A0A3Q0KMD0_SCHMA Loading...

G_PROTEIN_RECEP_F1_2 domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KMD0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 397 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
1M38.3Very low59Low199 Ų19998.9 Ų98.998%0.9853%0.529SS*.  0126.30-84.9179.2173.300107.9Y3M1-Y3 HydrophobicContact CB-CD2 4.48Å; M1-Y3 HydrophobicContact CB-CE2 4.18Å; M1-Y3 PolarHBondContact O-N 2.91Å; M1-Y3 HydrophobicContact SD-CE1 4.47Å
2I43.3Very low59.8Low166 Ų16694.4 Ų94.485%0.85151%0.508SS*.  trans-82.5108.1170.1-61.6171.8000107N4I2-N4 PolarHBondContact O-N 3.26Å
3Y48.4Very low60.9Low56 Ų5688.8 Ų88.822%0.2248%0.478CS..  trans-85.289.7175.6-74.4-70.5000109.1M1 L5 F14 I19 R23M1-Y3 HydrophobicContact CB-CD2 4.48Å; M1-Y3 HydrophobicContact CB-CE2 4.18Å; M1-Y3 PolarHBondContact O-N 2.91Å; M1-Y3 HydrophobicContact SD-CE1 4.47Å; Y3-L5 VanDerWaalsContact C-N 3.33Å; Y3-L5 HydrophobicContact CD1-CD1 4.22Å; Y3-L5 PolarHBondContact O-N 2.95Å; Y3-L5 VanDerWaalsContact O-N 3.08Å; Y3-F14 HydrophobicContact CD2-CD1 4.05Å; Y3-F14 HydrophobicContact CD2-CE1 4.17Å; Y3-F14 HydrophobicContact CG-CD1 4.27Å; Y3-F14 AromaticContact CG-CE1 3.92Å; Y3-F14 HydrophobicContact CG-CE1 3.92Å; Y3-F14 HydrophobicContact CG-CZ 4.37Å; Y3-F14 WeakPolarHBondContact O-CE2 3.16Å; Y3-F14 WeakPolarHBondContact O-CZ 3.39Å; Y3-I19 HydrophobicContact CE2-CD1 4.23Å; Y3-R23 PolarHBondContact OH-NH2 3.08Å
4N50.5Low62.3Low152 Ų15285.9 Ų85.981%0.81346%0.459SS*.  trans-85.476.9177.4-146.59.4000109.9I2I2-N4 PolarHBondContact O-N 3.26Å
5L60.2Low63.8Low15 Ų1582 Ų828%0.07944%0.44CS..  trans-110.7109.9-179.9-87.377.3000109.7Y3 C7 F8 F14 K92 C93Y3-L5 VanDerWaalsContact C-N 3.33Å; Y3-L5 HydrophobicContact CD1-CD1 4.22Å; Y3-L5 PolarHBondContact O-N 2.95Å; Y3-L5 VanDerWaalsContact O-N 3.08Å; L5-C7 PolarHBondContact O-N 2.89Å; L5-C7 VanDerWaalsContact O-N 3.16Å; L5-F8 HydrophobicContact CB-CD2 3.92Å; L5-F8 HydrophobicContact CD2-CD2 3.58Å; L5-F8 HydrophobicContact CD2-CE2 3.73Å; L5-F8 HydrophobicContact CG-CD2 4.4Å; L5-F8 PolarHBondContact O-N 2.79Å; L5-F8 VanDerWaalsContact O-O 3.1Å; L5-F14 HydrophobicContact CB-CZ 4.34Å; L5-K92 HydrophobicContact CG-CB 4.35Å; L5-C93 VanDerWaalsContact CB-SG 3.59Å
6T65.2Low65.3Low139 Ų13984.2 Ų84.285%0.85345%0.451SS*.THydrogen-bonded Turntrans-64.2-20.2-173.351.90000115.2
7C74.5Confident66.8Low37 Ų3781.6 Ų81.625%0.2544%0.436CS..THydrogen-bonded Turntrans-91.3-2.9179.473.50000114.6L5 C93L5-C7 PolarHBondContact O-N 2.89Å; L5-C7 VanDerWaalsContact O-N 3.16Å; C7-C93 VanDerWaalsContact CA-SG 3.59Å; C7-C93 HydrophobicContact CB-CB 3.7Å; C7-C93 WeakPolarHBondContact CB-SG 3.42Å; C7-C93 PolarHBondContact N-SG 3.48Å; C7-C93 WeakPolarHBondContact SG-CB 3.49Å; C7-C93 CovalentContact SG-SG 2.03Å; C7-C93 PolarHBondContact SG-SG 3.1Å
8F74.4Confident68.1Low25 Ų2577.1 Ų77.111%0.1141%0.412CS..SBendtrans-118.6142174.9-64.8-66.3000109.9L5 A10 D13 F14 Y22 A88 W89L5-F8 HydrophobicContact CB-CD2 3.92Å; L5-F8 HydrophobicContact CD2-CD2 3.58Å; L5-F8 HydrophobicContact CD2-CE2 3.73Å; L5-F8 HydrophobicContact CG-CD2 4.4Å; L5-F8 PolarHBondContact O-N 2.79Å; L5-F8 VanDerWaalsContact O-O 3.1Å; F8-A10 PolarHBondContact O-N 3.09Å; F8-D13 WeakPolarHBondContact CA-OD2 3.26Å; F8-D13 HydrophobicContact CB-CB 4.06Å; F8-F14 HydrophobicContact CB-CZ 4.36Å; F8-Y22 AromaticContact CD1-CE1 3.96Å; F8-Y22 HydrophobicContact CD1-CE1 3.96Å; F8-Y22 HydrophobicContact CD1-CE2 4.17Å; F8-Y22 AromaticContact CD1-CZ 3.65Å; F8-Y22 AromaticContact CE1-CD1 3.88Å; F8-Y22 HydrophobicContact CE1-CD1 3.88Å; F8-Y22 AromaticContact CE1-CE1 3.25Å; F8-Y22 HydrophobicContact CE1-CE1 3.25Å; F8-Y22 HydrophobicContact CE1-CE2 4.24Å; F8-Y22 AromaticContact CE1-CZ 3.47Å; F8-Y22 VanDerWaalsContact CE1-CZ 3.47Å; F8-Y22 HydrophobicContact CZ-CD1 4.08Å; F8-Y22 AromaticContact CZ-CE1 3.91Å; F8-Y22 HydrophobicContact CZ-CE1 3.91Å; F8-A88 HydrophobicContact CE2-CB 4.5Å; F8-A88 HydrophobicContact CZ-CB 4.13Å; F8-W89 HydrophobicContact CE2-CB 4.03Å; F8-W89 HydrophobicContact CZ-CB 4.02Å
9N68.4Low69.3Low62 Ų6274.4 Ų74.433%0.33240%0.397SS..  trans-81.7114.3176.1174.6-8.2000108.8Q11 T12 D13N9-Q11 PolarHBondContact O-N 3.4Å; N9-Q11 VanDerWaalsContact O-N 3.11Å; N9-Q11 PolarHBondContact OD1-N 3.43Å; N9-T12 WeakPolarHBondContact CB-OG1 3.32Å; N9-T12 PolarHBondContact O-N 3.46Å; N9-T12 VanDerWaalsContact O-N 3.09Å; N9-D13 PolarHBondContact N-OD2 2.88Å; N9-D13 WeakPolarHBondContact O-CB 3.44Å; N9-D13 PolarHBondContact O-N 3.38Å
10A64.8Low70.5Confident64 Ų6476.6 Ų76.653%0.52941%0.406SS..Hα-helixtrans-59-28.4-174.200000114.5F8 F14F8-A10 PolarHBondContact O-N 3.09Å; A10-F14 VanDerWaalsContact CA-CD2 3.41Å; A10-F14 HydrophobicContact CB-CD2 3.75Å; A10-F14 HydrophobicContact CB-CE2 3.79Å
11Q61.4Low71.6Confident173 Ų17372.9 Ų72.981%0.80839%0.387SS*.Hα-helixtrans-78.4-30.6179.1-66.3178.8-19.700113N9N9-Q11 PolarHBondContact O-N 3.4Å; N9-Q11 VanDerWaalsContact O-N 3.11Å; N9-Q11 PolarHBondContact OD1-N 3.43Å
12T68.9Low74.2Confident45 Ų4564.1 Ų64.128%0.27634%0.343SS..Hα-helixtrans-102.8-34-176.159.80000113.3N9 H296N9-T12 WeakPolarHBondContact CB-OG1 3.32Å; N9-T12 PolarHBondContact O-N 3.46Å; N9-T12 VanDerWaalsContact O-N 3.09Å; T12-H296 PolarHBondContact O-NE2 2.9Å
13D74Confident76.7Confident21 Ų2161.7 Ų61.711%0.11232%0.323CS..Hα-helixtrans-93.5-24.8-169-67-34.1000114F8 N9 T15 Y22 H296F8-D13 WeakPolarHBondContact CA-OD2 3.26Å; F8-D13 HydrophobicContact CB-CB 4.06Å; N9-D13 PolarHBondContact N-OD2 2.88Å; N9-D13 WeakPolarHBondContact O-CB 3.44Å; N9-D13 PolarHBondContact O-N 3.38Å; D13-T15 VanDerWaalsContact C-N 3.26Å; D13-T15 PolarHBondContact O-N 3.05Å; D13-Y22 HydrophobicContact CB-CE2 3.92Å; D13-Y22 PolarHBondContact OD1-OH 3.26Å; D13-H296 IonicContact OD1-CE1 2.66Å
14F79.6Confident78.9Confident48 Ų4860.5 Ų60.521%0.21132%0.319CS..  trans-89.230.2178.3-59.5-49.1000114.8Y3 L5 F8 A10 I19Y3-F14 HydrophobicContact CD2-CD1 4.05Å; Y3-F14 HydrophobicContact CD2-CE1 4.17Å; Y3-F14 HydrophobicContact CG-CD1 4.27Å; Y3-F14 AromaticContact CG-CE1 3.92Å; Y3-F14 HydrophobicContact CG-CE1 3.92Å; Y3-F14 HydrophobicContact CG-CZ 4.37Å; Y3-F14 WeakPolarHBondContact O-CE2 3.16Å; Y3-F14 WeakPolarHBondContact O-CZ 3.39Å; L5-F14 HydrophobicContact CB-CZ 4.34Å; F8-F14 HydrophobicContact CB-CZ 4.36Å; A10-F14 VanDerWaalsContact CA-CD2 3.41Å; A10-F14 HydrophobicContact CB-CD2 3.75Å; A10-F14 HydrophobicContact CB-CE2 3.79Å; F14-I19 HydrophobicContact CB-CD1 4.41Å; F14-I19 HydrophobicContact CD1-CD1 4.46Å; F14-I19 HydrophobicContact CD1-CG1 4.21Å
15T84.8Confident81.1Confident28 Ų2853.5 Ų53.517%0.17228%0.281CS..SBendtrans-66.4156.6158.257.50000109.9D13 E17 G18 I19 H296D13-T15 VanDerWaalsContact C-N 3.26Å; D13-T15 PolarHBondContact O-N 3.05Å; T15-E17 WeakPolarHBondContact CB-OE2 3.45Å; T15-E17 PolarHBondContact O-N 2.87Å; T15-G18 PolarHBondContact O-N 2.04Å; T15-G18 PolarHBondContact OG1-N 3.13Å; T15-I19 WeakPolarHBondContact O-CG1 3.29Å; T15-I19 PolarHBondContact O-N 2.92Å; T15-H296 PolarHBondContact OG1-CD2 2.92Å
16N88.2Confident82.8Confident117 Ų11752.9 Ų52.963%0.62628%0.278SS*.Hα-helixtrans-59-40.3177.9-74.3-29.5000111I19 M20N16-I19 PolarHBondContact O-N 3.01Å; N16-M20 VanDerWaalsContact O-CG 3.32Å; N16-M20 WeakPolarHBondContact O-CG 3.19Å; N16-M20 PolarHBondContact O-N 3.43Å
17E90.8Very high84.2Confident41 Ų4152.1 Ų52.119%0.19226%0.26CS..Hα-helixtrans-66.9-42.5178.4-5876.4-174.400111.3T15 M20 M21 Q293 H296T15-E17 WeakPolarHBondContact CB-OE2 3.45Å; T15-E17 PolarHBondContact O-N 2.87Å; E17-M20 PolarHBondContact O-N 2.99Å; E17-M21 WeakPolarHBondContact O-CB 3.37Å; E17-M21 PolarHBondContact O-N 2.91Å; E17-Q293 HydrophobicContact CG-CB 4.38Å; E17-Q293 HydrophobicContact CG-CG 4.42Å; E17-Q293 PolarHBondContact OE1-NE2 3.31Å; E17-H296 HydrophobicContact CB-CB 3.97Å
18G89.5Confident85.3Confident0 Ų054 Ų540%027%0.267CS..Hα-helixtrans-61.2-46.8172.500000111.8T15 M20 M21 Y22T15-G18 PolarHBondContact O-N 2.04Å; T15-G18 PolarHBondContact OG1-N 3.13Å; G18-M20 VanDerWaalsContact C-N 3.34Å; G18-M20 PolarHBondContact O-N 3.21Å; G18-M21 WeakPolarHBondContact O-CB 3.25Å; G18-M21 PolarHBondContact O-N 3.32Å; G18-Y22 WeakPolarHBondContact O-CD2 3.3Å; G18-Y22 PolarHBondContact O-N 3.36Å
19I91Very high86.4Confident25 Ų2552.8 Ų52.813%0.12826%0.262CS..Hα-helixtrans-60.8-41.5176.1-67166.1000111.2Y3 F14 T15 N16 R23Y3-I19 HydrophobicContact CE2-CD1 4.23Å; F14-I19 HydrophobicContact CB-CD1 4.41Å; F14-I19 HydrophobicContact CD1-CD1 4.46Å; F14-I19 HydrophobicContact CD1-CG1 4.21Å; T15-I19 WeakPolarHBondContact O-CG1 3.29Å; T15-I19 PolarHBondContact O-N 2.92Å; N16-I19 PolarHBondContact O-N 3.01Å; I19-R23 HydrophobicContact CG2-CG 4.43Å; I19-R23 WeakPolarHBondContact O-CB 3.31Å; I19-R23 VanDerWaalsContact O-CG 3.23Å; I19-R23 WeakPolarHBondContact O-CG 3.06Å; I19-R23 PolarHBondContact O-N 3Å
20M93.7Very high87.8Confident118 Ų11851.4 Ų51.458%0.58126%0.257SS*.Hα-helixtrans-62.4-46.3173.9-72.5179.8-168.700111.8N16 E17 G18 R23 F24 L300N16-M20 VanDerWaalsContact O-CG 3.32Å; N16-M20 WeakPolarHBondContact O-CG 3.19Å; N16-M20 PolarHBondContact O-N 3.43Å; E17-M20 PolarHBondContact O-N 2.99Å; G18-M20 VanDerWaalsContact C-N 3.34Å; G18-M20 PolarHBondContact O-N 3.21Å; M20-R23 PolarHBondContact O-N 3.31Å; M20-F24 WeakPolarHBondContact O-CB 3.06Å; M20-F24 PolarHBondContact O-N 3.19Å; M20-L300 HydrophobicContact CB-CD2 4.21Å
21M94.2Very high89.3Confident0 Ų053.9 Ų53.90%026%0.26CS..Hα-helixtrans-57.2-51176.8-175.3-152.461.500111.7E17 G18 F24 R25 K299 L300E17-M21 WeakPolarHBondContact O-CB 3.37Å; E17-M21 PolarHBondContact O-N 2.91Å; G18-M21 WeakPolarHBondContact O-CB 3.25Å; G18-M21 PolarHBondContact O-N 3.32Å; M21-F24 PolarHBondContact O-N 3.4Å; M21-R25 WeakPolarHBondContact O-CB 3.46Å; M21-R25 WeakPolarHBondContact O-CD 3.3Å; M21-R25 VanDerWaalsContact O-CG 3.28Å; M21-R25 WeakPolarHBondContact O-CG 3.48Å; M21-R25 PolarHBondContact O-N 2.97Å; M21-K299 HydrophobicContact CG-CB 4.17Å; M21-K299 HydrophobicContact SD-CB 3.41Å; M21-K299 WeakPolarHBondContact SD-CB 3.32Å; M21-K299 HydrophobicContact SD-CD 3.68Å; M21-K299 HydrophobicContact SD-CG 4.21Å; M21-L300 HydrophobicContact CB-CB 4.14Å; M21-L300 HydrophobicContact CG-CB 4.25Å
22Y92.9Very high91Very high15 Ų1546.5 Ų46.56%0.05923%0.226CC..Hα-helixtrans-67.1-38.3-179.9-70.3-65.3000112.7F8 D13 G18 R25 A26 R85 W89F8-Y22 AromaticContact CD1-CE1 3.96Å; F8-Y22 HydrophobicContact CD1-CE1 3.96Å; F8-Y22 HydrophobicContact CD1-CE2 4.17Å; F8-Y22 AromaticContact CD1-CZ 3.65Å; F8-Y22 AromaticContact CE1-CD1 3.88Å; F8-Y22 HydrophobicContact CE1-CD1 3.88Å; F8-Y22 AromaticContact CE1-CE1 3.25Å; F8-Y22 HydrophobicContact CE1-CE1 3.25Å; F8-Y22 HydrophobicContact CE1-CE2 4.24Å; F8-Y22 AromaticContact CE1-CZ 3.47Å; F8-Y22 VanDerWaalsContact CE1-CZ 3.47Å; F8-Y22 HydrophobicContact CZ-CD1 4.08Å; F8-Y22 AromaticContact CZ-CE1 3.91Å; F8-Y22 HydrophobicContact CZ-CE1 3.91Å; D13-Y22 HydrophobicContact CB-CE2 3.92Å; D13-Y22 PolarHBondContact OD1-OH 3.26Å; G18-Y22 WeakPolarHBondContact O-CD2 3.3Å; G18-Y22 PolarHBondContact O-N 3.36Å; Y22-R25 PolarHBondContact O-N 2.85Å; Y22-A26 VanDerWaalsContact O-CB 3.24Å; Y22-A26 WeakPolarHBondContact O-CB 3.3Å; Y22-A26 PolarHBondContact O-N 3.2Å; Y22-R85 HydrophobicContact CE1-CB 4.29Å; Y22-W89 HydrophobicContact CD1-CB 4.46Å; Y22-W89 AromaticContact CG-CD1 3.89Å; Y22-W89 HydrophobicContact CG-CG 4.34Å
23R94.6Very high92.4Very high115 Ų11544.9 Ų44.943%0.43422%0.216SC..Hα-helixtrans-62.3-42.8174-76.8175.8-178.1-161.83.7112.4Y3 I19 M20 A26 Y27 W89Y3-R23 PolarHBondContact OH-NH2 3.08Å; I19-R23 HydrophobicContact CG2-CG 4.43Å; I19-R23 WeakPolarHBondContact O-CB 3.31Å; I19-R23 VanDerWaalsContact O-CG 3.23Å; I19-R23 WeakPolarHBondContact O-CG 3.06Å; I19-R23 PolarHBondContact O-N 3Å; M20-R23 PolarHBondContact O-N 3.31Å; R23-A26 PolarHBondContact O-N 3.26Å; R23-Y27 HydrophobicContact CB-CD2 4.5Å; R23-Y27 PolarHBondContact O-N 3.28Å; R23-W89 HydrophobicContact CG-CH2 3.55Å; R23-W89 HydrophobicContact CG-CZ2 3.5Å; R23-W89 HydrophobicContact CG-CZ3 4.25Å
24F96.3Very high93.5Very high31 Ų3149 Ų4914%0.13624%0.237CC..Iπ-helixtrans-62.6-44176.7-174.6-85.8000111.4M20 M21 I28 T29 I32 L300 I304 I307M20-F24 WeakPolarHBondContact O-CB 3.06Å; M20-F24 PolarHBondContact O-N 3.19Å; M21-F24 PolarHBondContact O-N 3.4Å; F24-I28 HydrophobicContact CD2-CB 3.93Å; F24-I28 HydrophobicContact CD2-CG1 4.11Å; F24-I28 HydrophobicContact CD2-CG2 4.11Å; F24-I28 HydrophobicContact CE2-CB 4.01Å; F24-I28 HydrophobicContact CE2-CG2 3.67Å; F24-I28 HydrophobicContact CG-CB 4.29Å; F24-I28 HydrophobicContact CZ-CB 4.42Å; F24-I28 HydrophobicContact CZ-CG2 4.02Å; F24-I28 WeakPolarHBondContact O-CB 3.45Å; F24-I28 PolarHBondContact O-N 2.83Å; F24-T29 WeakPolarHBondContact CD1-OG1 3.49Å; F24-T29 WeakPolarHBondContact CE1-OG1 3.27Å; F24-T29 PolarHBondContact O-N 2.99Å; F24-T29 PolarHBondContact O-OG1 3.14Å; F24-I32 HydrophobicContact CE1-CD1 4.11Å; F24-I32 HydrophobicContact CE2-CD1 4.48Å; F24-I32 HydrophobicContact CZ-CD1 3.61Å; F24-L300 HydrophobicContact CB-CD1 3.83Å; F24-L300 HydrophobicContact CD1-CD1 4.45Å; F24-L300 HydrophobicContact CD2-CD1 4.39Å; F24-L300 HydrophobicContact CG-CD1 3.98Å; F24-I304 HydrophobicContact CD2-CG1 4.34Å; F24-I304 HydrophobicContact CE1-CG1 4.19Å; F24-I304 HydrophobicContact CE2-CG1 3.8Å; F24-I304 HydrophobicContact CZ-CB 4.46Å; F24-I304 HydrophobicContact CZ-CG1 3.72Å; F24-I307 HydrophobicContact CZ-CD1 4.26Å
25R95.7Very high94.4Very high4 Ų451.3 Ų51.32%0.01525%0.248CC..Iπ-helixtrans-65-38.8176.6-73.2168.1177.4-106.9-11.4112.9M21 Y22 T29 D81 F82 K299 S303M21-R25 WeakPolarHBondContact O-CB 3.46Å; M21-R25 WeakPolarHBondContact O-CD 3.3Å; M21-R25 VanDerWaalsContact O-CG 3.28Å; M21-R25 WeakPolarHBondContact O-CG 3.48Å; M21-R25 PolarHBondContact O-N 2.97Å; Y22-R25 PolarHBondContact O-N 2.85Å; R25-T29 WeakPolarHBondContact CA-OG1 3.21Å; R25-T29 WeakPolarHBondContact O-CB 3.47Å; R25-D81 HydrophobicContact CG-CB 4.17Å; R25-D81 IonicContact CZ-OD1 2.78Å; R25-D81 IonicContact CZ-OD2 3.76Å; R25-D81 IonicContact NE-OD1 2.61Å; R25-D81 VanDerWaalsContact NH1-CG 3.32Å; R25-D81 IonicContact NH1-OD1 3.37Å; R25-D81 PolarHBondContact NH1-OD1 2.89Å; R25-D81 IonicContact NH1-OD2 2.82Å; R25-D81 IonicContact NH2-OD1 2.67Å; R25-D81 PolarHBondContact NH2-OD1 3.39Å; R25-D81 IonicContact NH2-OD2 2.9Å; R25-D81 PolarHBondContact NH2-OD2 3.4Å; R25-F82 WeakPolarHBondContact O-CD2 3.15Å; R25-K299 PolarHBondContact NH2-O 2.9Å; R25-S303 PolarHBondContact NE-OG 3.28Å; R25-S303 PolarHBondContact NH2-OG 3.37Å
26A95.3Very high95Very high2 Ų250 Ų502%0.01724%0.24CC..Iπ-helixtrans-74.7-44.2-179.500000114.2Y22 R23 P30 G86 W89 L90Y22-A26 VanDerWaalsContact O-CB 3.24Å; Y22-A26 WeakPolarHBondContact O-CB 3.3Å; Y22-A26 PolarHBondContact O-N 3.2Å; R23-A26 PolarHBondContact O-N 3.26Å; A26-P30 WeakPolarHBondContact O-CG 3.27Å; A26-G86 WeakPolarHBondContact CB-O 3.3Å; A26-W89 HydrophobicContact CB-CD2 4.33Å; A26-W89 HydrophobicContact CB-CE3 3.42Å; A26-W89 VanDerWaalsContact CB-CE3 3.42Å; A26-W89 HydrophobicContact CB-CZ3 3.99Å; A26-L90 HydrophobicContact CB-CB 4.21Å
27Y96.1Very high95.5Very high123 Ų12345.6 Ų45.648%0.48222%0.217SC..Iπ-helixtrans-107.3-40.6-169.9-63.7-60.8000114.7R23 W89 L90R23-Y27 HydrophobicContact CB-CD2 4.5Å; R23-Y27 PolarHBondContact O-N 3.28Å; Y27-W89 HydrophobicContact CD2-CZ3 4.13Å; Y27-W89 HydrophobicContact CE2-CE3 4.43Å; Y27-W89 AromaticContact CE2-CH2 3.67Å; Y27-W89 HydrophobicContact CE2-CH2 3.67Å; Y27-W89 AromaticContact CE2-CZ3 3.3Å; Y27-W89 HydrophobicContact CE2-CZ3 3.3Å; Y27-W89 AromaticContact CZ-CZ3 3.62Å; Y27-L90 HydrophobicContact CD1-CD1 4.07Å; Y27-L90 HydrophobicContact CE1-CD1 3.38Å
28I97.1Very high95.8Very high77 Ų7748.1 Ų48.140%0.39523%0.231SC..Iπ-helixtrans-90.9-42-170.6-52.3-57.9000110.9F24 L31 I32F24-I28 HydrophobicContact CD2-CB 3.93Å; F24-I28 HydrophobicContact CD2-CG1 4.11Å; F24-I28 HydrophobicContact CD2-CG2 4.11Å; F24-I28 HydrophobicContact CE2-CB 4.01Å; F24-I28 HydrophobicContact CE2-CG2 3.67Å; F24-I28 HydrophobicContact CG-CB 4.29Å; F24-I28 HydrophobicContact CZ-CB 4.42Å; F24-I28 HydrophobicContact CZ-CG2 4.02Å; F24-I28 WeakPolarHBondContact O-CB 3.45Å; F24-I28 PolarHBondContact O-N 2.83Å; I28-L31 WeakPolarHBondContact O-CB 3.45Å; I28-L31 PolarHBondContact O-N 3.29Å; I28-L31 VanDerWaalsContact O-N 3.13Å; I28-I32 HydrophobicContact CG2-CD1 3.78Å; I28-I32 HydrophobicContact CG2-CG1 4.24Å; I28-I32 WeakPolarHBondContact O-CG1 3.38Å; I28-I32 PolarHBondContact O-N 3.33Å
29T97.2Very high96.2Very high0 Ų048.3 Ų48.30%023%0.233CC..Hα-helixtrans-57.5-45.4-179.1-55.70000114.2F24 R25 L31 I32 V33 A77 D81 F82F24-T29 WeakPolarHBondContact CD1-OG1 3.49Å; F24-T29 WeakPolarHBondContact CE1-OG1 3.27Å; F24-T29 PolarHBondContact O-N 2.99Å; F24-T29 PolarHBondContact O-OG1 3.14Å; R25-T29 WeakPolarHBondContact CA-OG1 3.21Å; R25-T29 WeakPolarHBondContact O-CB 3.47Å; T29-L31 VanDerWaalsContact C-N 3.25Å; T29-L31 PolarHBondContact O-N 2.77Å; T29-I32 WeakPolarHBondContact O-CB 3.5Å; T29-I32 PolarHBondContact O-N 3.5Å; T29-I32 VanDerWaalsContact O-N 3.15Å; T29-V33 HydrophobicContact CG2-CG2 4.32Å; T29-V33 WeakPolarHBondContact O-CG2 3.15Å; T29-V33 PolarHBondContact O-N 3.19Å; T29-A77 HydrophobicContact CG2-CB 3.97Å; T29-A77 WeakPolarHBondContact CG2-O 3.45Å; T29-D81 HydrophobicContact CG2-CB 4.08Å; T29-F82 HydrophobicContact CG2-CB 4.44Å
30P97.1Very high96.5Very high33 Ų3347.1 Ų47.121%0.21423%0.227CC..Hα-helixtrans-62.4-30.4176.523.7-34.7000113.4A26 L34 F82A26-P30 WeakPolarHBondContact O-CG 3.27Å; P30-L34 WeakPolarHBondContact O-CB 3.49Å; P30-L34 PolarHBondContact O-N 3.15Å; P30-F82 HydrophobicContact CB-CD1 4.41Å; P30-F82 HydrophobicContact CB-CD2 4Å; P30-F82 HydrophobicContact CB-CE1 4.42Å; P30-F82 HydrophobicContact CB-CE2 4.01Å; P30-F82 HydrophobicContact CB-CG 4.21Å; P30-F82 HydrophobicContact CB-CZ 4.22Å; P30-F82 HydrophobicContact CG-CD2 3.81Å; P30-F82 HydrophobicContact CG-CE2 3.77Å; P30-F82 HydrophobicContact CG-CG 4.47Å; P30-F82 HydrophobicContact CG-CZ 4.4Å
31L97.4Very high96.7Very high115 Ų11545.7 Ų45.760%0.60222%0.22SC*.Hα-helixtrans-71-42.2174.2-59.6174.9000111.4I28 T29 L34 F35I28-L31 WeakPolarHBondContact O-CB 3.45Å; I28-L31 PolarHBondContact O-N 3.29Å; I28-L31 VanDerWaalsContact O-N 3.13Å; T29-L31 VanDerWaalsContact C-N 3.25Å; T29-L31 PolarHBondContact O-N 2.77Å; L31-L34 PolarHBondContact O-N 2.97Å; L31-F35 VanDerWaalsContact O-CB 3.29Å; L31-F35 WeakPolarHBondContact O-CB 3.34Å; L31-F35 PolarHBondContact O-N 3.16Å
32I97.4Very high96.9Very high18 Ų1847.7 Ų47.79%0.09223%0.231CC..Hα-helixtrans-59.5-45.9173.2-66.8166.8000110.4F24 I28 T29 G36 L73 I307 A310F24-I32 HydrophobicContact CE1-CD1 4.11Å; F24-I32 HydrophobicContact CE2-CD1 4.48Å; F24-I32 HydrophobicContact CZ-CD1 3.61Å; I28-I32 HydrophobicContact CG2-CD1 3.78Å; I28-I32 HydrophobicContact CG2-CG1 4.24Å; I28-I32 WeakPolarHBondContact O-CG1 3.38Å; I28-I32 PolarHBondContact O-N 3.33Å; T29-I32 WeakPolarHBondContact O-CB 3.5Å; T29-I32 PolarHBondContact O-N 3.5Å; T29-I32 VanDerWaalsContact O-N 3.15Å; I32-G36 WeakPolarHBondContact O-CA 3.22Å; I32-G36 PolarHBondContact O-N 3.06Å; I32-L73 HydrophobicContact CG2-CD2 4.07Å; I32-I307 HydrophobicContact CD1-CD1 4.22Å; I32-I307 HydrophobicContact CD1-CG1 3.52Å; I32-I307 HydrophobicContact CG1-CG1 4.25Å; I32-A310 HydrophobicContact CG2-CB 3.76Å
33V97.8Very high97.1Very high12 Ų1247 Ų477%0.07323%0.228CC..Hα-helixtrans-60.6-52.6177.3168.30000110.8T29 F35 G36 T37 A77 F78T29-V33 HydrophobicContact CG2-CG2 4.32Å; T29-V33 WeakPolarHBondContact O-CG2 3.15Å; T29-V33 PolarHBondContact O-N 3.19Å; V33-F35 PolarHBondContact O-N 2.68Å; V33-G36 PolarHBondContact O-N 3.47Å; V33-T37 HydrophobicContact CG1-CG2 4.21Å; V33-T37 VanDerWaalsContact O-CB 3.31Å; V33-T37 WeakPolarHBondContact O-CB 3.26Å; V33-T37 VanDerWaalsContact O-CG2 3.28Å; V33-T37 WeakPolarHBondContact O-CG2 3.44Å; V33-T37 PolarHBondContact O-N 2.88Å; V33-T37 PolarHBondContact O-OG1 3.32Å; V33-A77 HydrophobicContact CG2-CB 3.67Å; V33-F78 HydrophobicContact CB-CB 4.47Å; V33-F78 HydrophobicContact CG1-CB 3.75Å; V33-F78 HydrophobicContact CG1-CD2 3.9Å; V33-F78 HydrophobicContact CG1-CG 3.99Å; V33-F78 HydrophobicContact CG2-CB 3.89Å
34L97.4Very high97.2Very high106 Ų10642.9 Ų42.956%0.55521%0.214SC*.Hα-helixtrans-61.4-47.6-176.9-178.565.2000111.5P30 L31 T37 I38P30-L34 WeakPolarHBondContact O-CB 3.49Å; P30-L34 PolarHBondContact O-N 3.15Å; L31-L34 PolarHBondContact O-N 2.97Å; L34-T37 PolarHBondContact O-OG1 3.48Å; L34-I38 HydrophobicContact CD1-CD1 3.7Å; L34-I38 HydrophobicContact CG-CD1 4.2Å; L34-I38 WeakPolarHBondContact O-CB 3.32Å; L34-I38 WeakPolarHBondContact O-CD1 3.31Å; L34-I38 VanDerWaalsContact O-CG1 3.28Å; L34-I38 WeakPolarHBondContact O-CG1 3.26Å; L34-I38 PolarHBondContact O-N 3Å
