128-I205 HydrophobicContact CE2-CG1 3.94Å; F128-P208 HydrophobicContact CB-CB 3.93Å; F128-P208 HydrophobicContact CB-CG 4.06Å; F128-P208 HydrophobicContact CD2-CG 4.08Å; F128-L209 HydrophobicContact CD2-CD2 4.25Å; F128-L209 HydrophobicContact CD2-CG 4.36Å; F128-L209 HydrophobicContact CE2-CD2 3.62Å; F128-L209 HydrophobicContact CE2-CG 3.97Å; F128-L209 HydrophobicContact CZ-CD2 4.1Å; F128-L212 HydrophobicContact CB-CD1 4.07Å; F128-L212 HydrophobicContact CG-CD1 4.28Å
129M95.5Very high94.6Very high84 Ų8439.2 Ų39.241%0.41421%0.21SC..Hα-helixtrans-59.7-38.1178.3-69.5-61.4-177.800112N92 C125 C126 V132 M133N92-M129 HydrophobicContact CB-CB 4.49Å; C125-M129 WeakPolarHBondContact O-CG 3.44Å; C125-M129 PolarHBondContact O-N 3Å; C126-M129 PolarHBondContact O-N 2.84Å; M129-V132 PolarHBondContact O-N 3.22Å; M129-M133 WeakPolarHBondContact O-CB 3.24Å; M129-M133 VanDerWaalsContact O-CG 3.29Å; M129-M133 WeakPolarHBondContact O-CG 3.35Å; M129-M133 PolarHBondContact O-N 3.41Å
130S96.4Very high94.6Very high0 Ų038.2 Ų38.20%021%0.207CC..Hα-helixtrans-62.4-41.4174.4-172.20000112.5A89 R93 C126 Y127 F128 S134A89-S130 WeakPolarHBondContact O-CB 3.5Å; A89-S130 PolarHBondContact O-OG 2.9Å; R93-S130 PolarHBondContact NE-OG 3.26Å; R93-S130 PolarHBondContact NH2-OG 3.15Å; C126-S130 WeakPolarHBondContact O-CB 3.49Å; C126-S130 PolarHBondContact O-N 3.37Å; Y127-S130 WeakPolarHBondContact O-CB 3.45Å; Y127-S130 PolarHBondContact O-N 3.19Å; F128-S130 VanDerWaalsContact C-N 3.25Å; F128-S130 PolarHBondContact O-N 3.39Å; S130-S134 WeakPolarHBondContact O-CB 3.11Å; S130-S134 PolarHBondContact O-N 2.89Å; S130-S134 VanDerWaalsContact O-N 3.07Å; S130-S134 PolarHBondContact O-OG 3Å
131L95.6Very high94.5Very high2 Ų238.8 Ų38.81%0.0121%0.21CC..Hα-helixtrans-67.6-45.6176.4-71.4176000111.9Y127 F128 M133 S134 L135 N201 D204 P208Y127-L131 HydrophobicContact CD1-CD1 4.07Å; Y127-L131 HydrophobicContact CE1-CD1 3.66Å; Y127-L131 HydrophobicContact CE1-CG 4.3Å; Y127-L131 HydrophobicContact CE2-CD2 4.49Å; Y127-L131 HydrophobicContact CE2-CG 4.44Å; Y127-L131 WeakPolarHBondContact O-CG 3.45Å; Y127-L131 PolarHBondContact O-N 3.17Å; F128-L131 WeakPolarHBondContact O-CB 3.22Å; F128-L131 PolarHBondContact O-N 2.89Å; L131-M133 VanDerWaalsContact C-N 3.33Å; L131-M133 PolarHBondContact O-N 3.27Å; L131-S134 PolarHBondContact O-N 2.84Å; L131-S134 VanDerWaalsContact O-N 3.14Å; L131-L135 WeakPolarHBondContact O-CG 3.41Å; L131-L135 PolarHBondContact O-N 3.09Å; L131-N201 HydrophobicContact CD2-CB 4.38Å; L131-D204 HydrophobicContact CD1-CB 4.09Å; L131-D204 HydrophobicContact CD2-CB 4.07Å; L131-P208 HydrophobicContact CD1-CG 3.96Å
132V96.3Very high94.3Very high48 Ų4836.6 Ų36.629%0.29120%0.198SC..Hα-helixtrans-57-49177.81720000110.3F128 M129 S134 L135 T136F128-V132 HydrophobicContact CD1-CG2 4.27Å; F128-V132 HydrophobicContact CD2-CG2 4.37Å; F128-V132 HydrophobicContact CE1-CG2 3.86Å; F128-V132 HydrophobicContact CE2-CG2 3.97Å; F128-V132 HydrophobicContact CZ-CG2 3.69Å; F128-V132 WeakPolarHBondContact O-CG2 3.33Å; F128-V132 PolarHBondContact O-N 3.32Å; M129-V132 PolarHBondContact O-N 3.22Å; V132-S134 VanDerWaalsContact C-N 3.3Å; V132-S134 PolarHBondContact O-N 3.17Å; V132-L135 PolarHBondContact O-N 3.13Å; V132-T136 PolarHBondContact O-N 2.91Å; V132-T136 PolarHBondContact O-OG1 3.34Å
133M95.6Very high94Very high52 Ų5235.7 Ų35.726%0.25620%0.196SC..Hα-helixtrans-64.2-34.6178.5-69.9-72.4170.400113V88 A89 M129 L131 R137V88-M133 HydrophobicContact CB-CG 4.27Å; V88-M133 HydrophobicContact CB-SD 4.25Å; V88-M133 HydrophobicContact CG1-CE 3.94Å; V88-M133 HydrophobicContact CG1-CG 3.87Å; V88-M133 HydrophobicContact CG1-SD 4.07Å; A89-M133 HydrophobicContact CB-CB 3.79Å; M129-M133 WeakPolarHBondContact O-CB 3.24Å; M129-M133 VanDerWaalsContact O-CG 3.29Å; M129-M133 WeakPolarHBondContact O-CG 3.35Å; M129-M133 PolarHBondContact O-N 3.41Å; L131-M133 VanDerWaalsContact C-N 3.33Å; L131-M133 PolarHBondContact O-N 3.27Å; M133-R137 PolarHBondContact O-N 2.97Å; M133-R137 VanDerWaalsContact O-N 3.08Å
134S94.3Very high93.7Very high4 Ų438.8 Ų38.83%0.02821%0.209CC..Hα-helixtrans-68.6-42175.5-54.20000110.9R93 S130 L131 V132 R137 D138R93-S134 PolarHBondContact NH2-OG 2.86Å; S130-S134 WeakPolarHBondContact O-CB 3.11Å; S130-S134 PolarHBondContact O-N 2.89Å; S130-S134 VanDerWaalsContact O-N 3.07Å; S130-S134 PolarHBondContact O-OG 3Å; L131-S134 PolarHBondContact O-N 2.84Å; L131-S134 VanDerWaalsContact O-N 3.14Å; V132-S134 VanDerWaalsContact C-N 3.3Å; V132-S134 PolarHBondContact O-N 3.17Å; S134-R137 WeakPolarHBondContact O-CB 3.31Å; S134-R137 PolarHBondContact O-N 3.44Å; S134-D138 PolarHBondContact O-N 3.12Å
135L94.8Very high93.3Very high28 Ų2838.3 Ų38.315%0.14721%0.206CC..Hα-helixtrans-65.4-40.8174.4-74.4171000112.5L131 V132 R137 D138 V139 T198 N201 I202 I205L131-L135 WeakPolarHBondContact O-CG 3.41Å; L131-L135 PolarHBondContact O-N 3.09Å; V132-L135 PolarHBondContact O-N 3.13Å; L135-R137 VanDerWaalsContact C-N 3.27Å; L135-R137 PolarHBondContact O-N 2.88Å; L135-D138 PolarHBondContact O-N 3.24Å; L135-D138 VanDerWaalsContact O-N 3.13Å; L135-V139 WeakPolarHBondContact O-CG2 3.38Å; L135-V139 PolarHBondContact O-N 3.35Å; L135-T198 HydrophobicContact CD2-CG2 4.42Å; L135-N201 HydrophobicContact CD2-CB 3.53Å; L135-N201 HydrophobicContact CG-CB 3.8Å; L135-I202 HydrophobicContact CD2-CG1 3.76Å; L135-I205 HydrophobicContact CD1-CD1 3.99Å
136T94.6Very high92.7Very high67 Ų6736.4 Ų36.441%0.41119%0.192SC..Hα-helixtrans-59-42.6174-56.80000110.7V132 Y140V132-T136 PolarHBondContact O-N 2.91Å; V132-T136 PolarHBondContact O-OG1 3.34Å; T136-Y140 WeakPolarHBondContact O-CB 2.82Å; T136-Y140 PolarHBondContact O-N 3.41Å
137R94Very high92.2Very high22 Ų2239 Ų398%0.08321%0.207CC..Hα-helixtrans-60.2-47.1172.7-178.6-80.4-50.9-125.8-0.6111.6L82 C85 L86 M133 S134 L135 V139 Y140 V141 D197L82-R137 HydrophobicContact CD1-CG 3.22Å; C85-R137 HydrophobicContact CB-CB 3.98Å; L86-R137 HydrophobicContact CD2-CB 4.41Å; L86-R137 HydrophobicContact CD2-CG 3.88Å; L86-R137 HydrophobicContact CG-CG 4.04Å; M133-R137 PolarHBondContact O-N 2.97Å; M133-R137 VanDerWaalsContact O-N 3.08Å; S134-R137 WeakPolarHBondContact O-CB 3.31Å; S134-R137 PolarHBondContact O-N 3.44Å; L135-R137 VanDerWaalsContact C-N 3.27Å; L135-R137 PolarHBondContact O-N 2.88Å; R137-V139 PolarHBondContact O-N 3.35Å; R137-Y140 WeakPolarHBondContact O-CB 3.44Å; R137-Y140 PolarHBondContact O-N 2.83Å; R137-V141 WeakPolarHBondContact O-CG2 3.35Å; R137-V141 PolarHBondContact O-N 3.14Å; R137-D197 IonicContact CZ-OD2 2.98Å; R137-D197 IonicContact NH2-OD2 2.7Å; R137-D197 PolarHBondContact NH2-OD2 2.98Å
138D92.6Very high91.6Very high0 Ų043.5 Ų43.50%023%0.229CC..Hα-helixtrans-60-47.4-178.2-62.1-18.8000111S134 L135 Y140 V141 I142 V194 T198 N201S134-D138 PolarHBondContact O-N 3.12Å; L135-D138 PolarHBondContact O-N 3.24Å; L135-D138 VanDerWaalsContact O-N 3.13Å; D138-Y140 VanDerWaalsContact C-N 3.35Å; D138-Y140 PolarHBondContact O-N 3.04Å; D138-V141 PolarHBondContact O-N 2.94Å; D138-I142 WeakPolarHBondContact O-CB 3.46Å; D138-I142 WeakPolarHBondContact O-CD1 3.33Å; D138-I142 VanDerWaalsContact O-CG1 3.22Å; D138-I142 WeakPolarHBondContact O-CG1 3.31Å; D138-I142 PolarHBondContact O-N 3.41Å; D138-V194 HydrophobicContact CB-CG1 4.4Å; D138-T198 HydrophobicContact CB-CG2 4.5Å; D138-T198 WeakPolarHBondContact CB-OG1 3.36Å; D138-T198 WeakPolarHBondContact OD2-CA 3.32Å; D138-N201 PolarHBondContact OD2-ND2 3.26Å
139V91.9Very high90.7Very high85 Ų8543.1 Ų43.152%0.51523%0.226SC..Hα-helixtrans-59.6-45.7175.2173.40000110.8L135 R137 V141 I142 T143L135-V139 WeakPolarHBondContact O-CG2 3.38Å; L135-V139 PolarHBondContact O-N 3.35Å; R137-V139 PolarHBondContact O-N 3.35Å; V139-V141 PolarHBondContact O-N 2.92Å; V139-I142 PolarHBondContact O-N 2.81Å; V139-T143 WeakPolarHBondContact O-CB 3.18Å; V139-T143 PolarHBondContact O-N 2.94Å; V139-T143 PolarHBondContact O-OG1 3.32Å
140Y92.6Very high89.8Confident65 Ų6542 Ų4226%0.25522%0.224SC..Hα-helixtrans-57.8-47.5178.7-179.9-102.8000112.4D79 V81 T136 R137 D138 T143 Q144D79-Y140 VanDerWaalsContact OD2-CE1 3.31Å; D79-Y140 WeakPolarHBondContact OD2-CE1 3.47Å; D79-Y140 PolarHBondContact OD2-OH 3.43Å; V81-Y140 HydrophobicContact CB-CD2 4.47Å; V81-Y140 HydrophobicContact CB-CE1 4.09Å; V81-Y140 HydrophobicContact CB-CE2 4.01Å; V81-Y140 HydrophobicContact CG1-CD1 4.26Å; V81-Y140 HydrophobicContact CG1-CD2 3.83Å; V81-Y140 HydrophobicContact CG1-CE1 4.26Å; V81-Y140 HydrophobicContact CG1-CE2 3.84Å; V81-Y140 HydrophobicContact CG1-CG 4.03Å; V81-Y140 HydrophobicContact CG2-CE2 4.13Å; T136-Y140 WeakPolarHBondContact O-CB 2.82Å; T136-Y140 PolarHBondContact O-N 3.41Å; R137-Y140 WeakPolarHBondContact O-CB 3.44Å; R137-Y140 PolarHBondContact O-N 2.83Å; D138-Y140 VanDerWaalsContact C-N 3.35Å; D138-Y140 PolarHBondContact O-N 3.04Å; Y140-T143 PolarHBondContact O-N 3.35Å; Y140-Q144 HydrophobicContact CD1-CG 4.45Å; Y140-Q144 HydrophobicContact CE1-CG 4.08Å; Y140-Q144 HydrophobicContact CE2-CG 4.45Å; Y140-Q144 WeakPolarHBondContact O-CG 3.18Å; Y140-Q144 PolarHBondContact O-N 3.35Å; Y140-Q144 PolarHBondContact OH-NE2 3.11Å