35F97.8Very high97.3Very high98 Ų9844.8 Ų44.843%0.4323%0.225SC..Hα-helixtrans-66.8-48.4179-179.1-97.8000111.9L31 V33 G39 M311 F313 P314L31-F35 VanDerWaalsContact O-CB 3.29Å; L31-F35 WeakPolarHBondContact O-CB 3.34Å; L31-F35 PolarHBondContact O-N 3.16Å; V33-F35 PolarHBondContact O-N 2.68Å; F35-G39 PolarHBondContact O-N 3.31Å; F35-M311 HydrophobicContact CD1-CE 4.35Å; F35-M311 HydrophobicContact CE1-CE 4.03Å; F35-F313 HydrophobicContact CZ-CD1 4.49Å; F35-P314 HydrophobicContact CE1-CG 3.63Å; F35-P314 HydrophobicContact CZ-CG 3.68Å
36G97.8Very high97.4Very high0 Ų044.6 Ų44.60%023%0.225CC..Hα-helixtrans-66.8-43.6-176.200000113I32 V33 G39 N40 L73I32-G36 WeakPolarHBondContact O-CA 3.22Å; I32-G36 PolarHBondContact O-N 3.06Å; V33-G36 PolarHBondContact O-N 3.47Å; G36-G39 PolarHBondContact O-N 2.77Å; G36-N40 WeakPolarHBondContact O-CB 3.1Å; G36-N40 PolarHBondContact O-N 3.36Å; G36-N40 PolarHBondContact O-ND2 3.23Å; G36-N40 PolarHBondContact O-OD1 3.2Å; G36-L73 VanDerWaalsContact C-CD1 3.48Å
37T97.8Very high97.4Very high25 Ų2544.5 Ų44.515%0.15322%0.224CC..Hα-helixtrans-66.4-47.3179.554.40000111.6V33 L34 N40 I41 L73 I74V33-T37 HydrophobicContact CG1-CG2 4.21Å; V33-T37 VanDerWaalsContact O-CB 3.31Å; V33-T37 WeakPolarHBondContact O-CB 3.26Å; V33-T37 VanDerWaalsContact O-CG2 3.28Å; V33-T37 WeakPolarHBondContact O-CG2 3.44Å; V33-T37 PolarHBondContact O-N 2.88Å; V33-T37 PolarHBondContact O-OG1 3.32Å; L34-T37 PolarHBondContact O-OG1 3.48Å; T37-N40 PolarHBondContact O-N 2.84Å; T37-I41 WeakPolarHBondContact O-CB 3.28Å; T37-I41 WeakPolarHBondContact O-CD1 3.43Å; T37-I41 VanDerWaalsContact O-CG1 3.22Å; T37-I41 WeakPolarHBondContact O-CG1 3.05Å; T37-I41 PolarHBondContact O-N 3.16Å; T37-L73 HydrophobicContact CG2-CB 3.96Å; T37-L73 HydrophobicContact CG2-CD1 4.33Å; T37-I74 HydrophobicContact CG2-CG1 4.3Å
38I97.6Very high97.5Very high93 Ų9342 Ų4248%0.47722%0.218SC..Hα-helixtrans-62.2-45.8175.9-65173.3000110.5L34 I41 L42L34-I38 HydrophobicContact CD1-CD1 3.7Å; L34-I38 HydrophobicContact CG-CD1 4.2Å; L34-I38 WeakPolarHBondContact O-CB 3.32Å; L34-I38 WeakPolarHBondContact O-CD1 3.31Å; L34-I38 VanDerWaalsContact O-CG1 3.28Å; L34-I38 WeakPolarHBondContact O-CG1 3.26Å; L34-I38 PolarHBondContact O-N 3Å; I38-I41 PolarHBondContact O-N 3.44Å; I38-L42 HydrophobicContact CG2-CD1 4.25Å; I38-L42 WeakPolarHBondContact O-CG 3.42Å; I38-L42 PolarHBondContact O-N 2.98Å; I38-L42 VanDerWaalsContact O-N 3.1Å
39G97.7Very high97.4Very high4 Ų441.5 Ų41.54%0.04122%0.216CC..Hα-helixtrans-58.2-47.8176.800000112.3F35 G36 L42 V43F35-G39 PolarHBondContact O-N 3.31Å; G36-G39 PolarHBondContact O-N 2.77Å; G39-L42 WeakPolarHBondContact O-CB 3.31Å; G39-L42 PolarHBondContact O-N 3.36Å; G39-V43 WeakPolarHBondContact O-CG2 3.32Å; G39-V43 PolarHBondContact O-N 3.01Å
40N97.9Very high97.2Very high0 Ų042 Ų420%022%0.218CC..Hα-helixtrans-70.1-35.6-177.3-73.2-4.6000113G36 T37 L42 V43 I44 T66 I70 L73 A309 E312G36-N40 WeakPolarHBondContact O-CB 3.1Å; G36-N40 PolarHBondContact O-N 3.36Å; G36-N40 PolarHBondContact O-ND2 3.23Å; G36-N40 PolarHBondContact O-OD1 3.2Å; T37-N40 PolarHBondContact O-N 2.84Å; N40-L42 VanDerWaalsContact C-N 3.33Å; N40-V43 WeakPolarHBondContact O-CB 3.41Å; N40-V43 PolarHBondContact O-N 3.08Å; N40-I44 WeakPolarHBondContact O-CG1 3.34Å; N40-I44 PolarHBondContact O-N 3.38Å; N40-T66 HydrophobicContact CB-CG2 3.48Å; N40-T66 VanDerWaalsContact CB-CG2 3.48Å; N40-T66 WeakPolarHBondContact O-CG2 3.23Å; N40-I70 HydrophobicContact CB-CD1 3.84Å; N40-I70 HydrophobicContact CB-CG1 3.51Å; N40-L73 WeakPolarHBondContact ND2-CD1 3.06Å; N40-A309 PolarHBondContact ND2-O 3.15Å; N40-A309 PolarHBondContact OD1-O 2.98Å; N40-E312 WeakPolarHBondContact OD1-CB 3.45Å
41I98Very high97.1Very high88 Ų8842.1 Ų42.145%0.45122%0.216SC..Hα-helixtrans-61.2-44.3170.7-69.9164.6000110.2T37 I38 I44 I45 I70T37-I41 WeakPolarHBondContact O-CB 3.28Å; T37-I41 WeakPolarHBondContact O-CD1 3.43Å; T37-I41 VanDerWaalsContact O-CG1 3.22Å; T37-I41 WeakPolarHBondContact O-CG1 3.05Å; T37-I41 PolarHBondContact O-N 3.16Å; I38-I41 PolarHBondContact O-N 3.44Å; I41-I44 PolarHBondContact O-N 3.46Å; I41-I45 HydrophobicContact CG2-CD1 3.83Å; I41-I45 VanDerWaalsContact O-CG1 3.27Å; I41-I45 WeakPolarHBondContact O-CG1 3.33Å; I41-I45 PolarHBondContact O-N 3.48Å; I41-I70 HydrophobicContact CG1-CD1 4.03Å
42L97.3Very high97Very high43 Ų4345.2 Ų45.223%0.22522%0.224CC..Hα-helixtrans-63.7-40.9174.9-70169.1000112I38 G39 N40 I45 I46 F313 F327 L330I38-L42 HydrophobicContact CG2-CD1 4.25Å; I38-L42 WeakPolarHBondContact O-CG 3.42Å; I38-L42 PolarHBondContact O-N 2.98Å; I38-L42 VanDerWaalsContact O-N 3.1Å; G39-L42 WeakPolarHBondContact O-CB 3.31Å; G39-L42 PolarHBondContact O-N 3.36Å; N40-L42 VanDerWaalsContact C-N 3.33Å; L42-I45 PolarHBondContact O-N 2.92Å; L42-I46 WeakPolarHBondContact O-CB 3.31Å; L42-I46 WeakPolarHBondContact O-CD1 3.47Å; L42-I46 VanDerWaalsContact O-CG1 3.22Å; L42-I46 WeakPolarHBondContact O-CG1 3.37Å; L42-I46 PolarHBondContact O-N 3.17Å; L42-F313 HydrophobicContact CB-CD2 4.16Å; L42-F313 HydrophobicContact CB-CE2 4.16Å; L42-F313 HydrophobicContact CD1-CE2 4.11Å; L42-F327 HydrophobicContact CD1-CE2 4.26Å; L42-L330 HydrophobicContact CD2-CD2 4.27Å
43V97.6Very high96.7Very high0 Ų052.1 Ų52.10%025%0.254CS..Hα-helixtrans-57.1-52.9175.3166.90000110.5G39 N40 I45 I46 F47 I62 T66 F313 F316 F323G39-V43 WeakPolarHBondContact O-CG2 3.32Å; G39-V43 PolarHBondContact O-N 3.01Å; N40-V43 WeakPolarHBondContact O-CB 3.41Å; N40-V43 PolarHBondContact O-N 3.08Å; V43-I45 PolarHBondContact O-N 3.43Å; V43-I46 PolarHBondContact O-N 3.49Å; V43-F47 HydrophobicContact CG1-CD2 3.67Å; V43-F47 HydrophobicContact CG1-CE2 3.92Å; V43-F47 VanDerWaalsContact O-CD2 3.28Å; V43-F47 WeakPolarHBondContact O-CD2 3.37Å; V43-F47 PolarHBondContact O-N 3.14Å; V43-I62 HydrophobicContact CG1-CG2 3.8Å; V43-T66 HydrophobicContact CB-CG2 4.16Å; V43-T66 HydrophobicContact CG1-CG2 3.9Å; V43-T66 WeakPolarHBondContact CG1-OG1 3.21Å; V43-F313 HydrophobicContact CG2-CB 3.86Å; V43-F313 HydrophobicContact CG2-CD2 4.12Å; V43-F313 HydrophobicContact CG2-CG 4.49Å; V43-F316 HydrophobicContact CG1-CD2 3.92Å; V43-F316 HydrophobicContact CG1-CE2 3.97Å; V43-F316 HydrophobicContact CG2-CD2 3.98Å; V43-F323 HydrophobicContact CB-CE2 4.43Å; V43-F323 HydrophobicContact CG2-CE2 4.03Å; V43-F323 HydrophobicContact CG2-CZ 3.82Å
44I97.9Very high96.2Very high28 Ų2854.8 Ų54.814%0.14427%0.273CS..Hα-helixtrans-57.6-48.6177.9-70.2171000111.1N40 I41 I46 F47 I48 T66 I67 I70N40-I44 WeakPolarHBondContact O-CG1 3.34Å; N40-I44 PolarHBondContact O-N 3.38Å; I41-I44 PolarHBondContact O-N 3.46Å; I44-I46 PolarHBondContact O-N 3.23Å; I44-F47 PolarHBondContact O-N 2.81Å; I44-I48 HydrophobicContact CG2-CD1 3.56Å; I44-I48 HydrophobicContact CG2-CG1 4.29Å; I44-I48 WeakPolarHBondContact O-CB 3.31Å; I44-I48 VanDerWaalsContact O-CG1 3.25Å; I44-I48 WeakPolarHBondContact O-CG1 3.3Å; I44-I48 PolarHBondContact O-N 3.37Å; I44-T66 HydrophobicContact CD1-CG2 3.96Å; I44-T66 HydrophobicContact CG1-CG2 3.67Å; I44-I67 HydrophobicContact CD1-CG1 3.7Å; I44-I70 HydrophobicContact CD1-CD1 3.5Å
45I97.4Very high95.9Very high71 Ų7152.9 Ų52.936%0.36427%0.267SS..Hα-helixtrans-58.7-47.5179.9-70166.2000111I41 L42 V43 I48 I49 L330I41-I45 HydrophobicContact CG2-CD1 3.83Å; I41-I45 VanDerWaalsContact O-CG1 3.27Å; I41-I45 WeakPolarHBondContact O-CG1 3.33Å; I41-I45 PolarHBondContact O-N 3.48Å; L42-I45 PolarHBondContact O-N 2.92Å; V43-I45 PolarHBondContact O-N 3.43Å; I45-I48 PolarHBondContact O-N 3.37Å; I45-I49 HydrophobicContact CG2-CD1 3.95Å; I45-I49 VanDerWaalsContact O-CG1 3.3Å; I45-I49 WeakPolarHBondContact O-CG1 3.2Å; I45-I49 PolarHBondContact O-N 3.23Å; I45-L330 HydrophobicContact CG2-CD1 4.14Å
46I97Very high95.7Very high1 Ų148.3 Ų48.31%0.00525%0.247CC..Hα-helixtrans-66.1-44.2-178.7-68.5160.3000110.8L42 V43 I44 I49 M50 F323 H326 F327L42-I46 WeakPolarHBondContact O-CB 3.31Å; L42-I46 WeakPolarHBondContact O-CD1 3.47Å; L42-I46 VanDerWaalsContact O-CG1 3.22Å; L42-I46 WeakPolarHBondContact O-CG1 3.37Å; L42-I46 PolarHBondContact O-N 3.17Å; V43-I46 PolarHBondContact O-N 3.49Å; I44-I46 PolarHBondContact O-N 3.23Å; I46-I49 PolarHBondContact O-N 3.07Å; I46-M50 HydrophobicContact CG2-CG 4.37Å; I46-M50 HydrophobicContact CG2-SD 3.82Å; I46-M50 WeakPolarHBondContact O-CB 3.45Å; I46-M50 WeakPolarHBondContact O-CG 3.35Å; I46-M50 PolarHBondContact O-N 2.85Å; I46-F323 HydrophobicContact CB-CD2 4.12Å; I46-F323 HydrophobicContact CB-CE2 3.82Å; I46-F323 HydrophobicContact CD1-CD2 4.3Å; I46-F323 HydrophobicContact CD1-CE1 3.99Å; I46-F323 HydrophobicContact CD1-CE2 3.66Å; I46-F323 HydrophobicContact CD1-CZ 3.48Å; I46-F323 VanDerWaalsContact CD1-CZ 3.48Å; I46-F323 HydrophobicContact CG1-CE2 4.37Å; I46-F323 HydrophobicContact CG2-CD2 3.46Å; I46-F323 VanDerWaalsContact CG2-CD2 3.46Å; I46-F323 HydrophobicContact CG2-CE2 3.71Å; I46-F323 HydrophobicContact CG2-CG 4.16Å; I46-H326 HydrophobicContact CG2-CB 3.89Å; I46-F327 HydrophobicContact CD1-CB 3.85Å; I46-F327 HydrophobicContact CD1-CD2 4Å; I46-F327 HydrophobicContact CD1-CG 4.4Å
47F96.8Very high95.5Very high0 Ų048.7 Ų48.70%025%0.249CC..Hα-helixtrans-69.8-31178.7-80.8-70.6000113V43 I44 M50 Q51 F58 N59 I62 I63 F316 L320 F323V43-F47 HydrophobicContact CG1-CD2 3.67Å; V43-F47 HydrophobicContact CG1-CE2 3.92Å; V43-F47 VanDerWaalsContact O-CD2 3.28Å; V43-F47 WeakPolarHBondContact O-CD2 3.37Å; V43-F47 PolarHBondContact O-N 3.14Å; I44-F47 PolarHBondContact O-N 2.81Å; F47-M50 HydrophobicContact CD1-CE 4.25Å; F47-M50 HydrophobicContact CD1-SD 4.37Å; F47-M50 HydrophobicContact CE1-CE 3.96Å; F47-M50 HydrophobicContact CE1-SD 4.35Å; F47-M50 PolarHBondContact O-N 3.5Å; F47-Q51 WeakPolarHBondContact O-CB 3.37Å; F47-Q51 PolarHBondContact O-N 3.21Å; F47-F58 HydrophobicContact CE1-CD1 4.02Å; F47-F58 AromaticContact CE1-CE1 3.67Å; F47-F58 HydrophobicContact CE1-CE1 3.67Å; F47-F58 AromaticContact CZ-CE1 3.9Å; F47-F58 HydrophobicContact CZ-CE1 3.9Å; F47-N59 HydrophobicContact CD1-CB 3.91Å; F47-I62 HydrophobicContact CD2-CB 4.25Å; F47-I62 HydrophobicContact CD2-CG2 3.61Å; F47-I62 HydrophobicContact CE2-CB 4.3Å; F47-I62 HydrophobicContact CE2-CG2 3.6Å; F47-I62 HydrophobicContact CG-CB 4.42Å; F47-I62 HydrophobicContact CG-CG2 4.24Å; F47-I62 HydrophobicContact CZ-CB 4.5Å; F47-I62 HydrophobicContact CZ-CG1 4.32Å; F47-I62 HydrophobicContact CZ-CG2 4.21Å; F47-I63 HydrophobicContact CB-CD1 4Å; F47-I63 HydrophobicContact CB-CG1 3.69Å; F47-F316 HydrophobicContact CE2-CB 4.28Å; F47-F316 HydrophobicContact CE2-CD1 4.24Å; F47-F316 AromaticContact CE2-CD2 3.78Å; F47-F316 HydrophobicContact CE2-CD2 3.78Å; F47-F316 HydrophobicContact CE2-CE2 4.23Å; F47-F316 AromaticContact CE2-CG 3.81Å; F47-F316 HydrophobicContact CE2-CG 3.81Å; F47-F316 HydrophobicContact CZ-CB 4.42Å; F47-F316 HydrophobicContact CZ-CD1 4.03Å; F47-F316 HydrophobicContact CZ-CD2 4.39Å; F47-F316 AromaticContact CZ-CG 4Å; F47-F316 HydrophobicContact CZ-CG 4Å; F47-L320 HydrophobicContact CE1-CD2 4.23Å; F47-L320 HydrophobicContact CZ-CD2 3.9Å; F47-F323 HydrophobicContact CD2-CD2 4.23Å; F47-F323 HydrophobicContact CD2-CE2 4.15Å; F47-F323 AromaticContact CE2-CD2 3.59Å; F47-F323 HydrophobicContact CE2-CD2 3.59Å; F47-F323 AromaticContact CE2-CE2 3.73Å; F47-F323 HydrophobicContact CE2-CE2 3.73Å; F47-F323 AromaticContact CZ-CD2 3.92Å; F47-F323 HydrophobicContact CZ-CD2 3.92Å
48I96.9Very high95.2Very high71 Ų7147.5 Ų47.536%0.36424%0.241SC..Hα-helixtrans-64.1-44.2169.9-72.3170.1000110.7I44 I45 Q51 K52 I63I44-I48 HydrophobicContact CG2-CD1 3.56Å; I44-I48 HydrophobicContact CG2-CG1 4.29Å; I44-I48 WeakPolarHBondContact O-CB 3.31Å; I44-I48 VanDerWaalsContact O-CG1 3.25Å; I44-I48 WeakPolarHBondContact O-CG1 3.3Å; I44-I48 PolarHBondContact O-N 3.37Å; I45-I48 PolarHBondContact O-N 3.37Å; I48-Q51 PolarHBondContact O-N 3.31Å; I48-K52 HydrophobicContact CG2-CD 4.44Å; I48-K52 WeakPolarHBondContact O-CG 3.15Å; I48-K52 PolarHBondContact O-N 3.39Å; I48-I63 HydrophobicContact CG1-CD1 3.9Å; I48-I63 HydrophobicContact CG1-CG1 4.48Å
49I95.7Very high95.1Very high66 Ų6643.1 Ų43.134%0.33822%0.219SC..Hα-helixtrans-62.1-46.9175.9-67.7164.5000110.4I45 I46 Q51 K52 K53 L330I45-I49 HydrophobicContact CG2-CD1 3.95Å; I45-I49 VanDerWaalsContact O-CG1 3.3Å; I45-I49 WeakPolarHBondContact O-CG1 3.2Å; I45-I49 PolarHBondContact O-N 3.23Å; I46-I49 PolarHBondContact O-N 3.07Å; I49-Q51 VanDerWaalsContact C-N 3.33Å; I49-Q51 PolarHBondContact O-N 3.05Å; I49-K52 PolarHBondContact O-N 3.3Å; I49-K53 PolarHBondContact O-N 3.32Å; I49-K53 VanDerWaalsContact O-N 3.09Å; I49-L330 HydrophobicContact CD1-CD1 3.93Å
50M93.8Very high95Very high9 Ų943.6 Ų43.64%0.04422%0.221CC..Hα-helixtrans-62.3-38.7176.8-74.2176.351.100112I46 F47 K53 S54 H326I46-M50 HydrophobicContact CG2-CG 4.37Å; I46-M50 HydrophobicContact CG2-SD 3.82Å; I46-M50 WeakPolarHBondContact O-CB 3.45Å; I46-M50 WeakPolarHBondContact O-CG 3.35Å; I46-M50 PolarHBondContact O-N 2.85Å; F47-M50 HydrophobicContact CD1-CE 4.25Å; F47-M50 HydrophobicContact CD1-SD 4.37Å; F47-M50 HydrophobicContact CE1-CE 3.96Å; F47-M50 HydrophobicContact CE1-SD 4.35Å; F47-M50 PolarHBondContact O-N 3.5Å; M50-K53 PolarHBondContact O-N 3.04Å; M50-S54 CarbonylContact O-C 3.54Å; M50-S54 PolarHBondContact O-N 3.25Å; M50-H326 HydrophobicContact CG-CB 4.46Å
51Q94.4Very high95Very high37 Ų3744 Ų4417%0.17322%0.223CC..Hα-helixtrans-68.2-38178.6-175.667.2-10.900112.5F47 I48 I49 K53 P55 C56 N59 S60F47-Q51 WeakPolarHBondContact O-CB 3.37Å; F47-Q51 PolarHBondContact O-N 3.21Å; I48-Q51 PolarHBondContact O-N 3.31Å; I49-Q51 VanDerWaalsContact C-N 3.33Å; I49-Q51 PolarHBondContact O-N 3.05Å; Q51-K53 VanDerWaalsContact C-N 3.34Å; Q51-P55 WeakPolarHBondContact O-CA 3.33Å; Q51-P55 WeakPolarHBondContact O-CG 3.07Å; Q51-C56 PolarHBondContact OE1-O 3.09Å; Q51-C56 VanDerWaalsContact OE1-O 3.11Å; Q51-N59 HydrophobicContact CB-CB 4.16Å; Q51-N59 PolarHBondContact OE1-ND2 3.16Å; Q51-S60 PolarHBondContact NE2-OG 3.18Å; Q51-S60 VanDerWaalsContact NE2-OG 3.15Å
52K93.9Very high94.9Very high180 Ų18039.8 Ų39.878%0.78320%0.201SC*.Hα-helixtrans-66.6-35173.2-72.8-179.3177.9-172.90112.4I48 I49I48-K52 HydrophobicContact CG2-CD 4.44Å; I48-K52 WeakPolarHBondContact O-CG 3.15Å; I48-K52 PolarHBondContact O-N 3.39Å; I49-K52 PolarHBondContact O-N 3.3Å
53K91.3Very high94.9Very high162 Ų16239.1 Ų39.170%0.70420%0.198SC*.Hα-helixtrans-83.8-35.7-178.8-176.5173.2179.1177.10113.9I49 M50 Q51I49-K53 PolarHBondContact O-N 3.32Å; I49-K53 VanDerWaalsContact O-N 3.09Å; M50-K53 PolarHBondContact O-N 3.04Å; Q51-K53 VanDerWaalsContact C-N 3.34Å
54S88.9Confident94.8Very high68 Ų6839.3 Ų39.348%0.47620%0.2SC..SBendtrans-14988.8-179.2-1770000108.5M50 C56 N59M50-S54 CarbonylContact O-C 3.54Å; M50-S54 PolarHBondContact O-N 3.25Å; S54-C56 PolarHBondContact O-N 2.84Å; S54-N59 PolarHBondContact O-ND2 2.75Å
55P91.3Very high94.8Very high67 Ų6738 Ų3844%0.43519%0.193SC..  trans-58.1124.2-179.5-23.432.8000111.1Q51 L148Q51-P55 WeakPolarHBondContact O-CA 3.33Å; Q51-P55 WeakPolarHBondContact O-CG 3.07Å; P55-L148 HydrophobicContact CB-CD2 3.34Å
56C92Very high94.8Very high2 Ų234.6 Ų34.61%0.01418%0.176CC..  trans-148.9137.2-179.4-1780000111.1Q51 S54 F58 N59 S60 G144Q51-C56 PolarHBondContact OE1-O 3.09Å; Q51-C56 VanDerWaalsContact OE1-O 3.11Å; S54-C56 PolarHBondContact O-N 2.84Å; C56-F58 PolarHBondContact O-N 3.02Å; C56-F58 VanDerWaalsContact O-N 3.17Å; C56-N59 PolarHBondContact O-N 3.48Å; C56-S60 PolarHBondContact O-N 2.69Å; C56-G144 VanDerWaalsContact CA-O 3.32Å; C56-G144 WeakPolarHBondContact CA-O 3.39Å
57R93.5Very high94.8Very high8 Ų837.7 Ų37.73%0.0319%0.192CC..Hα-helixtrans-52-37.8176-67.7-173.8-73.9150.65.9112.8N59 S60 Y61 D131 F142 R143 G144 R146 L148 A151R57-N59 VanDerWaalsContact C-N 3.33Å; R57-N59 PolarHBondContact O-N 3Å; R57-S60 WeakPolarHBondContact O-CB 3.01Å; R57-S60 PolarHBondContact O-N 3.36Å; R57-Y61 HydrophobicContact CB-CD2 4.43Å; R57-Y61 HydrophobicContact CB-CE2 3.95Å; R57-Y61 WeakPolarHBondContact O-CD2 3.41Å; R57-Y61 PolarHBondContact O-N 3.13Å; R57-D131 IonicContact CZ-OD1 3.82Å; R57-D131 IonicContact CZ-OD2 3.6Å; R57-D131 IonicContact NE-OD1 3.26Å; R57-D131 IonicContact NH1-OD1 3.19Å; R57-D131 PolarHBondContact NH1-OD1 3.44Å; R57-D131 IonicContact NH1-OD2 3.4Å; R57-F142 VanDerWaalsContact NH2-C 3.3Å; R57-F142 PolarHBondContact NH2-O 3.36Å; R57-R143 PolarHBondContact NH2-O 2.98Å; R57-G144 PolarHBondContact N-O 3.11Å; R57-R146 WeakPolarHBondContact CD-O 3.27Å; R57-R146 WeakPolarHBondContact CG-O 3.48Å; R57-R146 PolarHBondContact NE-O 2.74Å; R57-L148 HydrophobicContact CG-CD1 4.2Å; R57-L148 HydrophobicContact CG-CG 4.34Å; R57-A151 HydrophobicContact CB-CB 4.18Å; R57-A151 HydrophobicContact CG-CB 3.74Å
58F93.1Very high94.8Very high0 Ų037.8 Ų37.80%019%0.193CC..Hα-helixtrans-51.4-50.2175.1-179.1-79.6000111.9F47 C56 S60 Y61 I62 F128 R250 F316 L320F47-F58 HydrophobicContact CE1-CD1 4.02Å; F47-F58 AromaticContact CE1-CE1 3.67Å; F47-F58 HydrophobicContact CE1-CE1 3.67Å; F47-F58 AromaticContact CZ-CE1 3.9Å; F47-F58 HydrophobicContact CZ-CE1 3.9Å; C56-F58 PolarHBondContact O-N 3.02Å; C56-F58 VanDerWaalsContact O-N 3.17Å; F58-S60 VanDerWaalsContact C-N 3.32Å; F58-S60 PolarHBondContact O-N 3.21Å; F58-Y61 PolarHBondContact O-N 3.08Å; F58-I62 HydrophobicContact CD1-CG1 4.03Å; F58-I62 HydrophobicContact CE1-CD1 4.35Å; F58-I62 HydrophobicContact CE1-CG1 3.59Å; F58-I62 HydrophobicContact CZ-CD1 4.3Å; F58-I62 HydrophobicContact CZ-CG1 4.03Å; F58-I62 WeakPolarHBondContact O-CG1 3.4Å; F58-I62 PolarHBondContact O-N 3.34Å; F58-I62 VanDerWaalsContact O-N 3.09Å; F58-F128 AromaticContact CD2-CE2 3.8Å; F58-F128 HydrophobicContact CD2-CE2 3.8Å; F58-F128 AromaticContact CD2-CZ 3.53Å; F58-F128 HydrophobicContact CD2-CZ 3.53Å; F58-F128 HydrophobicContact CE2-CE2 4.28Å; F58-F128 AromaticContact CE2-CZ 3.56Å; F58-F128 HydrophobicContact CE2-CZ 3.56Å; F58-F128 HydrophobicContact CG-CE2 4.44Å; F58-F128 HydrophobicContact CG-CZ 4.27Å; F58-F128 HydrophobicContact CZ-CZ 4.28Å; F58-R250 HydrophobicContact CD1-CG 4.39Å; F58-R250 HydrophobicContact CD2-CB 3.71Å; F58-R250 HydrophobicContact CD2-CG 3.83Å; F58-R250 HydrophobicContact CE1-CG 4.46Å; F58-R250 HydrophobicContact CE2-CB 3.62Å; F58-R250 HydrophobicContact CE2-CG 3.88Å; F58-R250 WeakPolarHBondContact CE2-O 3.47Å; F58-R250 HydrophobicContact CG-CB 4.47Å; F58-R250 HydrophobicContact CG-CG 4.11Å; F58-R250 HydrophobicContact CZ-CB 4.34Å; F58-R250 HydrophobicContact CZ-CG 4.22Å; F58-F316 HydrophobicContact CZ-CE1 4.29Å; F58-L320 HydrophobicContact CE1-CD2 3.61Å; F58-L320 HydrophobicContact CZ-CD1 4.49Å; F58-L320 HydrophobicContact CZ-CD2 3.74Å
59N94.8Very high94.8Very high1 Ų134.7 Ų34.71%0.00518%0.176CC..Hα-helixtrans-66-39.1-176.5-49.2-29.9000110.5F47 Q51 S54 C56 R57 I62 I63F47-N59 HydrophobicContact CD1-CB 3.91Å; Q51-N59 HydrophobicContact CB-CB 4.16Å; Q51-N59 PolarHBondContact OE1-ND2 3.16Å; S54-N59 PolarHBondContact O-ND2 2.75Å; C56-N59 PolarHBondContact O-N 3.48Å; R57-N59 VanDerWaalsContact C-N 3.33Å; R57-N59 PolarHBondContact O-N 3Å; N59-I62 PolarHBondContact O-N 3.31Å; N59-I63 WeakPolarHBondContact O-CD1 3.29Å; N59-I63 VanDerWaalsContact O-CG1 3.25Å; N59-I63 WeakPolarHBondContact O-CG1 3.03Å; N59-I63 PolarHBondContact O-N 3.29Å
60S96Very high94.9Very high13 Ų1332.6 Ų32.69%0.09117%0.166CC..Hα-helixtrans-60.2-46.1176.4-600000112Q51 C56 R57 F58 I63 G64Q51-S60 PolarHBondContact NE2-OG 3.18Å; Q51-S60 VanDerWaalsContact NE2-OG 3.15Å; C56-S60 PolarHBondContact O-N 2.69Å; R57-S60 WeakPolarHBondContact O-CB 3.01Å; R57-S60 PolarHBondContact O-N 3.36Å; F58-S60 VanDerWaalsContact C-N 3.32Å; F58-S60 PolarHBondContact O-N 3.21Å; S60-I63 PolarHBondContact O-N 2.84Å; S60-G64 PolarHBondContact O-N 3Å
61Y96.6Very high95.1Very high8 Ų835.8 Ų35.83%0.03118%0.181CC..Hα-helixtrans-62.6-45.1177-66.2-58.9000111.9R57 F58 I63 G64 I65 V124 L127 F128 D131 A151 I155R57-Y61 HydrophobicContact CB-CD2 4.43Å; R57-Y61 HydrophobicContact CB-CE2 3.95Å; R57-Y61 WeakPolarHBondContact O-CD2 3.41Å; R57-Y61 PolarHBondContact O-N 3.13Å; F58-Y61 PolarHBondContact O-N 3.08Å; Y61-I63 PolarHBondContact O-N 3.46Å; Y61-G64 PolarHBondContact O-N 3.38Å; Y61-I65 VanDerWaalsContact O-CG1 3.31Å; Y61-I65 WeakPolarHBondContact O-CG1 3.18Å; Y61-I65 PolarHBondContact O-N 3.33Å; Y61-V124 HydrophobicContact CD1-CG1 4.16Å; Y61-L127 HydrophobicContact CE1-CD2 3.72Å; Y61-L127 HydrophobicContact CE1-CG 3.82Å; Y61-F128 HydrophobicContact CD1-CB 4.17Å; Y61-F128 HydrophobicContact CD2-CB 4.26Å; Y61-F128 AromaticContact CD2-CD2 3.39Å; Y61-F128 HydrophobicContact CD2-CD2 3.39Å; Y61-F128 AromaticContact CD2-CE2 3.98Å; Y61-F128 HydrophobicContact CD2-CE2 3.98Å; Y61-F128 HydrophobicContact CD2-CG 4.03Å; Y61-F128 HydrophobicContact CE2-CD2 4.14Å; Y61-F128 HydrophobicContact CG-CB 3.89Å; Y61-F128 AromaticContact CG-CD2 3.75Å; Y61-F128 HydrophobicContact CG-CD2 3.75Å; Y61-F128 HydrophobicContact CG-CE2 4.49Å; Y61-F128 AromaticContact CG-CG 3.9Å; Y61-F128 HydrophobicContact CG-CG 3.9Å; Y61-D131 HydrophobicContact CE2-CB 3.8Å; Y61-D131 WeakPolarHBondContact CE2-OD1 3.32Å; Y61-D131 PolarHBondContact OH-OD1 3.32Å; Y61-A151 HydrophobicContact CE1-CB 4.4Å; Y61-A151 HydrophobicContact CE2-CB 4.43Å; Y61-I155 HydrophobicContact CD1-CD1 3.68Å; Y61-I155 HydrophobicContact CD1-CG1 3.83Å; Y61-I155 HydrophobicContact CE1-CD1 4.09Å; Y61-I155 HydrophobicContact CE1-CG1 4.02Å; Y61-I155 HydrophobicContact CG-CD1 4.41Å