141V90.9Very high88.8Confident31 Ų3151.8 Ų51.819%0.18826%0.261CS..Hα-helixtrans-63.9-44.3177.6174.30000110.8R137 D138 V139 T143 Q144 T145 V194R137-V141 WeakPolarHBondContact O-CG2 3.35Å; R137-V141 PolarHBondContact O-N 3.14Å; D138-V141 PolarHBondContact O-N 2.94Å; V139-V141 PolarHBondContact O-N 2.92Å; V141-T143 VanDerWaalsContact C-N 3.33Å; V141-T143 PolarHBondContact O-N 2.7Å; V141-Q144 PolarHBondContact O-N 2.58Å; V141-T145 PolarHBondContact O-N 3.02Å; V141-T145 PolarHBondContact O-OG1 3.36Å; V141-T145 VanDerWaalsContact O-OG1 3.11Å; V141-V194 HydrophobicContact CB-CG1 4.48Å; V141-V194 HydrophobicContact CG1-CG1 4.35Å; V141-V194 HydrophobicContact CG1-CG2 3.83Å
142I88.8Confident88Confident16 Ų1656.5 Ų56.58%0.08228%0.283CS..Hα-helixtrans-59.4-45177-69.5162.2000110.7D138 V139 T145 M146 L184 L188 V194D138-I142 WeakPolarHBondContact O-CB 3.46Å; D138-I142 WeakPolarHBondContact O-CD1 3.33Å; D138-I142 VanDerWaalsContact O-CG1 3.22Å; D138-I142 WeakPolarHBondContact O-CG1 3.31Å; D138-I142 PolarHBondContact O-N 3.41Å; V139-I142 PolarHBondContact O-N 2.81Å; I142-T145 PolarHBondContact O-N 3.42Å; I142-M146 HydrophobicContact CG2-CG 4.42Å; I142-M146 HydrophobicContact CG2-SD 3.88Å; I142-M146 VanDerWaalsContact O-CG 3.23Å; I142-M146 WeakPolarHBondContact O-CG 3.32Å; I142-M146 PolarHBondContact O-N 3.11Å; I142-L184 HydrophobicContact CG2-CD1 3.6Å; I142-L188 HydrophobicContact CD1-CD2 3.68Å; I142-L188 HydrophobicContact CG1-CD2 4.1Å; I142-V194 HydrophobicContact CD1-CG1 4.18Å; I142-V194 HydrophobicContact CG1-CG1 3.86Å
143T87.6Confident86.5Confident71 Ų7163.9 Ų63.944%0.43631%0.305SS..Hα-helixtrans-64.6-43.5178-57.70000111.6V139 Y140 V141 T145 M146 V147V139-T143 WeakPolarHBondContact O-CB 3.18Å; V139-T143 PolarHBondContact O-N 2.94Å; V139-T143 PolarHBondContact O-OG1 3.32Å; Y140-T143 PolarHBondContact O-N 3.35Å; V141-T143 VanDerWaalsContact C-N 3.33Å; V141-T143 PolarHBondContact O-N 2.7Å; T143-T145 VanDerWaalsContact C-N 3.35Å; T143-T145 PolarHBondContact O-N 2.94Å; T143-M146 PolarHBondContact O-N 2.81Å; T143-V147 WeakPolarHBondContact O-CG2 3.36Å; T143-V147 PolarHBondContact O-N 3.21Å
144Q88.8Confident85.3Confident69 Ų6968.4 Ų68.432%0.32233%0.326SS..Hα-helixtrans-59.7-45.4174.8-78.2-168.5-23.100111.7D79 Y140 V141 M146 V147 Q148D79-Q144 PolarHBondContact OD2-NE2 3.24Å; Y140-Q144 HydrophobicContact CD1-CG 4.45Å; Y140-Q144 HydrophobicContact CE1-CG 4.08Å; Y140-Q144 HydrophobicContact CE2-CG 4.45Å; Y140-Q144 WeakPolarHBondContact O-CG 3.18Å; Y140-Q144 PolarHBondContact O-N 3.35Å; Y140-Q144 PolarHBondContact OH-NE2 3.11Å; V141-Q144 PolarHBondContact O-N 2.58Å; Q144-M146 VanDerWaalsContact C-N 3.34Å; Q144-M146 PolarHBondContact O-N 3.15Å; Q144-V147 PolarHBondContact O-N 3.29Å; Q144-Q148 WeakPolarHBondContact O-CG 3.44Å; Q144-Q148 PolarHBondContact O-N 3.41Å
145T85.3Confident84.1Confident9 Ų968.7 Ų68.76%0.05533%0.327CS..Hα-helixtrans-61.2-42.6176.1-62.70000111.6V141 I142 T143 Q148 R149 S187 H191V141-T145 PolarHBondContact O-N 3.02Å; V141-T145 PolarHBondContact O-OG1 3.36Å; V141-T145 VanDerWaalsContact O-OG1 3.11Å; I142-T145 PolarHBondContact O-N 3.42Å; T143-T145 VanDerWaalsContact C-N 3.35Å; T143-T145 PolarHBondContact O-N 2.94Å; T145-Q148 PolarHBondContact O-N 3.43Å; T145-R149 HydrophobicContact CG2-CG 4.47Å; T145-R149 WeakPolarHBondContact O-CB 3.41Å; T145-R149 WeakPolarHBondContact O-CG 3.49Å; T145-R149 PolarHBondContact O-N 3.35Å; T145-S187 WeakPolarHBondContact CB-OG 3.2Å; T145-S187 WeakPolarHBondContact CG2-OG 3.4Å; T145-H191 VanDerWaalsContact CG2-CD2 3.42Å; T145-H191 WeakPolarHBondContact CG2-CD2 3.4Å; T145-H191 WeakPolarHBondContact CG2-NE2 3.47Å
146M83.6Confident83Confident15 Ų1571.2 Ų71.27%0.07434%0.337CS..Hα-helixtrans-60.6-46.4177.2-72.2170.977.600111I142 T143 Q144 Q148 R149 T150 F180 L183 L184I142-M146 HydrophobicContact CG2-CG 4.42Å; I142-M146 HydrophobicContact CG2-SD 3.88Å; I142-M146 VanDerWaalsContact O-CG 3.23Å; I142-M146 WeakPolarHBondContact O-CG 3.32Å; I142-M146 PolarHBondContact O-N 3.11Å; T143-M146 PolarHBondContact O-N 2.81Å; Q144-M146 VanDerWaalsContact C-N 3.34Å; Q144-M146 PolarHBondContact O-N 3.15Å; M146-Q148 VanDerWaalsContact C-N 3.35Å; M146-Q148 PolarHBondContact O-N 3.41Å; M146-R149 PolarHBondContact O-N 2.88Å; M146-T150 PolarHBondContact O-N 2.96Å; M146-T150 PolarHBondContact O-OG1 3.14Å; M146-F180 HydrophobicContact CE-CD2 3.6Å; M146-F180 HydrophobicContact CE-CE2 3.49Å; M146-F180 VanDerWaalsContact CE-CE2 3.49Å; M146-F180 HydrophobicContact CE-CG 4.34Å; M146-F180 HydrophobicContact CE-CZ 4.12Å; M146-F180 HydrophobicContact SD-CE2 4.43Å; M146-L183 HydrophobicContact CE-CB 3.72Å; M146-L184 HydrophobicContact CE-CB 4.22Å; M146-L184 HydrophobicContact SD-CB 4.49Å; M146-L184 HydrophobicContact SD-CD1 4.05Å
147V85.4Confident81.9Confident74 Ų7473.6 Ų73.645%0.44834%0.344SS..Hα-helixtrans-63.3-39.6178.51720000112T143 Q144T143-V147 WeakPolarHBondContact O-CG2 3.36Å; T143-V147 PolarHBondContact O-N 3.21Å; Q144-V147 PolarHBondContact O-N 3.29Å
148Q83Confident81Confident122 Ų12277.8 Ų77.857%0.5736%0.363SS*.Hα-helixtrans-63.2-43.9175.3-74.1175.4-3.600111.3Q144 T145 M146 T150 R151Q144-Q148 WeakPolarHBondContact O-CG 3.44Å; Q144-Q148 PolarHBondContact O-N 3.41Å; T145-Q148 PolarHBondContact O-N 3.43Å; M146-Q148 VanDerWaalsContact C-N 3.35Å; M146-Q148 PolarHBondContact O-N 3.41Å; Q148-T150 PolarHBondContact O-N 3.36Å; Q148-R151 WeakPolarHBondContact O-CB 3.4Å; Q148-R151 PolarHBondContact O-N 3.19Å; Q148-R151 VanDerWaalsContact O-N 3.12Å
149R77.4Confident80Confident42 Ų4279.3 Ų79.316%0.15837%0.37CS..Hα-helixtrans-67.1-35.9179.5-74.8176.3175.4-99-25.1113.5T145 M146 R151 E152 F155 S190T145-R149 HydrophobicContact CG2-CG 4.47Å; T145-R149 WeakPolarHBondContact O-CB 3.41Å; T145-R149 WeakPolarHBondContact O-CG 3.49Å; T145-R149 PolarHBondContact O-N 3.35Å; M146-R149 PolarHBondContact O-N 2.88Å; R149-R151 PolarHBondContact O-N 2.84Å; R149-R151 VanDerWaalsContact O-N 3.15Å; R149-E152 WeakPolarHBondContact O-CB 3.42Å; R149-E152 PolarHBondContact O-N 3.19Å; R149-F155 HydrophobicContact CB-CD1 4.5Å; R149-F155 HydrophobicContact CB-CG 4.46Å; R149-S190 VanDerWaalsContact CZ-CB 3.44Å; R149-S190 PolarHBondContact NE-OG 2.93Å; R149-S190 PolarHBondContact NH2-OG 3.05Å
150T76.1Confident79.1Confident60 Ų6079.8 Ų79.837%0.36837%0.37SS..Hα-helixtrans-60.6-23.6174-52.50000112.3M146 Q148 Q156M146-T150 PolarHBondContact O-N 2.96Å; M146-T150 PolarHBondContact O-OG1 3.14Å; Q148-T150 PolarHBondContact O-N 3.36Å; T150-Q156 PolarHBondContact O-NE2 3.46Å
151R75.3Confident78.3Confident205 Ų20582.6 Ų82.677%0.77439%0.386SS*.THydrogen-bonded Turntrans-82.9-14.8175.7-64.1177.3-179.8-173.1-0.8113.4Q148 R149 R153Q148-R151 WeakPolarHBondContact O-CB 3.4Å; Q148-R151 PolarHBondContact O-N 3.19Å; Q148-R151 VanDerWaalsContact O-N 3.12Å; R149-R151 PolarHBondContact O-N 2.84Å; R149-R151 VanDerWaalsContact O-N 3.15Å; R151-R153 PolarHBondContact O-N 2.94Å
152E80.1Confident77.4Confident102 Ų10286 Ų8648%0.47740%0.399SS..  trans-81.4114.8177.5-65.3176.4175.300110.1R149 Q154 F155 Q156R149-E152 WeakPolarHBondContact O-CB 3.42Å; R149-E152 PolarHBondContact O-N 3.19Å; E152-Q154 VanDerWaalsContact C-N 3.27Å; E152-Q154 PolarHBondContact O-N 3Å; E152-F155 HydrophobicContact CB-CB 4.28Å; E152-F155 WeakPolarHBondContact O-CB 3.28Å; E152-F155 PolarHBondContact O-N 3.22Å; E152-Q156 PolarHBondContact O-N 3.24Å
153R64.1Low76.6Confident203 Ų20388.2 Ų88.277%0.76641%0.411SS*.Hα-helixtrans-56.2-38.9-178.4-72-175.5178.2175.9-1.1113.3R151 F155 Q156 E157R151-R153 PolarHBondContact O-N 2.94Å; R153-F155 PolarHBondContact O-N 3.44Å; R153-Q156 PolarHBondContact O-N 3.09Å; R153-E157 WeakPolarHBondContact O-CG 3.4Å; R153-E157 PolarHBondContact O-N 2.98Å
154Q69.9Low75.7Confident147 Ų14791.4 Ų91.469%0.68743%0.425SS*.Hα-helixtrans-61.4-26.4177-67.2-178.8-13.600113.4E152 K158E152-Q154 VanDerWaalsContact C-N 3.27Å; E152-Q154 PolarHBondContact O-N 3Å; Q154-K158 WeakPolarHBondContact O-CG 3.38Å; Q154-K158 PolarHBondContact O-N 3.49Å
155F69.6Low74.9Confident10 Ų1094.5 Ų94.54%0.04444%0.444CS..Hα-helixtrans-84.4-37.7178.1-170.4-90.2000111.5R149 E152 R153 E157 K158 M159 F182 L183 Q186R149-F155 HydrophobicContact CB-CD1 4.5Å; R149-F155 HydrophobicContact CB-CG 4.46Å; E152-F155 HydrophobicContact CB-CB 4.28Å; E152-F155 WeakPolarHBondContact O-CB 3.28Å; E152-F155 PolarHBondContact O-N 3.22Å; R153-F155 PolarHBondContact O-N 3.44Å; F155-E157 VanDerWaalsContact C-N 3.31Å; F155-E157 PolarHBondContact O-N 3.22Å; F155-K158 PolarHBondContact O-N 2.98Å; F155-M159 HydrophobicContact CE1-CB 4.36Å; F155-M159 WeakPolarHBondContact O-CB 3.26Å; F155-M159 PolarHBondContact O-N 3.28Å; F155-F182 HydrophobicContact CE1-CD1 4.42Å; F155-F182 HydrophobicContact CE1-CE1 4.26Å; F155-F182 AromaticContact CE2-CE1 3.87Å; F155-F182 HydrophobicContact CE2-CE1 3.87Å; F155-F182 AromaticContact CZ-CD1 3.78Å; F155-F182 HydrophobicContact CZ-CD1 3.78Å; F155-F182 AromaticContact CZ-CE1 3.45Å; F155-F182 HydrophobicContact CZ-CE1 3.45Å; F155-F182 VanDerWaalsContact CZ-CE1 3.45Å; F155-F182 HydrophobicContact CZ-CZ 4.49Å; F155-L183 HydrophobicContact CD1-CD2 3.83Å; F155-L183 HydrophobicContact CE1-CD2 3.09Å; F155-L183 HydrophobicContact CE1-CG 3.77Å; F155-L183 HydrophobicContact CZ-CD2 3.73Å; F155-L183 HydrophobicContact CZ-CG 4.24Å; F155-Q186 HydrophobicContact CE2-CB 4.06Å; F155-Q186 HydrophobicContact CE2-CG 3.76Å; F155-Q186 HydrophobicContact CZ-CB 4.31Å; F155-Q186 HydrophobicContact CZ-CG 4.49Å
156Q70.9Confident73.8Confident80 Ų8098.4 Ų98.437%0.37447%0.465SS..Hα-helixtrans-56.9-46.8170.6-66.7-174-14.100110.8T150 E152 R153 K158 M159 D160T150-Q156 PolarHBondContact O-NE2 3.46Å; E152-Q156 PolarHBondContact O-N 3.24Å; R153-Q156 PolarHBondContact O-N 3.09Å; Q156-K158 VanDerWaalsContact C-N 3.34Å; Q156-K158 PolarHBondContact O-N 3.18Å; Q156-M159 WeakPolarHBondContact O-CB 3.49Å; Q156-M159 PolarHBondContact O-N 3.24Å; Q156-M159 VanDerWaalsContact O-N 3.13Å; Q156-D160 WeakPolarHBondContact O-CB 3.38Å; Q156-D160 VanDerWaalsContact O-CG 3.24Å; Q156-D160 PolarHBondContact O-N 3.23Å
157E72.7Confident72.6Confident118 Ų118102.1 Ų102.155%0.55149%0.49SS*.Hα-helixtrans-58.9-41.5177-71.1169.6-178.200112.9R153 F155 Q161R153-E157 WeakPolarHBondContact O-CG 3.4Å; R153-E157 PolarHBondContact O-N 2.98Å; F155-E157 VanDerWaalsContact C-N 3.31Å; F155-E157 PolarHBondContact O-N 3.22Å; E157-Q161 WeakPolarHBondContact O-CB 3.35Å; E157-Q161 VanDerWaalsContact O-CG 3.28Å; E157-Q161 WeakPolarHBondContact O-CG 3.23Å; E157-Q161 PolarHBondContact O-N 3.18Å
158K75.6Confident71.3Confident110 Ų110106.2 Ų106.248%0.47851%0.509SS..Hα-helixtrans-68.5-37.9175.8-76179.3-178.6176.80112.8Q154 F155 Q156 H162Q154-K158 WeakPolarHBondContact O-CG 3.38Å; Q154-K158 PolarHBondContact O-N 3.49Å; F155-K158 PolarHBondContact O-N 2.98Å; Q156-K158 VanDerWaalsContact C-N 3.34Å; Q156-K158 PolarHBondContact O-N 3.18Å; K158-H162 WeakPolarHBondContact O-CB 3.46Å; K158-H162 PolarHBondContact O-CD2 2.95Å; K158-H162 VanDerWaalsContact O-CD2 3.22Å; K158-H162 PolarHBondContact O-N 2.88Å
159M71.6Confident70Confident32 Ų32103.1 Ų103.116%0.15850%0.499CS..Hα-helixtrans-66.7-43.2177.3-175.5178.66900110.6F155 Q156 H162 L163 A179 F182 L183F155-M159 HydrophobicContact CE1-CB 4.36Å; F155-M159 WeakPolarHBondContact O-CB 3.26Å; F155-M159 PolarHBondContact O-N 3.28Å; Q156-M159 WeakPolarHBondContact O-CB 3.49Å; Q156-M159 PolarHBondContact O-N 3.24Å; Q156-M159 VanDerWaalsContact O-N 3.13Å; M159-H162 PolarHBondContact O-N 3.41Å; M159-L163 HydrophobicContact CG-CD1 4.24Å; M159-L163 WeakPolarHBondContact O-CG 3.37Å; M159-L163 PolarHBondContact O-N 3.08Å; M159-A179 HydrophobicContact SD-CB 4.07Å; M159-F182 HydrophobicContact CB-CE1 4.45Å; M159-F182 HydrophobicContact CG-CD1 4.46Å; M159-L183 HydrophobicContact SD-CD1 4.22Å; M159-L183 HydrophobicContact SD-CG 4.42Å
160D71.1Confident68.7Low95 Ų95104 Ų10451%0.50852%0.515SS..Hα-helixtrans-63.6-41.4176.1-66.8-22.1000111.1Q156 L163 N164Q156-D160 WeakPolarHBondContact O-CB 3.38Å; Q156-D160 VanDerWaalsContact O-CG 3.24Å; Q156-D160 PolarHBondContact O-N 3.23Å; D160-L163 PolarHBondContact O-N 3.21Å; D160-N164 WeakPolarHBondContact O-CB 3.31Å; D160-N164 PolarHBondContact O-N 2.95Å
161Q77.2Confident67.5Low124 Ų124106 Ų10658%0.57953%0.527SS*.Hα-helixtrans-60-47.3172.1-76.7172.6-7.600112.3E157 L163 N164 D165E157-Q161 WeakPolarHBondContact O-CB 3.35Å; E157-Q161 VanDerWaalsContact O-CG 3.28Å; E157-Q161 WeakPolarHBondContact O-CG 3.23Å; E157-Q161 PolarHBondContact O-N 3.18Å; Q161-L163 PolarHBondContact O-N 3.05Å; Q161-N164 PolarHBondContact O-N 3.02Å; Q161-D165 PolarHBondContact O-N 2.61Å
162H72.6Confident66.5Low102 Ų102102.8 Ų102.847%0.47253%0.53SS..Hα-helixtrans-63.4-38178.7-91.1-71.4000113.3K158 M159 N164 F182K158-H162 WeakPolarHBondContact O-CB 3.46Å; K158-H162 PolarHBondContact O-CD2 2.95Å; K158-H162 VanDerWaalsContact O-CD2 3.22Å; K158-H162 PolarHBondContact O-N 2.88Å; M159-H162 PolarHBondContact O-N 3.41Å; H162-N164 VanDerWaalsContact C-N 3.33Å; H162-F182 HydrophobicContact CB-CE2 4.45Å; H162-F182 AromaticContact CD2-CE2 3.29Å; H162-F182 WeakPolarHBondContact CD2-CE2 3.42Å; H162-F182 AromaticContact CD2-CZ 3.15Å; H162-F182 WeakPolarHBondContact CD2-CZ 3.31Å; H162-F182 AromaticContact CE1-CE2 3.86Å; H162-F182 AromaticContact CG-CE2 3.7Å; H162-F182 AromaticContact CG-CZ 3.89Å; H162-F182 AromaticContact NE2-CE2 3.39Å; H162-F182 WeakPolarHBondContact NE2-CE2 3.47Å; H162-F182 AromaticContact NE2-CZ 3.55Å
163L70Confident65.2Low62 Ų62105.4 Ų105.433%0.32555%0.546SS..Hα-helixtrans-69.1-31.7175.6-71.9169.7000112M159 D160 Q161M159-L163 HydrophobicContact CG-CD1 4.24Å; M159-L163 WeakPolarHBondContact O-CG 3.37Å; M159-L163 PolarHBondContact O-N 3.08Å; D160-L163 PolarHBondContact O-N 3.21Å; Q161-L163 PolarHBondContact O-N 3.05Å
164N70.4Confident65.1Low138 Ų13898 Ų9874%0.73852%0.523SS*.Hα-helixtrans-79.4-32.5179.8-13210.8000113D160 Q161 H162 N166D160-N164 WeakPolarHBondContact O-CB 3.31Å; D160-N164 PolarHBondContact O-N 2.95Å; Q161-N164 PolarHBondContact O-N 3.02Å; H162-N164 VanDerWaalsContact C-N 3.33Å; N164-N166 VanDerWaalsContact C-N 3.29Å; N164-N166 PolarHBondContact O-N 3.47Å
165D70.7Confident64.8Low134 Ų13493.2 Ų93.272%0.71751%0.505SS*.Hα-helixtrans-74.2-14.7-179.1-82.8-9.9000113.7Q161 P167Q161-D165 PolarHBondContact O-N 2.61Å; D165-P167 VanDerWaalsContact C-CD 3.47Å; D165-P167 WeakPolarHBondContact O-CD 3.41Å
166N63.2Low64.7Low92 Ų92100.7 Ų100.749%0.49254%0.54SS..  trans-12863-173.9-130.1-7.4000113.3N164 D168 V169N164-N166 VanDerWaalsContact C-N 3.29Å; N164-N166 PolarHBondContact O-N 3.47Å; N166-D168 VanDerWaalsContact C-N 3.27Å; N166-D168 PolarHBondContact O-N 3.26Å; N166-V169 PolarHBondContact O-N 3.01Å
167P58.4Low64.9Low93 Ų93101.8 Ų101.860%0.60455%0.547SS*.G310 helixtrans-65.4-24-172.925.9-33.9000114.2D165 V169 A170D165-P167 VanDerWaalsContact C-CD 3.47Å; D165-P167 WeakPolarHBondContact O-CD 3.41Å; P167-V169 VanDerWaalsContact C-N 3.27Å; P167-V169 PolarHBondContact O-N 3.16Å; P167-A170 PolarHBondContact O-N 3.29Å
168D56.6Low65Low159 Ų15998.7 Ų98.785%0.8553%0.534SS*.G310 helixtrans-72.4-15.3-178.4-77.7-25.6000114.1N166N166-D168 VanDerWaalsContact C-N 3.27Å; N166-D168 PolarHBondContact O-N 3.26Å
169V56Low65Low58 Ų5894.2 Ų94.235%0.35252%0.518SS..G310 helixtrans-88.9-14.3177.7-173.80000111.4N166 P167 T171 V174N166-V169 PolarHBondContact O-N 3.01Å; P167-V169 VanDerWaalsContact C-N 3.27Å; P167-V169 PolarHBondContact O-N 3.16Å; V169-T171 PolarHBondContact O-N 3.4Å; V169-V174 HydrophobicContact CG1-CG1 3.73Å; V169-V174 WeakPolarHBondContact O-CB 3.49Å; V169-V174 WeakPolarHBondContact O-CG1 3.37Å
170A50.8Low65.4Low60 Ų6097.6 Ų97.650%0.49653%0.532SS..  trans-86.762.7-170.600000113.8P167P167-A170 PolarHBondContact O-N 3.29Å
171T50.9Low65.9Low103 Ų10397.4 Ų97.463%0.63253%0.53SS*.  trans-88.9101.5160.437.10000109V169 I173 V174V169-T171 PolarHBondContact O-N 3.4Å; T171-I173 PolarHBondContact O-N 3.11Å; T171-V174 WeakPolarHBondContact O-CB 3.44Å; T171-V174 WeakPolarHBondContact O-CG2 3.35Å; T171-V174 PolarHBondContact O-N 3.16Å
172V54Low66.1Low137 Ų13793.5 Ų93.583%0.8351%0.512SS*.THydrogen-bonded Turntrans17-32.9168-171.70000121.3
173I53.3Low66.5Low157 Ų15789.6 Ų89.681%0.80549%0.494SS*.THydrogen-bonded Turntrans-93.9-20.6172.2-60.3170.9000111.8T171T171-I173 PolarHBondContact O-N 3.11Å