62I96Very high95.1Very high0 Ų034.3 Ų34.30%018%0.175CC..Hα-helixtrans-60.5-47.6177.3-59.9-43.2000111V43 F47 F58 N59 G64 I65 T66 F128 M257 F316V43-I62 HydrophobicContact CG1-CG2 3.8Å; F47-I62 HydrophobicContact CD2-CB 4.25Å; F47-I62 HydrophobicContact CD2-CG2 3.61Å; F47-I62 HydrophobicContact CE2-CB 4.3Å; F47-I62 HydrophobicContact CE2-CG2 3.6Å; F47-I62 HydrophobicContact CG-CB 4.42Å; F47-I62 HydrophobicContact CG-CG2 4.24Å; F47-I62 HydrophobicContact CZ-CB 4.5Å; F47-I62 HydrophobicContact CZ-CG1 4.32Å; F47-I62 HydrophobicContact CZ-CG2 4.21Å; F58-I62 HydrophobicContact CD1-CG1 4.03Å; F58-I62 HydrophobicContact CE1-CD1 4.35Å; F58-I62 HydrophobicContact CE1-CG1 3.59Å; F58-I62 HydrophobicContact CZ-CD1 4.3Å; F58-I62 HydrophobicContact CZ-CG1 4.03Å; F58-I62 WeakPolarHBondContact O-CG1 3.4Å; F58-I62 PolarHBondContact O-N 3.34Å; F58-I62 VanDerWaalsContact O-N 3.09Å; N59-I62 PolarHBondContact O-N 3.31Å; I62-G64 VanDerWaalsContact C-N 3.3Å; I62-G64 PolarHBondContact O-N 3.35Å; I62-I65 PolarHBondContact O-N 3.06Å; I62-T66 VanDerWaalsContact O-CB 3.31Å; I62-T66 WeakPolarHBondContact O-CB 3.22Å; I62-T66 PolarHBondContact O-N 3.38Å; I62-T66 PolarHBondContact O-OG1 2.03Å; I62-F128 HydrophobicContact CD1-CD1 4.23Å; I62-F128 HydrophobicContact CD1-CE1 3.36Å; I62-F128 HydrophobicContact CD1-CZ 3.86Å; I62-F128 HydrophobicContact CG1-CE1 4.49Å; I62-M257 HydrophobicContact CD1-SD 4.46Å; I62-F316 HydrophobicContact CB-CZ 4.38Å; I62-F316 HydrophobicContact CD1-CE1 3.78Å; I62-F316 HydrophobicContact CD1-CZ 3.49Å; I62-F316 VanDerWaalsContact CD1-CZ 3.49Å; I62-F316 HydrophobicContact CG1-CE1 4.01Å; I62-F316 HydrophobicContact CG1-CZ 3.84Å; I62-F316 HydrophobicContact CG2-CD2 4.3Å; I62-F316 HydrophobicContact CG2-CE1 4.38Å; I62-F316 HydrophobicContact CG2-CE2 3.51Å; I62-F316 HydrophobicContact CG2-CZ 3.6Å
63I97.3Very high95.3Very high29 Ų2925.7 Ų25.715%0.14914%0.137CC..Hα-helixtrans-56.6-46177.2-67.2161.1000110.7F47 I48 N59 S60 Y61 T66 I67F47-I63 HydrophobicContact CB-CD1 4Å; F47-I63 HydrophobicContact CB-CG1 3.69Å; I48-I63 HydrophobicContact CG1-CD1 3.9Å; I48-I63 HydrophobicContact CG1-CG1 4.48Å; N59-I63 WeakPolarHBondContact O-CD1 3.29Å; N59-I63 VanDerWaalsContact O-CG1 3.25Å; N59-I63 WeakPolarHBondContact O-CG1 3.03Å; N59-I63 PolarHBondContact O-N 3.29Å; S60-I63 PolarHBondContact O-N 2.84Å; Y61-I63 PolarHBondContact O-N 3.46Å; I63-T66 PolarHBondContact O-N 2.78Å; I63-I67 HydrophobicContact CG2-CD1 3.82Å; I63-I67 HydrophobicContact CG2-CG1 4.49Å; I63-I67 WeakPolarHBondContact O-CD1 3.28Å; I63-I67 VanDerWaalsContact O-CG1 3.25Å; I63-I67 WeakPolarHBondContact O-CG1 3.33Å; I63-I67 PolarHBondContact O-N 3.31Å
64G97Very high95.6Very high5 Ų520.7 Ų20.75%0.05212%0.118CC..Hα-helixtrans-60.4-47.5177.600000113.2S60 Y61 I62 A68 Y159S60-G64 PolarHBondContact O-N 3Å; Y61-G64 PolarHBondContact O-N 3.38Å; I62-G64 VanDerWaalsContact C-N 3.3Å; I62-G64 PolarHBondContact O-N 3.35Å; G64-A68 PolarHBondContact O-N 2.77Å; G64-Y159 PolarHBondContact O-OH 2.88Å
65I96.8Very high95.9Very high0 Ų019.1 Ų19.10%010%0.102CC..Hα-helixtrans-66.4-44.5178.7-61.2162.8000110.7Y61 I62 I67 A68 H69 V124 L125 F128 M257Y61-I65 VanDerWaalsContact O-CG1 3.31Å; Y61-I65 WeakPolarHBondContact O-CG1 3.18Å; Y61-I65 PolarHBondContact O-N 3.33Å; I62-I65 PolarHBondContact O-N 3.06Å; I65-I67 VanDerWaalsContact C-N 3.34Å; I65-I67 PolarHBondContact O-N 3.32Å; I65-A68 PolarHBondContact O-N 3.23Å; I65-A68 VanDerWaalsContact O-N 3.15Å; I65-H69 VanDerWaalsContact CG2-CE1 3.4Å; I65-H69 WeakPolarHBondContact CG2-CE1 3.49Å; I65-H69 PolarHBondContact O-N 3.1Å; I65-V124 HydrophobicContact CD1-CG1 4.2Å; I65-V124 HydrophobicContact CG1-CB 3.84Å; I65-V124 HydrophobicContact CG1-CG1 3.56Å; I65-L125 HydrophobicContact CD1-CB 4.19Å; I65-L125 HydrophobicContact CD1-CD1 4.28Å; I65-F128 HydrophobicContact CD1-CD1 3.86Å; I65-M257 HydrophobicContact CB-CE 4.39Å; I65-M257 HydrophobicContact CD1-CE 3.97Å; I65-M257 HydrophobicContact CG2-CE 3.64Å
66T97.4Very high96.1Very high0 Ų017 Ų170%09%0.087CC..Hα-helixtrans-65.5-33.5-177.5-55.20000112.6N40 V43 I44 I62 I63 H69 I70N40-T66 HydrophobicContact CB-CG2 3.48Å; N40-T66 VanDerWaalsContact CB-CG2 3.48Å; N40-T66 WeakPolarHBondContact O-CG2 3.23Å; V43-T66 HydrophobicContact CB-CG2 4.16Å; V43-T66 HydrophobicContact CG1-CG2 3.9Å; V43-T66 WeakPolarHBondContact CG1-OG1 3.21Å; I44-T66 HydrophobicContact CD1-CG2 3.96Å; I44-T66 HydrophobicContact CG1-CG2 3.67Å; I62-T66 VanDerWaalsContact O-CB 3.31Å; I62-T66 WeakPolarHBondContact O-CB 3.22Å; I62-T66 PolarHBondContact O-N 3.38Å; I62-T66 PolarHBondContact O-OG1 2.03Å; I63-T66 PolarHBondContact O-N 2.78Å; T66-H69 PolarHBondContact O-N 2.88Å; T66-I70 WeakPolarHBondContact O-CG1 3.28Å; T66-I70 PolarHBondContact O-N 3.45Å
67I97.7Very high96.3Very high65 Ų6517 Ų1733%0.3339%0.087SC..Hα-helixtrans-61.8-46.9172.3-71165000110.4I44 I63 I65 I70 M71 Y159I44-I67 HydrophobicContact CD1-CG1 3.7Å; I63-I67 HydrophobicContact CG2-CD1 3.82Å; I63-I67 HydrophobicContact CG2-CG1 4.49Å; I63-I67 WeakPolarHBondContact O-CD1 3.28Å; I63-I67 VanDerWaalsContact O-CG1 3.25Å; I63-I67 WeakPolarHBondContact O-CG1 3.33Å; I63-I67 PolarHBondContact O-N 3.31Å; I65-I67 VanDerWaalsContact C-N 3.34Å; I65-I67 PolarHBondContact O-N 3.32Å; I67-I70 PolarHBondContact O-N 3.23Å; I67-M71 PolarHBondContact O-N 3.02Å; I67-Y159 WeakPolarHBondContact CB-OH 3.45Å; I67-Y159 WeakPolarHBondContact CG2-OH 3.28Å
68A97.3Very high96.5Very high3 Ų320.3 Ų20.33%0.02510%0.102CC..Hα-helixtrans-64.1-41.417700000112G64 I65 I70 M71 E72 I120G64-A68 PolarHBondContact O-N 2.77Å; I65-A68 PolarHBondContact O-N 3.23Å; I65-A68 VanDerWaalsContact O-N 3.15Å; A68-I70 VanDerWaalsContact C-N 3.34Å; A68-I70 PolarHBondContact O-N 3.46Å; A68-M71 WeakPolarHBondContact O-CB 3.43Å; A68-M71 PolarHBondContact O-N 3.28Å; A68-M71 VanDerWaalsContact O-N 3.11Å; A68-E72 PolarHBondContact O-N 3.13Å; A68-I120 HydrophobicContact CB-CB 4.39Å; A68-I120 HydrophobicContact CB-CG2 3.97Å
69H97.1Very high96.6Very high5 Ų521.6 Ų21.62%0.02311%0.109CC..Hα-helixtrans-63.4-31.5173.9-76.4161.3000113.8I65 T66 E72 L73 A309 E312I65-H69 VanDerWaalsContact CG2-CE1 3.4Å; I65-H69 WeakPolarHBondContact CG2-CE1 3.49Å; I65-H69 PolarHBondContact O-N 3.1Å; T66-H69 PolarHBondContact O-N 2.88Å; H69-E72 IonicContact CD2-OE2 3.95Å; H69-E72 PolarHBondContact O-N 2.79Å; H69-L73 WeakPolarHBondContact O-CB 3.36Å; H69-L73 VanDerWaalsContact O-CG 3.28Å; H69-L73 WeakPolarHBondContact O-CG 3.39Å; H69-L73 PolarHBondContact O-N 3.13Å; H69-A309 HydrophobicContact CB-CB 3.82Å; H69-E312 IonicContact CE1-OE1 3.88Å; H69-E312 PolarHBondContact CE1-OE1 3.34Å; H69-E312 VanDerWaalsContact CE1-OE1 3.26Å; H69-E312 IonicContact ND1-OE1 2.95Å; H69-E312 PolarHBondContact ND1-OE1 2.99Å
70I97.8Very high96.5Very high22 Ų2223.3 Ų23.311%0.11312%0.118CC..Hα-helixtrans-65.6-42.2170.6-73.5175.1000110.8N40 I41 I44 T66 I67 A68 E72 L73 I74N40-I70 HydrophobicContact CB-CD1 3.84Å; N40-I70 HydrophobicContact CB-CG1 3.51Å; I41-I70 HydrophobicContact CG1-CD1 4.03Å; I44-I70 HydrophobicContact CD1-CD1 3.5Å; T66-I70 WeakPolarHBondContact O-CG1 3.28Å; T66-I70 PolarHBondContact O-N 3.45Å; I67-I70 PolarHBondContact O-N 3.23Å; A68-I70 VanDerWaalsContact C-N 3.34Å; A68-I70 PolarHBondContact O-N 3.46Å; I70-E72 VanDerWaalsContact C-N 3.34Å; I70-L73 PolarHBondContact O-N 3.05Å; I70-I74 HydrophobicContact CG2-CD1 3.66Å; I70-I74 HydrophobicContact CG2-CG1 4.39Å; I70-I74 WeakPolarHBondContact O-CB 3.47Å; I70-I74 WeakPolarHBondContact O-CG1 3.43Å; I70-I74 PolarHBondContact O-N 3.38Å
71M96.5Very high96.4Very high76 Ų7622.7 Ų22.737%0.37411%0.113SC..Hα-helixtrans-64.7-39.7177-62.6-61.1163.900111.4I67 A68 I74 F75I67-M71 PolarHBondContact O-N 3.02Å; A68-M71 WeakPolarHBondContact O-CB 3.43Å; A68-M71 PolarHBondContact O-N 3.28Å; A68-M71 VanDerWaalsContact O-N 3.11Å; M71-I74 PolarHBondContact O-N 2.85Å; M71-F75 HydrophobicContact CB-CD2 4.41Å; M71-F75 WeakPolarHBondContact O-CB 3.3Å; M71-F75 WeakPolarHBondContact O-CD2 3.4Å; M71-F75 PolarHBondContact O-N 3.01Å; M71-F75 HydrophobicContact SD-CD2 4.18Å; M71-F75 HydrophobicContact SD-CE2 3.77Å
72E95.4Very high96.4Very high6 Ų623.9 Ų23.93%0.02812%0.119CC..Iπ-helixtrans-62.6-46.8173.5-171.1170179.600111.4A68 H69 I70 I74 N76 A77 K305A68-E72 PolarHBondContact O-N 3.13Å; H69-E72 IonicContact CD2-OE2 3.95Å; H69-E72 PolarHBondContact O-N 2.79Å; I70-E72 VanDerWaalsContact C-N 3.34Å; E72-I74 VanDerWaalsContact C-N 3.34Å; E72-I74 PolarHBondContact O-N 3.4Å; E72-N76 HydrophobicContact CG-CB 4.28Å; E72-N76 WeakPolarHBondContact O-CA 3.43Å; E72-N76 WeakPolarHBondContact O-CB 3.4Å; E72-N76 PolarHBondContact O-N 3.41Å; E72-A77 PolarHBondContact O-N 3.11Å; E72-A77 VanDerWaalsContact O-N 3.14Å; E72-K305 IonicContact OE1-NZ 2.6Å; E72-K305 PolarHBondContact OE1-NZ 3.25Å; E72-K305 IonicContact OE2-NZ 3.74Å; E72-K305 PolarHBondContact OE2-NZ 2.8Å
73L97.6Very high96.4Very high0 Ų025.2 Ų25.20%013%0.125CC..Iπ-helixtrans-63.8-35.1177.4-73.3170000113.5I32 G36 T37 N40 H69 I70 A77 F78 A309 A310I32-L73 HydrophobicContact CG2-CD2 4.07Å; G36-L73 VanDerWaalsContact C-CD1 3.48Å; T37-L73 HydrophobicContact CG2-CB 3.96Å; T37-L73 HydrophobicContact CG2-CD1 4.33Å; N40-L73 WeakPolarHBondContact ND2-CD1 3.06Å; H69-L73 WeakPolarHBondContact O-CB 3.36Å; H69-L73 VanDerWaalsContact O-CG 3.28Å; H69-L73 WeakPolarHBondContact O-CG 3.39Å; H69-L73 PolarHBondContact O-N 3.13Å; I70-L73 PolarHBondContact O-N 3.05Å; L73-A77 HydrophobicContact CD2-CB 4.44Å; L73-A77 WeakPolarHBondContact O-CB 3.46Å; L73-F78 WeakPolarHBondContact O-CB 3.4Å; L73-F78 PolarHBondContact O-N 3.23Å; L73-A309 HydrophobicContact CD1-CB 4.3Å; L73-A309 HydrophobicContact CD2-CB 4.14Å; L73-A309 HydrophobicContact CG-CB 3.92Å; L73-A310 HydrophobicContact CD2-CB 4.49Å
74I97Very high96.1Very high57 Ų5724 Ų2429%0.29212%0.12SC..Iπ-helixtrans-78.2-59.8178.1-66.7170.9000110.1T37 I70 M71 E72 F78 L79T37-I74 HydrophobicContact CG2-CG1 4.3Å; I70-I74 HydrophobicContact CG2-CD1 3.66Å; I70-I74 HydrophobicContact CG2-CG1 4.39Å; I70-I74 WeakPolarHBondContact O-CB 3.47Å; I70-I74 WeakPolarHBondContact O-CG1 3.43Å; I70-I74 PolarHBondContact O-N 3.38Å; M71-I74 PolarHBondContact O-N 2.85Å; E72-I74 VanDerWaalsContact C-N 3.34Å; E72-I74 PolarHBondContact O-N 3.4Å; I74-F78 WeakPolarHBondContact O-CB 3.2Å; I74-F78 PolarHBondContact O-N 3.19Å; I74-L79 HydrophobicContact CG2-CD1 3.96Å; I74-L79 HydrophobicContact CG2-CG 4.44Å; I74-L79 VanDerWaalsContact O-CG 3.29Å; I74-L79 WeakPolarHBondContact O-CG 3.25Å; I74-L79 PolarHBondContact O-N 3.46Å
75F96Very high95.8Very high35 Ų3526.9 Ų26.915%0.15413%0.129CC..Iπ-helixtrans-78.5-38.7-169.2-69.1-75.6000113.5M71 L79 D80 F109 F110 I113 P114M71-F75 HydrophobicContact CB-CD2 4.41Å; M71-F75 WeakPolarHBondContact O-CB 3.3Å; M71-F75 WeakPolarHBondContact O-CD2 3.4Å; M71-F75 PolarHBondContact O-N 3.01Å; M71-F75 HydrophobicContact SD-CD2 4.18Å; M71-F75 HydrophobicContact SD-CE2 3.77Å; F75-L79 HydrophobicContact CD1-CD1 3.76Å; F75-L79 HydrophobicContact CE1-CD1 3.87Å; F75-D80 PolarHBondContact O-N 3.25Å; F75-F109 HydrophobicContact CD1-CE1 4.25Å; F75-F109 HydrophobicContact CE1-CD1 4.34Å; F75-F109 AromaticContact CE1-CE1 3.52Å; F75-F109 HydrophobicContact CE1-CE1 3.52Å; F75-F109 HydrophobicContact CE1-CZ 4.28Å; F75-F109 AromaticContact CZ-CE1 3.92Å; F75-F109 HydrophobicContact CZ-CE1 3.92Å; F75-F109 HydrophobicContact CZ-CZ 4.25Å; F75-F110 HydrophobicContact CD1-CD1 4.22Å; F75-F110 AromaticContact CD1-CE1 3.87Å; F75-F110 HydrophobicContact CD1-CE1 3.87Å; F75-F110 HydrophobicContact CE1-CE1 4.39Å; F75-I113 HydrophobicContact CB-CG2 4.01Å; F75-I113 HydrophobicContact CD1-CG2 4.37Å; F75-I113 HydrophobicContact CD2-CB 4.45Å; F75-I113 HydrophobicContact CD2-CG2 3.39Å; F75-I113 HydrophobicContact CE2-CG2 3.95Å; F75-I113 HydrophobicContact CG-CB 4.27Å; F75-I113 HydrophobicContact CG-CG2 3.64Å; F75-P114 HydrophobicContact CB-CG 3.98Å
76N94.7Very high95.6Very high23 Ų2326.9 Ų26.912%0.12313%0.129CC..Iπ-helixtrans-82.8-62.3177.4-162.432.9000110.7E72 D80 D81 P114E72-N76 HydrophobicContact CG-CB 4.28Å; E72-N76 WeakPolarHBondContact O-CA 3.43Å; E72-N76 WeakPolarHBondContact O-CB 3.4Å; E72-N76 PolarHBondContact O-N 3.41Å; N76-D80 PolarHBondContact O-N 3.44Å; N76-D81 WeakPolarHBondContact O-CB 3.45Å; N76-D81 PolarHBondContact O-N 3.43Å; N76-P114 HydrophobicContact CB-CB 4.08Å
77A96.6Very high95.4Very high0 Ų028.4 Ų28.40%014%0.137CC..Iπ-helixtrans-75.9-42.4-168.300000113.6T29 V33 E72 L73 D81 F82T29-A77 HydrophobicContact CG2-CB 3.97Å; T29-A77 WeakPolarHBondContact CG2-O 3.45Å; V33-A77 HydrophobicContact CG2-CB 3.67Å; E72-A77 PolarHBondContact O-N 3.11Å; E72-A77 VanDerWaalsContact O-N 3.14Å; L73-A77 HydrophobicContact CD2-CB 4.44Å; L73-A77 WeakPolarHBondContact O-CB 3.46Å; A77-D81 WeakPolarHBondContact O-CB 3.17Å; A77-F82 PolarHBondContact O-N 3.01Å
78F97.3Very high95.1Very high78 Ų7825.4 Ų25.434%0.34212%0.122SC..Iπ-helixtrans-82.9-52.4-179-174.9-122.7000112.8V33 L73 I74 F82 I83V33-F78 HydrophobicContact CB-CB 4.47Å; V33-F78 HydrophobicContact CG1-CB 3.75Å; V33-F78 HydrophobicContact CG1-CD2 3.9Å; V33-F78 HydrophobicContact CG1-CG 3.99Å; V33-F78 HydrophobicContact CG2-CB 3.89Å; L73-F78 WeakPolarHBondContact O-CB 3.4Å; L73-F78 PolarHBondContact O-N 3.23Å; I74-F78 WeakPolarHBondContact O-CB 3.2Å; I74-F78 PolarHBondContact O-N 3.19Å; F78-F82 HydrophobicContact CD2-CD1 4Å; F78-F82 AromaticContact CE2-CD1 3.91Å; F78-F82 HydrophobicContact CE2-CD1 3.91Å; F78-F82 HydrophobicContact CE2-CE1 4.33Å; F78-F82 WeakPolarHBondContact O-CB 3.48Å; F78-I83 HydrophobicContact CD1-CD1 4.42Å; F78-I83 HydrophobicContact CE1-CD1 3.9Å; F78-I83 HydrophobicContact CE2-CD1 4.32Å; F78-I83 HydrophobicContact CE2-CG1 4.41Å; F78-I83 HydrophobicContact CZ-CD1 3.84Å; F78-I83 HydrophobicContact CZ-CG1 4.42Å; F78-I83 WeakPolarHBondContact O-CG1 3.49Å; F78-I83 PolarHBondContact O-N 2.91Å
79L95.8Very high94.8Very high28 Ų2826.3 Ų26.315%0.14713%0.125CC..Iπ-helixtrans-82.5-46.7-169.6-60.7176.8000113.3I74 F75 I83 G84 L99 F110I74-L79 HydrophobicContact CG2-CD1 3.96Å; I74-L79 HydrophobicContact CG2-CG 4.44Å; I74-L79 VanDerWaalsContact O-CG 3.29Å; I74-L79 WeakPolarHBondContact O-CG 3.25Å; I74-L79 PolarHBondContact O-N 3.46Å; F75-L79 HydrophobicContact CD1-CD1 3.76Å; F75-L79 HydrophobicContact CE1-CD1 3.87Å; L79-I83 HydrophobicContact CD2-CD1 3.88Å; L79-G84 PolarHBondContact O-N 3.14Å; L79-L99 HydrophobicContact CB-CD1 4.33Å; L79-L99 HydrophobicContact CD2-CD1 3.83Å; L79-F110 HydrophobicContact CB-CD1 4.47Å; L79-F110 HydrophobicContact CB-CE1 3.65Å; L79-F110 HydrophobicContact CB-CZ 4.37Å; L79-F110 HydrophobicContact CD1-CE1 3.63Å; L79-F110 HydrophobicContact CD1-CZ 4.05Å; L79-F110 HydrophobicContact CG-CE1 4.24Å
80D93.3Very high94.5Very high36 Ų3629.5 Ų29.519%0.19314%0.142CC..Iπ-helixtrans-80.4-57.8174-175.538.3000112.5F75 N76 G84 R85F75-D80 PolarHBondContact O-N 3.25Å; N76-D80 PolarHBondContact O-N 3.44Å; D80-G84 CarbonylContact O-C 3.46Å; D80-G84 VanDerWaalsContact O-CA 3.22Å; D80-G84 WeakPolarHBondContact O-CA 3.24Å; D80-G84 PolarHBondContact O-N 2.95Å; D80-R85 VanDerWaalsContact CG-CZ 3.5Å; D80-R85 PolarHBondContact O-N 3.28Å; D80-R85 IonicContact OD1-CZ 3.08Å; D80-R85 IonicContact OD1-NE 2.69Å; D80-R85 IonicContact OD1-NH1 3.51Å; D80-R85 IonicContact OD1-NH2 2.75Å; D80-R85 PolarHBondContact OD1-NH2 3.18Å; D80-R85 IonicContact OD2-CZ 3.62Å; D80-R85 IonicContact OD2-NH1 3.85Å; D80-R85 PolarHBondContact OD2-NH1 2.97Å; D80-R85 IonicContact OD2-NH2 3.11Å; D80-R85 PolarHBondContact OD2-NH2 2.99Å
81D94.6Very high94.2Very high0 Ų030.3 Ų30.30%015%0.148CC..Iπ-helixtrans-67.3-52.7-170.4-83.610000112.7R25 T29 N76 A77 G86 S303R25-D81 HydrophobicContact CG-CB 4.17Å; R25-D81 IonicContact CZ-OD1 2.78Å; R25-D81 IonicContact CZ-OD2 3.76Å; R25-D81 IonicContact NE-OD1 2.61Å; R25-D81 VanDerWaalsContact NH1-CG 3.32Å; R25-D81 IonicContact NH1-OD1 3.37Å; R25-D81 PolarHBondContact NH1-OD1 2.89Å; R25-D81 IonicContact NH1-OD2 2.82Å; R25-D81 IonicContact NH2-OD1 2.67Å; R25-D81 PolarHBondContact NH2-OD1 3.39Å; R25-D81 IonicContact NH2-OD2 2.9Å; R25-D81 PolarHBondContact NH2-OD2 3.4Å; T29-D81 HydrophobicContact CG2-CB 4.08Å; N76-D81 WeakPolarHBondContact O-CB 3.45Å; N76-D81 PolarHBondContact O-N 3.43Å; A77-D81 WeakPolarHBondContact O-CB 3.17Å; D81-G86 PolarHBondContact O-N 2.94Å; D81-S303 WeakPolarHBondContact OD2-CA 3.26Å; D81-S303 WeakPolarHBondContact OD2-CB 3.2Å; D81-S303 PolarHBondContact OD2-OG 2.96Å
82F96.1Very high93.8Very high33 Ų3334.7 Ų34.715%0.14516%0.164CC..Iπ-helixtrans-79.9-64.2179178-112.9000112.7R25 T29 P30 A77 F78 G86 L87R25-F82 WeakPolarHBondContact O-CD2 3.15Å; T29-F82 HydrophobicContact CG2-CB 4.44Å; P30-F82 HydrophobicContact CB-CD1 4.41Å; P30-F82 HydrophobicContact CB-CD2 4Å; P30-F82 HydrophobicContact CB-CE1 4.42Å; P30-F82 HydrophobicContact CB-CE2 4.01Å; P30-F82 HydrophobicContact CB-CG 4.21Å; P30-F82 HydrophobicContact CB-CZ 4.22Å; P30-F82 HydrophobicContact CG-CD2 3.81Å; P30-F82 HydrophobicContact CG-CE2 3.77Å; P30-F82 HydrophobicContact CG-CG 4.47Å; P30-F82 HydrophobicContact CG-CZ 4.4Å; A77-F82 PolarHBondContact O-N 3.01Å; F78-F82 HydrophobicContact CD2-CD1 4Å; F78-F82 AromaticContact CE2-CD1 3.91Å; F78-F82 HydrophobicContact CE2-CD1 3.91Å; F78-F82 HydrophobicContact CE2-CE1 4.33Å; F78-F82 WeakPolarHBondContact O-CB 3.48Å; F82-G86 CarbonylContact O-C 3.44Å; F82-G86 VanDerWaalsContact O-CA 3.29Å; F82-G86 WeakPolarHBondContact O-CA 3.3Å; F82-G86 PolarHBondContact O-N 3.31Å; F82-L87 HydrophobicContact CZ-CD1 4.31Å; F82-L87 PolarHBondContact O-N 3.1Å
83I94.7Very high93.4Very high28 Ų2835.3 Ų35.314%0.14417%0.17CC..Iπ-helixtrans-65.1-50.1-175.6-64.9-174.8000111.3F78 L79 R85 I97 L99F78-I83 HydrophobicContact CD1-CD1 4.42Å; F78-I83 HydrophobicContact CE1-CD1 3.9Å; F78-I83 HydrophobicContact CE2-CD1 4.32Å; F78-I83 HydrophobicContact CE2-CG1 4.41Å; F78-I83 HydrophobicContact CZ-CD1 3.84Å; F78-I83 HydrophobicContact CZ-CG1 4.42Å; F78-I83 WeakPolarHBondContact O-CG1 3.49Å; F78-I83 PolarHBondContact O-N 2.91Å; L79-I83 HydrophobicContact CD2-CD1 3.88Å; I83-R85 VanDerWaalsContact C-N 3.32Å; I83-R85 PolarHBondContact O-N 3.06Å; I83-I97 HydrophobicContact CG2-CB 3.93Å; I83-I97 HydrophobicContact CG2-CG2 3.94Å; I83-L99 HydrophobicContact CG2-CD1 4.25Å; I83-L99 HydrophobicContact CG2-CG 4.41Å
84G90.8Very high92.9Very high3 Ų342 Ų423%0.03121%0.205CC..Iπ-helixtrans-65.1-25.4-176.400000115.8L79 D80 I97L79-G84 PolarHBondContact O-N 3.14Å; D80-G84 CarbonylContact O-C 3.46Å; D80-G84 VanDerWaalsContact O-CA 3.22Å; D80-G84 WeakPolarHBondContact O-CA 3.24Å; D80-G84 PolarHBondContact O-N 2.95Å; G84-I97 WeakPolarHBondContact CA-O 3.34Å
85R90.6Very high92.5Very high67 Ų6742.8 Ų42.825%0.25321%0.209SC..Iπ-helixtrans-141.7-46.1-173.4-55.1-175.2-162.7131.111114.6Y22 D80 I83 W89Y22-R85 HydrophobicContact CE1-CB 4.29Å; D80-R85 VanDerWaalsContact CG-CZ 3.5Å; D80-R85 PolarHBondContact O-N 3.28Å; D80-R85 IonicContact OD1-CZ 3.08Å; D80-R85 IonicContact OD1-NE 2.69Å; D80-R85 IonicContact OD1-NH1 3.51Å; D80-R85 IonicContact OD1-NH2 2.75Å; D80-R85 PolarHBondContact OD1-NH2 3.18Å; D80-R85 IonicContact OD2-CZ 3.62Å; D80-R85 IonicContact OD2-NH1 3.85Å; D80-R85 PolarHBondContact OD2-NH1 2.97Å; D80-R85 IonicContact OD2-NH2 3.11Å; D80-R85 PolarHBondContact OD2-NH2 2.99Å; I83-R85 VanDerWaalsContact C-N 3.32Å; I83-R85 PolarHBondContact O-N 3.06Å; R85-W89 PolarHBondContact O-N 3.4Å
86G93.2Very high92Very high0 Ų044.5 Ų44.50%022%0.22CC..Iπ-helixtrans-63-41.8-178.700000114A26 D81 F82 W89 L90A26-G86 WeakPolarHBondContact CB-O 3.3Å; D81-G86 PolarHBondContact O-N 2.94Å; F82-G86 CarbonylContact O-C 3.44Å; F82-G86 VanDerWaalsContact O-CA 3.29Å; F82-G86 WeakPolarHBondContact O-CA 3.3Å; F82-G86 PolarHBondContact O-N 3.31Å; G86-W89 PolarHBondContact O-N 3.4Å; G86-L90 WeakPolarHBondContact O-CB 3.29Å; G86-L90 PolarHBondContact O-N 3.45Å
87L93.3Very high91.7Very high32 Ų3246.1 Ų46.117%0.16823%0.228CC..Hα-helixtrans-68.3-39.5-179.7-175.562.8000111.9F82 W89 L90 T91 I95F82-L87 HydrophobicContact CZ-CD1 4.31Å; F82-L87 PolarHBondContact O-N 3.1Å; L87-W89 VanDerWaalsContact C-N 3.32Å; L87-W89 PolarHBondContact O-N 3.11Å; L87-L90 PolarHBondContact O-N 2.84Å; L87-T91 HydrophobicContact CD1-CG2 3.97Å; L87-T91 HydrophobicContact CG-CG2 4.46Å; L87-T91 WeakPolarHBondContact O-CB 3.45Å; L87-T91 WeakPolarHBondContact O-CG2 3.19Å; L87-T91 PolarHBondContact O-N 2.82Å; L87-T91 PolarHBondContact O-OG1 3.14Å; L87-I95 HydrophobicContact CD2-CG2 3.78Å; L87-I95 HydrophobicContact CG-CB 4.42Å; L87-I95 HydrophobicContact CG-CG2 4.21Å