174V60.9Low67.1Low47 Ų4788.9 Ų88.929%0.28549%0.491SS..Hα-helixtrans-83.9-26.1-173.8-175.70000116.6V169 T171 Q176 L177 D178V169-V174 HydrophobicContact CG1-CG1 3.73Å; V169-V174 WeakPolarHBondContact O-CB 3.49Å; V169-V174 WeakPolarHBondContact O-CG1 3.37Å; T171-V174 WeakPolarHBondContact O-CB 3.44Å; T171-V174 WeakPolarHBondContact O-CG2 3.35Å; T171-V174 PolarHBondContact O-N 3.16Å; V174-Q176 PolarHBondContact O-N 2.82Å; V174-L177 PolarHBondContact O-N 2.91Å; V174-D178 HydrophobicContact CG1-CB 4.47Å; V174-D178 WeakPolarHBondContact O-CB 3.5Å; V174-D178 PolarHBondContact O-N 2.82Å
175P64.1Low67.7Low47 Ų4789.2 Ų89.231%0.30549%0.486SS..Hα-helixtrans-69.8-32.5-17124.2-30.8000113.6A179P175-A179 WeakPolarHBondContact O-CB 3.45Å; P175-A179 PolarHBondContact O-N 3Å
176Q68.4Low68.1Low167 Ų16785.3 Ų85.378%0.7846%0.463SS*.Hα-helixtrans-71.2-37.6175.9-70.3-176.9-22.300112.2V174 F180V174-Q176 PolarHBondContact O-N 2.82Å; Q176-F180 VanDerWaalsContact O-CB 3.24Å; Q176-F180 WeakPolarHBondContact O-CB 3.22Å; Q176-F180 PolarHBondContact O-N 3.43Å
177L74.3Confident68.9Low102 Ų10281 Ų8153%0.53444%0.44SS..Hα-helixtrans-71.5-40.2177.1-174.663.7000110.8V174 F180 L181V174-L177 PolarHBondContact O-N 2.91Å; L177-F180 WeakPolarHBondContact O-CB 3.49Å; L177-F180 PolarHBondContact O-N 3.35Å; L177-L181 HydrophobicContact CD1-CG 4.5Å; L177-L181 HydrophobicContact CG-CD1 4.2Å; L177-L181 HydrophobicContact CG-CG 4.44Å; L177-L181 WeakPolarHBondContact O-CB 3.41Å; L177-L181 VanDerWaalsContact O-CG 3.26Å; L177-L181 WeakPolarHBondContact O-CG 3.37Å; L177-L181 PolarHBondContact O-N 3.46Å
178D75.3Confident70Confident53 Ų5378.5 Ų78.528%0.28342%0.422SS..Hα-helixtrans-65.7-45.8176.6-164.521.4000111.2V174 F180 L181 F182V174-D178 HydrophobicContact CG1-CB 4.47Å; V174-D178 WeakPolarHBondContact O-CB 3.5Å; V174-D178 PolarHBondContact O-N 2.82Å; D178-F180 VanDerWaalsContact C-N 3.29Å; D178-F180 PolarHBondContact O-N 2.98Å; D178-L181 PolarHBondContact O-N 3.23Å; D178-F182 VanDerWaalsContact O-CB 3.29Å; D178-F182 WeakPolarHBondContact O-CB 3.47Å; D178-F182 PolarHBondContact O-N 3.35Å
179A74.4Confident71.2Confident16 Ų1678.1 Ų78.113%0.13241%0.412CS..Hα-helixtrans-57.8-42171.500000112M159 P175 L183M159-A179 HydrophobicContact SD-CB 4.07Å; P175-A179 WeakPolarHBondContact O-CB 3.45Å; P175-A179 PolarHBondContact O-N 3Å; A179-L183 VanDerWaalsContact O-CB 3.25Å; A179-L183 WeakPolarHBondContact O-CB 3.37Å; A179-L183 WeakPolarHBondContact O-CD1 3.4Å; A179-L183 VanDerWaalsContact O-CG 3.28Å; A179-L183 WeakPolarHBondContact O-CG 3.36Å; A179-L183 PolarHBondContact O-N 3.25Å
180F81.4Confident72.3Confident104 Ų10477.3 Ų77.346%0.45641%0.409SS..Hα-helixtrans-64.5-45.3175.9176.6-92000112.3M146 Q176 L177 D178 L183 L184M146-F180 HydrophobicContact CE-CD2 3.6Å; M146-F180 HydrophobicContact CE-CE2 3.49Å; M146-F180 VanDerWaalsContact CE-CE2 3.49Å; M146-F180 HydrophobicContact CE-CG 4.34Å; M146-F180 HydrophobicContact CE-CZ 4.12Å; M146-F180 HydrophobicContact SD-CE2 4.43Å; Q176-F180 VanDerWaalsContact O-CB 3.24Å; Q176-F180 WeakPolarHBondContact O-CB 3.22Å; Q176-F180 PolarHBondContact O-N 3.43Å; L177-F180 WeakPolarHBondContact O-CB 3.49Å; L177-F180 PolarHBondContact O-N 3.35Å; D178-F180 VanDerWaalsContact C-N 3.29Å; D178-F180 PolarHBondContact O-N 2.98Å; F180-L183 WeakPolarHBondContact O-CB 3.45Å; F180-L183 PolarHBondContact O-N 3.49Å; F180-L184 HydrophobicContact CE1-CD2 4.32Å; F180-L184 VanDerWaalsContact O-CB 3.23Å; F180-L184 WeakPolarHBondContact O-CB 3.42Å; F180-L184 PolarHBondContact O-N 2.96Å
181L82.1Confident73.7Confident90 Ų9077.9 Ų77.947%0.47140%0.401SS..Hα-helixtrans-65.8-40.3178.7-73.4174.5000111.3L177 D178 L184 F185L177-L181 HydrophobicContact CD1-CG 4.5Å; L177-L181 HydrophobicContact CG-CD1 4.2Å; L177-L181 HydrophobicContact CG-CG 4.44Å; L177-L181 WeakPolarHBondContact O-CB 3.41Å; L177-L181 VanDerWaalsContact O-CG 3.26Å; L177-L181 WeakPolarHBondContact O-CG 3.37Å; L177-L181 PolarHBondContact O-N 3.46Å; D178-L181 PolarHBondContact O-N 3.23Å; L181-L184 PolarHBondContact O-N 3.32Å; L181-F185 WeakPolarHBondContact O-CB 3.43Å; L181-F185 PolarHBondContact O-N 3.44Å
182F80.6Confident75.2Confident42 Ų4275.3 Ų75.318%0.18439%0.387CS..Hα-helixtrans-61.9-48.4173.3-179.9-101.9000111.5F155 M159 H162 D178 L184 F185 Q186F155-F182 HydrophobicContact CE1-CD1 4.42Å; F155-F182 HydrophobicContact CE1-CE1 4.26Å; F155-F182 AromaticContact CE2-CE1 3.87Å; F155-F182 HydrophobicContact CE2-CE1 3.87Å; F155-F182 AromaticContact CZ-CD1 3.78Å; F155-F182 HydrophobicContact CZ-CD1 3.78Å; F155-F182 AromaticContact CZ-CE1 3.45Å; F155-F182 HydrophobicContact CZ-CE1 3.45Å; F155-F182 VanDerWaalsContact CZ-CE1 3.45Å; F155-F182 HydrophobicContact CZ-CZ 4.49Å; M159-F182 HydrophobicContact CB-CE1 4.45Å; M159-F182 HydrophobicContact CG-CD1 4.46Å; H162-F182 HydrophobicContact CB-CE2 4.45Å; H162-F182 AromaticContact CD2-CE2 3.29Å; H162-F182 WeakPolarHBondContact CD2-CE2 3.42Å; H162-F182 AromaticContact CD2-CZ 3.15Å; H162-F182 WeakPolarHBondContact CD2-CZ 3.31Å; H162-F182 AromaticContact CE1-CE2 3.86Å; H162-F182 AromaticContact CG-CE2 3.7Å; H162-F182 AromaticContact CG-CZ 3.89Å; H162-F182 AromaticContact NE2-CE2 3.39Å; H162-F182 WeakPolarHBondContact NE2-CE2 3.47Å; H162-F182 AromaticContact NE2-CZ 3.55Å; D178-F182 VanDerWaalsContact O-CB 3.29Å; D178-F182 WeakPolarHBondContact O-CB 3.47Å; D178-F182 PolarHBondContact O-N 3.35Å; F182-L184 VanDerWaalsContact C-N 3.33Å; F182-L184 PolarHBondContact O-N 2.86Å; F182-F185 PolarHBondContact O-N 2.69Å; F182-Q186 WeakPolarHBondContact O-CB 3.27Å; F182-Q186 PolarHBondContact O-N 2.84Å
183L80Confident76.7Confident20 Ų2069.9 Ų69.911%0.10536%0.355CS..Hα-helixtrans-57.4-45.8174.3-85.6162.4000111.7M146 F155 M159 A179 F180 S187M146-L183 HydrophobicContact CE-CB 3.72Å; F155-L183 HydrophobicContact CD1-CD2 3.83Å; F155-L183 HydrophobicContact CE1-CD2 3.09Å; F155-L183 HydrophobicContact CE1-CG 3.77Å; F155-L183 HydrophobicContact CZ-CD2 3.73Å; F155-L183 HydrophobicContact CZ-CG 4.24Å; M159-L183 HydrophobicContact SD-CD1 4.22Å; M159-L183 HydrophobicContact SD-CG 4.42Å; A179-L183 VanDerWaalsContact O-CB 3.25Å; A179-L183 WeakPolarHBondContact O-CB 3.37Å; A179-L183 WeakPolarHBondContact O-CD1 3.4Å; A179-L183 VanDerWaalsContact O-CG 3.28Å; A179-L183 WeakPolarHBondContact O-CG 3.36Å; A179-L183 PolarHBondContact O-N 3.25Å; F180-L183 WeakPolarHBondContact O-CB 3.45Å; F180-L183 PolarHBondContact O-N 3.49Å; L183-S187 WeakPolarHBondContact O-CB 3.33Å; L183-S187 PolarHBondContact O-N 2.94Å
184L83.4Confident78.3Confident48 Ų4862.8 Ų62.825%0.25132%0.319SS..Hα-helixtrans-62.4-50.6179.2-178.670.1000110.4I142 M146 F180 L181 F182 Q186 S187 L188I142-L184 HydrophobicContact CG2-CD1 3.6Å; M146-L184 HydrophobicContact CE-CB 4.22Å; M146-L184 HydrophobicContact SD-CB 4.49Å; M146-L184 HydrophobicContact SD-CD1 4.05Å; F180-L184 HydrophobicContact CE1-CD2 4.32Å; F180-L184 VanDerWaalsContact O-CB 3.23Å; F180-L184 WeakPolarHBondContact O-CB 3.42Å; F180-L184 PolarHBondContact O-N 2.96Å; L181-L184 PolarHBondContact O-N 3.32Å; F182-L184 VanDerWaalsContact C-N 3.33Å; F182-L184 PolarHBondContact O-N 2.86Å; L184-Q186 PolarHBondContact O-N 3.44Å; L184-S187 WeakPolarHBondContact O-CB 2.99Å; L184-S187 PolarHBondContact O-N 3.01Å; L184-L188 HydrophobicContact CD1-CD1 4.41Å; L184-L188 HydrophobicContact CG-CD1 4.09Å; L184-L188 WeakPolarHBondContact O-CB 3.18Å; L184-L188 VanDerWaalsContact O-CG 3.24Å; L184-L188 WeakPolarHBondContact O-CG 3.17Å; L184-L188 PolarHBondContact O-N 2.92Å
185F82.3Confident79.5Confident145 Ų14561.8 Ų61.864%0.63631%0.313SS*.Hα-helixtrans-62.7-43.9-178.6-172.6-99.5000111.8L181 F182 L188 K189L181-F185 WeakPolarHBondContact O-CB 3.43Å; L181-F185 PolarHBondContact O-N 3.44Å; F182-F185 PolarHBondContact O-N 2.69Å; F185-L188 PolarHBondContact O-N 3.41Å; F185-K189 WeakPolarHBondContact O-CB 3.47Å; F185-K189 PolarHBondContact O-N 3.33Å
186Q80.5Confident80.7Confident52 Ų5260.7 Ų60.724%0.24330%0.304CS..Hα-helixtrans-67.4-40.1177.1-169.678-18.100111.9F155 F182 L184 K189 S190F155-Q186 HydrophobicContact CE2-CB 4.06Å; F155-Q186 HydrophobicContact CE2-CG 3.76Å; F155-Q186 HydrophobicContact CZ-CB 4.31Å; F155-Q186 HydrophobicContact CZ-CG 4.49Å; F182-Q186 WeakPolarHBondContact O-CB 3.27Å; F182-Q186 PolarHBondContact O-N 2.84Å; L184-Q186 PolarHBondContact O-N 3.44Å; Q186-K189 PolarHBondContact O-N 3.5Å; Q186-S190 WeakPolarHBondContact O-CB 3.39Å; Q186-S190 PolarHBondContact O-N 2.85Å; Q186-S190 PolarHBondContact O-OG 3.36Å