88A91.5Very high91.3Very high1 Ų149.2 Ų49.21%0.00824%0.241CC..Hα-helixtrans-61.2-41.3173.200000111.4F8 K92 C93 I95 N96F8-A88 HydrophobicContact CE2-CB 4.5Å; F8-A88 HydrophobicContact CZ-CB 4.13Å; A88-K92 PolarHBondContact O-N 2.77Å; A88-C93 PolarHBondContact O-N 3.28Å; A88-I95 VanDerWaalsContact CA-O 3.23Å; A88-I95 WeakPolarHBondContact CA-O 3.42Å; A88-I95 PolarHBondContact N-O 3.5Å; A88-N96 HydrophobicContact CB-CB 4.2Å
89W90.8Very high91Very high23 Ų2347.7 Ų47.79%0.08724%0.237CC..Hα-helixtrans-67.9-45.9174.7-173.193.7000112.2F8 Y22 R23 A26 Y27 R85 G86 L87 T91 K92F8-W89 HydrophobicContact CE2-CB 4.03Å; F8-W89 HydrophobicContact CZ-CB 4.02Å; Y22-W89 HydrophobicContact CD1-CB 4.46Å; Y22-W89 AromaticContact CG-CD1 3.89Å; Y22-W89 HydrophobicContact CG-CG 4.34Å; R23-W89 HydrophobicContact CG-CH2 3.55Å; R23-W89 HydrophobicContact CG-CZ2 3.5Å; R23-W89 HydrophobicContact CG-CZ3 4.25Å; A26-W89 HydrophobicContact CB-CD2 4.33Å; A26-W89 HydrophobicContact CB-CE3 3.42Å; A26-W89 VanDerWaalsContact CB-CE3 3.42Å; A26-W89 HydrophobicContact CB-CZ3 3.99Å; Y27-W89 HydrophobicContact CD2-CZ3 4.13Å; Y27-W89 HydrophobicContact CE2-CE3 4.43Å; Y27-W89 AromaticContact CE2-CH2 3.67Å; Y27-W89 HydrophobicContact CE2-CH2 3.67Å; Y27-W89 AromaticContact CE2-CZ3 3.3Å; Y27-W89 HydrophobicContact CE2-CZ3 3.3Å; Y27-W89 AromaticContact CZ-CZ3 3.62Å; R85-W89 PolarHBondContact O-N 3.4Å; G86-W89 PolarHBondContact O-N 3.4Å; L87-W89 VanDerWaalsContact C-N 3.32Å; L87-W89 PolarHBondContact O-N 3.11Å; W89-T91 VanDerWaalsContact C-N 3.3Å; W89-T91 PolarHBondContact O-N 2.66Å; W89-K92 PolarHBondContact O-N 3.11Å
90L91.7Very high90.7Very high72 Ų7247.7 Ų47.738%0.37724%0.237SC..Hα-helixtrans-59-40.1-179.9-177.263.6000112.5A26 Y27 G86 L87A26-L90 HydrophobicContact CB-CB 4.21Å; Y27-L90 HydrophobicContact CD1-CD1 4.07Å; Y27-L90 HydrophobicContact CE1-CD1 3.38Å; G86-L90 WeakPolarHBondContact O-CB 3.29Å; G86-L90 PolarHBondContact O-N 3.45Å; L87-L90 PolarHBondContact O-N 2.84Å
91T91Very high90.6Very high38 Ų3847.3 Ų47.323%0.23324%0.236CC..THydrogen-bonded Turntrans-93.39.6-176.563.30000113.8L87 W89 C93 N94 I95L87-T91 HydrophobicContact CD1-CG2 3.97Å; L87-T91 HydrophobicContact CG-CG2 4.46Å; L87-T91 WeakPolarHBondContact O-CB 3.45Å; L87-T91 WeakPolarHBondContact O-CG2 3.19Å; L87-T91 PolarHBondContact O-N 2.82Å; L87-T91 PolarHBondContact O-OG1 3.14Å; W89-T91 VanDerWaalsContact C-N 3.3Å; W89-T91 PolarHBondContact O-N 2.66Å; T91-C93 VanDerWaalsContact C-N 3.31Å; T91-C93 PolarHBondContact O-N 2.97Å; T91-N94 WeakPolarHBondContact O-CB 3.33Å; T91-N94 PolarHBondContact O-N 3.01Å; T91-I95 HydrophobicContact CG2-CB 4.17Å; T91-I95 HydrophobicContact CG2-CD1 4.21Å; T91-I95 HydrophobicContact CG2-CG1 4.24Å; T91-I95 PolarHBondContact OG1-N 3.43Å; T91-I95 PolarHBondContact OG1-O 3.32Å
92K88.6Confident90.4Very high168 Ų16854.8 Ų54.873%0.7327%0.265SS*.THydrogen-bonded Turntrans52.146.1-175.9-54.9179.2-175.9174.80113.1L5 A88 W89 N94L5-K92 HydrophobicContact CG-CB 4.35Å; A88-K92 PolarHBondContact O-N 2.77Å; W89-K92 PolarHBondContact O-N 3.11Å; K92-N94 VanDerWaalsContact C-N 3.25Å; K92-N94 PolarHBondContact O-N 3.14Å
93C86.1Confident90.3Very high20 Ų2055 Ų5514%0.13527%0.271CS..THydrogen-bonded Turntrans67.15.8-174.8-560000116.7L5 C7 A88 T91 I95L5-C93 VanDerWaalsContact CB-SG 3.59Å; C7-C93 VanDerWaalsContact CA-SG 3.59Å; C7-C93 HydrophobicContact CB-CB 3.7Å; C7-C93 WeakPolarHBondContact CB-SG 3.42Å; C7-C93 PolarHBondContact N-SG 3.48Å; C7-C93 WeakPolarHBondContact SG-CB 3.49Å; C7-C93 CovalentContact SG-SG 2.03Å; C7-C93 PolarHBondContact SG-SG 3.1Å; A88-C93 PolarHBondContact O-N 3.28Å; T91-C93 VanDerWaalsContact C-N 3.31Å; T91-C93 PolarHBondContact O-N 2.97Å; C93-I95 VanDerWaalsContact C-N 3.3Å; C93-I95 PolarHBondContact O-N 3.24Å
94N87.3Confident90.3Very high140 Ų14057.9 Ų57.975%0.74929%0.286SS*.SBendtrans-66.1-32.6176-170.443000112.6T91 K92T91-N94 WeakPolarHBondContact O-CB 3.33Å; T91-N94 PolarHBondContact O-N 3.01Å; K92-N94 VanDerWaalsContact C-N 3.25Å; K92-N94 PolarHBondContact O-N 3.14Å
95I87.8Confident90.5Very high73 Ų7363.7 Ų63.737%0.37432%0.315SS..SBendtrans-125.5103.4175-53.9179.3000108.9L87 A88 T91 C93 I97L87-I95 HydrophobicContact CD2-CG2 3.78Å; L87-I95 HydrophobicContact CG-CB 4.42Å; L87-I95 HydrophobicContact CG-CG2 4.21Å; A88-I95 VanDerWaalsContact CA-O 3.23Å; A88-I95 WeakPolarHBondContact CA-O 3.42Å; A88-I95 PolarHBondContact N-O 3.5Å; T91-I95 HydrophobicContact CG2-CB 4.17Å; T91-I95 HydrophobicContact CG2-CD1 4.21Å; T91-I95 HydrophobicContact CG2-CG1 4.24Å; T91-I95 PolarHBondContact OG1-N 3.43Å; T91-I95 PolarHBondContact OG1-O 3.32Å; C93-I95 VanDerWaalsContact C-N 3.3Å; C93-I95 PolarHBondContact O-N 3.24Å; I95-I97 HydrophobicContact CG2-CD1 3.69Å; I95-I97 HydrophobicContact CG2-CG1 3.89Å
96N86.1Confident90.7Very high72 Ų7263.4 Ų63.439%0.38532%0.318SS..  trans-121.396.6179.8179.524.7000109.6A88A88-N96 HydrophobicContact CB-CB 4.2Å
97I88.9Confident90.7Very high56 Ų5663.4 Ų63.429%0.28732%0.318SS..  trans-113.599.2-174.8-58.5172.2000108.8I83 G84 I95 L99 Y102I83-I97 HydrophobicContact CG2-CB 3.93Å; I83-I97 HydrophobicContact CG2-CG2 3.94Å; G84-I97 WeakPolarHBondContact CA-O 3.34Å; I95-I97 HydrophobicContact CG2-CD1 3.69Å; I95-I97 HydrophobicContact CG2-CG1 3.89Å; I97-L99 HydrophobicContact CG2-CD2 3.74Å; I97-L99 HydrophobicContact CG2-CG 4.09Å; I97-Y102 HydrophobicContact CG2-CE2 4.27Å
98K88.6Confident90.8Very high65 Ų6564.8 Ų64.828%0.28332%0.323SS..  trans-99.190.4176.1-72.6-173.4-178.7179.20110.5D100 T101 Y102K98-D100 WeakPolarHBondContact CB-OD1 3.38Å; K98-D100 PolarHBondContact O-N 2.85Å; K98-T101 HydrophobicContact CB-CG2 4.15Å; K98-T101 WeakPolarHBondContact CB-OG1 3.43Å; K98-T101 PolarHBondContact O-N 3.46Å; K98-T101 VanDerWaalsContact O-N 3.08Å; K98-T101 PolarHBondContact O-OG1 3.37Å; K98-Y102 WeakPolarHBondContact O-CD2 3.41Å; K98-Y102 VanDerWaalsContact O-CE2 3.31Å; K98-Y102 WeakPolarHBondContact O-CE2 3.41Å
99L90.1Very high91Very high46 Ų4669 Ų6924%0.24134%0.341CS..G310 helixtrans-61.3-28.2-173.4-65.8174.9000113.2L79 I83 I97 T101 Y102 L106 F110L79-L99 HydrophobicContact CB-CD1 4.33Å; L79-L99 HydrophobicContact CD2-CD1 3.83Å; I83-L99 HydrophobicContact CG2-CD1 4.25Å; I83-L99 HydrophobicContact CG2-CG 4.41Å; I97-L99 HydrophobicContact CG2-CD2 3.74Å; I97-L99 HydrophobicContact CG2-CG 4.09Å; L99-T101 VanDerWaalsContact C-N 3.34Å; L99-Y102 HydrophobicContact CD2-CE2 4.25Å; L99-L106 WeakPolarHBondContact O-CB 3.38Å; L99-F110 HydrophobicContact CB-CD2 4.34Å; L99-F110 HydrophobicContact CB-CE2 3.59Å; L99-F110 HydrophobicContact CB-CZ 3.78Å; L99-F110 HydrophobicContact CD1-CZ 4.09Å
100D90.7Very high91.2Very high29 Ų2969.5 Ų69.516%0.15534%0.344CS..G310 helixtrans-66.8-27.417562.6-50.3000113.6K98 C107 F110 C185K98-D100 WeakPolarHBondContact CB-OD1 3.38Å; K98-D100 PolarHBondContact O-N 2.85Å; D100-C107 VanDerWaalsContact O-CA 3.26Å; D100-C107 WeakPolarHBondContact O-CA 3.47Å; D100-C107 VanDerWaalsContact O-CB 3.25Å; D100-C107 WeakPolarHBondContact O-CB 3.42Å; D100-C107 PolarHBondContact O-N 2.82Å; D100-F110 HydrophobicContact CB-CB 4.19Å; D100-F110 HydrophobicContact CB-CD2 4.42Å; D100-C185 HydrophobicContact CB-CB 3.94Å; D100-C185 WeakPolarHBondContact OD2-CB 3.09Å
101T90.7Very high91.2Very high28 Ų2867.7 Ų67.717%0.17234%0.337CS..G310 helixtrans-91-11.2-174.860.80000114.9K98 L99 S103 T183K98-T101 HydrophobicContact CB-CG2 4.15Å; K98-T101 WeakPolarHBondContact CB-OG1 3.43Å; K98-T101 PolarHBondContact O-N 3.46Å; K98-T101 VanDerWaalsContact O-N 3.08Å; K98-T101 PolarHBondContact O-OG1 3.37Å; L99-T101 VanDerWaalsContact C-N 3.34Å; T101-S103 VanDerWaalsContact C-N 3.33Å; T101-S103 PolarHBondContact O-N 3.22Å; T101-T183 WeakPolarHBondContact CG2-O 3.37Å
102Y90.8Very high91.4Very high156 Ų15667 Ų6761%0.61233%0.331SS*.SBendtrans-67-29.6-176-78.8-96.2000114I97 K98 L99I97-Y102 HydrophobicContact CG2-CE2 4.27Å; K98-Y102 WeakPolarHBondContact O-CD2 3.41Å; K98-Y102 VanDerWaalsContact O-CE2 3.31Å; K98-Y102 WeakPolarHBondContact O-CE2 3.41Å; L99-Y102 HydrophobicContact CD2-CE2 4.25Å
103S93.7Very high91.8Very high37 Ų3760.3 Ų60.326%0.25930%0.303SS..  trans-160158.6177.2670000111.8T101 I105 L106 C107T101-S103 VanDerWaalsContact C-N 3.33Å; T101-S103 PolarHBondContact O-N 3.22Å; S103-I105 VanDerWaalsContact C-N 3.26Å; S103-I105 PolarHBondContact O-N 2.89Å; S103-I105 VanDerWaalsContact OG-CG2 3.3Å; S103-I105 WeakPolarHBondContact OG-CG2 3.43Å; S103-L106 PolarHBondContact O-N 2.82Å; S103-L106 VanDerWaalsContact OG-CG 3.3Å; S103-L106 WeakPolarHBondContact OG-CG 3.37Å; S103-L106 PolarHBondContact OG-N 3.21Å; S103-C107 PolarHBondContact O-N 2.6Å
104L93.8Very high92.1Very high90 Ų9060.2 Ų60.247%0.47130%0.301SS..Hα-helixtrans-59.4-36.8177.6-177.561.9000112.5K108L104-K108 HydrophobicContact CG-CD 4.4Å; L104-K108 VanDerWaalsContact O-CG 3.31Å; L104-K108 WeakPolarHBondContact O-CG 3.41Å; L104-K108 PolarHBondContact O-N 3.49Å; L104-K108 VanDerWaalsContact O-N 3.13Å
105I95.1Very high92.4Very high124 Ų12456.8 Ų56.864%0.63628%0.281SS*.Hα-helixtrans-68.4-38.4178.4-174.460.6000111.7S103 K108 F109S103-I105 VanDerWaalsContact C-N 3.26Å; S103-I105 PolarHBondContact O-N 2.89Å; S103-I105 VanDerWaalsContact OG-CG2 3.3Å; S103-I105 WeakPolarHBondContact OG-CG2 3.43Å; I105-K108 PolarHBondContact O-N 3.4Å; I105-F109 VanDerWaalsContact O-CB 3.3Å; I105-F109 WeakPolarHBondContact O-CB 3.18Å; I105-F109 PolarHBondContact O-N 3.42Å
106L94.2Very high92.8Very high61 Ų6153.5 Ų53.532%0.31926%0.264SS..Hα-helixtrans-68.6-44.3175.8-68.5172000111.4L99 S103 K108 F109 F110L99-L106 WeakPolarHBondContact O-CB 3.38Å; S103-L106 PolarHBondContact O-N 2.82Å; S103-L106 VanDerWaalsContact OG-CG 3.3Å; S103-L106 WeakPolarHBondContact OG-CG 3.37Å; S103-L106 PolarHBondContact OG-N 3.21Å; L106-K108 VanDerWaalsContact C-N 3.29Å; L106-K108 PolarHBondContact O-N 3.04Å; L106-F109 PolarHBondContact O-N 2.97Å; L106-F109 VanDerWaalsContact O-N 3.16Å; L106-F110 HydrophobicContact CB-CD2 4.16Å; L106-F110 HydrophobicContact CB-CE2 4.31Å; L106-F110 HydrophobicContact CD2-CE2 4.06Å; L106-F110 WeakPolarHBondContact O-CB 3.47Å; L106-F110 VanDerWaalsContact O-CD2 3.26Å; L106-F110 WeakPolarHBondContact O-CD2 3.29Å; L106-F110 PolarHBondContact O-N 2.92Å
107C94.7Very high93.2Very high0 Ų050.4 Ų50.40%025%0.248CC..Hα-helixtrans-52.1-48.4173.5171.20000111.9D100 S103 S111 G174 L175 C185D100-C107 VanDerWaalsContact O-CA 3.26Å; D100-C107 WeakPolarHBondContact O-CA 3.47Å; D100-C107 VanDerWaalsContact O-CB 3.25Å; D100-C107 WeakPolarHBondContact O-CB 3.42Å; D100-C107 PolarHBondContact O-N 2.82Å; S103-C107 PolarHBondContact O-N 2.6Å; C107-S111 VanDerWaalsContact O-CB 3.32Å; C107-S111 WeakPolarHBondContact O-CB 3.34Å; C107-S111 PolarHBondContact O-N 2.95Å; C107-S111 PolarHBondContact O-OG 3.07Å; C107-G174 VanDerWaalsContact SG-C 3.52Å; C107-G174 PolarHBondContact SG-O 3.36Å; C107-L175 HydrophobicContact CB-CD2 3.93Å; C107-L175 HydrophobicContact CB-CG 4.39Å; C107-C185 VanDerWaalsContact C-SG 3.53Å; C107-C185 WeakPolarHBondContact CA-SG 3.06Å; C107-C185 HydrophobicContact CB-CB 3.78Å; C107-C185 WeakPolarHBondContact CB-SG 3.44Å; C107-C185 PolarHBondContact O-SG 2.86Å; C107-C185 VanDerWaalsContact SG-CA 3.53Å; C107-C185 WeakPolarHBondContact SG-CB 3.48Å; C107-C185 CovalentContact SG-SG 2.04Å; C107-C185 PolarHBondContact SG-SG 3.21Å
108K95.2Very high93.5Very high61 Ų6148 Ų4827%0.26524%0.238SC..Hα-helixtrans-63-45.1177.6-71179.9168.4-144.70112.6L104 I105 L106 S111 Y112 A170 I171 S173L104-K108 HydrophobicContact CG-CD 4.4Å; L104-K108 VanDerWaalsContact O-CG 3.31Å; L104-K108 WeakPolarHBondContact O-CG 3.41Å; L104-K108 PolarHBondContact O-N 3.49Å; L104-K108 VanDerWaalsContact O-N 3.13Å; I105-K108 PolarHBondContact O-N 3.4Å; L106-K108 VanDerWaalsContact C-N 3.29Å; L106-K108 PolarHBondContact O-N 3.04Å; K108-S111 PolarHBondContact O-N 3.4Å; K108-Y112 WeakPolarHBondContact O-CB 3.11Å; K108-Y112 PolarHBondContact O-N 2.83Å; K108-A170 WeakPolarHBondContact CD-O 3.3Å; K108-A170 VanDerWaalsContact CE-O 3.26Å; K108-A170 WeakPolarHBondContact CE-O 3.31Å; K108-A170 VanDerWaalsContact CG-O 3.29Å; K108-A170 WeakPolarHBondContact CG-O 3.47Å; K108-A170 PolarHBondContact NZ-O 2.86Å; K108-I171 PolarHBondContact NZ-O 2.97Å; K108-S173 WeakPolarHBondContact CE-O 3.29Å
109F95.1Very high93.7Very high91 Ų9145.2 Ų45.240%0.39923%0.226SC..Hα-helixtrans-66.1-46.8-178.9-170.9-108.4000112.5F75 I105 L106 S111 Y112 I113F75-F109 HydrophobicContact CD1-CE1 4.25Å; F75-F109 HydrophobicContact CE1-CD1 4.34Å; F75-F109 AromaticContact CE1-CE1 3.52Å; F75-F109 HydrophobicContact CE1-CE1 3.52Å; F75-F109 HydrophobicContact CE1-CZ 4.28Å; F75-F109 AromaticContact CZ-CE1 3.92Å; F75-F109 HydrophobicContact CZ-CE1 3.92Å; F75-F109 HydrophobicContact CZ-CZ 4.25Å; I105-F109 VanDerWaalsContact O-CB 3.3Å; I105-F109 WeakPolarHBondContact O-CB 3.18Å; I105-F109 PolarHBondContact O-N 3.42Å; L106-F109 PolarHBondContact O-N 2.97Å; L106-F109 VanDerWaalsContact O-N 3.16Å; F109-S111 VanDerWaalsContact C-N 3.34Å; F109-S111 PolarHBondContact O-N 3.14Å; F109-Y112 PolarHBondContact O-N 3.18Å; F109-I113 HydrophobicContact CD1-CG1 4.32Å; F109-I113 HydrophobicContact CD2-CD1 4.25Å; F109-I113 HydrophobicContact CD2-CG1 3.79Å; F109-I113 HydrophobicContact CE1-CG1 4.13Å; F109-I113 HydrophobicContact CE2-CD1 3.73Å; F109-I113 HydrophobicContact CE2-CG1 3.55Å; F109-I113 HydrophobicContact CG-CG1 4.17Å; F109-I113 HydrophobicContact CZ-CD1 4.14Å; F109-I113 HydrophobicContact CZ-CG1 3.74Å; F109-I113 WeakPolarHBondContact O-CG1 3.48Å; F109-I113 PolarHBondContact O-N 3.21Å
110F94.4Very high94Very high33 Ų3343.3 Ų43.315%0.14522%0.216CC..Hα-helixtrans-69-28.5177.3-78.7-67000113.4F75 L79 L99 D100 L106 P114F75-F110 HydrophobicContact CD1-CD1 4.22Å; F75-F110 AromaticContact CD1-CE1 3.87Å; F75-F110 HydrophobicContact CD1-CE1 3.87Å; F75-F110 HydrophobicContact CE1-CE1 4.39Å; L79-F110 HydrophobicContact CB-CD1 4.47Å; L79-F110 HydrophobicContact CB-CE1 3.65Å; L79-F110 HydrophobicContact CB-CZ 4.37Å; L79-F110 HydrophobicContact CD1-CE1 3.63Å; L79-F110 HydrophobicContact CD1-CZ 4.05Å; L79-F110 HydrophobicContact CG-CE1 4.24Å; L99-F110 HydrophobicContact CB-CD2 4.34Å; L99-F110 HydrophobicContact CB-CE2 3.59Å; L99-F110 HydrophobicContact CB-CZ 3.78Å; L99-F110 HydrophobicContact CD1-CZ 4.09Å; D100-F110 HydrophobicContact CB-CB 4.19Å; D100-F110 HydrophobicContact CB-CD2 4.42Å; L106-F110 HydrophobicContact CB-CD2 4.16Å; L106-F110 HydrophobicContact CB-CE2 4.31Å; L106-F110 HydrophobicContact CD2-CE2 4.06Å; L106-F110 WeakPolarHBondContact O-CB 3.47Å; L106-F110 VanDerWaalsContact O-CD2 3.26Å; L106-F110 WeakPolarHBondContact O-CD2 3.29Å; L106-F110 PolarHBondContact O-N 2.92Å; F110-P114 WeakPolarHBondContact O-CD 3.44Å; F110-P114 VanDerWaalsContact O-CG 3.27Å; F110-P114 WeakPolarHBondContact O-CG 3.38Å
111S92.8Very high94.2Very high33 Ų3342 Ų4223%0.23121%0.209CC..Hα-helixtrans-73.1-31.8171.2-58.90000112.6C107 K108 F109 T169 C185C107-S111 VanDerWaalsContact O-CB 3.32Å; C107-S111 WeakPolarHBondContact O-CB 3.34Å; C107-S111 PolarHBondContact O-N 2.95Å; C107-S111 PolarHBondContact O-OG 3.07Å; K108-S111 PolarHBondContact O-N 3.4Å; F109-S111 VanDerWaalsContact C-N 3.34Å; F109-S111 PolarHBondContact O-N 3.14Å; S111-T169 WeakPolarHBondContact O-CG2 3.37Å; S111-C185 PolarHBondContact OG-SG 2.89Å; S111-C185 VanDerWaalsContact OG-SG 3.36Å
112Y95.3Very high94.4Very high24 Ų2440.8 Ų40.89%0.09420%0.201CC..Hα-helixtrans-90.6-46.2-169.7170.9-96.9000114.1K108 F109 T116 M163 Y166 A170K108-Y112 WeakPolarHBondContact O-CB 3.11Å; K108-Y112 PolarHBondContact O-N 2.83Å; F109-Y112 PolarHBondContact O-N 3.18Å; Y112-T116 WeakPolarHBondContact CE2-OG1 3.39Å; Y112-T116 WeakPolarHBondContact O-CB 3.35Å; Y112-T116 PolarHBondContact O-N 2.93Å; Y112-T116 PolarHBondContact O-OG1 3.33Å; Y112-M163 HydrophobicContact CE1-CE 4.16Å; Y112-M163 HydrophobicContact CE1-SD 4.01Å; Y112-M163 WeakPolarHBondContact OH-CA 3.38Å; Y112-M163 VanDerWaalsContact OH-CB 3.3Å; Y112-M163 WeakPolarHBondContact OH-CB 3.49Å; Y112-M163 VanDerWaalsContact OH-CE 3.31Å; Y112-M163 WeakPolarHBondContact OH-CE 3.49Å; Y112-M163 PolarHBondContact OH-O 3.39Å; Y112-M163 PolarHBondContact OH-SD 2.97Å; Y112-Y166 WeakPolarHBondContact CD2-O 3.34Å; Y112-A170 HydrophobicContact CD2-CB 3.85Å; Y112-A170 HydrophobicContact CG-CB 4.08Å
113I96Very high94.6Very high28 Ų2835.8 Ų35.814%0.14419%0.186CC..Hα-helixtrans-65.4-45.1-171.7-63.8-68.8000113.1F75 F109 E115 T116 S117F75-I113 HydrophobicContact CB-CG2 4.01Å; F75-I113 HydrophobicContact CD1-CG2 4.37Å; F75-I113 HydrophobicContact CD2-CB 4.45Å; F75-I113 HydrophobicContact CD2-CG2 3.39Å; F75-I113 HydrophobicContact CE2-CG2 3.95Å; F75-I113 HydrophobicContact CG-CB 4.27Å; F75-I113 HydrophobicContact CG-CG2 3.64Å; F109-I113 HydrophobicContact CD1-CG1 4.32Å; F109-I113 HydrophobicContact CD2-CD1 4.25Å; F109-I113 HydrophobicContact CD2-CG1 3.79Å; F109-I113 HydrophobicContact CE1-CG1 4.13Å; F109-I113 HydrophobicContact CE2-CD1 3.73Å; F109-I113 HydrophobicContact CE2-CG1 3.55Å; F109-I113 HydrophobicContact CG-CG1 4.17Å; F109-I113 HydrophobicContact CZ-CD1 4.14Å; F109-I113 HydrophobicContact CZ-CG1 3.74Å; F109-I113 WeakPolarHBondContact O-CG1 3.48Å; F109-I113 PolarHBondContact O-N 3.21Å; I113-E115 PolarHBondContact O-N 2.91Å; I113-T116 PolarHBondContact O-N 2.77Å; I113-S117 WeakPolarHBondContact O-CB 3.5Å; I113-S117 PolarHBondContact O-N 2.88Å; I113-S117 PolarHBondContact O-OG 2.94Å
114P93.5Very high94.7Very high17 Ų1734 Ų3411%0.1117%0.173CC..Hα-helixtrans-57-51.2177.6-28.338.2000112.8F75 N76 F110 T116 S117 G118F75-P114 HydrophobicContact CB-CG 3.98Å; N76-P114 HydrophobicContact CB-CB 4.08Å; F110-P114 WeakPolarHBondContact O-CD 3.44Å; F110-P114 VanDerWaalsContact O-CG 3.27Å; F110-P114 WeakPolarHBondContact O-CG 3.38Å; P114-T116 PolarHBondContact O-N 3.47Å; P114-S117 PolarHBondContact O-N 3.33Å; P114-S117 PolarHBondContact O-OG 3.39Å; P114-G118 PolarHBondContact O-N 2.93Å
115E92.9Very high94.7Very high68 Ų6830 Ų3032%0.31815%0.152SC..Hα-helixtrans-59.4-46.4178.6-68.9-63.7140.500111.9I113 G118 I119 Y166 S202I113-E115 PolarHBondContact O-N 2.91Å; E115-G118 PolarHBondContact O-N 2.94Å; E115-I119 PolarHBondContact O-N 3.46Å; E115-Y166 HydrophobicContact CB-CD1 3.6Å; E115-Y166 HydrophobicContact CB-CE1 3.47Å; E115-Y166 VanDerWaalsContact CB-CE1 3.47Å; E115-Y166 HydrophobicContact CB-CG 4.15Å; E115-Y166 HydrophobicContact CG-CD1 4.31Å; E115-Y166 HydrophobicContact CG-CE1 3.97Å; E115-Y166 WeakPolarHBondContact OE2-CE1 3.47Å; E115-Y166 PolarHBondContact OE2-OH 3.21Å; E115-Y166 VanDerWaalsContact OE2-OH 3.11Å; E115-S202 VanDerWaalsContact OE2-CB 3.24Å; E115-S202 WeakPolarHBondContact OE2-CB 3.31Å; E115-S202 PolarHBondContact OE2-OG 3.42Å
116T95.9Very high94.6Very high4 Ų425.1 Ų25.13%0.02513%0.128CC..Hα-helixtrans-64.8-42.2179.4-54.60000111.8Y112 I113 P114 G118 I119 I120 M163 Y166Y112-T116 WeakPolarHBondContact CE2-OG1 3.39Å; Y112-T116 WeakPolarHBondContact O-CB 3.35Å; Y112-T116 PolarHBondContact O-N 2.93Å; Y112-T116 PolarHBondContact O-OG1 3.33Å; I113-T116 PolarHBondContact O-N 2.77Å; P114-T116 PolarHBondContact O-N 3.47Å; T116-G118 VanDerWaalsContact C-N 3.32Å; T116-G118 PolarHBondContact O-N 3.3Å; T116-I119 WeakPolarHBondContact O-CG2 3.41Å; T116-I120 HydrophobicContact CG2-CD1 3.82Å; T116-I120 WeakPolarHBondContact O-CB 3.49Å; T116-I120 WeakPolarHBondContact O-CD1 3.5Å; T116-I120 WeakPolarHBondContact O-CG1 3.22Å; T116-I120 PolarHBondContact O-N 2.94Å; T116-I120 VanDerWaalsContact O-N 3.14Å; T116-M163 HydrophobicContact CG2-CB 4.42Å; T116-M163 HydrophobicContact CG2-CG 3.94Å; T116-M163 HydrophobicContact CG2-SD 3.59Å; T116-M163 VanDerWaalsContact CG2-SD 3.59Å; T116-Y166 WeakPolarHBondContact OG1-CB 3.4Å
117S95.7Very high94.7Very high7 Ų724 Ų245%0.04912%0.122CC..Hα-helixtrans-65.5-3717570.10000112.1I113 P114 I120 S121I113-S117 WeakPolarHBondContact O-CB 3.5Å; I113-S117 PolarHBondContact O-N 2.88Å; I113-S117 PolarHBondContact O-OG 2.94Å; P114-S117 PolarHBondContact O-N 3.33Å; P114-S117 PolarHBondContact O-OG 3.39Å; S117-I120 PolarHBondContact O-N 3.3Å; S117-S121 WeakPolarHBondContact O-CB 3.36Å; S117-S121 PolarHBondContact O-N 3.2Å; S117-S121 PolarHBondContact O-OG 2.87Å
118G93.7Very high94.6Very high7 Ų724 Ų247%0.07212%0.122CC..Hα-helixtrans-64.6-45.8177.500000113.1P114 E115 T116 S121 T122P114-G118 PolarHBondContact O-N 2.93Å; E115-G118 PolarHBondContact O-N 2.94Å; T116-G118 VanDerWaalsContact C-N 3.32Å; T116-G118 PolarHBondContact O-N 3.3Å; G118-S121 PolarHBondContact O-OG 2.95Å; G118-T122 VanDerWaalsContact O-CG2 3.31Å; G118-T122 WeakPolarHBondContact O-CG2 3.27Å; G118-T122 PolarHBondContact O-N 2.93Å; G118-T122 PolarHBondContact O-OG1 3.3Å
119I94.4Very high94.5Very high6 Ų621.1 Ų21.13%0.03111%0.11CC..Hα-helixtrans-70.1-34.4177.3-165.7166.3000112.4E115 T116 T122 N123 L165 Y166 L201 A206E115-I119 PolarHBondContact O-N 3.46Å; T116-I119 WeakPolarHBondContact O-CG2 3.41Å; I119-T122 PolarHBondContact O-OG1 2.89Å; I119-N123 WeakPolarHBondContact CG1-ND2 3.34Å; I119-N123 VanDerWaalsContact O-CB 3.28Å; I119-N123 WeakPolarHBondContact O-CB 3.46Å; I119-N123 PolarHBondContact O-N 3.42Å; I119-N123 PolarHBondContact O-ND2 3.28Å; I119-L165 HydrophobicContact CD1-CD1 4.15Å; I119-Y166 HydrophobicContact CB-CD2 4.34Å; I119-Y166 HydrophobicContact CB-CE2 3.66Å; I119-Y166 HydrophobicContact CD1-CD2 4.41Å; I119-Y166 HydrophobicContact CD1-CE2 3.71Å; I119-Y166 HydrophobicContact CG1-CE2 4.26Å; I119-Y166 HydrophobicContact CG2-CD2 3.64Å; I119-Y166 HydrophobicContact CG2-CE2 3.48Å; I119-Y166 VanDerWaalsContact CG2-CE2 3.48Å; I119-L201 HydrophobicContact CD1-CD1 3.84Å; I119-L201 HydrophobicContact CD1-CG 4.15Å; I119-A206 HydrophobicContact CB-CB 4.04Å; I119-A206 HydrophobicContact CG1-CB 4.17Å
120I96.2Very high94.4Very high6 Ų620.6 Ų20.63%0.03111%0.11CC..Hα-helixtrans-66.9-47.5177.1-70.3168.6000110.1A68 T116 S117 T122 N123 V124 Y159A68-I120 HydrophobicContact CB-CB 4.39Å; A68-I120 HydrophobicContact CB-CG2 3.97Å; T116-I120 HydrophobicContact CG2-CD1 3.82Å; T116-I120 WeakPolarHBondContact O-CB 3.49Å; T116-I120 WeakPolarHBondContact O-CD1 3.5Å; T116-I120 WeakPolarHBondContact O-CG1 3.22Å; T116-I120 PolarHBondContact O-N 2.94Å; T116-I120 VanDerWaalsContact O-N 3.14Å; S117-I120 PolarHBondContact O-N 3.3Å; I120-T122 PolarHBondContact O-N 3.41Å; I120-N123 PolarHBondContact O-N 3.21Å; I120-V124 HydrophobicContact CG2-CG2 4.29Å; I120-V124 WeakPolarHBondContact O-CB 3.33Å; I120-V124 VanDerWaalsContact O-CG2 3.28Å; I120-V124 WeakPolarHBondContact O-CG2 3.49Å; I120-V124 PolarHBondContact O-N 2.86Å; I120-Y159 HydrophobicContact CD1-CD1 3.89Å; I120-Y159 HydrophobicContact CD1-CE1 4.31Å; I120-Y159 HydrophobicContact CD1-CG 4.15Å; I120-Y159 HydrophobicContact CG2-CD1 4.17Å; I120-Y159 HydrophobicContact CG2-CD2 3.57Å; I120-Y159 HydrophobicContact CG2-CE1 3.98Å; I120-Y159 HydrophobicContact CG2-CE2 3.36Å; I120-Y159 HydrophobicContact CG2-CG 3.98Å
121S95.2Very high94.3Very high2 Ų219.3 Ų19.31%0.01411%0.105CC..Hα-helixtrans-60.4-45179.366.40000111.4S117 G118 L125S117-S121 WeakPolarHBondContact O-CB 3.36Å; S117-S121 PolarHBondContact O-N 3.2Å; S117-S121 PolarHBondContact O-OG 2.87Å; G118-S121 PolarHBondContact O-OG 2.95Å; S121-L125 VanDerWaalsContact O-CB 3.32Å; S121-L125 WeakPolarHBondContact O-CB 3.3Å; S121-L125 PolarHBondContact O-N 2.88Å
122T93.9Very high94.2Very high1 Ų117.7 Ų17.71%0.0069%0.094CC..Hα-helixtrans-72.6-36.2-178.865.70000113.4G118 I119 I120 L125 V126 A206 F261G118-T122 VanDerWaalsContact O-CG2 3.31Å; G118-T122 WeakPolarHBondContact O-CG2 3.27Å; G118-T122 PolarHBondContact O-N 2.93Å; G118-T122 PolarHBondContact O-OG1 3.3Å; I119-T122 PolarHBondContact O-OG1 2.89Å; I120-T122 PolarHBondContact O-N 3.41Å; T122-L125 PolarHBondContact O-N 3.41Å; T122-V126 WeakPolarHBondContact O-CG2 3.48Å; T122-V126 PolarHBondContact O-N 2.89Å; T122-A206 WeakPolarHBondContact CB-O 3.46Å; T122-A206 VanDerWaalsContact CG2-O 3.28Å; T122-A206 WeakPolarHBondContact CG2-O 3.13Å; T122-A206 PolarHBondContact OG1-O 2.97Å; T122-A206 VanDerWaalsContact OG1-O 3.06Å; T122-F261 HydrophobicContact CG2-CE2 3.68Å; T122-F261 HydrophobicContact CG2-CZ 3.77Å
123N94.5Very high94Very high52 Ų5218.2 Ų18.228%0.27810%0.098SC..Hα-helixtrans-75.9-34.7177.5-79.2-91000113.1I119 I120 L125 V126 L127 I158I119-N123 WeakPolarHBondContact CG1-ND2 3.34Å; I119-N123 VanDerWaalsContact O-CB 3.28Å; I119-N123 WeakPolarHBondContact O-CB 3.46Å; I119-N123 PolarHBondContact O-N 3.42Å; I119-N123 PolarHBondContact O-ND2 3.28Å; I120-N123 PolarHBondContact O-N 3.21Å; N123-L125 VanDerWaalsContact C-N 3.31Å; N123-V126 PolarHBondContact O-N 3.35Å; N123-L127 WeakPolarHBondContact O-CB 3.23Å; N123-L127 PolarHBondContact O-N 2.93Å; N123-I158 HydrophobicContact CB-CG2 3.75Å
124V96.1Very high93.7Very high0 Ų020 Ų200%011%0.107CC..Hα-helixtrans-67-35.8170.6-177.80000110.5Y61 I65 I120 L127 F128 I155 I158Y61-V124 HydrophobicContact CD1-CG1 4.16Å; I65-V124 HydrophobicContact CD1-CG1 4.2Å; I65-V124 HydrophobicContact CG1-CB 3.84Å; I65-V124 HydrophobicContact CG1-CG1 3.56Å; I120-V124 HydrophobicContact CG2-CG2 4.29Å; I120-V124 WeakPolarHBondContact O-CB 3.33Å; I120-V124 VanDerWaalsContact O-CG2 3.28Å; I120-V124 WeakPolarHBondContact O-CG2 3.49Å; I120-V124 PolarHBondContact O-N 2.86Å; V124-L127 PolarHBondContact O-N 2.84Å; V124-F128 VanDerWaalsContact O-CB 3.22Å; V124-F128 WeakPolarHBondContact O-CB 3.42Å; V124-F128 PolarHBondContact O-N 3.49Å; V124-I155 HydrophobicContact CG1-CG1 4.13Å; V124-I155 HydrophobicContact CG2-CG2 4.38Å; V124-I158 HydrophobicContact CG2-CB 4.13Å; V124-I158 HydrophobicContact CG2-CD1 4.09Å; V124-I158 HydrophobicContact CG2-CG2 3.76Å
125L94Very high93.5Very high5 Ų519.6 Ų19.63%0.02610%0.104CC..Hα-helixtrans-63.3-39.9171.9-18060.4000112.6I65 S121 T122 N123 F128 S129 M257 T258 F261I65-L125 HydrophobicContact CD1-CB 4.19Å; I65-L125 HydrophobicContact CD1-CD1 4.28Å; S121-L125 VanDerWaalsContact O-CB 3.32Å; S121-L125 WeakPolarHBondContact O-CB 3.3Å; S121-L125 PolarHBondContact O-N 2.88Å; T122-L125 PolarHBondContact O-N 3.41Å; N123-L125 VanDerWaalsContact C-N 3.31Å; L125-F128 HydrophobicContact CD1-CD1 4.47Å; L125-F128 PolarHBondContact O-N 3.42Å; L125-S129 WeakPolarHBondContact O-CB 3.5Å; L125-S129 PolarHBondContact O-N 3.21Å; L125-S129 PolarHBondContact O-OG 2.89Å; L125-M257 HydrophobicContact CD1-CE 4.06Å; L125-M257 HydrophobicContact CD1-CG 4.37Å; L125-M257 HydrophobicContact CD1-SD 3.89Å; L125-T258 HydrophobicContact CD1-CG2 4.01Å; L125-F261 HydrophobicContact CD2-CB 4.21Å; L125-F261 HydrophobicContact CD2-CD1 3.99Å; L125-F261 HydrophobicContact CD2-CD2 4.01Å; L125-F261 HydrophobicContact CD2-CE1 4.37Å; L125-F261 HydrophobicContact CD2-CE2 4.41Å; L125-F261 HydrophobicContact CD2-CG 3.8Å
126V93.5Very high93.2Very high21 Ų2116.9 Ų16.913%0.1279%0.093CC..Hα-helixtrans-62.9-49.1173.41630000111.5T122 N123 F128 S129 I130 P210 V213T122-V126 WeakPolarHBondContact O-CG2 3.48Å; T122-V126 PolarHBondContact O-N 2.89Å; N123-V126 PolarHBondContact O-N 3.35Å; V126-F128 VanDerWaalsContact C-N 3.28Å; V126-F128 PolarHBondContact O-N 2.91Å; V126-S129 WeakPolarHBondContact O-CB 3.35Å; V126-S129 PolarHBondContact O-N 2.78Å; V126-S129 VanDerWaalsContact O-N 3.12Å; V126-I130 HydrophobicContact CG1-CD1 4.03Å; V126-I130 WeakPolarHBondContact O-CG1 3.28Å; V126-I130 PolarHBondContact O-N 2.89Å; V126-P210 HydrophobicContact CG2-CB 3.7Å; V126-P210 HydrophobicContact CG2-CG 4.23Å; V126-V213 HydrophobicContact CG1-CB 4.49Å; V126-V213 HydrophobicContact CG1-CG1 3.94Å; V126-V213 HydrophobicContact CG2-CB 4.24Å; V126-V213 HydrophobicContact CG2-CG1 4.32Å
127L95Very high92.9Very high39 Ų3921.3 Ų21.320%0.20411%0.112CC..Hα-helixtrans-58.2-43.1176.4175.563.2000111.2Y61 N123 V124 S129 I130 D131 I158Y61-L127 HydrophobicContact CE1-CD2 3.72Å; Y61-L127 HydrophobicContact CE1-CG 3.82Å; N123-L127 WeakPolarHBondContact O-CB 3.23Å; N123-L127 PolarHBondContact O-N 2.93Å; V124-L127 PolarHBondContact O-N 2.84Å; L127-S129 VanDerWaalsContact C-N 3.35Å; L127-I130 PolarHBondContact O-N 2.89Å; L127-D131 WeakPolarHBondContact O-CB 3.33Å; L127-D131 PolarHBondContact O-N 3.06Å; L127-I158 HydrophobicContact CB-CD1 3.91Å; L127-I158 HydrophobicContact CD2-CD1 3.59Å; L127-I158 HydrophobicContact CG-CD1 4.36Å
128F94.5Very high92.5Very high0 Ų026 Ų260%013%0.132CC..Hα-helixtrans-63.7-39.6176.3-177.8-152.7000111.8F58 Y61 I62 I65 V124 L125 V126 I130 D131 R132 H254F58-F128 AromaticContact CD2-CE2 3.8Å; F58-F128 HydrophobicContact CD2-CE2 3.8Å; F58-F128 AromaticContact CD2-CZ 3.53Å; F58-F128 HydrophobicContact CD2-CZ 3.53Å; F58-F128 HydrophobicContact CE2-CE2 4.28Å; F58-F128 AromaticContact CE2-CZ 3.56Å; F58-F128 HydrophobicContact CE2-CZ 3.56Å; F58-F128 HydrophobicContact CG-CE2 4.44Å; F58-F128 HydrophobicContact CG-CZ 4.27Å; F58-F128 HydrophobicContact CZ-CZ 4.28Å; Y61-F128 HydrophobicContact CD1-CB 4.17Å; Y61-F128 HydrophobicContact CD2-CB 4.26Å; Y61-F128 AromaticContact CD2-CD2 3.39Å; Y61-F128 HydrophobicContact CD2-CD2 3.39Å; Y61-F128 AromaticContact CD2-CE2 3.98Å; Y61-F128 HydrophobicContact CD2-CE2 3.98Å; Y61-F128 HydrophobicContact CD2-CG 4.03Å; Y61-F128 HydrophobicContact CE2-CD2 4.14Å; Y61-F128 HydrophobicContact CG-CB 3.89Å; Y61-F128 AromaticContact CG-CD2 3.75Å; Y61-F128 HydrophobicContact CG-CD2 3.75Å; Y61-F128 HydrophobicContact CG-CE2 4.49Å; Y61-F128 AromaticContact CG-CG 3.9Å; Y61-F128 HydrophobicContact CG-CG 3.9Å; I62-F128 HydrophobicContact CD1-CD1 4.23Å; I62-F128 HydrophobicContact CD1-CE1 3.36Å; I62-F128 HydrophobicContact CD1-CZ 3.86Å; I62-F128 HydrophobicContact CG1-CE1 4.49Å; I65-F128 HydrophobicContact CD1-CD1 3.86Å; V124-F128 VanDerWaalsContact O-CB 3.22Å; V124-F128 WeakPolarHBondContact O-CB 3.42Å; V124-F128 PolarHBondContact O-N 3.49Å; L125-F128 HydrophobicContact CD1-CD1 4.47Å; L125-F128 PolarHBondContact O-N 3.42Å; V126-F128 VanDerWaalsContact C-N 3.28Å; V126-F128 PolarHBondContact O-N 2.91Å; F128-I130 PolarHBondContact O-N 3.37Å; F128-D131 WeakPolarHBondContact O-CB 3.28Å; F128-D131 PolarHBondContact O-N 2.95Å; F128-R132 HydrophobicContact CD2-CG 4.09Å; F128-R132 HydrophobicContact CE2-CG 3.94Å; F128-R132 WeakPolarHBondContact O-CG 3.36Å; F128-R132 PolarHBondContact O-N 2.85Å; F128-H254 AromaticContact CD1-CD2 3.56Å; F128-H254 HydrophobicContact CE1-CB 4.49Å; F128-H254 AromaticContact CE1-CD2 3.49Å; F128-H254 VanDerWaalsContact CE1-CD2 3.49Å; F128-H254 WeakPolarHBondContact CE1-CD2 3.31Å; F128-H254 AromaticContact CG-CD2 3.98Å; F128-H254 HydrophobicContact CZ-CB 4.37Å; F128-H254 AromaticContact CZ-CD2 3.86Å
129S92.6Very high91.9Very high0 Ų029.5 Ų29.50%015%0.154CC..Hα-helixtrans-61.9-43.1174.8-60.40000112.6L125 V126 L127 R132 I133 H254L125-S129 WeakPolarHBondContact O-CB 3.5Å; L125-S129 PolarHBondContact O-N 3.21Å; L125-S129 PolarHBondContact O-OG 2.89Å; V126-S129 WeakPolarHBondContact O-CB 3.35Å; V126-S129 PolarHBondContact O-N 2.78Å; V126-S129 VanDerWaalsContact O-N 3.12Å; L127-S129 VanDerWaalsContact C-N 3.35Å; S129-R132 PolarHBondContact O-N 3.5Å; S129-I133 PolarHBondContact O-N 2.94Å; S129-H254 WeakPolarHBondContact CA-NE2 3.22Å; S129-H254 PolarHBondContact OG-CE1 2.84Å; S129-H254 PolarHBondContact OG-NE2 3.28Å; S129-H254 VanDerWaalsContact OG-NE2 3.16Å
130I92.5Very high91.3Very high79 Ų7936.1 Ų36.141%0.40519%0.188SC..Hα-helixtrans-63.3-44.5174.6-64.9164.7000110.3V126 L127 F128 R132 I133 L134V126-I130 HydrophobicContact CG1-CD1 4.03Å; V126-I130 WeakPolarHBondContact O-CG1 3.28Å; V126-I130 PolarHBondContact O-N 2.89Å; L127-I130 PolarHBondContact O-N 2.89Å; F128-I130 PolarHBondContact O-N 3.37Å; I130-R132 VanDerWaalsContact C-N 3.3Å; I130-R132 PolarHBondContact O-N 3.26Å; I130-I133 WeakPolarHBondContact O-CB 3.21Å; I130-I133 PolarHBondContact O-N 3.2Å; I130-I133 VanDerWaalsContact O-N 3.16Å; I130-L134 HydrophobicContact CG2-CD1 4.33Å; I130-L134 WeakPolarHBondContact O-CG 3.4Å; I130-L134 PolarHBondContact O-N 2.88Å
131D92.6Very high90.7Very high6 Ų644 Ų443%0.03222%0.217CC..Hα-helixtrans-59.4-38.5175.7-175.5104.1000112.6R57 Y61 L127 F128 L134 T135R57-D131 IonicContact CZ-OD1 3.82Å; R57-D131 IonicContact CZ-OD2 3.6Å; R57-D131 IonicContact NE-OD1 3.26Å; R57-D131 IonicContact NH1-OD1 3.19Å; R57-D131 PolarHBondContact NH1-OD1 3.44Å; R57-D131 IonicContact NH1-OD2 3.4Å; Y61-D131 HydrophobicContact CE2-CB 3.8Å; Y61-D131 WeakPolarHBondContact CE2-OD1 3.32Å; Y61-D131 PolarHBondContact OH-OD1 3.32Å; L127-D131 WeakPolarHBondContact O-CB 3.33Å; L127-D131 PolarHBondContact O-N 3.06Å; F128-D131 WeakPolarHBondContact O-CB 3.28Å; F128-D131 PolarHBondContact O-N 2.95Å; D131-L134 PolarHBondContact O-N 3.36Å; D131-T135 WeakPolarHBondContact O-CB 3.44Å; D131-T135 PolarHBondContact O-N 2.98Å; D131-T135 PolarHBondContact O-OG1 2.96Å
132R90.5Very high90.2Very high0 Ų045.8 Ų45.80%023%0.225CC..Hα-helixtrans-66.2-42.3173-68.2-53.685.3-1772.2112.3F128 S129 I130 T135 V136 I221 E247 H254F128-R132 HydrophobicContact CD2-CG 4.09Å; F128-R132 HydrophobicContact CE2-CG 3.94Å; F128-R132 WeakPolarHBondContact O-CG 3.36Å; F128-R132 PolarHBondContact O-N 2.85Å; S129-R132 PolarHBondContact O-N 3.5Å; I130-R132 VanDerWaalsContact C-N 3.3Å; I130-R132 PolarHBondContact O-N 3.26Å; R132-T135 PolarHBondContact O-N 3.02Å; R132-V136 WeakPolarHBondContact O-CB 3.49Å; R132-V136 VanDerWaalsContact O-CG2 3.31Å; R132-V136 WeakPolarHBondContact O-CG2 3.44Å; R132-V136 PolarHBondContact O-N 3.32Å; R132-I221 HydrophobicContact CB-CD1 3.86Å; R132-E247 IonicContact NH1-OE2 3.96Å; R132-H254 HydrophobicContact CG-CB 4.2Å
133I90.8Very high89.6Confident35 Ų3552.3 Ų52.318%0.17925%0.249CC..Hα-helixtrans-56-54.1172.7-71177.5000109.9S129 I130 T135 V136 F137 T217 I220 I221S129-I133 PolarHBondContact O-N 2.94Å; I130-I133 WeakPolarHBondContact O-CB 3.21Å; I130-I133 PolarHBondContact O-N 3.2Å; I130-I133 VanDerWaalsContact O-N 3.16Å; I133-T135 VanDerWaalsContact C-N 3.25Å; I133-T135 PolarHBondContact O-N 3.23Å; I133-V136 PolarHBondContact O-N 2.94Å; I133-F137 HydrophobicContact CG2-CD2 3.73Å; I133-F137 HydrophobicContact CG2-CE2 3.92Å; I133-F137 WeakPolarHBondContact O-CD2 3.32Å; I133-F137 PolarHBondContact O-N 3.41Å; I133-T217 HydrophobicContact CD1-CG2 3.44Å; I133-T217 VanDerWaalsContact CD1-CG2 3.44Å; I133-T217 HydrophobicContact CG1-CG2 4.24Å; I133-I220 HydrophobicContact CD1-CD1 4.23Å; I133-I220 HydrophobicContact CD1-CG2 4.26Å; I133-I220 HydrophobicContact CG1-CG2 4.25Å; I133-I221 HydrophobicContact CG1-CD1 4.43Å; I133-I221 HydrophobicContact CG1-CG1 4.24Å
134L91Very high88.9Confident64 Ų6450 Ų5034%0.33524%0.238SC..Hα-helixtrans-57.7-39.4-179.1-66.2172.8000112.3I130 D131 H138 F142I130-L134 HydrophobicContact CG2-CD1 4.33Å; I130-L134 WeakPolarHBondContact O-CG 3.4Å; I130-L134 PolarHBondContact O-N 2.88Å; D131-L134 PolarHBondContact O-N 3.36Å; L134-H138 PolarHBondContact O-N 2.91Å; L134-F142 HydrophobicContact CB-CB 4.49Å; L134-F142 HydrophobicContact CB-CD1 4.04Å; L134-F142 HydrophobicContact CB-CD2 4.11Å; L134-F142 HydrophobicContact CB-CE1 4.23Å; L134-F142 HydrophobicContact CB-CE2 4.29Å; L134-F142 HydrophobicContact CB-CG 3.96Å; L134-F142 HydrophobicContact CB-CZ 4.34Å; L134-F142 HydrophobicContact CD1-CD1 4.42Å; L134-F142 HydrophobicContact CD1-CE1 3.95Å; L134-F142 HydrophobicContact CD1-CZ 4.2Å; L134-F142 HydrophobicContact CD2-CE2 4.38Å; L134-F142 HydrophobicContact CD2-CZ 4.29Å
135T88.7Confident88.3Confident10 Ų1053.7 Ų53.76%0.06126%0.258CS..Hα-helixtrans-65.8-37.8175.8-55.10000112.4D131 R132 I133 P139 F142D131-T135 WeakPolarHBondContact O-CB 3.44Å; D131-T135 PolarHBondContact O-N 2.98Å; D131-T135 PolarHBondContact O-OG1 2.96Å; R132-T135 PolarHBondContact O-N 3.02Å; I133-T135 VanDerWaalsContact C-N 3.25Å; I133-T135 PolarHBondContact O-N 3.23Å; T135-P139 VanDerWaalsContact O-CA 3.22Å; T135-P139 WeakPolarHBondContact O-CA 3.34Å; T135-F142 PolarHBondContact OG1-O 2.83Å
136V86.9Confident87.9Confident11 Ų1159.7 Ų59.77%0.06728%0.28CS..Hα-helixtrans-76.9-34.7-179.6168.70000112.7R132 I133 K224 L228 I251R132-V136 WeakPolarHBondContact O-CB 3.49Å; R132-V136 VanDerWaalsContact O-CG2 3.31Å; R132-V136 WeakPolarHBondContact O-CG2 3.44Å; R132-V136 PolarHBondContact O-N 3.32Å; I133-V136 PolarHBondContact O-N 2.94Å; V136-K224 HydrophobicContact CG1-CB 3.96Å; V136-K224 HydrophobicContact CG1-CG 3.49Å; V136-K224 VanDerWaalsContact CG1-CG 3.49Å; V136-L228 HydrophobicContact CG1-CD1 4.45Å; V136-I251 HydrophobicContact CG2-CD1 3.68Å; V136-I251 HydrophobicContact CG2-CG1 4.14Å; V136-I251 HydrophobicContact CG2-CG2 4.45Å
137F88.1Confident87.7Confident97 Ų9763.4 Ų63.443%0.42530%0.296SS..Hα-helixtrans-79.1-35.5176.2-82.5-94.7000113.1I133 I220I133-F137 HydrophobicContact CG2-CD2 3.73Å; I133-F137 HydrophobicContact CG2-CE2 3.92Å; I133-F137 WeakPolarHBondContact O-CD2 3.32Å; I133-F137 PolarHBondContact O-N 3.41Å; F137-I220 HydrophobicContact CE2-CG2 3.55Å; F137-I220 HydrophobicContact CZ-CG2 4Å
138H87.4Confident87.6Confident105 Ų10563.3 Ų63.349%0.48630%0.295SS..  trans-134.964.9-173.5-62.5-55000112.1L134 I140 R141 F142L134-H138 PolarHBondContact O-N 2.91Å; H138-I140 VanDerWaalsContact C-N 3.27Å; H138-I140 PolarHBondContact O-N 2.99Å; H138-I140 VanDerWaalsContact O-N 3.15Å; H138-R141 HydrophobicContact CB-CB 4.22Å; H138-R141 PolarHBondContact O-N 2.85Å; H138-R141 VanDerWaalsContact O-N 3.1Å; H138-F142 HydrophobicContact CB-CD2 3.86Å; H138-F142 HydrophobicContact CB-CE2 4.38Å; H138-F142 PolarHBondContact O-N 3.43Å
139P82.6Confident87.6Confident81 Ų8172.4 Ų72.453%0.52633%0.331SS..THydrogen-bonded Turntrans-61-29.3-170.623.1-34.8000114.6T135 R143T135-P139 VanDerWaalsContact O-CA 3.22Å; T135-P139 WeakPolarHBondContact O-CA 3.34Å; P139-R143 WeakPolarHBondContact O-CA 3.29Å; P139-R143 PolarHBondContact O-N 3.13Å
140I81.9Confident87.7Confident145 Ų14577.1 Ų77.174%0.74436%0.355SS*.THydrogen-bonded Turntrans-74.4-42.2177.7-58.8171.8000111.1H138H138-I140 VanDerWaalsContact C-N 3.27Å; H138-I140 PolarHBondContact O-N 2.99Å; H138-I140 VanDerWaalsContact O-N 3.15Å
141R82.9Confident87.8Confident172 Ų17273.4 Ų73.465%0.64934%0.337SS*.THydrogen-bonded Turntrans-73.8-45.3-178.8-173.2174.3-179.51721.5111H138H138-R141 HydrophobicContact CB-CB 4.22Å; H138-R141 PolarHBondContact O-N 2.85Å; H138-R141 VanDerWaalsContact O-N 3.1Å
142F83.8Confident87.9Confident38 Ų3875.9 Ų75.917%0.16735%0.354CS..THydrogen-bonded Turntrans-103.641.4-177.3-67.5-87000112.4R57 L134 T135 H138R57-F142 VanDerWaalsContact NH2-C 3.3Å; R57-F142 PolarHBondContact NH2-O 3.36Å; L134-F142 HydrophobicContact CB-CB 4.49Å; L134-F142 HydrophobicContact CB-CD1 4.04Å; L134-F142 HydrophobicContact CB-CD2 4.11Å; L134-F142 HydrophobicContact CB-CE1 4.23Å; L134-F142 HydrophobicContact CB-CE2 4.29Å; L134-F142 HydrophobicContact CB-CG 3.96Å; L134-F142 HydrophobicContact CB-CZ 4.34Å; L134-F142 HydrophobicContact CD1-CD1 4.42Å; L134-F142 HydrophobicContact CD1-CE1 3.95Å; L134-F142 HydrophobicContact CD1-CZ 4.2Å; L134-F142 HydrophobicContact CD2-CE2 4.38Å; L134-F142 HydrophobicContact CD2-CZ 4.29Å; T135-F142 PolarHBondContact OG1-O 2.83Å; H138-F142 HydrophobicContact CB-CD2 3.86Å; H138-F142 HydrophobicContact CB-CE2 4.38Å; H138-F142 PolarHBondContact O-N 3.43Å
143R82.3Confident88.3Confident138 Ų13881 Ų8152%0.52138%0.376SS..  trans-56.9146.6170.2-163.9176.3142.1137.2-3.2110.4R57 P139 D145 R146R57-R143 PolarHBondContact NH2-O 2.98Å; P139-R143 WeakPolarHBondContact O-CA 3.29Å; P139-R143 PolarHBondContact O-N 3.13Å; R143-D145 WeakPolarHBondContact CB-OD1 3.5Å; R143-D145 WeakPolarHBondContact CD-OD1 3.46Å; R143-D145 WeakPolarHBondContact CG-OD1 3.28Å; R143-D145 IonicContact CZ-OD2 3.76Å; R143-D145 VanDerWaalsContact CZ-OD2 3.26Å; R143-D145 VanDerWaalsContact NE-CG 3.34Å; R143-D145 IonicContact NE-OD1 2.73Å; R143-D145 PolarHBondContact NE-OD1 3.47Å; R143-D145 IonicContact NE-OD2 3.4Å; R143-D145 PolarHBondContact NE-OD2 3.02Å; R143-D145 IonicContact NH2-OD2 2.91Å; R143-D145 PolarHBondContact NH2-OD2 2.79Å; R143-D145 PolarHBondContact O-N 3.38Å; R143-D145 VanDerWaalsContact O-N 3.14Å; R143-R146 PolarHBondContact O-N 3.13Å; R143-R146 VanDerWaalsContact O-N 3.11Å
144G79.3Confident88.5Confident4 Ų480.9 Ų80.94%0.04138%0.379CS..THydrogen-bonded Turntrans-63.2-21.2-169.600000115.4C56 R57C56-G144 VanDerWaalsContact CA-O 3.32Å; C56-G144 WeakPolarHBondContact CA-O 3.39Å; R57-G144 PolarHBondContact N-O 3.11Å
145D82.9Confident88.8Confident77 Ų7778.6 Ų78.641%0.41237%0.366SS..THydrogen-bonded Turntrans-89.6-2.6179.151.59.5000114.1R143 L148R143-D145 WeakPolarHBondContact CB-OD1 3.5Å; R143-D145 WeakPolarHBondContact CD-OD1 3.46Å; R143-D145 WeakPolarHBondContact CG-OD1 3.28Å; R143-D145 IonicContact CZ-OD2 3.76Å; R143-D145 VanDerWaalsContact CZ-OD2 3.26Å; R143-D145 VanDerWaalsContact NE-CG 3.34Å; R143-D145 IonicContact NE-OD1 2.73Å; R143-D145 PolarHBondContact NE-OD1 3.47Å; R143-D145 IonicContact NE-OD2 3.4Å; R143-D145 PolarHBondContact NE-OD2 3.02Å; R143-D145 IonicContact NH2-OD2 2.91Å; R143-D145 PolarHBondContact NH2-OD2 2.79Å; R143-D145 PolarHBondContact O-N 3.38Å; R143-D145 VanDerWaalsContact O-N 3.14Å; D145-L148 WeakPolarHBondContact O-CD1 3.4Å
146R86Confident89.3Confident131 Ų13182.9 Ų82.949%0.49439%0.389SS..SBendtrans-96.7156.2174.3-66.9-176.1170.4-171.7-4.8111.7R57 R143 L148R57-R146 WeakPolarHBondContact CD-O 3.27Å; R57-R146 WeakPolarHBondContact CG-O 3.48Å; R57-R146 PolarHBondContact NE-O 2.74Å; R143-R146 PolarHBondContact O-N 3.13Å; R143-R146 VanDerWaalsContact O-N 3.11Å; R146-L148 VanDerWaalsContact C-N 3.28Å; R146-L148 PolarHBondContact O-N 3.39Å
147H90.2Very high89.8Confident99 Ų9983.9 Ų83.946%0.45840%0.396SS..SBendtrans56.131.6174.5-54.4-74.7000115.4Y149 L150 A151H147-Y149 PolarHBondContact O-N 2.99Å; H147-L150 HydrophobicContact CB-CB 4.28Å; H147-L150 PolarHBondContact O-N 3.01Å; H147-A151 PolarHBondContact O-N 2.93Å
148L92Very high90.2Very high38 Ų3880.8 Ų80.820%0.19938%0.384CS..Hα-helixtrans-60-43.9179.1-90.276.2000113.2P55 R57 D145 R146 L150 A151 C152P55-L148 HydrophobicContact CB-CD2 3.34Å; R57-L148 HydrophobicContact CG-CD1 4.2Å; R57-L148 HydrophobicContact CG-CG 4.34Å; D145-L148 WeakPolarHBondContact O-CD1 3.4Å; R146-L148 VanDerWaalsContact C-N 3.28Å; R146-L148 PolarHBondContact O-N 3.39Å; L148-L150 VanDerWaalsContact C-N 3.31Å; L148-L150 PolarHBondContact O-N 3.45Å; L148-A151 PolarHBondContact O-N 3.43Å; L148-C152 PolarHBondContact O-N 3.46Å; L148-C152 PolarHBondContact O-SG 3.31Å; L148-C152 VanDerWaalsContact O-SG 3.4Å