187S78.8Confident81.8Confident2 Ų254.4 Ų54.41%0.01428%0.276CS..Hα-helixtrans-58-49174.8-176.90000110.5T145 L183 L184 K189 S190 H191T145-S187 WeakPolarHBondContact CB-OG 3.2Å; T145-S187 WeakPolarHBondContact CG2-OG 3.4Å; L183-S187 WeakPolarHBondContact O-CB 3.33Å; L183-S187 PolarHBondContact O-N 2.94Å; L184-S187 WeakPolarHBondContact O-CB 2.99Å; L184-S187 PolarHBondContact O-N 3.01Å; S187-K189 PolarHBondContact O-N 2.93Å; S187-S190 PolarHBondContact O-N 3.37Å; S187-S190 VanDerWaalsContact O-N 3.16Å; S187-S190 PolarHBondContact O-OG 3.49Å; S187-H191 PolarHBondContact O-N 3.3Å; S187-H191 VanDerWaalsContact O-N 3.08Å
188L81.8Confident82.6Confident40 Ų4050.4 Ų50.421%0.20926%0.256CS..Hα-helixtrans-61.2-40.9176.3-69.9173.3000112.5I142 L184 F185 S190 H191 T195I142-L188 HydrophobicContact CD1-CD2 3.68Å; I142-L188 HydrophobicContact CG1-CD2 4.1Å; L184-L188 HydrophobicContact CD1-CD1 4.41Å; L184-L188 HydrophobicContact CG-CD1 4.09Å; L184-L188 WeakPolarHBondContact O-CB 3.18Å; L184-L188 VanDerWaalsContact O-CG 3.24Å; L184-L188 WeakPolarHBondContact O-CG 3.17Å; L184-L188 PolarHBondContact O-N 2.92Å; F185-L188 PolarHBondContact O-N 3.41Å; L188-S190 VanDerWaalsContact C-N 3.29Å; L188-S190 PolarHBondContact O-N 3.16Å; L188-H191 CarbonylContact O-C 3.46Å; L188-T195 VanDerWaalsContact C-OG1 3.23Å; L188-T195 WeakPolarHBondContact CA-OG1 3.23Å; L188-T195 HydrophobicContact CB-CG2 4.16Å; L188-T195 WeakPolarHBondContact CB-OG1 3.35Å; L188-T195 HydrophobicContact CD2-CG2 4.19Å; L188-T195 VanDerWaalsContact CD2-OG1 3.26Å; L188-T195 WeakPolarHBondContact CD2-OG1 3.47Å; L188-T195 PolarHBondContact O-OG1 3.33Å
189K81.4Confident83.4Confident151 Ų15151.8 Ų51.866%0.65726%0.263SS*.Hα-helixtrans-63.9-35.9177.1-173.4176.5179.7179.10112.2F185 Q186 S187F185-K189 WeakPolarHBondContact O-CB 3.47Å; F185-K189 PolarHBondContact O-N 3.33Å; Q186-K189 PolarHBondContact O-N 3.5Å; S187-K189 PolarHBondContact O-N 2.93Å
190S78.6Confident84.3Confident41 Ų4153.1 Ų53.129%0.28727%0.265SS..Hα-helixtrans-79.6-26.8-177.967.10000114.7R149 Q186 S187 L188 P192R149-S190 VanDerWaalsContact CZ-CB 3.44Å; R149-S190 PolarHBondContact NE-OG 2.93Å; R149-S190 PolarHBondContact NH2-OG 3.05Å; Q186-S190 WeakPolarHBondContact O-CB 3.39Å; Q186-S190 PolarHBondContact O-N 2.85Å; Q186-S190 PolarHBondContact O-OG 3.36Å; S187-S190 PolarHBondContact O-N 3.37Å; S187-S190 VanDerWaalsContact O-N 3.16Å; S187-S190 PolarHBondContact O-OG 3.49Å; L188-S190 VanDerWaalsContact C-N 3.29Å; L188-S190 PolarHBondContact O-N 3.16Å; S190-P192 VanDerWaalsContact C-CD 3.42Å; S190-P192 VanDerWaalsContact O-CD 3.23Å; S190-P192 WeakPolarHBondContact O-CD 3.4Å
191H81.9Confident84.9Confident71 Ų7148.2 Ų48.233%0.32924%0.244SC..  trans-116.971.9175.9-67-86.2000109.9T145 S187 L188 S193 V194 T195T145-H191 VanDerWaalsContact CG2-CD2 3.42Å; T145-H191 WeakPolarHBondContact CG2-CD2 3.4Å; T145-H191 WeakPolarHBondContact CG2-NE2 3.47Å; S187-H191 PolarHBondContact O-N 3.3Å; S187-H191 VanDerWaalsContact O-N 3.08Å; L188-H191 CarbonylContact O-C 3.46Å; H191-S193 PolarHBondContact O-N 3.17Å; H191-S193 VanDerWaalsContact O-N 3.09Å; H191-V194 HydrophobicContact CB-CB 4.34Å; H191-V194 HydrophobicContact CB-CG2 4.26Å; H191-V194 PolarHBondContact O-N 2.92Å; H191-V194 VanDerWaalsContact O-N 3.16Å; H191-T195 PolarHBondContact O-N 2.72Å; H191-T195 VanDerWaalsContact O-N 3.16Å; H191-T195 PolarHBondContact O-OG1 3.44Å
192P82.4Confident85.5Confident50 Ų5047.8 Ų47.833%0.32524%0.242SC..Hα-helixtrans-63.9-23.7-173.330.2-38.7000112S190 L196 L242S190-P192 VanDerWaalsContact C-CD 3.42Å; S190-P192 VanDerWaalsContact O-CD 3.23Å; S190-P192 WeakPolarHBondContact O-CD 3.4Å; P192-L196 WeakPolarHBondContact O-CB 3.37Å; P192-L196 WeakPolarHBondContact O-CG 3.23Å; P192-L196 PolarHBondContact O-N 2.93Å; P192-L242 HydrophobicContact CB-CD2 3.68Å; P192-L242 HydrophobicContact CG-CD2 3.46Å; P192-L242 VanDerWaalsContact CG-CD2 3.46Å
193S84.4Confident86.1Confident23 Ų2346.8 Ų46.816%0.16124%0.239CC..Hα-helixtrans-64.9-47.617661.50000112.8H191 D197 L242 I244H191-S193 PolarHBondContact O-N 3.17Å; H191-S193 VanDerWaalsContact O-N 3.09Å; S193-D197 PolarHBondContact O-N 2.96Å; S193-L242 WeakPolarHBondContact CA-O 3.3Å; S193-L242 WeakPolarHBondContact CB-O 3.37Å; S193-I244 VanDerWaalsContact CB-CG1 3.41Å; S193-I244 WeakPolarHBondContact O-CD1 3.45Å; S193-I244 WeakPolarHBondContact O-CG1 3.47Å
194V86.3Confident86.8Confident8 Ų846 Ų465%0.04824%0.236CC..Hα-helixtrans-67.4-40.3176.8-177.80000110.5D138 V141 I142 H191 L196 D197 T198 I244D138-V194 HydrophobicContact CB-CG1 4.4Å; V141-V194 HydrophobicContact CB-CG1 4.48Å; V141-V194 HydrophobicContact CG1-CG1 4.35Å; V141-V194 HydrophobicContact CG1-CG2 3.83Å; I142-V194 HydrophobicContact CD1-CG1 4.18Å; I142-V194 HydrophobicContact CG1-CG1 3.86Å; H191-V194 HydrophobicContact CB-CB 4.34Å; H191-V194 HydrophobicContact CB-CG2 4.26Å; H191-V194 PolarHBondContact O-N 2.92Å; H191-V194 VanDerWaalsContact O-N 3.16Å; V194-L196 PolarHBondContact O-N 3.28Å; V194-D197 PolarHBondContact O-N 3.24Å; V194-T198 WeakPolarHBondContact O-CB 3.41Å; V194-T198 PolarHBondContact O-N 2.9Å; V194-T198 PolarHBondContact O-OG1 3.47Å; V194-I244 HydrophobicContact CB-CD1 4.49Å; V194-I244 HydrophobicContact CG2-CD1 4.18Å; V194-I244 HydrophobicContact CG2-CG1 4.35Å
195T87.6Confident87.3Confident25 Ų2545.4 Ų45.415%0.15323%0.232CC..Hα-helixtrans-60.4-47176.8-57.90000112.3L188 H191 D197 T198 L199L188-T195 VanDerWaalsContact C-OG1 3.23Å; L188-T195 WeakPolarHBondContact CA-OG1 3.23Å; L188-T195 HydrophobicContact CB-CG2 4.16Å; L188-T195 WeakPolarHBondContact CB-OG1 3.35Å; L188-T195 HydrophobicContact CD2-CG2 4.19Å; L188-T195 VanDerWaalsContact CD2-OG1 3.26Å; L188-T195 WeakPolarHBondContact CD2-OG1 3.47Å; L188-T195 PolarHBondContact O-OG1 3.33Å; H191-T195 PolarHBondContact O-N 2.72Å; H191-T195 VanDerWaalsContact O-N 3.16Å; H191-T195 PolarHBondContact O-OG1 3.44Å; T195-D197 PolarHBondContact O-N 2.92Å; T195-T198 PolarHBondContact O-N 3Å; T195-L199 HydrophobicContact CG2-CD1 4.12Å; T195-L199 WeakPolarHBondContact O-CB 3.2Å; T195-L199 WeakPolarHBondContact O-CG 3.38Å; T195-L199 PolarHBondContact O-N 2.91Å
196L89.3Confident87.8Confident25 Ų2541.1 Ų41.113%0.13121%0.213CC..Hα-helixtrans-63.3-41.6178.2-72.5172.9000112P192 V194 K200 L232 L242P192-L196 WeakPolarHBondContact O-CB 3.37Å; P192-L196 WeakPolarHBondContact O-CG 3.23Å; P192-L196 PolarHBondContact O-N 2.93Å; V194-L196 PolarHBondContact O-N 3.28Å; L196-K200 WeakPolarHBondContact O-CB 3.42Å; L196-K200 PolarHBondContact O-N 3.35Å; L196-L232 HydrophobicContact CD2-CD2 3.67Å; L196-L242 HydrophobicContact CD1-CB 3.96Å; L196-L242 HydrophobicContact CD1-CD1 3.9Å; L196-L242 HydrophobicContact CD1-CG 4.42Å
197D90.3Very high88.3Confident34 Ų3440.3 Ų40.318%0.18221%0.21CC..Hα-helixtrans-68.3-40.8177.6-157.660.7000111.7R137 S193 V194 T195 K200 N201 I244R137-D197 IonicContact CZ-OD2 2.98Å; R137-D197 IonicContact NH2-OD2 2.7Å; R137-D197 PolarHBondContact NH2-OD2 2.98Å; S193-D197 PolarHBondContact O-N 2.96Å; V194-D197 PolarHBondContact O-N 3.24Å; T195-D197 PolarHBondContact O-N 2.92Å; D197-K200 PolarHBondContact O-N 3.11Å; D197-K200 IonicContact OD1-NZ 3.86Å; D197-N201 VanDerWaalsContact O-CB 3.31Å; D197-N201 WeakPolarHBondContact O-CB 3.49Å; D197-N201 PolarHBondContact O-N 3.47Å; D197-N201 PolarHBondContact O-ND2 3.42Å; D197-N201 VanDerWaalsContact O-ND2 3.11Å; D197-N201 PolarHBondContact OD2-ND2 2.89Å; D197-I244 HydrophobicContact CB-CD1 3.64Å
198T91.9Very high89Confident18 Ų1840.3 Ų40.311%0.1121%0.21CC..Hα-helixtrans-58.2-53.5175-53.20000110.9L135 D138 V194 T195 K200 N201 I202L135-T198 HydrophobicContact CD2-CG2 4.42Å; D138-T198 HydrophobicContact CB-CG2 4.5Å; D138-T198 WeakPolarHBondContact CB-OG1 3.36Å; D138-T198 WeakPolarHBondContact OD2-CA 3.32Å; V194-T198 WeakPolarHBondContact O-CB 3.41Å; V194-T198 PolarHBondContact O-N 2.9Å; V194-T198 PolarHBondContact O-OG1 3.47Å; T195-T198 PolarHBondContact O-N 3Å; T198-K200 VanDerWaalsContact C-N 3.3Å; T198-K200 PolarHBondContact O-N 3.31Å; T198-N201 PolarHBondContact O-N 2.95Å; T198-I202 HydrophobicContact CG2-CD1 3.78Å; T198-I202 HydrophobicContact CG2-CG1 4.39Å; T198-I202 WeakPolarHBondContact O-CB 3.26Å; T198-I202 VanDerWaalsContact O-CG1 3.27Å; T198-I202 WeakPolarHBondContact O-CG1 3.33Å; T198-I202 PolarHBondContact O-N 3.11Å
199L92.5Very high89.4Confident82 Ų8239.7 Ų39.743%0.42921%0.207SC..Hα-helixtrans-60.2-41.9-180-73.1175000111.7T195 C203 L232T195-L199 HydrophobicContact CG2-CD1 4.12Å; T195-L199 WeakPolarHBondContact O-CB 3.2Å; T195-L199 WeakPolarHBondContact O-CG 3.38Å; T195-L199 PolarHBondContact O-N 2.91Å; L199-C203 WeakPolarHBondContact O-CB 3.15Å; L199-C203 PolarHBondContact O-N 3.18Å; L199-C203 PolarHBondContact O-SG 3.16Å; L199-L232 HydrophobicContact CB-CD1 3.73Å