149Y93.8Very high90.7Very high191 Ų19178.5 Ų78.575%0.74937%0.371SS*.Hα-helixtrans-59.2-44.3178.2-178.1-94.7000111.4H147 A151 C152 F153H147-Y149 PolarHBondContact O-N 2.99Å; Y149-A151 PolarHBondContact O-N 2.94Å; Y149-C152 PolarHBondContact O-N 3.03Å; Y149-F153 VanDerWaalsContact O-CB 3.29Å; Y149-F153 WeakPolarHBondContact O-CB 3.17Å; Y149-F153 PolarHBondContact O-N 3.18Å
150L94.7Very high91.4Very high98 Ų9879 Ų7951%0.51337%0.368SS..Hα-helixtrans-61.6-43.9176-178.862.9000111.7H147 L148 F153 S154H147-L150 HydrophobicContact CB-CB 4.28Å; H147-L150 PolarHBondContact O-N 3.01Å; L148-L150 VanDerWaalsContact C-N 3.31Å; L148-L150 PolarHBondContact O-N 3.45Å; L150-F153 PolarHBondContact O-N 3.4Å; L150-S154 WeakPolarHBondContact O-CB 3.32Å; L150-S154 PolarHBondContact O-N 2.66Å; L150-S154 PolarHBondContact O-OG 3.02Å; L150-S154 VanDerWaalsContact O-OG 3.05Å
151A94.8Very high92.2Very high2 Ų276.6 Ų76.62%0.01736%0.356CS..Hα-helixtrans-62.2-45176.600000112.2R57 Y61 H147 L148 Y149 S154 I155R57-A151 HydrophobicContact CB-CB 4.18Å; R57-A151 HydrophobicContact CG-CB 3.74Å; Y61-A151 HydrophobicContact CE1-CB 4.4Å; Y61-A151 HydrophobicContact CE2-CB 4.43Å; H147-A151 PolarHBondContact O-N 2.93Å; L148-A151 PolarHBondContact O-N 3.43Å; Y149-A151 PolarHBondContact O-N 2.94Å; A151-S154 PolarHBondContact O-N 3.15Å; A151-I155 WeakPolarHBondContact O-CD1 3.39Å; A151-I155 VanDerWaalsContact O-CG1 3.24Å; A151-I155 WeakPolarHBondContact O-CG1 3.42Å; A151-I155 PolarHBondContact O-N 3.35Å
152C96.1Very high92.8Very high58 Ų5868.6 Ų68.639%0.39233%0.327SS..Hα-helixtrans-64.3-41176.1-66.80000112.2L148 Y149 I155 L156L148-C152 PolarHBondContact O-N 3.46Å; L148-C152 PolarHBondContact O-SG 3.31Å; L148-C152 VanDerWaalsContact O-SG 3.4Å; Y149-C152 PolarHBondContact O-N 3.03Å; C152-I155 PolarHBondContact O-N 3.07Å; C152-L156 WeakPolarHBondContact O-CB 3.23Å; C152-L156 PolarHBondContact O-N 2.9Å
153F97.2Very high93.3Very high107 Ų10771 Ų7147%0.46934%0.34SS..Hα-helixtrans-61.7-48.6175178.7-96.6000111.1Y149 L150 I155 L156 S157Y149-F153 VanDerWaalsContact O-CB 3.29Å; Y149-F153 WeakPolarHBondContact O-CB 3.17Å; Y149-F153 PolarHBondContact O-N 3.18Å; L150-F153 PolarHBondContact O-N 3.4Å; F153-I155 VanDerWaalsContact C-N 3.34Å; F153-I155 PolarHBondContact O-N 2.53Å; F153-L156 CarbonylContact O-C 3.58Å; F153-L156 WeakPolarHBondContact O-CB 3.28Å; F153-L156 PolarHBondContact O-N 3.03Å; F153-L156 VanDerWaalsContact O-N 3.13Å; F153-S157 WeakPolarHBondContact CE1-OG 3.44Å; F153-S157 PolarHBondContact O-N 2.93Å; F153-S157 PolarHBondContact O-OG 3.15Å
154S96.7Very high94Very high32 Ų3269.6 Ų69.622%0.22434%0.342CS..Hα-helixtrans-62.8-37.2178.2-61.50000113.1L150 A151 S157 I158L150-S154 WeakPolarHBondContact O-CB 3.32Å; L150-S154 PolarHBondContact O-N 2.66Å; L150-S154 PolarHBondContact O-OG 3.02Å; L150-S154 VanDerWaalsContact O-OG 3.05Å; A151-S154 PolarHBondContact O-N 3.15Å; S154-S157 PolarHBondContact O-N 3.39Å; S154-I158 WeakPolarHBondContact O-CG1 3.38Å; S154-I158 PolarHBondContact O-N 3.5Å
155I97.4Very high94.7Very high16 Ų1672 Ų728%0.08235%0.354CS..Hα-helixtrans-61.8-50.2171.6-66.3161.9000109.8Y61 V124 A151 C152 F153 S157 I158 Y159Y61-I155 HydrophobicContact CD1-CD1 3.68Å; Y61-I155 HydrophobicContact CD1-CG1 3.83Å; Y61-I155 HydrophobicContact CE1-CD1 4.09Å; Y61-I155 HydrophobicContact CE1-CG1 4.02Å; Y61-I155 HydrophobicContact CG-CD1 4.41Å; V124-I155 HydrophobicContact CG1-CG1 4.13Å; V124-I155 HydrophobicContact CG2-CG2 4.38Å; A151-I155 WeakPolarHBondContact O-CD1 3.39Å; A151-I155 VanDerWaalsContact O-CG1 3.24Å; A151-I155 WeakPolarHBondContact O-CG1 3.42Å; A151-I155 PolarHBondContact O-N 3.35Å; C152-I155 PolarHBondContact O-N 3.07Å; F153-I155 VanDerWaalsContact C-N 3.34Å; F153-I155 PolarHBondContact O-N 2.53Å; I155-S157 VanDerWaalsContact C-N 3.3Å; I155-S157 PolarHBondContact O-N 3.41Å; I155-I158 PolarHBondContact O-N 2.92Å; I155-I158 VanDerWaalsContact O-N 3.13Å; I155-Y159 HydrophobicContact CG2-CD2 4.01Å; I155-Y159 HydrophobicContact CG2-CE2 3.99Å; I155-Y159 WeakPolarHBondContact O-CD2 3.44Å; I155-Y159 PolarHBondContact O-N 2.94Å
156L97.6Very high95.2Very high101 Ų10168.4 Ų68.453%0.52933%0.334SS..Hα-helixtrans-60.2-39.5178.5-17962.3000112.1C152 F153 Y159 I160C152-L156 WeakPolarHBondContact O-CB 3.23Å; C152-L156 PolarHBondContact O-N 2.9Å; F153-L156 CarbonylContact O-C 3.58Å; F153-L156 WeakPolarHBondContact O-CB 3.28Å; F153-L156 PolarHBondContact O-N 3.03Å; F153-L156 VanDerWaalsContact O-N 3.13Å; L156-Y159 WeakPolarHBondContact O-CB 3.34Å; L156-Y159 PolarHBondContact O-N 3.38Å; L156-I160 HydrophobicContact CD1-CD1 4.27Å; L156-I160 HydrophobicContact CD1-CG1 4.5Å; L156-I160 HydrophobicContact CG-CD1 4.01Å; L156-I160 WeakPolarHBondContact O-CG1 3.44Å; L156-I160 PolarHBondContact O-N 3.19Å
157S97.8Very high95.6Very high32 Ų3266.5 Ų66.522%0.22433%0.333CS..Hα-helixtrans-61.2-43.5174-57.70000111.8F153 S154 I155 Y159 I160 I161F153-S157 WeakPolarHBondContact CE1-OG 3.44Å; F153-S157 PolarHBondContact O-N 2.93Å; F153-S157 PolarHBondContact O-OG 3.15Å; S154-S157 PolarHBondContact O-N 3.39Å; I155-S157 VanDerWaalsContact C-N 3.3Å; I155-S157 PolarHBondContact O-N 3.41Å; S157-Y159 VanDerWaalsContact C-N 3.32Å; S157-Y159 PolarHBondContact O-N 2.99Å; S157-I160 PolarHBondContact O-N 2.87Å; S157-I161 VanDerWaalsContact O-CB 3.29Å; S157-I161 WeakPolarHBondContact O-CB 3.46Å; S157-I161 WeakPolarHBondContact O-CD1 3.13Å; S157-I161 WeakPolarHBondContact O-CG1 3.45Å; S157-I161 PolarHBondContact O-N 3.42Å
158I97.4Very high95.7Very high31 Ų3163.2 Ų63.216%0.15932%0.321CS..Hα-helixtrans-62.8-39.1175.4-69.1165.9000111.2N123 V124 L127 S154 I155 G162N123-I158 HydrophobicContact CB-CG2 3.75Å; V124-I158 HydrophobicContact CG2-CB 4.13Å; V124-I158 HydrophobicContact CG2-CD1 4.09Å; V124-I158 HydrophobicContact CG2-CG2 3.76Å; L127-I158 HydrophobicContact CB-CD1 3.91Å; L127-I158 HydrophobicContact CD2-CD1 3.59Å; L127-I158 HydrophobicContact CG-CD1 4.36Å; S154-I158 WeakPolarHBondContact O-CG1 3.38Å; S154-I158 PolarHBondContact O-N 3.5Å; I155-I158 PolarHBondContact O-N 2.92Å; I155-I158 VanDerWaalsContact O-N 3.13Å; I158-G162 PolarHBondContact O-N 3.4Å
159Y97.9Very high95.7Very high57 Ų5761.6 Ų61.622%0.22431%0.312CS..Hα-helixtrans-60.8-49174.2-92.7-102.9000112.1G64 I67 I120 I155 L156 S157 M163G64-Y159 PolarHBondContact O-OH 2.88Å; I67-Y159 WeakPolarHBondContact CB-OH 3.45Å; I67-Y159 WeakPolarHBondContact CG2-OH 3.28Å; I120-Y159 HydrophobicContact CD1-CD1 3.89Å; I120-Y159 HydrophobicContact CD1-CE1 4.31Å; I120-Y159 HydrophobicContact CD1-CG 4.15Å; I120-Y159 HydrophobicContact CG2-CD1 4.17Å; I120-Y159 HydrophobicContact CG2-CD2 3.57Å; I120-Y159 HydrophobicContact CG2-CE1 3.98Å; I120-Y159 HydrophobicContact CG2-CE2 3.36Å; I120-Y159 HydrophobicContact CG2-CG 3.98Å; I155-Y159 HydrophobicContact CG2-CD2 4.01Å; I155-Y159 HydrophobicContact CG2-CE2 3.99Å; I155-Y159 WeakPolarHBondContact O-CD2 3.44Å; I155-Y159 PolarHBondContact O-N 2.94Å; L156-Y159 WeakPolarHBondContact O-CB 3.34Å; L156-Y159 PolarHBondContact O-N 3.38Å; S157-Y159 VanDerWaalsContact C-N 3.32Å; S157-Y159 PolarHBondContact O-N 2.99Å; Y159-M163 WeakPolarHBondContact O-CG 3.43Å; Y159-M163 PolarHBondContact O-N 3.34Å; Y159-M163 VanDerWaalsContact O-N 3.1Å
160I97.8Very high95.6Very high92 Ų9253.5 Ų53.547%0.47229%0.285SS..Hα-helixtrans-64.5-47.1179.6-66.4166.1000110.8L156 S157 M163 I164L156-I160 HydrophobicContact CD1-CD1 4.27Å; L156-I160 HydrophobicContact CD1-CG1 4.5Å; L156-I160 HydrophobicContact CG-CD1 4.01Å; L156-I160 WeakPolarHBondContact O-CG1 3.44Å; L156-I160 PolarHBondContact O-N 3.19Å; S157-I160 PolarHBondContact O-N 2.87Å; I160-M163 PolarHBondContact O-N 3.41Å; I160-I164 HydrophobicContact CG2-CD1 3.82Å; I160-I164 WeakPolarHBondContact O-CG1 3.46Å; I160-I164 PolarHBondContact O-N 2.91Å
161I96.7Very high95.5Very high94 Ų9453.7 Ų53.748%0.48229%0.286SS..Hα-helixtrans-63.5-45179.3-68.9165.6000110.6S157 M163 I164 L165S157-I161 VanDerWaalsContact O-CB 3.29Å; S157-I161 WeakPolarHBondContact O-CB 3.46Å; S157-I161 WeakPolarHBondContact O-CD1 3.13Å; S157-I161 WeakPolarHBondContact O-CG1 3.45Å; S157-I161 PolarHBondContact O-N 3.42Å; I161-M163 VanDerWaalsContact C-N 3.33Å; I161-M163 PolarHBondContact O-N 3.11Å; I161-I164 PolarHBondContact O-N 3.04Å; I161-I164 VanDerWaalsContact O-N 3.16Å; I161-L165 HydrophobicContact CG2-CD1 3.61Å; I161-L165 HydrophobicContact CG2-CG 4Å; I161-L165 WeakPolarHBondContact O-CB 3.24Å; I161-L165 VanDerWaalsContact O-CG 3.25Å; I161-L165 WeakPolarHBondContact O-CG 3.25Å; I161-L165 PolarHBondContact O-N 3.36Å
162G96Very high95.4Very high4 Ų454.3 Ų54.34%0.04129%0.289CS..Hα-helixtrans-59.1-42.3177.800000112.8I158 L165 Y166I158-G162 PolarHBondContact O-N 3.4Å; G162-L165 PolarHBondContact O-N 2.98Å; G162-Y166 PolarHBondContact O-N 3.05Å
163M95.8Very high95.2Very high89 Ų8951.7 Ų51.744%0.43827%0.271SS..Hα-helixtrans-63-42.6174.4-67-83.3-68.400112Y112 T116 Y159 I160 I161 L167Y112-M163 HydrophobicContact CE1-CE 4.16Å; Y112-M163 HydrophobicContact CE1-SD 4.01Å; Y112-M163 WeakPolarHBondContact OH-CA 3.38Å; Y112-M163 VanDerWaalsContact OH-CB 3.3Å; Y112-M163 WeakPolarHBondContact OH-CB 3.49Å; Y112-M163 VanDerWaalsContact OH-CE 3.31Å; Y112-M163 WeakPolarHBondContact OH-CE 3.49Å; Y112-M163 PolarHBondContact OH-O 3.39Å; Y112-M163 PolarHBondContact OH-SD 2.97Å; T116-M163 HydrophobicContact CG2-CB 4.42Å; T116-M163 HydrophobicContact CG2-CG 3.94Å; T116-M163 HydrophobicContact CG2-SD 3.59Å; T116-M163 VanDerWaalsContact CG2-SD 3.59Å; Y159-M163 WeakPolarHBondContact O-CG 3.43Å; Y159-M163 PolarHBondContact O-N 3.34Å; Y159-M163 VanDerWaalsContact O-N 3.1Å; I160-M163 PolarHBondContact O-N 3.41Å; I161-M163 VanDerWaalsContact C-N 3.33Å; I161-M163 PolarHBondContact O-N 3.11Å; M163-L167 PolarHBondContact O-N 3.28Å
164I96.2Very high94.9Very high108 Ų10846.7 Ų46.755%0.55425%0.25SC*.Hα-helixtrans-66.7-44.8178.2-68166000111.3I160 I161 Y166 L167I160-I164 HydrophobicContact CG2-CD1 3.82Å; I160-I164 WeakPolarHBondContact O-CG1 3.46Å; I160-I164 PolarHBondContact O-N 2.91Å; I161-I164 PolarHBondContact O-N 3.04Å; I161-I164 VanDerWaalsContact O-N 3.16Å; I164-Y166 VanDerWaalsContact C-N 3.29Å; I164-Y166 PolarHBondContact O-N 3.4Å; I164-L167 VanDerWaalsContact O-CB 3.27Å; I164-L167 WeakPolarHBondContact O-CB 3.43Å; I164-L167 PolarHBondContact O-N 2.85Å
165L94.4Very high94.7Very high56 Ų5648.2 Ų48.229%0.29326%0.255SS..Hα-helixtrans-61.7-34.4-176.5-72.8171.9000112.8I119 I161 G162 P168 Y197 L201I119-L165 HydrophobicContact CD1-CD1 4.15Å; I161-L165 HydrophobicContact CG2-CD1 3.61Å; I161-L165 HydrophobicContact CG2-CG 4Å; I161-L165 WeakPolarHBondContact O-CB 3.24Å; I161-L165 VanDerWaalsContact O-CG 3.25Å; I161-L165 WeakPolarHBondContact O-CG 3.25Å; I161-L165 PolarHBondContact O-N 3.36Å; G162-L165 PolarHBondContact O-N 2.98Å; L165-P168 VanDerWaalsContact O-CD 3.27Å; L165-P168 WeakPolarHBondContact O-CD 3.28Å; L165-Y197 WeakPolarHBondContact CD2-OH 3.45Å; L165-L201 HydrophobicContact CB-CD2 3.88Å; L165-L201 HydrophobicContact CD1-CD1 4.45Å; L165-L201 WeakPolarHBondContact O-CD2 3.49Å
166Y93.7Very high94.3Very high1 Ų149.4 Ų49.40%0.00426%0.262CS..Hα-helixtrans-94.80.1178.7-84.8-80.1000115.4Y112 E115 T116 I119 G162 I164 P168 T169 L201 S202Y112-Y166 WeakPolarHBondContact CD2-O 3.34Å; E115-Y166 HydrophobicContact CB-CD1 3.6Å; E115-Y166 HydrophobicContact CB-CE1 3.47Å; E115-Y166 VanDerWaalsContact CB-CE1 3.47Å; E115-Y166 HydrophobicContact CB-CG 4.15Å; E115-Y166 HydrophobicContact CG-CD1 4.31Å; E115-Y166 HydrophobicContact CG-CE1 3.97Å; E115-Y166 WeakPolarHBondContact OE2-CE1 3.47Å; E115-Y166 PolarHBondContact OE2-OH 3.21Å; E115-Y166 VanDerWaalsContact OE2-OH 3.11Å; T116-Y166 WeakPolarHBondContact OG1-CB 3.4Å; I119-Y166 HydrophobicContact CB-CD2 4.34Å; I119-Y166 HydrophobicContact CB-CE2 3.66Å; I119-Y166 HydrophobicContact CD1-CD2 4.41Å; I119-Y166 HydrophobicContact CD1-CE2 3.71Å; I119-Y166 HydrophobicContact CG1-CE2 4.26Å; I119-Y166 HydrophobicContact CG2-CD2 3.64Å; I119-Y166 HydrophobicContact CG2-CE2 3.48Å; I119-Y166 VanDerWaalsContact CG2-CE2 3.48Å; G162-Y166 PolarHBondContact O-N 3.05Å; I164-Y166 VanDerWaalsContact C-N 3.29Å; I164-Y166 PolarHBondContact O-N 3.4Å; Y166-P168 VanDerWaalsContact O-N 3.14Å; Y166-T169 VanDerWaalsContact O-CB 3.31Å; Y166-T169 WeakPolarHBondContact O-CB 3.48Å; Y166-T169 PolarHBondContact O-N 2.68Å; Y166-L201 HydrophobicContact CD1-CD2 4.12Å; Y166-L201 HydrophobicContact CD2-CD2 3.71Å; Y166-L201 HydrophobicContact CE1-CD2 3.95Å; Y166-L201 HydrophobicContact CE1-CG 4.43Å; Y166-L201 HydrophobicContact CE2-CD2 3.48Å; Y166-L201 VanDerWaalsContact CE2-CD2 3.48Å; Y166-L201 HydrophobicContact CE2-CG 3.85Å; Y166-L201 HydrophobicContact CG-CD2 4.06Å; Y166-S202 WeakPolarHBondContact OH-CA 3.47Å; Y166-S202 WeakPolarHBondContact OH-CB 3.4Å; Y166-S202 PolarHBondContact OH-N 3.34Å
167L93.4Very high93.8Very high91 Ų9150.2 Ų50.248%0.47627%0.267SS..Hα-helixtrans-49.8-36.4172.6-17263.4000113.4M163 I164 T169 A170 I171M163-L167 PolarHBondContact O-N 3.28Å; I164-L167 VanDerWaalsContact O-CB 3.27Å; I164-L167 WeakPolarHBondContact O-CB 3.43Å; I164-L167 PolarHBondContact O-N 2.85Å; L167-T169 VanDerWaalsContact C-N 3.26Å; L167-T169 PolarHBondContact O-N 3.02Å; L167-A170 PolarHBondContact O-N 2.93Å; L167-A170 VanDerWaalsContact O-N 3.15Å; L167-I171 HydrophobicContact CG-CD1 4.14Å; L167-I171 WeakPolarHBondContact O-CG1 3.47Å; L167-I171 PolarHBondContact O-N 2.86Å; L167-I171 VanDerWaalsContact O-N 3.14Å
168P92.3Very high92.9Very high30 Ų3051.3 Ų51.320%0.19527%0.27CS..Hα-helixtrans-66-22.5175.9-16.230.3000114.1L165 Y166 I171 N172 S194 Y197L165-P168 VanDerWaalsContact O-CD 3.27Å; L165-P168 WeakPolarHBondContact O-CD 3.28Å; Y166-P168 VanDerWaalsContact O-N 3.14Å; P168-I171 PolarHBondContact O-N 3.15Å; P168-N172 PolarHBondContact O-N 3.27Å; P168-N172 PolarHBondContact O-ND2 3.27Å; P168-S194 WeakPolarHBondContact CB-OG 3.22Å; P168-Y197 HydrophobicContact CG-CD1 4.44Å; P168-Y197 HydrophobicContact CG-CE1 4.25Å
169T91.9Very high91.9Very high4 Ų454.4 Ų54.43%0.02529%0.294CS..Hα-helixtrans-65.1-47.1169.6-65.80000111S111 Y166 L167 I171 N172 S173 F187 N198S111-T169 WeakPolarHBondContact O-CG2 3.37Å; Y166-T169 VanDerWaalsContact O-CB 3.31Å; Y166-T169 WeakPolarHBondContact O-CB 3.48Å; Y166-T169 PolarHBondContact O-N 2.68Å; L167-T169 VanDerWaalsContact C-N 3.26Å; L167-T169 PolarHBondContact O-N 3.02Å; T169-I171 VanDerWaalsContact C-N 3.26Å; T169-I171 PolarHBondContact O-N 3.47Å; T169-N172 PolarHBondContact O-N 3.36Å; T169-S173 WeakPolarHBondContact O-CB 3.31Å; T169-S173 PolarHBondContact O-N 2.99Å; T169-S173 PolarHBondContact O-OG 3.46Å; T169-F187 HydrophobicContact CG2-CE1 4.17Å; T169-F187 HydrophobicContact CG2-CZ 4.27Å; T169-N198 WeakPolarHBondContact CA-ND2 3.32Å; T169-N198 PolarHBondContact N-ND2 3.27Å; T169-N198 PolarHBondContact OG1-ND2 2.91Å; T169-N198 VanDerWaalsContact OG1-ND2 3.14Å; T169-N198 PolarHBondContact OG1-OD1 2.99Å
170A92.4Very high90.8Very high21 Ų2157.6 Ų57.617%0.17431%0.311CS..Hα-helixtrans-65.9-26.2177.800000113.3K108 Y112 L167K108-A170 WeakPolarHBondContact CD-O 3.3Å; K108-A170 VanDerWaalsContact CE-O 3.26Å; K108-A170 WeakPolarHBondContact CE-O 3.31Å; K108-A170 VanDerWaalsContact CG-O 3.29Å; K108-A170 WeakPolarHBondContact CG-O 3.47Å; K108-A170 PolarHBondContact NZ-O 2.86Å; Y112-A170 HydrophobicContact CD2-CB 3.85Å; Y112-A170 HydrophobicContact CG-CB 4.08Å; L167-A170 PolarHBondContact O-N 2.93Å; L167-A170 VanDerWaalsContact O-N 3.15Å
171I91.9Very high89.9Confident102 Ų10260.2 Ų60.252%0.52333%0.326SS..Hα-helixtrans-75.7-47.4177.8-67.8168.5000111.2K108 L167 P168 T169K108-I171 PolarHBondContact NZ-O 2.97Å; L167-I171 HydrophobicContact CG-CD1 4.14Å; L167-I171 WeakPolarHBondContact O-CG1 3.47Å; L167-I171 PolarHBondContact O-N 2.86Å; L167-I171 VanDerWaalsContact O-N 3.14Å; P168-I171 PolarHBondContact O-N 3.15Å; T169-I171 VanDerWaalsContact C-N 3.26Å; T169-I171 PolarHBondContact O-N 3.47Å
172N92Very high89.2Confident15 Ų1560.7 Ų60.78%0.0832%0.323CS..Hα-helixtrans-95.5-9.3-169.7-58.9-77.2000115.1P168 T169 F187 V188 K192 S194 V195P168-N172 PolarHBondContact O-N 3.27Å; P168-N172 PolarHBondContact O-ND2 3.27Å; T169-N172 PolarHBondContact O-N 3.36Å; N172-F187 HydrophobicContact CB-CD1 4.2Å; N172-F187 WeakPolarHBondContact O-CA 3.35Å; N172-V188 PolarHBondContact O-N 3.09Å; N172-V188 VanDerWaalsContact O-N 3.09Å; N172-K192 WeakPolarHBondContact OD1-CD 3.37Å; N172-K192 WeakPolarHBondContact OD1-CE 3.26Å; N172-K192 PolarHBondContact OD1-NZ 3.46Å; N172-S194 WeakPolarHBondContact ND2-CB 3.23Å; N172-S194 PolarHBondContact ND2-OG 3.3Å; N172-V195 HydrophobicContact CB-CG2 4.11Å
173S91.8Very high88.8Confident3 Ų363.5 Ų63.52%0.02134%0.339CS..EExtended strand (participates in β ladder)trans-72.1135.8168.745.40000110.8K108 T169K108-S173 WeakPolarHBondContact CE-O 3.29Å; T169-S173 WeakPolarHBondContact O-CB 3.31Å; T169-S173 PolarHBondContact O-N 2.99Å; T169-S173 PolarHBondContact O-OG 3.46Å
174G92.8Very high88.4Confident2 Ų260.7 Ų60.72%0.02133%0.326CS..EExtended strand (participates in β ladder)trans-158.8170.6-179.100000112.8C107 Q186C107-G174 VanDerWaalsContact SG-C 3.52Å; C107-G174 PolarHBondContact SG-O 3.36Å; G174-Q186 PolarHBondContact N-O 3.34Å; G174-Q186 PolarHBondContact O-N 3.04Å
175L91.8Very high88Confident63 Ų6356.8 Ų56.833%0.3331%0.308SS..EExtended strand (participates in β ladder)trans-84.2124.3175-62.4175.6000109.3C107 I184C107-L175 HydrophobicContact CB-CD2 3.93Å; C107-L175 HydrophobicContact CB-CG 4.39Å; L175-I184 WeakPolarHBondContact CA-O 3.32Å
176V89.4Confident87.8Confident41 Ų4158.3 Ų58.325%0.24831%0.313CS..EExtended strand (participates in β ladder)trans-123.2141.8176.4-173.50000108.8T183 I184 Q186V176-T183 WeakPolarHBondContact O-CA 3.46Å; V176-I184 PolarHBondContact N-O 2.94Å; V176-I184 WeakPolarHBondContact O-CG1 3.46Å; V176-I184 PolarHBondContact O-N 3.4Å; V176-Q186 HydrophobicContact CB-CG 3.96Å; V176-Q186 HydrophobicContact CG2-CG 3.71Å
177L86.5Confident87.5Confident119 Ų11961.6 Ų61.662%0.62333%0.328SS*.EExtended strand (participates in β ladder)trans-80.7126.1172.2-76.2160.2000109.5T183L177-T183 HydrophobicContact CD2-CG2 3.83Å; L177-T183 HydrophobicContact CG-CG2 4.39Å
178N79.2Confident87Confident54 Ų5462 Ų6229%0.28933%0.334SS..  trans-83.8167.9174.5-1629.7000111.2H180 N181 Y182 I184N178-H180 PolarHBondContact O-N 3.15Å; N178-N181 PolarHBondContact O-N 3.24Å; N178-Y182 HydrophobicContact CB-CD2 4.32Å; N178-Y182 HydrophobicContact CB-CE2 4.06Å; N178-Y182 PolarHBondContact N-O 2.78Å; N178-Y182 PolarHBondContact ND2-OH 2.92Å; N178-I184 HydrophobicContact CB-CD1 4.12Å; N178-I184 HydrophobicContact CB-CG1 4.45Å
179S76.1Confident86.6Confident96 Ų9664.1 Ų64.167%0.67134%0.343SS*.THydrogen-bonded Turntrans-51.9-22.5179.656.70000115.6
180H75.5Confident85.9Confident125 Ų12568.2 Ų68.258%0.57937%0.37SS*.THydrogen-bonded Turntrans-101.224.9177.8-52.2-81.5000113N178 Y182N178-H180 PolarHBondContact O-N 3.15Å; H180-Y182 HydrophobicContact CB-CD1 3.72Å; H180-Y182 HydrophobicContact CB-CE1 3.68Å; H180-Y182 AromaticContact CD2-CE1 3.98Å; H180-Y182 PolarHBondContact O-N 3.33Å; H180-Y182 VanDerWaalsContact O-N 3.08Å
181N79.1Confident85.3Confident146 Ų14673.8 Ų73.878%0.78140%0.396SS*.SBendtrans57.719177.6-68.3-21000116.5N178N178-N181 PolarHBondContact O-N 3.24Å
182Y81.7Confident85Confident104 Ų10473.6 Ų73.641%0.40839%0.391SS..  trans-100.3146.8169.565.4-99.5000111.7N178 H180 I184N178-Y182 HydrophobicContact CB-CD2 4.32Å; N178-Y182 HydrophobicContact CB-CE2 4.06Å; N178-Y182 PolarHBondContact N-O 2.78Å; N178-Y182 PolarHBondContact ND2-OH 2.92Å; H180-Y182 HydrophobicContact CB-CD1 3.72Å; H180-Y182 HydrophobicContact CB-CE1 3.68Å; H180-Y182 AromaticContact CD2-CE1 3.98Å; H180-Y182 PolarHBondContact O-N 3.33Å; H180-Y182 VanDerWaalsContact O-N 3.08Å; Y182-I184 HydrophobicContact CD2-CG2 3.66Å; Y182-I184 HydrophobicContact CE2-CG2 3.38Å
183T86Confident84.7Confident63 Ų6380.6 Ų80.639%0.38742%0.421SS..EExtended strand (participates in β ladder)trans-77.7140.8175.948.70000111.3T101 V176 L177T101-T183 WeakPolarHBondContact CG2-O 3.37Å; V176-T183 WeakPolarHBondContact O-CA 3.46Å; L177-T183 HydrophobicContact CD2-CG2 3.83Å; L177-T183 HydrophobicContact CG-CG2 4.39Å
184I87.6Confident84.4Confident31 Ų3181.7 Ų81.716%0.15943%0.429CS..EExtended strand (participates in β ladder)trans-130.7142.2171.952.2177.1000110.1L175 V176 N178 Y182 Q186L175-I184 WeakPolarHBondContact CA-O 3.32Å; V176-I184 PolarHBondContact N-O 2.94Å; V176-I184 WeakPolarHBondContact O-CG1 3.46Å; V176-I184 PolarHBondContact O-N 3.4Å; N178-I184 HydrophobicContact CB-CD1 4.12Å; N178-I184 HydrophobicContact CB-CG1 4.45Å; Y182-I184 HydrophobicContact CD2-CG2 3.66Å; Y182-I184 HydrophobicContact CE2-CG2 3.38Å; I184-Q186 HydrophobicContact CD1-CG 4.23Å; I184-Q186 VanDerWaalsContact CD1-OE1 3.28Å; I184-Q186 HydrophobicContact CG1-CG 4.23Å