200K93.1Very high89.8Confident44 Ų4435.7 Ų35.719%0.19119%0.193CC..Hα-helixtrans-62.4-47.9176177.9-169.8158.4-1290111.3L196 D197 T198 C203 D204 L232L196-K200 WeakPolarHBondContact O-CB 3.42Å; L196-K200 PolarHBondContact O-N 3.35Å; D197-K200 PolarHBondContact O-N 3.11Å; D197-K200 IonicContact OD1-NZ 3.86Å; T198-K200 VanDerWaalsContact C-N 3.3Å; T198-K200 PolarHBondContact O-N 3.31Å; K200-C203 PolarHBondContact O-N 2.67Å; K200-D204 WeakPolarHBondContact O-CB 3.23Å; K200-D204 PolarHBondContact O-N 3.09Å; K200-L232 HydrophobicContact CB-CD1 4.5Å
201N94.1Very high90.3Very high2 Ų239.7 Ų39.71%0.01120%0.202CC..Hα-helixtrans-66.2-39.3-178.7-68.4-29.2000111.5L131 L135 D138 D197 T198 D204 I205L131-N201 HydrophobicContact CD2-CB 4.38Å; L135-N201 HydrophobicContact CD2-CB 3.53Å; L135-N201 HydrophobicContact CG-CB 3.8Å; D138-N201 PolarHBondContact OD2-ND2 3.26Å; D197-N201 VanDerWaalsContact O-CB 3.31Å; D197-N201 WeakPolarHBondContact O-CB 3.49Å; D197-N201 PolarHBondContact O-N 3.47Å; D197-N201 PolarHBondContact O-ND2 3.42Å; D197-N201 VanDerWaalsContact O-ND2 3.11Å; D197-N201 PolarHBondContact OD2-ND2 2.89Å; T198-N201 PolarHBondContact O-N 2.95Å; N201-D204 PolarHBondContact O-N 3.29Å; N201-I205 PolarHBondContact O-N 2.96Å; N201-I205 VanDerWaalsContact O-N 3.09Å
202I94Very high90.8Very high81 Ų8138.8 Ų38.842%0.41520%0.199SC..Hα-helixtrans-61.8-47.1172.7-69.4171.6000110.4L135 T198 D204 I205L135-I202 HydrophobicContact CD2-CG1 3.76Å; T198-I202 HydrophobicContact CG2-CD1 3.78Å; T198-I202 HydrophobicContact CG2-CG1 4.39Å; T198-I202 WeakPolarHBondContact O-CB 3.26Å; T198-I202 VanDerWaalsContact O-CG1 3.27Å; T198-I202 WeakPolarHBondContact O-CG1 3.33Å; T198-I202 PolarHBondContact O-N 3.11Å; I202-D204 VanDerWaalsContact C-N 3.32Å; I202-D204 PolarHBondContact O-N 3.42Å; I202-I205 WeakPolarHBondContact O-CG2 3.49Å; I202-I205 PolarHBondContact O-N 3.23Å
203C93.5Very high91Very high21 Ų2138.8 Ų38.814%0.14221%0.208CC..Hα-helixtrans-63.9-38.8177.6-76.50000112.1L199 K200 I205 C225L199-C203 WeakPolarHBondContact O-CB 3.15Å; L199-C203 PolarHBondContact O-N 3.18Å; L199-C203 PolarHBondContact O-SG 3.16Å; K200-C203 PolarHBondContact O-N 2.67Å; C203-I205 VanDerWaalsContact C-N 3.29Å; C203-I205 PolarHBondContact O-N 3.44Å; C203-C225 HydrophobicContact CB-CB 3.98Å; C203-C225 WeakPolarHBondContact CB-O 3.38Å; C203-C225 WeakPolarHBondContact O-CB 3.24Å
204D94.4Very high91.2Very high4 Ų442.8 Ų42.82%0.02123%0.231CC..Hα-helixtrans-74.1-17.1-178.9-84.3-13.6000113.5R19 Y127 L131 K200 N201 I202 F206 I207 P208 S229R19-D204 IonicContact CZ-OD1 3.1Å; R19-D204 IonicContact CZ-OD2 2.65Å; R19-D204 IonicContact NH2-OD1 3.88Å; R19-D204 PolarHBondContact NH2-OD1 3.32Å; R19-D204 IonicContact NH2-OD2 3.63Å; R19-D204 PolarHBondContact NH2-OD2 3.02Å; Y127-D204 PolarHBondContact OH-OD2 2.98Å; Y127-D204 VanDerWaalsContact OH-OD2 3.08Å; L131-D204 HydrophobicContact CD1-CB 4.09Å; L131-D204 HydrophobicContact CD2-CB 4.07Å; K200-D204 WeakPolarHBondContact O-CB 3.23Å; K200-D204 PolarHBondContact O-N 3.09Å; N201-D204 PolarHBondContact O-N 3.29Å; I202-D204 VanDerWaalsContact C-N 3.32Å; I202-D204 PolarHBondContact O-N 3.42Å; D204-F206 VanDerWaalsContact C-N 3.26Å; D204-F206 PolarHBondContact O-N 3.36Å; D204-I207 HydrophobicContact CB-CD1 4.36Å; D204-I207 WeakPolarHBondContact O-CB 3.41Å; D204-I207 PolarHBondContact O-N 3.44Å; D204-I207 WeakPolarHBondContact OD1-CD1 3.43Å; D204-P208 WeakPolarHBondContact O-CD 3.39Å; D204-S229 WeakPolarHBondContact OD1-CB 3.48Å; D204-S229 PolarHBondContact OD1-OG 2.6Å
205I94.3Very high91.2Very high34 Ų3448.9 Ų48.917%0.17425%0.254CS..Hα-helixtrans-64-30.5-178.2-149.5174.5000112.8F128 L135 N201 I202 C203 I207 P208 L209F128-I205 HydrophobicContact CD2-CG1 4.25Å; F128-I205 HydrophobicContact CE2-CD1 4.14Å; F128-I205 HydrophobicContact CE2-CG1 3.94Å; L135-I205 HydrophobicContact CD1-CD1 3.99Å; N201-I205 PolarHBondContact O-N 2.96Å; N201-I205 VanDerWaalsContact O-N 3.09Å; I202-I205 WeakPolarHBondContact O-CG2 3.49Å; I202-I205 PolarHBondContact O-N 3.23Å; C203-I205 VanDerWaalsContact C-N 3.29Å; C203-I205 PolarHBondContact O-N 3.44Å; I205-I207 PolarHBondContact O-N 3.38Å; I205-P208 VanDerWaalsContact O-CD 3.25Å; I205-P208 WeakPolarHBondContact O-CD 3.23Å; I205-P208 WeakPolarHBondContact O-CG 3.12Å; I205-L209 HydrophobicContact CG1-CD1 4.1Å; I205-L209 HydrophobicContact CG1-CG 4.45Å; I205-L209 HydrophobicContact CG2-CD1 4.11Å; I205-L209 WeakPolarHBondContact O-CB 3.34Å; I205-L209 WeakPolarHBondContact O-CD1 3.49Å; I205-L209 VanDerWaalsContact O-CG 3.23Å; I205-L209 WeakPolarHBondContact O-CG 3.24Å; I205-L209 PolarHBondContact O-N 2.87Å
206F92.3Very high91Very high56 Ų5658.3 Ų58.325%0.24629%0.287CS..Hα-helixtrans-64.8-27179.2-66.2-77.1000112.3D204 D210 C225D204-F206 VanDerWaalsContact C-N 3.26Å; D204-F206 PolarHBondContact O-N 3.36Å; F206-D210 WeakPolarHBondContact O-CB 3.48Å; F206-D210 PolarHBondContact O-N 3.37Å; F206-D210 VanDerWaalsContact O-N 3.1Å; F206-C225 HydrophobicContact CD2-CB 4.24Å
207I91.4Very high90.8Very high35 Ų3557.6 Ų57.618%0.17928%0.284CS..Hα-helixtrans-66.8-57.5-177.1-58.9160.7000111.6R19 Y23 D204 I205 R211 V222R19-I207 VanDerWaalsContact NH2-CD1 3.29Å; Y23-I207 HydrophobicContact CE1-CD1 4.49Å; Y23-I207 VanDerWaalsContact OH-CD1 3.28Å; Y23-I207 WeakPolarHBondContact OH-CD1 3.43Å; D204-I207 HydrophobicContact CB-CD1 4.36Å; D204-I207 WeakPolarHBondContact O-CB 3.41Å; D204-I207 PolarHBondContact O-N 3.44Å; D204-I207 WeakPolarHBondContact OD1-CD1 3.43Å; I205-I207 PolarHBondContact O-N 3.38Å; I207-R211 PolarHBondContact O-N 3.39Å; I207-V222 HydrophobicContact CG1-CG1 4.13Å
208P93.1Very high90.8Very high1 Ų159.1 Ų59.11%0.00629%0.292CS..Hα-helixtrans-71.9-29.8177.229.2-35.3000112.9S124 Y127 F128 L131 D204 I205 D210 R211 L212S124-P208 WeakPolarHBondContact O-CB 3.28Å; Y127-P208 HydrophobicContact CD1-CB 4.1Å; Y127-P208 HydrophobicContact CD1-CG 3.85Å; Y127-P208 HydrophobicContact CE1-CG 4.31Å; F128-P208 HydrophobicContact CB-CB 3.93Å; F128-P208 HydrophobicContact CB-CG 4.06Å; F128-P208 HydrophobicContact CD2-CG 4.08Å; L131-P208 HydrophobicContact CD1-CG 3.96Å; D204-P208 WeakPolarHBondContact O-CD 3.39Å; I205-P208 VanDerWaalsContact O-CD 3.25Å; I205-P208 WeakPolarHBondContact O-CD 3.23Å; I205-P208 WeakPolarHBondContact O-CG 3.12Å; P208-D210 VanDerWaalsContact C-N 3.34Å; P208-D210 PolarHBondContact O-N 2.8Å; P208-R211 PolarHBondContact O-N 2.98Å; P208-L212 VanDerWaalsContact O-CB 3.32Å; P208-L212 WeakPolarHBondContact O-CB 3.41Å; P208-L212 WeakPolarHBondContact O-CG 3.29Å; P208-L212 PolarHBondContact O-N 3.08Å
209L91.5Very high90.6Very high27 Ų2762.4 Ų62.414%0.14131%0.314CS..Hα-helixtrans-61.2-42.6176.9-78.3175.4000112.4F128 I205 G213 V214 Y215F128-L209 HydrophobicContact CD2-CD2 4.25Å; F128-L209 HydrophobicContact CD2-CG 4.36Å; F128-L209 HydrophobicContact CE2-CD2 3.62Å; F128-L209 HydrophobicContact CE2-CG 3.97Å; F128-L209 HydrophobicContact CZ-CD2 4.1Å; I205-L209 HydrophobicContact CG1-CD1 4.1Å; I205-L209 HydrophobicContact CG1-CG 4.45Å; I205-L209 HydrophobicContact CG2-CD1 4.11Å; I205-L209 WeakPolarHBondContact O-CB 3.34Å; I205-L209 WeakPolarHBondContact O-CD1 3.49Å; I205-L209 VanDerWaalsContact O-CG 3.23Å; I205-L209 WeakPolarHBondContact O-CG 3.24Å; I205-L209 PolarHBondContact O-N 2.87Å; L209-G213 PolarHBondContact O-N 3.25Å; L209-V214 HydrophobicContact CD2-CB 4.02Å; L209-V214 HydrophobicContact CD2-CG1 4Å; L209-V214 PolarHBondContact O-N 3.27Å; L209-Y215 PolarHBondContact O-N 3.41Å
210D90.1Very high90.6Very high68 Ų6858.8 Ų58.836%0.36430%0.296SS..Hα-helixtrans-64.2-45.3174.9-171.771.6000111.1F206 P208 L212 G213 Y215 S217 V222F206-D210 WeakPolarHBondContact O-CB 3.48Å; F206-D210 PolarHBondContact O-N 3.37Å; F206-D210 VanDerWaalsContact O-N 3.1Å; P208-D210 VanDerWaalsContact C-N 3.34Å; P208-D210 PolarHBondContact O-N 2.8Å; D210-L212 PolarHBondContact O-N 3.41Å; D210-G213 PolarHBondContact O-N 2.96Å; D210-G213 VanDerWaalsContact O-N 3.12Å; D210-Y215 WeakPolarHBondContact CA-O 3.42Å; D210-S217 PolarHBondContact OD1-N 2.84Å; D210-V222 HydrophobicContact CB-CG2 4.43Å
211R89.2Confident90.5Very high125 Ų12559.6 Ų59.647%0.47231%0.305SS..Hα-helixtrans-67.6-32.8-179.1-171.855.4171.9176.47113.9S120 S124 I207 P208 G213S120-R211 PolarHBondContact OG-NE 2.7Å; S120-R211 VanDerWaalsContact OG-NE 3.12Å; S120-R211 PolarHBondContact OG-NH2 3.16Å; S124-R211 WeakPolarHBondContact OG-CG 3.26Å; I207-R211 PolarHBondContact O-N 3.39Å; P208-R211 PolarHBondContact O-N 2.98Å; R211-G213 VanDerWaalsContact C-N 3.26Å
212L91Very high90.4Very high52 Ų5260.6 Ų60.627%0.27231%0.311SS..THydrogen-bonded Turntrans-80.4-8.5176-68.1169.6000112.5L121 C125 F128 P208 D210 V214L121-L212 HydrophobicContact CD2-CD2 4.48Å; C125-L212 HydrophobicContact CB-CD2 4.22Å; F128-L212 HydrophobicContact CB-CD1 4.07Å; F128-L212 HydrophobicContact CG-CD1 4.28Å; P208-L212 VanDerWaalsContact O-CB 3.32Å; P208-L212 WeakPolarHBondContact O-CB 3.41Å; P208-L212 WeakPolarHBondContact O-CG 3.29Å; P208-L212 PolarHBondContact O-N 3.08Å; D210-L212 PolarHBondContact O-N 3.41Å; L212-V214 HydrophobicContact CB-CG2 3.96Å; L212-V214 PolarHBondContact O-N 3.28Å
213G87.4Confident90.4Very high50 Ų5056.8 Ų56.852%0.51529%0.292SS..THydrogen-bonded Turntrans72.28.1-178.600000114.6L209 D210 R211L209-G213 PolarHBondContact O-N 3.25Å; D210-G213 PolarHBondContact O-N 2.96Å; D210-G213 VanDerWaalsContact O-N 3.12Å; R211-G213 VanDerWaalsContact C-N 3.26Å
214V87.1Confident90.4Very high107 Ų10760.9 Ų60.965%0.64831%0.307SS*.SBendtrans-70.5-40.9179.5177.90000110.7L209 L212L209-V214 HydrophobicContact CD2-CB 4.02Å; L209-V214 HydrophobicContact CD2-CG1 4Å; L209-V214 PolarHBondContact O-N 3.27Å; L212-V214 HydrophobicContact CB-CG2 3.96Å; L212-V214 PolarHBondContact O-N 3.28Å
215Y86.8Confident90.5Very high136 Ų13661.2 Ų61.253%0.53331%0.31SS..SBendtrans-141.1112.1176.2-175-101.3000110L209 D210 S217L209-Y215 PolarHBondContact O-N 3.41Å; D210-Y215 WeakPolarHBondContact CA-O 3.42Å; Y215-S217 WeakPolarHBondContact CD1-OG 3.28Å; Y215-S217 PolarHBondContact O-N 2.88Å; Y215-S217 VanDerWaalsContact O-N 3.07Å
216R84.8Confident90.4Very high223 Ų22359.6 Ų59.684%0.84230%0.302SS*.  trans-74.899.8179.8-68.2-173.8-178.4177.70.8109.4
217S84.9Confident90.6Very high10 Ų1058.4 Ų58.47%0.0730%0.298CS..  trans-84.4147.1-179.8-63.10000109.5D210 Y215D210-S217 PolarHBondContact OD1-N 2.84Å; Y215-S217 WeakPolarHBondContact CD1-OG 3.28Å; Y215-S217 PolarHBondContact O-N 2.88Å; Y215-S217 VanDerWaalsContact O-N 3.07Å
218N89.6Confident90.7Very high66 Ų6659.3 Ų59.335%0.35330%0.303SS..  trans-62.2131.2170.8-176.9-28.8000109.1Y30 G220 V221 V222Y30-N218 WeakPolarHBondContact CE2-OD1 3.42Å; Y30-N218 PolarHBondContact OH-ND2 2.91Å; Y30-N218 PolarHBondContact OH-OD1 3.24Å; N218-G220 PolarHBondContact O-N 2.9Å; N218-G220 PolarHBondContact OD1-N 2.94Å; N218-V221 HydrophobicContact CB-CB 4.38Å; N218-V221 HydrophobicContact CB-CG2 3.97Å; N218-V221 WeakPolarHBondContact O-CA 3.25Å; N218-V221 WeakPolarHBondContact O-CB 3.48Å; N218-V221 PolarHBondContact O-N 3.46Å; N218-V222 PolarHBondContact O-N 2.83Å; N218-V222 VanDerWaalsContact O-N 3.12Å
219P88.1Confident90.8Very high87 Ų8759.3 Ų59.357%0.56530%0.303SS*.Hα-helixtrans-53.1-29.9178.7-28.334.6000114Y30 G223Y30-P219 HydrophobicContact CD2-CB 4.14Å; P219-G223 PolarHBondContact O-N 3.34Å
220G91.1Very high90.9Very high6 Ų658.2 Ų58.26%0.06230%0.297CS..Hα-helixtrans-66-38.7173.100000113.3Y30 N218 G223 F224Y30-G220 VanDerWaalsContact CD1-CA 3.45Å; Y30-G220 VanDerWaalsContact CD2-N 3.33Å; Y30-G220 VanDerWaalsContact CG-CA 3.41Å; N218-G220 PolarHBondContact O-N 2.9Å; N218-G220 PolarHBondContact OD1-N 2.94Å; G220-G223 PolarHBondContact O-N 3.28Å; G220-F224 VanDerWaalsContact O-CB 3.31Å; G220-F224 WeakPolarHBondContact O-CB 3.33Å; G220-F224 PolarHBondContact O-N 3.21Å
221V92.1Very high91Very high60 Ų6058.6 Ų58.636%0.36430%0.299SS..Hα-helixtrans-67.2-45.5175.9174.50000110.1N218 G223 F224 C225N218-V221 HydrophobicContact CB-CB 4.38Å; N218-V221 HydrophobicContact CB-CG2 3.97Å; N218-V221 WeakPolarHBondContact O-CA 3.25Å; N218-V221 WeakPolarHBondContact O-CB 3.48Å; N218-V221 PolarHBondContact O-N 3.46Å; V221-G223 VanDerWaalsContact C-N 3.31Å; V221-G223 PolarHBondContact O-N 2.8Å; V221-F224 PolarHBondContact O-N 2.81Å; V221-C225 WeakPolarHBondContact O-CB 3.37Å; V221-C225 PolarHBondContact O-N 3.12Å; V221-C225 PolarHBondContact O-SG 3.15Å; V221-C225 VanDerWaalsContact O-SG 3.35Å
222V92.4Very high91.1Very high23 Ų2354.2 Ų54.214%0.13928%0.284CS..Hα-helixtrans-61.1-42.4176.1-178.80000111Y23 I207 D210 N218 G226Y23-V222 HydrophobicContact CE1-CG1 4.43Å; I207-V222 HydrophobicContact CG1-CG1 4.13Å; D210-V222 HydrophobicContact CB-CG2 4.43Å; N218-V222 PolarHBondContact O-N 2.83Å; N218-V222 VanDerWaalsContact O-N 3.12Å; V222-G226 PolarHBondContact O-N 2.92Å
223G92.8Very high90.9Very high2 Ų251.8 Ų51.82%0.02127%0.272CS..Hα-helixtrans-58.8-49.1173.600000112.8P219 G220 V221 L227P219-G223 PolarHBondContact O-N 3.34Å; G220-G223 PolarHBondContact O-N 3.28Å; V221-G223 VanDerWaalsContact C-N 3.31Å; V221-G223 PolarHBondContact O-N 2.8Å; G223-L227 WeakPolarHBondContact O-CB 3.48Å; G223-L227 PolarHBondContact O-N 3.25Å
224F95.1Very high91Very high106 Ų10650.7 Ų50.747%0.46525%0.254SS..Hα-helixtrans-65.8-51.9179.9179.2-103.2000112.5L27 G220 V221 G226 L227 I228L27-F224 HydrophobicContact CD1-CB 4.1Å; L27-F224 HydrophobicContact CD2-CB 4.4Å; L27-F224 HydrophobicContact CD2-CD2 4.14Å; G220-F224 VanDerWaalsContact O-CB 3.31Å; G220-F224 WeakPolarHBondContact O-CB 3.33Å; G220-F224 PolarHBondContact O-N 3.21Å; V221-F224 PolarHBondContact O-N 2.81Å; F224-G226 VanDerWaalsContact C-N 3.34Å; F224-G226 PolarHBondContact O-N 3.25Å; F224-L227 WeakPolarHBondContact O-CB 3.45Å; F224-L227 PolarHBondContact O-N 2.96Å; F224-L227 VanDerWaalsContact O-N 3.11Å; F224-I228 HydrophobicContact CD1-CG1 4.32Å; F224-I228 HydrophobicContact CD2-CG1 4.43Å; F224-I228 HydrophobicContact CE1-CG1 3.92Å; F224-I228 HydrophobicContact CE2-CD1 4.15Å; F224-I228 HydrophobicContact CE2-CG1 4.05Å; F224-I228 HydrophobicContact CZ-CD1 4Å; F224-I228 HydrophobicContact CZ-CG1 3.77Å; F224-I228 WeakPolarHBondContact O-CG1 3.2Å; F224-I228 PolarHBondContact O-N 3.5Å
225C94.6Very high90.9Very high12 Ų1248.4 Ų48.48%0.08124%0.24CC..Hα-helixtrans-61.4-42.4179.1-68.70000111.6C203 F206 V221 L227 I228 S229C203-C225 HydrophobicContact CB-CB 3.98Å; C203-C225 WeakPolarHBondContact CB-O 3.38Å; C203-C225 WeakPolarHBondContact O-CB 3.24Å; F206-C225 HydrophobicContact CD2-CB 4.24Å; V221-C225 WeakPolarHBondContact O-CB 3.37Å; V221-C225 PolarHBondContact O-N 3.12Å; V221-C225 PolarHBondContact O-SG 3.15Å; V221-C225 VanDerWaalsContact O-SG 3.35Å; C225-L227 VanDerWaalsContact C-N 3.29Å; C225-L227 PolarHBondContact O-N 2.98Å; C225-I228 PolarHBondContact O-N 2.89Å; C225-S229 WeakPolarHBondContact O-CB 3.48Å; C225-S229 PolarHBondContact O-N 3.37Å; C225-S229 PolarHBondContact O-OG 3.33Å
226G93.7Very high90.7Very high0 Ų043.1 Ų43.10%022%0.223CC..Hα-helixtrans-63.7-33.4175.100000113.1Y23 V222 F224 S229 S230Y23-G226 WeakPolarHBondContact CD2-O 3.44Å; V222-G226 PolarHBondContact O-N 2.92Å; F224-G226 VanDerWaalsContact C-N 3.34Å; F224-G226 PolarHBondContact O-N 3.25Å; G226-S229 PolarHBondContact O-OG 2.87Å; G226-S230 WeakPolarHBondContact O-CB 3.45Å; G226-S230 PolarHBondContact O-N 2.94Å; G226-S230 PolarHBondContact O-OG 3.13Å
227L95.9Very high90.4Very high30 Ų3034.9 Ų34.916%0.15720%0.198CC..Hα-helixtrans-68.7-50.3174.117860.4000111T20 A24 L27 G223 F224 C225 S229 S230 L231T20-L227 HydrophobicContact CG2-CD1 3.71Å; A24-L227 HydrophobicContact CB-CD1 4.06Å; L27-L227 HydrophobicContact CD2-CD2 4.03Å; G223-L227 WeakPolarHBondContact O-CB 3.48Å; G223-L227 PolarHBondContact O-N 3.25Å; F224-L227 WeakPolarHBondContact O-CB 3.45Å; F224-L227 PolarHBondContact O-N 2.96Å; F224-L227 VanDerWaalsContact O-N 3.11Å; C225-L227 VanDerWaalsContact C-N 3.29Å; C225-L227 PolarHBondContact O-N 2.98Å; L227-S229 PolarHBondContact O-N 3.47Å; L227-S230 PolarHBondContact O-N 2.85Å; L227-L231 HydrophobicContact CD1-CD1 4.23Å; L227-L231 HydrophobicContact CD1-CG 4.3Å; L227-L231 HydrophobicContact CG-CD1 4.16Å; L227-L231 WeakPolarHBondContact O-CG 3.22Å; L227-L231 PolarHBondContact O-N 3.04Å
228I94.4Very high90.1Very high55 Ų5536.6 Ų36.628%0.28221%0.205SC..Hα-helixtrans-58.3-50.1178.5-66.4-65.1000110.7F224 C225 S230 L231 L232F224-I228 HydrophobicContact CD1-CG1 4.32Å; F224-I228 HydrophobicContact CD2-CG1 4.43Å; F224-I228 HydrophobicContact CE1-CG1 3.92Å; F224-I228 HydrophobicContact CE2-CD1 4.15Å; F224-I228 HydrophobicContact CE2-CG1 4.05Å; F224-I228 HydrophobicContact CZ-CD1 4Å; F224-I228 HydrophobicContact CZ-CG1 3.77Å; F224-I228 WeakPolarHBondContact O-CG1 3.2Å; F224-I228 PolarHBondContact O-N 3.5Å; C225-I228 PolarHBondContact O-N 2.89Å; I228-S230 PolarHBondContact O-N 3.34Å; I228-L231 PolarHBondContact O-N 3.21Å; I228-L232 HydrophobicContact CG2-CD1 3.95Å; I228-L232 HydrophobicContact CG2-CG 4.24Å; I228-L232 VanDerWaalsContact O-CG 3.3Å; I228-L232 WeakPolarHBondContact O-CG 3.45Å; I228-L232 PolarHBondContact O-N 3.2Å