185C89.6Confident84Confident26 Ų2682.1 Ų82.118%0.17643%0.432CS..EExtended strand (participates in β ladder)trans-79.5117.9165.6-175.90000108.8D100 C107 S111D100-C185 HydrophobicContact CB-CB 3.94Å; D100-C185 WeakPolarHBondContact OD2-CB 3.09Å; C107-C185 VanDerWaalsContact C-SG 3.53Å; C107-C185 WeakPolarHBondContact CA-SG 3.06Å; C107-C185 HydrophobicContact CB-CB 3.78Å; C107-C185 WeakPolarHBondContact CB-SG 3.44Å; C107-C185 PolarHBondContact O-SG 2.86Å; C107-C185 VanDerWaalsContact SG-CA 3.53Å; C107-C185 WeakPolarHBondContact SG-CB 3.48Å; C107-C185 CovalentContact SG-SG 2.04Å; C107-C185 PolarHBondContact SG-SG 3.21Å; S111-C185 PolarHBondContact OG-SG 2.89Å; S111-C185 VanDerWaalsContact OG-SG 3.36Å
186Q89.3Confident83.7Confident88 Ų8883.1 Ų83.141%0.41144%0.435SS..EExtended strand (participates in β ladder)trans-152.7176.5175.265.1177.68.800111G174 V176 I184 V188G174-Q186 PolarHBondContact N-O 3.34Å; G174-Q186 PolarHBondContact O-N 3.04Å; V176-Q186 HydrophobicContact CB-CG 3.96Å; V176-Q186 HydrophobicContact CG2-CG 3.71Å; I184-Q186 HydrophobicContact CD1-CG 4.23Å; I184-Q186 VanDerWaalsContact CD1-OE1 3.28Å; I184-Q186 HydrophobicContact CG1-CG 4.23Å; Q186-V188 PolarHBondContact O-N 2.99Å
187F87.1Confident83.8Confident70 Ų7084.8 Ų84.831%0.30744%0.437SS..EExtended strand (participates in β ladder)trans-68.5127.6168.9-65.1-63.7000110T169 N172 D189 V195T169-F187 HydrophobicContact CG2-CE1 4.17Å; T169-F187 HydrophobicContact CG2-CZ 4.27Å; N172-F187 HydrophobicContact CB-CD1 4.2Å; N172-F187 WeakPolarHBondContact O-CA 3.35Å; F187-D189 VanDerWaalsContact C-N 3.3Å; F187-D189 PolarHBondContact O-N 3.18Å; F187-V195 HydrophobicContact CB-CG1 3.92Å; F187-V195 HydrophobicContact CB-CG2 3.83Å; F187-V195 HydrophobicContact CD1-CG1 4.13Å; F187-V195 HydrophobicContact CD1-CG2 3.74Å; F187-V195 HydrophobicContact CD2-CG1 3.42Å; F187-V195 VanDerWaalsContact CD2-CG1 3.42Å; F187-V195 HydrophobicContact CD2-CG2 4.49Å; F187-V195 HydrophobicContact CE1-CG2 4.44Å; F187-V195 HydrophobicContact CE2-CG1 3.91Å; F187-V195 HydrophobicContact CG-CB 4.31Å; F187-V195 HydrophobicContact CG-CG1 3.54Å; F187-V195 HydrophobicContact CG-CG2 3.76Å; F187-V195 HydrophobicContact CZ-CG1 4.45Å
188V83.9Confident83.8Confident100 Ų10079.4 Ų79.461%0.60641%0.409SS*.SBendtrans-63.4-37.7-175.4178.90000111.8N172 Q186N172-V188 PolarHBondContact O-N 3.09Å; N172-V188 VanDerWaalsContact O-N 3.09Å; Q186-V188 PolarHBondContact O-N 2.99Å
189D82.7Confident84.1Confident74 Ų7480.8 Ų80.840%0.39642%0.416SS..  trans-130.4106.7171.91742.6000108.6F187 L191 K192 V195F187-D189 VanDerWaalsContact C-N 3.3Å; F187-D189 PolarHBondContact O-N 3.18Å; D189-L191 VanDerWaalsContact C-N 3.3Å; D189-L191 PolarHBondContact O-N 3.35Å; D189-L191 WeakPolarHBondContact OD1-CB 3.27Å; D189-L191 PolarHBondContact OD1-N 3.05Å; D189-K192 HydrophobicContact CB-CB 4.17Å; D189-K192 WeakPolarHBondContact O-CB 3.49Å; D189-K192 PolarHBondContact OD1-N 2.92Å; D189-V195 VanDerWaalsContact O-CG2 3.32Å; D189-V195 WeakPolarHBondContact O-CG2 3.44Å
190P77.5Confident84.7Confident89 Ų8982.4 Ų82.458%0.57841%0.408SS*.SBendtrans-75-16.1-179.131.3-35.5000113.8
191L80.7Confident85.4Confident139 Ų13977.5 Ų77.573%0.72839%0.386SS*.SBendtrans-85.5-20.1179.6-63.5175.4000112.2D189 F193D189-L191 VanDerWaalsContact C-N 3.3Å; D189-L191 PolarHBondContact O-N 3.35Å; D189-L191 WeakPolarHBondContact OD1-CB 3.27Å; D189-L191 PolarHBondContact OD1-N 3.05Å; L191-F193 PolarHBondContact O-N 3.42Å
192K84.7Confident85.8Confident97 Ų9771.7 Ų71.742%0.42236%0.357SS..SBendtrans-53.8129.9176.7-166.5172.9-178.3-176.50111.5N172 D189 S194 V195 Q196N172-K192 WeakPolarHBondContact OD1-CD 3.37Å; N172-K192 WeakPolarHBondContact OD1-CE 3.26Å; N172-K192 PolarHBondContact OD1-NZ 3.46Å; D189-K192 HydrophobicContact CB-CB 4.17Å; D189-K192 WeakPolarHBondContact O-CB 3.49Å; D189-K192 PolarHBondContact OD1-N 2.92Å; K192-S194 PolarHBondContact O-N 2.77Å; K192-V195 HydrophobicContact CB-CG2 4.48Å; K192-V195 WeakPolarHBondContact O-CB 3.49Å; K192-V195 PolarHBondContact O-N 3.43Å; K192-Q196 PolarHBondContact O-N 3.32Å
193F86.6Confident86Confident162 Ų16267.6 Ų67.671%0.71134%0.342SS*.Hα-helixtrans-46-39178.4175-101.9000113.7L191 V195 Q196 Y197L191-F193 PolarHBondContact O-N 3.42Å; F193-V195 VanDerWaalsContact C-N 3.26Å; F193-V195 PolarHBondContact O-N 2.88Å; F193-Q196 PolarHBondContact O-N 2.95Å; F193-Y197 WeakPolarHBondContact O-CB 3.31Å; F193-Y197 PolarHBondContact O-N 3.41Å
194S85Confident86.1Confident26 Ų2668 Ų6818%0.18234%0.341CS..Hα-helixtrans-62.4-28.1178.6-173.30000114.4P168 N172 K192 N198P168-S194 WeakPolarHBondContact CB-OG 3.22Å; N172-S194 WeakPolarHBondContact ND2-CB 3.23Å; N172-S194 PolarHBondContact ND2-OG 3.3Å; K192-S194 PolarHBondContact O-N 2.77Å; S194-N198 PolarHBondContact O-N 3.04Å; S194-N198 PolarHBondContact O-ND2 3.49Å; S194-N198 PolarHBondContact O-OD1 3.22Å
195V83.6Confident86.1Confident12 Ų1267.4 Ų67.47%0.07334%0.342CS..Hα-helixtrans-81.5-39.7177.6176.80000110.4N172 F187 D189 K192 F193 Y197 N198 L199N172-V195 HydrophobicContact CB-CG2 4.11Å; F187-V195 HydrophobicContact CB-CG1 3.92Å; F187-V195 HydrophobicContact CB-CG2 3.83Å; F187-V195 HydrophobicContact CD1-CG1 4.13Å; F187-V195 HydrophobicContact CD1-CG2 3.74Å; F187-V195 HydrophobicContact CD2-CG1 3.42Å; F187-V195 VanDerWaalsContact CD2-CG1 3.42Å; F187-V195 HydrophobicContact CD2-CG2 4.49Å; F187-V195 HydrophobicContact CE1-CG2 4.44Å; F187-V195 HydrophobicContact CE2-CG1 3.91Å; F187-V195 HydrophobicContact CG-CB 4.31Å; F187-V195 HydrophobicContact CG-CG1 3.54Å; F187-V195 HydrophobicContact CG-CG2 3.76Å; F187-V195 HydrophobicContact CZ-CG1 4.45Å; D189-V195 VanDerWaalsContact O-CG2 3.32Å; D189-V195 WeakPolarHBondContact O-CG2 3.44Å; K192-V195 HydrophobicContact CB-CG2 4.48Å; K192-V195 WeakPolarHBondContact O-CB 3.49Å; K192-V195 PolarHBondContact O-N 3.43Å; F193-V195 VanDerWaalsContact C-N 3.26Å; F193-V195 PolarHBondContact O-N 2.88Å; V195-Y197 VanDerWaalsContact C-N 3.31Å; V195-Y197 PolarHBondContact O-N 3.11Å; V195-N198 PolarHBondContact O-N 2.92Å; V195-L199 PolarHBondContact O-N 3.4Å; V195-L199 VanDerWaalsContact O-N 3.07Å
196Q86.7Confident85.9Confident84 Ų8466.5 Ų66.539%0.39334%0.336SS..Hα-helixtrans-59-44.6170.2-61.1-178.7-9.600110.9K192 F193 N198 L199 Y200K192-Q196 PolarHBondContact O-N 3.32Å; F193-Q196 PolarHBondContact O-N 2.95Å; Q196-N198 PolarHBondContact O-N 3.04Å; Q196-L199 WeakPolarHBondContact O-CB 3.39Å; Q196-L199 PolarHBondContact O-N 2.89Å; Q196-L199 VanDerWaalsContact O-N 3.17Å; Q196-Y200 HydrophobicContact CB-CD2 4.44Å; Q196-Y200 HydrophobicContact CB-CE2 4.21Å; Q196-Y200 WeakPolarHBondContact O-CD2 3.44Å; Q196-Y200 PolarHBondContact O-N 3.1Å
197Y90Very high85.8Confident75 Ų7563 Ų6329%0.29432%0.321SS..Hα-helixtrans-54.1-48.7172.9169-94.4000112.3L165 P168 F193 V195 L199 Y200 L201L165-Y197 WeakPolarHBondContact CD2-OH 3.45Å; P168-Y197 HydrophobicContact CG-CD1 4.44Å; P168-Y197 HydrophobicContact CG-CE1 4.25Å; F193-Y197 WeakPolarHBondContact O-CB 3.31Å; F193-Y197 PolarHBondContact O-N 3.41Å; V195-Y197 VanDerWaalsContact C-N 3.31Å; V195-Y197 PolarHBondContact O-N 3.11Å; Y197-L199 VanDerWaalsContact C-N 3.3Å; Y197-L199 PolarHBondContact O-N 3.13Å; Y197-Y200 PolarHBondContact O-N 3.36Å; Y197-L201 HydrophobicContact CE1-CD2 3.99Å; Y197-L201 WeakPolarHBondContact O-CB 3.24Å; Y197-L201 PolarHBondContact O-N 2.99Å
198N87.3Confident85.9Confident6 Ų661.3 Ų61.33%0.03232%0.315CS..Hα-helixtrans-60.2-40.2178-64.6-24.2000111.9T169 S194 V195 Q196 L201 S202T169-N198 WeakPolarHBondContact CA-ND2 3.32Å; T169-N198 PolarHBondContact N-ND2 3.27Å; T169-N198 PolarHBondContact OG1-ND2 2.91Å; T169-N198 VanDerWaalsContact OG1-ND2 3.14Å; T169-N198 PolarHBondContact OG1-OD1 2.99Å; S194-N198 PolarHBondContact O-N 3.04Å; S194-N198 PolarHBondContact O-ND2 3.49Å; S194-N198 PolarHBondContact O-OD1 3.22Å; V195-N198 PolarHBondContact O-N 2.92Å; Q196-N198 PolarHBondContact O-N 3.04Å; N198-L201 PolarHBondContact O-N 3.15Å; N198-S202 WeakPolarHBondContact O-CB 3.22Å; N198-S202 PolarHBondContact O-N 3.48Å
199L85.6Confident86.2Confident84 Ų8460.8 Ų60.844%0.4431%0.308SS..Hα-helixtrans-64.3-45176.4-176.368.5000111.7V195 Q196 Y197 N203V195-L199 PolarHBondContact O-N 3.4Å; V195-L199 VanDerWaalsContact O-N 3.07Å; Q196-L199 WeakPolarHBondContact O-CB 3.39Å; Q196-L199 PolarHBondContact O-N 2.89Å; Q196-L199 VanDerWaalsContact O-N 3.17Å; Y197-L199 VanDerWaalsContact C-N 3.3Å; Y197-L199 PolarHBondContact O-N 3.13Å; L199-N203 VanDerWaalsContact O-CB 3.3Å; L199-N203 WeakPolarHBondContact O-CB 3.21Å; L199-N203 PolarHBondContact O-N 3.34Å; L199-N203 PolarHBondContact O-ND2 3.46Å
200Y88.3Confident86.5Confident129 Ų12957.3 Ų57.351%0.50629%0.289SS..Hα-helixtrans-65.4-38.6175-70.8-60.8000112.1Q196 Y197 I204Q196-Y200 HydrophobicContact CB-CD2 4.44Å; Q196-Y200 HydrophobicContact CB-CE2 4.21Å; Q196-Y200 WeakPolarHBondContact O-CD2 3.44Å; Q196-Y200 PolarHBondContact O-N 3.1Å; Y197-Y200 PolarHBondContact O-N 3.36Å; Y200-I204 HydrophobicContact CD1-CD1 3.96Å; Y200-I204 WeakPolarHBondContact O-CA 3.33Å; Y200-I204 WeakPolarHBondContact O-CB 3.26Å; Y200-I204 WeakPolarHBondContact O-CG1 3.18Å; Y200-I204 PolarHBondContact O-N 2.95Å
201L91.2Very high87.1Confident22 Ų2253.4 Ų53.412%0.11526%0.264CS..Iπ-helixtrans-63.9-45.2177.4-178.366.5000111.7I119 L165 Y166 Y197 N198 G205 A206I119-L201 HydrophobicContact CD1-CD1 3.84Å; I119-L201 HydrophobicContact CD1-CG 4.15Å; L165-L201 HydrophobicContact CB-CD2 3.88Å; L165-L201 HydrophobicContact CD1-CD1 4.45Å; L165-L201 WeakPolarHBondContact O-CD2 3.49Å; Y166-L201 HydrophobicContact CD1-CD2 4.12Å; Y166-L201 HydrophobicContact CD2-CD2 3.71Å; Y166-L201 HydrophobicContact CE1-CD2 3.95Å; Y166-L201 HydrophobicContact CE1-CG 4.43Å; Y166-L201 HydrophobicContact CE2-CD2 3.48Å; Y166-L201 VanDerWaalsContact CE2-CD2 3.48Å; Y166-L201 HydrophobicContact CE2-CG 3.85Å; Y166-L201 HydrophobicContact CG-CD2 4.06Å; Y197-L201 HydrophobicContact CE1-CD2 3.99Å; Y197-L201 WeakPolarHBondContact O-CB 3.24Å; Y197-L201 PolarHBondContact O-N 2.99Å; N198-L201 PolarHBondContact O-N 3.15Å; L201-G205 CarbonylContact O-C 3.01Å; L201-G205 WeakPolarHBondContact O-CA 3.34Å; L201-G205 PolarHBondContact O-N 3.25Å; L201-A206 PolarHBondContact O-N 2.99Å
202S86.9Confident87.5Confident24 Ų2451 Ų5117%0.16825%0.251CS..Iπ-helixtrans-68.7-45.2178.6-162.70000112.3E115 Y166 N198 A206 T207E115-S202 VanDerWaalsContact OE2-CB 3.24Å; E115-S202 WeakPolarHBondContact OE2-CB 3.31Å; E115-S202 PolarHBondContact OE2-OG 3.42Å; Y166-S202 WeakPolarHBondContact OH-CA 3.47Å; Y166-S202 WeakPolarHBondContact OH-CB 3.4Å; Y166-S202 PolarHBondContact OH-N 3.34Å; N198-S202 WeakPolarHBondContact O-CB 3.22Å; N198-S202 PolarHBondContact O-N 3.48Å; S202-A206 WeakPolarHBondContact O-CB 3.31Å; S202-A206 PolarHBondContact O-N 2.89Å; S202-T207 PolarHBondContact O-N 3.26Å; S202-T207 PolarHBondContact O-OG1 2.9Å
203N85.8Confident87.8Confident19 Ų1948.1 Ų48.110%0.10224%0.241CC..Iπ-helixtrans-72.1-51.4-178.9-65.5-14.2000111.8L199 T207 I208 V272 Q276L199-N203 VanDerWaalsContact O-CB 3.3Å; L199-N203 WeakPolarHBondContact O-CB 3.21Å; L199-N203 PolarHBondContact O-N 3.34Å; L199-N203 PolarHBondContact O-ND2 3.46Å; N203-T207 WeakPolarHBondContact O-CB 3.43Å; N203-I208 VanDerWaalsContact O-CG1 3.3Å; N203-I208 WeakPolarHBondContact O-CG1 3.43Å; N203-I208 PolarHBondContact O-N 2.82Å; N203-V272 HydrophobicContact CB-CG1 3.94Å; N203-V272 WeakPolarHBondContact ND2-CG1 3.25Å; N203-V272 WeakPolarHBondContact OD1-CG1 3.45Å; N203-Q276 PolarHBondContact ND2-NE2 3.48Å
204I87.8Confident87.7Confident72 Ų7240.5 Ų40.537%0.36921%0.208SC..Iπ-helixtrans-84.5-53.8-174.7-54177.5000110.9Y200 I208 I209Y200-I204 HydrophobicContact CD1-CD1 3.96Å; Y200-I204 WeakPolarHBondContact O-CA 3.33Å; Y200-I204 WeakPolarHBondContact O-CB 3.26Å; Y200-I204 WeakPolarHBondContact O-CG1 3.18Å; Y200-I204 PolarHBondContact O-N 2.95Å; I204-I208 HydrophobicContact CG1-CD1 4.45Å; I204-I208 PolarHBondContact O-N 3.38Å; I204-I209 HydrophobicContact CG2-CD1 3.79Å; I204-I209 HydrophobicContact CG2-CG1 3.99Å; I204-I209 WeakPolarHBondContact O-CB 3.42Å; I204-I209 WeakPolarHBondContact O-CG1 3.41Å; I204-I209 PolarHBondContact O-N 3.26Å
205G86.9Confident87.9Confident17 Ų1743.4 Ų43.418%0.17522%0.218CC..Iπ-helixtrans-75-40.1-172.400000114.6L201 P210L201-G205 CarbonylContact O-C 3.01Å; L201-G205 WeakPolarHBondContact O-CA 3.34Å; L201-G205 PolarHBondContact O-N 3.25Å; G205-P210 VanDerWaalsContact O-CD 3.27Å; G205-P210 WeakPolarHBondContact O-CD 3.37Å; G205-P210 VanDerWaalsContact O-CG 3.3Å; G205-P210 WeakPolarHBondContact O-CG 3.44Å
206A86.9Confident88.3Confident7 Ų746.8 Ų46.86%0.05824%0.235CC..Iπ-helixtrans-92.1-22.8-179.400000113.9I119 T122 L201 S202I119-A206 HydrophobicContact CB-CB 4.04Å; I119-A206 HydrophobicContact CG1-CB 4.17Å; T122-A206 WeakPolarHBondContact CB-O 3.46Å; T122-A206 VanDerWaalsContact CG2-O 3.28Å; T122-A206 WeakPolarHBondContact CG2-O 3.13Å; T122-A206 PolarHBondContact OG1-O 2.97Å; T122-A206 VanDerWaalsContact OG1-O 3.06Å; L201-A206 PolarHBondContact O-N 2.99Å; S202-A206 WeakPolarHBondContact O-CB 3.31Å; S202-A206 PolarHBondContact O-N 2.89Å
207T86.4Confident88.4Confident16 Ų1643 Ų4310%0.09822%0.217CC..Iπ-helixtrans-117.7-62.2-173.4-42.20000114.1S202 N203 T211 L268 I269S202-T207 PolarHBondContact O-N 3.26Å; S202-T207 PolarHBondContact O-OG1 2.9Å; N203-T207 WeakPolarHBondContact O-CB 3.43Å; T207-T211 WeakPolarHBondContact O-CB 3.38Å; T207-T211 WeakPolarHBondContact O-CG2 3.47Å; T207-T211 PolarHBondContact O-N 2.78Å; T207-T211 VanDerWaalsContact O-N 3.15Å; T207-T211 PolarHBondContact O-OG1 3.16Å; T207-L268 HydrophobicContact CG2-CD2 4.36Å; T207-I269 HydrophobicContact CG2-CD1 4.09Å; T207-I269 HydrophobicContact CG2-CG1 3.62Å
208I88.9Confident88.3Confident33 Ų3340.4 Ų40.417%0.16921%0.209CC..Iπ-helixtrans-69.3-51.1-172.7-65.4163.8000112.4N203 I204 T211 I212 I269 L273N203-I208 VanDerWaalsContact O-CG1 3.3Å; N203-I208 WeakPolarHBondContact O-CG1 3.43Å; N203-I208 PolarHBondContact O-N 2.82Å; I204-I208 HydrophobicContact CG1-CD1 4.45Å; I204-I208 PolarHBondContact O-N 3.38Å; I208-T211 PolarHBondContact O-N 3.28Å; I208-T211 PolarHBondContact O-OG1 3.07Å; I208-I212 HydrophobicContact CG2-CD1 3.65Å; I208-I212 HydrophobicContact CG2-CG1 4.43Å; I208-I212 WeakPolarHBondContact O-CG1 3.37Å; I208-I212 PolarHBondContact O-N 3.33Å; I208-I269 HydrophobicContact CG1-CD1 4.49Å; I208-I269 HydrophobicContact CG1-CG1 4.19Å; I208-I269 HydrophobicContact CG1-CG2 4.02Å; I208-L273 HydrophobicContact CD1-CD2 4.2Å
209I90.2Very high88.5Confident90 Ų9043.8 Ų43.846%0.46223%0.226SC..Hα-helixtrans-61.6-48.6179.9-68.3173.4000111I204 T211 I212 V213I204-I209 HydrophobicContact CG2-CD1 3.79Å; I204-I209 HydrophobicContact CG2-CG1 3.99Å; I204-I209 WeakPolarHBondContact O-CB 3.42Å; I204-I209 WeakPolarHBondContact O-CG1 3.41Å; I204-I209 PolarHBondContact O-N 3.26Å; I209-T211 VanDerWaalsContact C-N 3.34Å; I209-T211 PolarHBondContact O-N 3.41Å; I209-I212 PolarHBondContact O-N 3.47Å; I209-V213 HydrophobicContact CG2-CG2 4.37Å; I209-V213 WeakPolarHBondContact O-CG2 3.25Å; I209-V213 PolarHBondContact O-N 2.96Å
210P90.4Very high88.7Confident1 Ų142.6 Ų42.61%0.00622%0.22CC..Hα-helixtrans-62.2-35.8179-2939.6000114.5V126 G205 A214 F261V126-P210 HydrophobicContact CG2-CB 3.7Å; V126-P210 HydrophobicContact CG2-CG 4.23Å; G205-P210 VanDerWaalsContact O-CD 3.27Å; G205-P210 WeakPolarHBondContact O-CD 3.37Å; G205-P210 VanDerWaalsContact O-CG 3.3Å; G205-P210 WeakPolarHBondContact O-CG 3.44Å; P210-A214 WeakPolarHBondContact O-CB 3.27Å; P210-A214 PolarHBondContact O-N 3.47Å; P210-F261 HydrophobicContact CB-CE1 4.38Å; P210-F261 HydrophobicContact CB-CZ 4.22Å
211T88.5Confident88.7Confident6 Ų636.5 Ų36.54%0.03720%0.196CC..Hα-helixtrans-71.9-39.6176.849.50000113.1T207 I208 I209 A214 F215 F261 N265 I269T207-T211 WeakPolarHBondContact O-CB 3.38Å; T207-T211 WeakPolarHBondContact O-CG2 3.47Å; T207-T211 PolarHBondContact O-N 2.78Å; T207-T211 VanDerWaalsContact O-N 3.15Å; T207-T211 PolarHBondContact O-OG1 3.16Å; I208-T211 PolarHBondContact O-N 3.28Å; I208-T211 PolarHBondContact O-OG1 3.07Å; I209-T211 VanDerWaalsContact C-N 3.34Å; I209-T211 PolarHBondContact O-N 3.41Å; T211-A214 PolarHBondContact O-N 3.47Å; T211-F215 VanDerWaalsContact O-CB 3.32Å; T211-F215 WeakPolarHBondContact O-CB 3.48Å; T211-F215 PolarHBondContact O-N 3.44Å; T211-F261 HydrophobicContact CG2-CD1 4.21Å; T211-F261 HydrophobicContact CG2-CE1 3.5Å; T211-F261 VanDerWaalsContact CG2-CE1 3.5Å; T211-F261 HydrophobicContact CG2-CZ 3.96Å; T211-N265 HydrophobicContact CG2-CB 3.52Å; T211-I269 HydrophobicContact CG2-CD1 3.79Å; T211-I269 WeakPolarHBondContact OG1-CD1 3.46Å
212I90.1Very high88.6Confident89 Ų8937.2 Ų37.246%0.45620%0.201SC..Hα-helixtrans-61.7-45.6173.7-68.7170.5000110.1I208 I209 F215 I216I208-I212 HydrophobicContact CG2-CD1 3.65Å; I208-I212 HydrophobicContact CG2-CG1 4.43Å; I208-I212 WeakPolarHBondContact O-CG1 3.37Å; I208-I212 PolarHBondContact O-N 3.33Å; I209-I212 PolarHBondContact O-N 3.47Å; I212-F215 PolarHBondContact O-N 2.8Å; I212-I216 HydrophobicContact CG2-CD1 3.76Å; I212-I216 VanDerWaalsContact O-CG1 3.32Å; I212-I216 WeakPolarHBondContact O-CG1 3.45Å; I212-I216 PolarHBondContact O-N 3.47Å
213V89.8Confident88.7Confident37 Ų3740.5 Ų40.522%0.22422%0.22CC..Hα-helixtrans-66.5-42.2177.5177.50000111.4V126 I209 F215 I216 T217V126-V213 HydrophobicContact CG1-CB 4.49Å; V126-V213 HydrophobicContact CG1-CG1 3.94Å; V126-V213 HydrophobicContact CG2-CB 4.24Å; V126-V213 HydrophobicContact CG2-CG1 4.32Å; I209-V213 HydrophobicContact CG2-CG2 4.37Å; I209-V213 WeakPolarHBondContact O-CG2 3.25Å; I209-V213 PolarHBondContact O-N 2.96Å; V213-F215 VanDerWaalsContact C-N 3.33Å; V213-F215 PolarHBondContact O-N 3.45Å; V213-I216 PolarHBondContact O-N 2.86Å; V213-T217 HydrophobicContact CG1-CG2 3.96Å; V213-T217 WeakPolarHBondContact O-CB 3.45Å; V213-T217 WeakPolarHBondContact O-CG2 3.24Å; V213-T217 PolarHBondContact O-N 3.37Å; V213-T217 PolarHBondContact O-OG1 2.81Å
214A86.1Confident88.8Confident2 Ų241.7 Ų41.72%0.01722%0.224CC..Hα-helixtrans-58.8-43.3174.200000111.7P210 T211 T217 T218 T258 F261P210-A214 WeakPolarHBondContact O-CB 3.27Å; P210-A214 PolarHBondContact O-N 3.47Å; T211-A214 PolarHBondContact O-N 3.47Å; A214-T217 WeakPolarHBondContact CA-OG1 3.28Å; A214-T217 PolarHBondContact O-N 3.42Å; A214-T217 PolarHBondContact O-OG1 3.42Å; A214-T218 WeakPolarHBondContact O-CB 3.46Å; A214-T218 PolarHBondContact O-N 3.38Å; A214-T218 PolarHBondContact O-OG1 2.8Å; A214-T258 HydrophobicContact CB-CG2 4.46Å; A214-F261 HydrophobicContact CB-CD1 4.1Å; A214-F261 HydrophobicContact CB-CE1 4.33Å
215F88.7Confident88.7Confident87 Ų8739.3 Ų39.338%0.38221%0.213SC..Hα-helixtrans-62.6-51.2177178.4-112.5000112.3T211 I212 V213 T217 T218 I219 F262T211-F215 VanDerWaalsContact O-CB 3.32Å; T211-F215 WeakPolarHBondContact O-CB 3.48Å; T211-F215 PolarHBondContact O-N 3.44Å; I212-F215 PolarHBondContact O-N 2.8Å; V213-F215 VanDerWaalsContact C-N 3.33Å; V213-F215 PolarHBondContact O-N 3.45Å; F215-T217 VanDerWaalsContact C-N 3.35Å; F215-T217 PolarHBondContact O-N 3.03Å; F215-T218 PolarHBondContact O-N 3.03Å; F215-I219 HydrophobicContact CD1-CD1 4Å; F215-I219 HydrophobicContact CD2-CD1 4.27Å; F215-I219 HydrophobicContact CE1-CD1 3.55Å; F215-I219 HydrophobicContact CE2-CD1 3.85Å; F215-I219 HydrophobicContact CG-CD1 4.36Å; F215-I219 HydrophobicContact CZ-CD1 3.49Å; F215-I219 VanDerWaalsContact CZ-CD1 3.49Å; F215-I219 WeakPolarHBondContact O-CG1 3.29Å; F215-I219 PolarHBondContact O-N 3.13Å; F215-F262 HydrophobicContact CB-CD2 4.02Å; F215-F262 HydrophobicContact CB-CE2 3.71Å; F215-F262 HydrophobicContact CB-CZ 4.18Å; F215-F262 HydrophobicContact CD2-CD1 4.25Å; F215-F262 HydrophobicContact CD2-CD2 4.32Å; F215-F262 AromaticContact CD2-CE1 3.51Å; F215-F262 HydrophobicContact CD2-CE1 3.51Å; F215-F262 AromaticContact CD2-CE2 3.62Å; F215-F262 HydrophobicContact CD2-CE2 3.62Å; F215-F262 AromaticContact CD2-CZ 3.15Å; F215-F262 HydrophobicContact CD2-CZ 3.15Å; F215-F262 AromaticContact CE2-CE1 3.85Å; F215-F262 HydrophobicContact CE2-CE1 3.85Å; F215-F262 HydrophobicContact CE2-CE2 4.42Å; F215-F262 AromaticContact CE2-CZ 3.57Å; F215-F262 HydrophobicContact CE2-CZ 3.57Å; F215-F262 AromaticContact CG-CE2 3.84Å; F215-F262 HydrophobicContact CG-CE2 3.84Å; F215-F262 AromaticContact CG-CZ 3.82Å; F215-F262 HydrophobicContact CG-CZ 3.82Å
216I91.8Very high88.7Confident83 Ų8347.5 Ų47.543%0.42624%0.238SC..Hα-helixtrans-59.2-45.6177.8-68.9169000110.7I212 V213 I219 I220I212-I216 HydrophobicContact CG2-CD1 3.76Å; I212-I216 VanDerWaalsContact O-CG1 3.32Å; I212-I216 WeakPolarHBondContact O-CG1 3.45Å; I212-I216 PolarHBondContact O-N 3.47Å; V213-I216 PolarHBondContact O-N 2.86Å; I216-I219 PolarHBondContact O-N 3.27Å; I216-I220 HydrophobicContact CG2-CD1 3.61Å; I216-I220 HydrophobicContact CG2-CG1 4.36Å; I216-I220 WeakPolarHBondContact O-CB 3.48Å; I216-I220 VanDerWaalsContact O-CG1 3.29Å; I216-I220 WeakPolarHBondContact O-CG1 3.31Å; I216-I220 PolarHBondContact O-N 2.97Å