229S94Very high89.3Confident1 Ų138.1 Ų38.11%0.00721%0.21CC..Hα-helixtrans-60.5-34.3-179.9730000112.7D204 C225 G226 L227 G233D204-S229 WeakPolarHBondContact OD1-CB 3.48Å; D204-S229 PolarHBondContact OD1-OG 2.6Å; C225-S229 WeakPolarHBondContact O-CB 3.48Å; C225-S229 PolarHBondContact O-N 3.37Å; C225-S229 PolarHBondContact O-OG 3.33Å; G226-S229 PolarHBondContact O-OG 2.87Å; L227-S229 PolarHBondContact O-N 3.47Å; S229-G233 PolarHBondContact O-N 3.42Å
230S93Very high87.9Confident3 Ų338.8 Ų38.82%0.02122%0.215CC..Hα-helixtrans-70.7-44.2176.8-55.60000112R19 T20 G226 L227 I228 G233 I234R19-S230 WeakPolarHBondContact CD-OG 3.37Å; R19-S230 WeakPolarHBondContact CG-OG 3.42Å; R19-S230 PolarHBondContact NE-OG 2.89Å; T20-S230 VanDerWaalsContact OG1-CB 3.23Å; T20-S230 WeakPolarHBondContact OG1-CB 3.39Å; G226-S230 WeakPolarHBondContact O-CB 3.45Å; G226-S230 PolarHBondContact O-N 2.94Å; G226-S230 PolarHBondContact O-OG 3.13Å; L227-S230 PolarHBondContact O-N 2.85Å; I228-S230 PolarHBondContact O-N 3.34Å; S230-G233 CarbonylContact O-C 3.57Å; S230-G233 WeakPolarHBondContact O-CA 3.15Å; S230-G233 PolarHBondContact O-N 3.48Å; S230-I234 WeakPolarHBondContact O-CG1 3.29Å; S230-I234 PolarHBondContact O-N 3.22Å
231L93.7Very high85.9Confident77 Ų7743.5 Ų43.540%0.40325%0.247SC..Hα-helixtrans-62.3-47.7176-69.5173.5000111.4T20 L227 I228 G233 I234 V235T20-L231 HydrophobicContact CG2-CD2 3.83Å; T20-L231 HydrophobicContact CG2-CG 4.37Å; L227-L231 HydrophobicContact CD1-CD1 4.23Å; L227-L231 HydrophobicContact CD1-CG 4.3Å; L227-L231 HydrophobicContact CG-CD1 4.16Å; L227-L231 WeakPolarHBondContact O-CG 3.22Å; L227-L231 PolarHBondContact O-N 3.04Å; I228-L231 PolarHBondContact O-N 3.21Å; L231-G233 PolarHBondContact O-N 2.91Å; L231-I234 PolarHBondContact O-N 2.87Å; L231-V235 WeakPolarHBondContact O-CG2 3.48Å; L231-V235 PolarHBondContact O-N 3.29Å
232L90.4Very high84Confident33 Ų3342.6 Ų42.617%0.17324%0.239CC..Hα-helixtrans-57.1-39.5173.8-64.8178.3000110.9L196 L199 K200 I228 I234 V235 S236L196-L232 HydrophobicContact CD2-CD2 3.67Å; L199-L232 HydrophobicContact CB-CD1 3.73Å; K200-L232 HydrophobicContact CB-CD1 4.5Å; I228-L232 HydrophobicContact CG2-CD1 3.95Å; I228-L232 HydrophobicContact CG2-CG 4.24Å; I228-L232 VanDerWaalsContact O-CG 3.3Å; I228-L232 WeakPolarHBondContact O-CG 3.45Å; I228-L232 PolarHBondContact O-N 3.2Å; L232-I234 PolarHBondContact O-N 3.03Å; L232-V235 PolarHBondContact O-N 3.27Å; L232-S236 WeakPolarHBondContact O-CB 3.37Å; L232-S236 PolarHBondContact O-N 3.23Å; L232-S236 PolarHBondContact O-OG 3.33Å
233G86.6Confident81.9Confident1 Ų148.6 Ų48.61%0.0126%0.264CS..Hα-helixtrans-63.5-34.817500000114.6R16 S229 S230 L231 V237R16-G233 PolarHBondContact NH1-O 3.24Å; S229-G233 PolarHBondContact O-N 3.42Å; S230-G233 CarbonylContact O-C 3.57Å; S230-G233 WeakPolarHBondContact O-CA 3.15Å; S230-G233 PolarHBondContact O-N 3.48Å; L231-G233 PolarHBondContact O-N 2.91Å; G233-V237 WeakPolarHBondContact O-CG2 3.34Å
234I89.3Confident79.6Confident26 Ų2650.7 Ų50.713%0.13327%0.274CS..Hα-helixtrans-72.5-48.3175-67.3172000109.8F7 R16 T20 S230 L231 L232 S236 V237 L238F7-I234 HydrophobicContact CE1-CG2 4.33Å; F7-I234 HydrophobicContact CE2-CG2 4.5Å; F7-I234 HydrophobicContact CZ-CB 4.4Å; F7-I234 HydrophobicContact CZ-CG1 3.87Å; F7-I234 HydrophobicContact CZ-CG2 4.07Å; R16-I234 HydrophobicContact CB-CG1 3.95Å; T20-I234 WeakPolarHBondContact OG1-CD1 3.39Å; S230-I234 WeakPolarHBondContact O-CG1 3.29Å; S230-I234 PolarHBondContact O-N 3.22Å; L231-I234 PolarHBondContact O-N 2.87Å; L232-I234 PolarHBondContact O-N 3.03Å; I234-S236 VanDerWaalsContact C-N 3.28Å; I234-S236 PolarHBondContact O-N 3.35Å; I234-V237 PolarHBondContact O-N 3.2Å; I234-L238 HydrophobicContact CG2-CD1 3.63Å; I234-L238 HydrophobicContact CG2-CG 4.2Å; I234-L238 WeakPolarHBondContact O-CG 3.48Å; I234-L238 PolarHBondContact O-N 3.45Å
235V86.6Confident76.9Confident59 Ų5953.9 Ų53.936%0.35829%0.29SS..Hα-helixtrans-56.3-44.1178.61720000110.9L231 L232 V237 L238 H239 L242L231-V235 WeakPolarHBondContact O-CG2 3.48Å; L231-V235 PolarHBondContact O-N 3.29Å; L232-V235 PolarHBondContact O-N 3.27Å; V235-V237 PolarHBondContact O-N 3.04Å; V235-L238 PolarHBondContact O-N 3.44Å; V235-H239 PolarHBondContact O-N 2.94Å; V235-L242 HydrophobicContact CG1-CD1 4.39Å
236S81.9Confident74.5Confident26 Ų2659.4 Ų59.418%0.18233%0.326CS..Hα-helixtrans-62.2-25.7179.2-57.50000113.8L232 I234L232-S236 WeakPolarHBondContact O-CB 3.37Å; L232-S236 PolarHBondContact O-N 3.23Å; L232-S236 PolarHBondContact O-OG 3.33Å; I234-S236 VanDerWaalsContact C-N 3.28Å; I234-S236 PolarHBondContact O-N 3.35Å
237V79.2Confident73.5Confident50 Ų5062.4 Ų62.430%0.30334%0.342SS..Hα-helixtrans-90.1-36.3177.9179.30000111.4F7 G233 I234 V235 H239F7-V237 HydrophobicContact CD2-CB 4.07Å; F7-V237 HydrophobicContact CD2-CG1 3.67Å; F7-V237 HydrophobicContact CE2-CB 4.24Å; F7-V237 HydrophobicContact CE2-CG1 4.24Å; G233-V237 WeakPolarHBondContact O-CG2 3.34Å; I234-V237 PolarHBondContact O-N 3.2Å; V235-V237 PolarHBondContact O-N 3.04Å; V237-H239 VanDerWaalsContact C-N 3.32Å
238L78.6Confident72.3Confident45 Ų4564.1 Ų64.124%0.23635%0.352CS..Hα-helixtrans-71.2-28.5178.7-69.8175.3000112.8F4 F7 I234 V235 P240F4-L238 HydrophobicContact CB-CD2 4.48Å; F4-L238 HydrophobicContact CD2-CD2 4.39Å; F7-L238 HydrophobicContact CB-CD2 3.77Å; F7-L238 HydrophobicContact CG-CD2 4.07Å; I234-L238 HydrophobicContact CG2-CD1 3.63Å; I234-L238 HydrophobicContact CG2-CG 4.2Å; I234-L238 WeakPolarHBondContact O-CG 3.48Å; I234-L238 PolarHBondContact O-N 3.45Å; V235-L238 PolarHBondContact O-N 3.44Å; L238-P240 VanDerWaalsContact O-CD 3.23Å; L238-P240 WeakPolarHBondContact O-CD 3.4Å
239H71.8Confident71.1Confident99 Ų9964.6 Ų64.646%0.45836%0.356SS..  trans-110.587.1175.2-66.7-80.9000110.2V235 V237 S241 L242V235-H239 PolarHBondContact O-N 2.94Å; V237-H239 VanDerWaalsContact C-N 3.32Å; H239-S241 PolarHBondContact O-N 3.27Å; H239-S241 VanDerWaalsContact O-N 3.11Å; H239-L242 HydrophobicContact CB-CB 4.41Å; H239-L242 HydrophobicContact CB-CD1 3.63Å; H239-L242 HydrophobicContact CB-CG 3.9Å; H239-L242 WeakPolarHBondContact O-CB 3.28Å; H239-L242 PolarHBondContact O-N 2.98Å
240P58.4Low69.8Low101 Ų10168.3 Ų68.366%0.65638%0.376SS*.G310 helixtrans-63.2-17.3-178.522.9-32000113.9L238 L242 K243L238-P240 VanDerWaalsContact O-CD 3.23Å; L238-P240 WeakPolarHBondContact O-CD 3.4Å; P240-L242 PolarHBondContact O-N 2.99Å; P240-K243 PolarHBondContact O-N 3.01Å
241S50.1Low68.3Low105 Ų10572.4 Ų72.473%0.73440%0.399SS*.G310 helixtrans-64.7-12.5168.751.30000113.9H239H239-S241 PolarHBondContact O-N 3.27Å; H239-S241 VanDerWaalsContact O-N 3.11Å
242L51.7Low66.6Low40 Ų4072.1 Ų72.121%0.20940%0.398CS..G310 helixtrans-106.36.2179.3-56.9178.2000112.8P192 S193 L196 V235 H239 P240P192-L242 HydrophobicContact CB-CD2 3.68Å; P192-L242 HydrophobicContact CG-CD2 3.46Å; P192-L242 VanDerWaalsContact CG-CD2 3.46Å; S193-L242 WeakPolarHBondContact CA-O 3.3Å; S193-L242 WeakPolarHBondContact CB-O 3.37Å; L196-L242 HydrophobicContact CD1-CB 3.96Å; L196-L242 HydrophobicContact CD1-CD1 3.9Å; L196-L242 HydrophobicContact CD1-CG 4.42Å; V235-L242 HydrophobicContact CG1-CD1 4.39Å; H239-L242 HydrophobicContact CB-CB 4.41Å; H239-L242 HydrophobicContact CB-CD1 3.63Å; H239-L242 HydrophobicContact CB-CG 3.9Å; H239-L242 WeakPolarHBondContact O-CB 3.28Å; H239-L242 PolarHBondContact O-N 2.98Å; P240-L242 PolarHBondContact O-N 2.99Å
243K47.2Very low64.9Low150 Ų15074.9 Ų74.965%0.65241%0.414SS*.  trans-84.2125.8-178.8-163.5174.1-179.3-177.60109.9P240 Q245P240-K243 PolarHBondContact O-N 3.01Å; K243-Q245 PolarHBondContact O-N 3.43Å; K243-Q245 VanDerWaalsContact O-N 3.08Å
244I44.4Very low63.2Low45 Ų4580.5 Ų80.523%0.23145%0.446CS..  trans-64.1112.5170.2-53.3172.7000106.5S193 V194 D197S193-I244 VanDerWaalsContact CB-CG1 3.41Å; S193-I244 WeakPolarHBondContact O-CD1 3.45Å; S193-I244 WeakPolarHBondContact O-CG1 3.47Å; V194-I244 HydrophobicContact CB-CD1 4.49Å; V194-I244 HydrophobicContact CG2-CD1 4.18Å; V194-I244 HydrophobicContact CG2-CG1 4.35Å; D197-I244 HydrophobicContact CB-CD1 3.64Å
245Q40.3Very low61.1Low173 Ų17385.1 Ų85.181%0.80847%0.472SS*.  trans-75.3134165.3-73.1-176.6-4.300107.7K243K243-Q245 PolarHBondContact O-N 3.43Å; K243-Q245 VanDerWaalsContact O-N 3.08Å
246P42.6Very low58.7Low128 Ų12887.5 Ų87.583%0.83148%0.482SS*.  trans-62.70178.628.3-34.2000111.9L77L77-P246 WeakPolarHBondContact CD2-OXT 3.24Å

Retrieved 246 of 246 residues in 298.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).