217T89Confident88.7Confident3 Ų354.5 Ų54.52%0.01826%0.263CS..Hα-helixtrans-66.4-39179.562.10000112.2I133 V213 A214 F215 I219 I220 I221I133-T217 HydrophobicContact CD1-CG2 3.44Å; I133-T217 VanDerWaalsContact CD1-CG2 3.44Å; I133-T217 HydrophobicContact CG1-CG2 4.24Å; V213-T217 HydrophobicContact CG1-CG2 3.96Å; V213-T217 WeakPolarHBondContact O-CB 3.45Å; V213-T217 WeakPolarHBondContact O-CG2 3.24Å; V213-T217 PolarHBondContact O-N 3.37Å; V213-T217 PolarHBondContact O-OG1 2.81Å; A214-T217 WeakPolarHBondContact CA-OG1 3.28Å; A214-T217 PolarHBondContact O-N 3.42Å; A214-T217 PolarHBondContact O-OG1 3.42Å; F215-T217 VanDerWaalsContact C-N 3.35Å; F215-T217 PolarHBondContact O-N 3.03Å; T217-I219 PolarHBondContact O-N 3.1Å; T217-I220 PolarHBondContact O-N 3.39Å; T217-I221 VanDerWaalsContact O-CB 3.26Å; T217-I221 WeakPolarHBondContact O-CB 3.42Å; T217-I221 WeakPolarHBondContact O-CD1 3.4Å; T217-I221 WeakPolarHBondContact O-CG1 3.43Å; T217-I221 PolarHBondContact O-N 3.37Å
218T88.3Confident88.5Confident21 Ų2156.2 Ų56.213%0.12927%0.271CS..Hα-helixtrans-60.8-43.3175.1-63.90000111.1A214 F215 T222 L255 T258A214-T218 WeakPolarHBondContact O-CB 3.46Å; A214-T218 PolarHBondContact O-N 3.38Å; A214-T218 PolarHBondContact O-OG1 2.8Å; F215-T218 PolarHBondContact O-N 3.03Å; T218-T222 VanDerWaalsContact O-CB 3.26Å; T218-T222 WeakPolarHBondContact O-CB 3.46Å; T218-T222 PolarHBondContact O-N 3.45Å; T218-T222 PolarHBondContact O-OG1 2.92Å; T218-L255 HydrophobicContact CG2-CD1 3.63Å; T218-L255 HydrophobicContact CG2-CG 4.45Å; T218-T258 PolarHBondContact OG1-OG1 3.43Å
219I90.1Very high88.2Confident77 Ų7759.8 Ų59.840%0.39529%0.286SS..Hα-helixtrans-63.8-54174.4-70.1170.6000110.9F215 I216 T217 I221 T222 V223F215-I219 HydrophobicContact CD1-CD1 4Å; F215-I219 HydrophobicContact CD2-CD1 4.27Å; F215-I219 HydrophobicContact CE1-CD1 3.55Å; F215-I219 HydrophobicContact CE2-CD1 3.85Å; F215-I219 HydrophobicContact CG-CD1 4.36Å; F215-I219 HydrophobicContact CZ-CD1 3.49Å; F215-I219 VanDerWaalsContact CZ-CD1 3.49Å; F215-I219 WeakPolarHBondContact O-CG1 3.29Å; F215-I219 PolarHBondContact O-N 3.13Å; I216-I219 PolarHBondContact O-N 3.27Å; T217-I219 PolarHBondContact O-N 3.1Å; I219-I221 VanDerWaalsContact C-N 3.34Å; I219-I221 PolarHBondContact O-N 2.97Å; I219-T222 PolarHBondContact O-N 3.2Å; I219-T222 VanDerWaalsContact O-N 3.12Å; I219-V223 HydrophobicContact CG2-CG2 4.26Å; I219-V223 WeakPolarHBondContact O-CG2 3.45Å; I219-V223 PolarHBondContact O-N 3.5Å
220I91.5Very high87.8Confident59 Ų5962.4 Ų62.430%0.30329%0.294SS..Hα-helixtrans-57.4-47.1-177-72.2171.8000111I133 F137 I216 T217 V223 K224I133-I220 HydrophobicContact CD1-CD1 4.23Å; I133-I220 HydrophobicContact CD1-CG2 4.26Å; I133-I220 HydrophobicContact CG1-CG2 4.25Å; F137-I220 HydrophobicContact CE2-CG2 3.55Å; F137-I220 HydrophobicContact CZ-CG2 4Å; I216-I220 HydrophobicContact CG2-CD1 3.61Å; I216-I220 HydrophobicContact CG2-CG1 4.36Å; I216-I220 WeakPolarHBondContact O-CB 3.48Å; I216-I220 VanDerWaalsContact O-CG1 3.29Å; I216-I220 WeakPolarHBondContact O-CG1 3.31Å; I216-I220 PolarHBondContact O-N 2.97Å; T217-I220 PolarHBondContact O-N 3.39Å; I220-V223 PolarHBondContact O-N 2.87Å; I220-K224 WeakPolarHBondContact O-CB 3.42Å; I220-K224 PolarHBondContact O-N 3.25Å
221I87.9Confident87.4Confident1 Ų165.7 Ų65.71%0.00531%0.309CS..Hα-helixtrans-62.2-45.4177.4-70.2167.7000110.2R132 I133 T217 I219 K224 L225 I251 L255R132-I221 HydrophobicContact CB-CD1 3.86Å; I133-I221 HydrophobicContact CG1-CD1 4.43Å; I133-I221 HydrophobicContact CG1-CG1 4.24Å; T217-I221 VanDerWaalsContact O-CB 3.26Å; T217-I221 WeakPolarHBondContact O-CB 3.42Å; T217-I221 WeakPolarHBondContact O-CD1 3.4Å; T217-I221 WeakPolarHBondContact O-CG1 3.43Å; T217-I221 PolarHBondContact O-N 3.37Å; I219-I221 VanDerWaalsContact C-N 3.34Å; I219-I221 PolarHBondContact O-N 2.97Å; I221-K224 PolarHBondContact O-N 2.67Å; I221-L225 HydrophobicContact CG2-CD1 3.86Å; I221-L225 HydrophobicContact CG2-CG 4.19Å; I221-L225 VanDerWaalsContact O-CB 3.24Å; I221-L225 WeakPolarHBondContact O-CB 3.32Å; I221-L225 VanDerWaalsContact O-CG 3.25Å; I221-L225 WeakPolarHBondContact O-CG 3.31Å; I221-L225 PolarHBondContact O-N 3.49Å; I221-I251 HydrophobicContact CG2-CG2 3.45Å; I221-I251 VanDerWaalsContact CG2-CG2 3.45Å; I221-L255 HydrophobicContact CG2-CD1 4.27Å
222T88.1Confident86.9Confident38 Ų3871.8 Ų71.823%0.23333%0.331CS..Hα-helixtrans-63-45.4179.9-60.40000112.2T218 I219 R226T218-T222 VanDerWaalsContact O-CB 3.26Å; T218-T222 WeakPolarHBondContact O-CB 3.46Å; T218-T222 PolarHBondContact O-N 3.45Å; T218-T222 PolarHBondContact O-OG1 2.92Å; I219-T222 PolarHBondContact O-N 3.2Å; I219-T222 VanDerWaalsContact O-N 3.12Å; T222-R226 WeakPolarHBondContact O-CB 3.33Å; T222-R226 WeakPolarHBondContact O-CG 3.39Å; T222-R226 PolarHBondContact O-N 3.45Å
223V90.5Very high86.1Confident93 Ų9376.8 Ų76.856%0.56435%0.346SS*.Hα-helixtrans-63.4-47.3178.1171.80000110.7I219 I220 R226 R227I219-V223 HydrophobicContact CG2-CG2 4.26Å; I219-V223 WeakPolarHBondContact O-CG2 3.45Å; I219-V223 PolarHBondContact O-N 3.5Å; I220-V223 PolarHBondContact O-N 2.87Å; V223-R226 PolarHBondContact O-N 2.9Å; V223-R227 PolarHBondContact O-N 3.32Å
224K87.3Confident85.3Confident43 Ų4379.9 Ų79.919%0.18736%0.361CS..Hα-helixtrans-69.2-36.3-179.5-174.954.6174.7172.40112.2V136 I220 I221 R227 L228V136-K224 HydrophobicContact CG1-CB 3.96Å; V136-K224 HydrophobicContact CG1-CG 3.49Å; V136-K224 VanDerWaalsContact CG1-CG 3.49Å; I220-K224 WeakPolarHBondContact O-CB 3.42Å; I220-K224 PolarHBondContact O-N 3.25Å; I221-K224 PolarHBondContact O-N 2.67Å; K224-R227 PolarHBondContact O-N 2.98Å; K224-L228 HydrophobicContact CD-CG 4.42Å; K224-L228 HydrophobicContact CG-CD1 4.32Å; K224-L228 VanDerWaalsContact O-CG 3.31Å; K224-L228 WeakPolarHBondContact O-CG 3.48Å; K224-L228 PolarHBondContact O-N 3.4Å
225L85.6Confident84.3Confident23 Ų2385.7 Ų85.712%0.1239%0.39CS..Hα-helixtrans-60.8-49.7170.9-79.9177.9000111.5I221 R227 L228 F229 L248 I251I221-L225 HydrophobicContact CG2-CD1 3.86Å; I221-L225 HydrophobicContact CG2-CG 4.19Å; I221-L225 VanDerWaalsContact O-CB 3.24Å; I221-L225 WeakPolarHBondContact O-CB 3.32Å; I221-L225 VanDerWaalsContact O-CG 3.25Å; I221-L225 WeakPolarHBondContact O-CG 3.31Å; I221-L225 PolarHBondContact O-N 3.49Å; L225-R227 VanDerWaalsContact C-N 3.27Å; L225-R227 PolarHBondContact O-N 3.28Å; L225-L228 PolarHBondContact O-N 3.48Å; L225-L228 VanDerWaalsContact O-N 3.13Å; L225-F229 HydrophobicContact CB-CD2 4.4Å; L225-F229 HydrophobicContact CB-CE2 4.39Å; L225-F229 WeakPolarHBondContact O-CD2 3.19Å; L225-F229 PolarHBondContact O-N 3.34Å; L225-L248 HydrophobicContact CD2-CD1 3.94Å; L225-I251 HydrophobicContact CD1-CG2 3.83Å; L225-I251 HydrophobicContact CD2-CD1 4.47Å; L225-I251 HydrophobicContact CD2-CG2 4.45Å; L225-I251 HydrophobicContact CG-CG2 4.42Å
226R86.9Confident83.1Confident188 Ų18887.8 Ų87.871%0.70941%0.413SS*.Hα-helixtrans-55.7-43.1177.5-76.4176.5-179.8-171.10.8111.6T222 V223 F229 K230T222-R226 WeakPolarHBondContact O-CB 3.33Å; T222-R226 WeakPolarHBondContact O-CG 3.39Å; T222-R226 PolarHBondContact O-N 3.45Å; V223-R226 PolarHBondContact O-N 2.9Å; R226-F229 PolarHBondContact O-N 3.46Å; R226-K230 PolarHBondContact O-N 2.9Å
227R87.2Confident81.6Confident155 Ų15591.6 Ų91.659%0.58543%0.429SS*.Hα-helixtrans-61.9-48.4174.7179.6172.9169.5163.85.8112.4V223 K224 L225 F229 K230 E231V223-R227 PolarHBondContact O-N 3.32Å; K224-R227 PolarHBondContact O-N 2.98Å; L225-R227 VanDerWaalsContact C-N 3.27Å; L225-R227 PolarHBondContact O-N 3.28Å; R227-F229 VanDerWaalsContact C-N 3.31Å; R227-F229 PolarHBondContact O-N 2.81Å; R227-K230 PolarHBondContact O-N 3.42Å; R227-E231 HydrophobicContact CG-CG 4.42Å; R227-E231 WeakPolarHBondContact CG-OE1 3.06Å; R227-E231 IonicContact CZ-OE1 3.36Å; R227-E231 IonicContact NE-OE1 2.72Å; R227-E231 PolarHBondContact NE-OE1 3.19Å; R227-E231 IonicContact NH2-OE1 3.09Å; R227-E231 PolarHBondContact NH2-OE1 3.18Å; R227-E231 VanDerWaalsContact NH2-OE1 3.09Å; R227-E231 WeakPolarHBondContact O-CG 3.38Å; R227-E231 PolarHBondContact O-N 3.18Å
228L81.9Confident80Confident52 Ų52100.4 Ų100.427%0.27246%0.463SS..Hα-helixtrans-63.3-33.8177.5-72.1170.3000112.9V136 K224 L225 R232V136-L228 HydrophobicContact CG1-CD1 4.45Å; K224-L228 HydrophobicContact CD-CG 4.42Å; K224-L228 HydrophobicContact CG-CD1 4.32Å; K224-L228 VanDerWaalsContact O-CG 3.31Å; K224-L228 WeakPolarHBondContact O-CG 3.48Å; K224-L228 PolarHBondContact O-N 3.4Å; L225-L228 PolarHBondContact O-N 3.48Å; L225-L228 VanDerWaalsContact O-N 3.13Å; L228-R232 VanDerWaalsContact O-CB 3.31Å; L228-R232 WeakPolarHBondContact O-CB 3.46Å; L228-R232 VanDerWaalsContact O-CG 3.22Å; L228-R232 WeakPolarHBondContact O-CG 3.38Å; L228-R232 PolarHBondContact O-N 3.05Å
229F81.7Confident78.4Confident107 Ų107110.4 Ų110.447%0.46950%0.5SS..Hα-helixtrans-68.7-39.7173.7-82.4-64.2000112.4L225 R226 R227 R232 Y233 L248L225-F229 HydrophobicContact CB-CD2 4.4Å; L225-F229 HydrophobicContact CB-CE2 4.39Å; L225-F229 WeakPolarHBondContact O-CD2 3.19Å; L225-F229 PolarHBondContact O-N 3.34Å; R226-F229 PolarHBondContact O-N 3.46Å; R227-F229 VanDerWaalsContact C-N 3.31Å; R227-F229 PolarHBondContact O-N 2.81Å; F229-R232 PolarHBondContact O-N 3.35Å; F229-Y233 WeakPolarHBondContact O-CB 3.27Å; F229-Y233 PolarHBondContact O-N 3.18Å; F229-L248 HydrophobicContact CE1-CD2 4.03Å; F229-L248 HydrophobicContact CE2-CD1 3.92Å; F229-L248 HydrophobicContact CZ-CD1 3.54Å; F229-L248 HydrophobicContact CZ-CD2 3.58Å; F229-L248 HydrophobicContact CZ-CG 4.19Å
230K83.5Confident76.8Confident145 Ų145110.9 Ų110.963%0.6350%0.504SS*.Hα-helixtrans-62.9-53.4173.8-170.8178.6178.3-177.50110.8R226 R227 R232 Y233 D234R226-K230 PolarHBondContact O-N 2.9Å; R227-K230 PolarHBondContact O-N 3.42Å; K230-R232 PolarHBondContact O-N 3.44Å; K230-R232 VanDerWaalsContact O-N 3.14Å; K230-Y233 WeakPolarHBondContact O-CB 3.12Å; K230-Y233 PolarHBondContact O-N 3.26Å; K230-D234 PolarHBondContact O-N 3.44Å
231E80.9Confident75.4Confident70 Ų70116.4 Ų116.433%0.32752%0.521SS..Hα-helixtrans-56.7-32.7178.2-69.4167.5169.400112.7R227 M235R227-E231 HydrophobicContact CG-CG 4.42Å; R227-E231 WeakPolarHBondContact CG-OE1 3.06Å; R227-E231 IonicContact CZ-OE1 3.36Å; R227-E231 IonicContact NE-OE1 2.72Å; R227-E231 PolarHBondContact NE-OE1 3.19Å; R227-E231 IonicContact NH2-OE1 3.09Å; R227-E231 PolarHBondContact NH2-OE1 3.18Å; R227-E231 VanDerWaalsContact NH2-OE1 3.09Å; R227-E231 WeakPolarHBondContact O-CG 3.38Å; R227-E231 PolarHBondContact O-N 3.18Å; E231-M235 WeakPolarHBondContact O-CB 3.34Å; E231-M235 WeakPolarHBondContact O-CG 3.38Å; E231-M235 PolarHBondContact O-N 3.39Å; E231-M235 VanDerWaalsContact O-N 3.12Å
232R77.3Confident74.1Confident134 Ų134123.9 Ų123.951%0.50656%0.555SS.*Hα-helixtrans-83.6-17.3174.7-75.1177.7178.2-151.3-3.5115.3L228 F229 K230 S244L228-R232 VanDerWaalsContact O-CB 3.31Å; L228-R232 WeakPolarHBondContact O-CB 3.46Å; L228-R232 VanDerWaalsContact O-CG 3.22Å; L228-R232 WeakPolarHBondContact O-CG 3.38Å; L228-R232 PolarHBondContact O-N 3.05Å; F229-R232 PolarHBondContact O-N 3.35Å; K230-R232 PolarHBondContact O-N 3.44Å; K230-R232 VanDerWaalsContact O-N 3.14Å; R232-S244 PolarHBondContact NH1-OG 3.41Å
233Y73.9Confident73Confident195 Ų195125.6 Ų125.677%0.76557%0.566SS**Hα-helixtrans-77.6-42.6169.8-180-94.5000109.3F229 K230 M235F229-Y233 WeakPolarHBondContact O-CB 3.27Å; F229-Y233 PolarHBondContact O-N 3.18Å; K230-Y233 WeakPolarHBondContact O-CB 3.12Å; K230-Y233 PolarHBondContact O-N 3.26Å; Y233-M235 VanDerWaalsContact C-N 3.32Å; Y233-M235 PolarHBondContact O-N 3.46Å
234D73.2Confident72Confident102 Ų102122.1 Ų122.155%0.54555%0.546SS..Hα-helixtrans-64.5-36.1176.2-54.3-26000111.5K230K230-D234 PolarHBondContact O-N 3.44Å
235M64.7Low71.6Confident124 Ų124121.5 Ų121.561%0.61155%0.547SS*.SBendtrans-105.498.9177.8-60.1-72.2-88.900111E231 Y233 Q237E231-M235 WeakPolarHBondContact O-CB 3.34Å; E231-M235 WeakPolarHBondContact O-CG 3.38Å; E231-M235 PolarHBondContact O-N 3.39Å; E231-M235 VanDerWaalsContact O-N 3.12Å; Y233-M235 VanDerWaalsContact C-N 3.32Å; Y233-M235 PolarHBondContact O-N 3.46Å; M235-Q237 PolarHBondContact O-N 2.98Å
236C64.6Low71.3Confident130 Ų130123.4 Ų123.488%0.87856%0.557SS**  trans-60.656.7-179.7-77.50000116Y238C236-Y238 PolarHBondContact O-N 3.39Å
237Q58.8Low71Confident163 Ų163116.6 Ų116.676%0.76253%0.534SS*.  trans-85.3107-178-77.3-166.8-1900112.6M235M235-Q237 PolarHBondContact O-N 2.98Å
238Y56.2Low70.9Confident188 Ų188111.9 Ų111.974%0.73752%0.52SS*.  trans-78-20.2174.4-165.2-104000113.7C236C236-Y238 PolarHBondContact O-N 3.39Å
239Y54.4Low71.1Confident231 Ų231114.7 Ų114.791%0.90653%0.527SS*.THydrogen-bonded Turntrans-82.2-28.7-151.9-151.4-97.2000117.3
240D57.9Low71.4Confident87 Ų87111.1 Ų111.147%0.46551%0.51SS..THydrogen-bonded Turntrans-116.542.3178.2-168.922.1000113.5H242 T243 S244D240-H242 VanDerWaalsContact C-N 3.35Å; D240-H242 PolarHBondContact O-N 2.85Å; D240-T243 WeakPolarHBondContact OD1-CB 3.37Å; D240-T243 PolarHBondContact OD1-N 3.08Å; D240-T243 PolarHBondContact OD1-OG1 2.93Å; D240-S244 VanDerWaalsContact O-CB 3.29Å; D240-S244 WeakPolarHBondContact O-CB 3.27Å; D240-S244 PolarHBondContact O-N 3.34Å; D240-S244 PolarHBondContact O-OG 3.5Å
241R61.8Low71.5Confident175 Ų175104.9 Ų104.966%0.6648%0.484SS*.Hα-helixtrans-69.5-30.2-177.4-156.7170.7-175.1167.71.3112.9S245R241-S245 WeakPolarHBondContact O-CB 3.49Å; R241-S245 PolarHBondContact O-N 3.12Å; R241-S245 PolarHBondContact O-OG 2.95Å
242H60.2Low71.8Confident158 Ų158103.1 Ų103.173%0.73148%0.481SS*.Hα-helixtrans-80.8-46.5-176.3-107.9-63.1000113.9D240 S245 N246D240-H242 VanDerWaalsContact C-N 3.35Å; D240-H242 PolarHBondContact O-N 2.85Å; H242-S245 PolarHBondContact O-OG 3.34Å; H242-S245 VanDerWaalsContact O-OG 3.12Å; H242-N246 PolarHBondContact O-N 2.86Å
243T63.6Low72.2Confident75 Ų7596.8 Ų96.846%0.4646%0.457SS..Hα-helixtrans-68.6-47178.2-34.40000110.1D240 S245 N246 E247D240-T243 WeakPolarHBondContact OD1-CB 3.37Å; D240-T243 PolarHBondContact OD1-N 3.08Å; D240-T243 PolarHBondContact OD1-OG1 2.93Å; T243-S245 VanDerWaalsContact C-N 3.35Å; T243-S245 PolarHBondContact O-N 2.88Å; T243-N246 PolarHBondContact O-N 3.26Å; T243-E247 PolarHBondContact O-N 2.85Å
244S70.7Confident72.9Confident20 Ų2087.5 Ų87.514%0.1442%0.421CS..Hα-helixtrans-68.9-28.3-177.474.50000114R232 D240 L248R232-S244 PolarHBondContact NH1-OG 3.41Å; D240-S244 VanDerWaalsContact O-CB 3.29Å; D240-S244 WeakPolarHBondContact O-CB 3.27Å; D240-S244 PolarHBondContact O-N 3.34Å; D240-S244 PolarHBondContact O-OG 3.5Å; S244-L248 WeakPolarHBondContact O-CB 3.38Å; S244-L248 PolarHBondContact O-N 3Å
245S77.7Confident73.6Confident30 Ų3084.5 Ų84.521%0.2140%0.404CS..Hα-helixtrans-71.1-30.8173.759.30000113.5R241 H242 T243 R249R241-S245 WeakPolarHBondContact O-CB 3.49Å; R241-S245 PolarHBondContact O-N 3.12Å; R241-S245 PolarHBondContact O-OG 2.95Å; H242-S245 PolarHBondContact O-OG 3.34Å; H242-S245 VanDerWaalsContact O-OG 3.12Å; T243-S245 VanDerWaalsContact C-N 3.35Å; T243-S245 PolarHBondContact O-N 2.88Å; S245-R249 WeakPolarHBondContact O-CB 3.47Å; S245-R249 VanDerWaalsContact O-CG 3.3Å; S245-R249 WeakPolarHBondContact O-CG 3.47Å; S245-R249 PolarHBondContact O-N 3.43Å
246N79.6Confident74.8Confident63 Ų6379.4 Ų79.434%0.33738%0.382SS..Hα-helixtrans-70.7-42.7173.9-78.7-30.4000112H242 T243 R249 R250H242-N246 PolarHBondContact O-N 2.86Å; T243-N246 PolarHBondContact O-N 3.26Å; N246-R249 PolarHBondContact O-N 3.37Å; N246-R250 WeakPolarHBondContact O-CG 3.3Å; N246-R250 PolarHBondContact O-N 3.07Å
247E81.5Confident75.9Confident45 Ų4573.5 Ų73.521%0.2134%0.342CS..Hα-helixtrans-66.2-41.5173.2-73.1-52.4129.100112R132 T243 R249 R250 I251R132-E247 IonicContact NH1-OE2 3.96Å; T243-E247 PolarHBondContact O-N 2.85Å; E247-R249 VanDerWaalsContact C-N 3.31Å; E247-R249 PolarHBondContact O-N 3.16Å; E247-R250 WeakPolarHBondContact O-CB 3.44Å; E247-R250 PolarHBondContact O-N 3.33Å; E247-R250 VanDerWaalsContact O-N 3.14Å; E247-R250 WeakPolarHBondContact OE1-CD 3.38Å; E247-R250 IonicContact OE1-CZ 3.67Å; E247-R250 IonicContact OE1-NE 3.96Å; E247-R250 IonicContact OE1-NH1 2.66Å; E247-R250 PolarHBondContact OE1-NH1 3.42Å; E247-I251 WeakPolarHBondContact O-CD1 3.19Å; E247-I251 VanDerWaalsContact O-CG1 3.28Å; E247-I251 WeakPolarHBondContact O-CG1 3.2Å; E247-I251 PolarHBondContact O-N 3.35Å
248L84.5Confident77.4Confident56 Ų5665.8 Ų65.829%0.29331%0.306SS..Hα-helixtrans-57.2-43.1173.3175.565.8000112.1L225 F229 S244 I251 A252L225-L248 HydrophobicContact CD2-CD1 3.94Å; F229-L248 HydrophobicContact CE1-CD2 4.03Å; F229-L248 HydrophobicContact CE2-CD1 3.92Å; F229-L248 HydrophobicContact CZ-CD1 3.54Å; F229-L248 HydrophobicContact CZ-CD2 3.58Å; F229-L248 HydrophobicContact CZ-CG 4.19Å; S244-L248 WeakPolarHBondContact O-CB 3.38Å; S244-L248 PolarHBondContact O-N 3Å; L248-I251 PolarHBondContact O-N 3.43Å; L248-A252 WeakPolarHBondContact O-CB 3.2Å; L248-A252 PolarHBondContact O-N 3.44Å
249R86.4Confident79Confident110 Ų11059.2 Ų59.242%0.41529%0.285SS..Hα-helixtrans-65-37.6175.8-79.3175177.2158.56.7112.8S245 N246 E247 A252 G253 S321S245-R249 WeakPolarHBondContact O-CB 3.47Å; S245-R249 VanDerWaalsContact O-CG 3.3Å; S245-R249 WeakPolarHBondContact O-CG 3.47Å; S245-R249 PolarHBondContact O-N 3.43Å; N246-R249 PolarHBondContact O-N 3.37Å; E247-R249 VanDerWaalsContact C-N 3.31Å; E247-R249 PolarHBondContact O-N 3.16Å; R249-A252 PolarHBondContact O-N 2.86Å; R249-G253 PolarHBondContact O-N 2.61Å; R249-S321 PolarHBondContact NH1-OG 3.26Å
250R87.5Confident80.7Confident32 Ų3250.7 Ų50.712%0.12126%0.255CS..Hα-helixtrans-62-44.9171.7-76.2170165.4165-1.8111.3F58 N246 E247 G253 H254F58-R250 HydrophobicContact CD1-CG 4.39Å; F58-R250 HydrophobicContact CD2-CB 3.71Å; F58-R250 HydrophobicContact CD2-CG 3.83Å; F58-R250 HydrophobicContact CE1-CG 4.46Å; F58-R250 HydrophobicContact CE2-CB 3.62Å; F58-R250 HydrophobicContact CE2-CG 3.88Å; F58-R250 WeakPolarHBondContact CE2-O 3.47Å; F58-R250 HydrophobicContact CG-CB 4.47Å; F58-R250 HydrophobicContact CG-CG 4.11Å; F58-R250 HydrophobicContact CZ-CB 4.34Å; F58-R250 HydrophobicContact CZ-CG 4.22Å; N246-R250 WeakPolarHBondContact O-CG 3.3Å; N246-R250 PolarHBondContact O-N 3.07Å; E247-R250 WeakPolarHBondContact O-CB 3.44Å; E247-R250 PolarHBondContact O-N 3.33Å; E247-R250 VanDerWaalsContact O-N 3.14Å; E247-R250 WeakPolarHBondContact OE1-CD 3.38Å; E247-R250 IonicContact OE1-CZ 3.67Å; E247-R250 IonicContact OE1-NE 3.96Å; E247-R250 IonicContact OE1-NH1 2.66Å; E247-R250 PolarHBondContact OE1-NH1 3.42Å; R250-G253 PolarHBondContact O-N 3.03Å; R250-H254 PolarHBondContact O-N 3.25Å
251I86.3Confident82.2Confident15 Ų1546.7 Ų46.78%0.07723%0.233CC..Hα-helixtrans-65.3-41.5177.2-61.1157.4000110.7V136 I221 L225 E247 L248 H254 L255V136-I251 HydrophobicContact CG2-CD1 3.68Å; V136-I251 HydrophobicContact CG2-CG1 4.14Å; V136-I251 HydrophobicContact CG2-CG2 4.45Å; I221-I251 HydrophobicContact CG2-CG2 3.45Å; I221-I251 VanDerWaalsContact CG2-CG2 3.45Å; L225-I251 HydrophobicContact CD1-CG2 3.83Å; L225-I251 HydrophobicContact CD2-CD1 4.47Å; L225-I251 HydrophobicContact CD2-CG2 4.45Å; L225-I251 HydrophobicContact CG-CG2 4.42Å; E247-I251 WeakPolarHBondContact O-CD1 3.19Å; E247-I251 VanDerWaalsContact O-CG1 3.28Å; E247-I251 WeakPolarHBondContact O-CG1 3.2Å; E247-I251 PolarHBondContact O-N 3.35Å; L248-I251 PolarHBondContact O-N 3.43Å; I251-H254 PolarHBondContact O-N 2.9Å; I251-L255 WeakPolarHBondContact O-CB 3.28Å; I251-L255 PolarHBondContact O-N 3.18Å
252A86.6Confident83.5Confident33 Ų3341 Ų4127%0.27321%0.213SC..Hα-helixtrans-63.7-41.5176.100000112.6L248 R249 L255 A256 F319L248-A252 WeakPolarHBondContact O-CB 3.2Å; L248-A252 PolarHBondContact O-N 3.44Å; R249-A252 PolarHBondContact O-N 2.86Å; A252-L255 PolarHBondContact O-N 3.35Å; A252-A256 WeakPolarHBondContact O-CB 3.28Å; A252-A256 PolarHBondContact O-N 3.05Å; A252-F319 HydrophobicContact CB-CD1 4.26Å
253G86.2Confident84.9Confident0 Ų038.4 Ų38.40%020%0.204CC..Hα-helixtrans-62.4-42.7174.100000112.7R249 R250 A256 M257R249-G253 PolarHBondContact O-N 2.61Å; R250-G253 PolarHBondContact O-N 3.03Å; G253-A256 PolarHBondContact O-N 2.93Å; G253-M257 WeakPolarHBondContact O-CB 3.5Å; G253-M257 PolarHBondContact O-N 3.39Å
254H88.2Confident86.2Confident1 Ų136.4 Ų36.41%0.00519%0.19CC..Hα-helixtrans-61.8-45.1172.4174.9-88.5000112.2F128 S129 R132 R250 I251 A256 M257 T258F128-H254 AromaticContact CD1-CD2 3.56Å; F128-H254 HydrophobicContact CE1-CB 4.49Å; F128-H254 AromaticContact CE1-CD2 3.49Å; F128-H254 VanDerWaalsContact CE1-CD2 3.49Å; F128-H254 WeakPolarHBondContact CE1-CD2 3.31Å; F128-H254 AromaticContact CG-CD2 3.98Å; F128-H254 HydrophobicContact CZ-CB 4.37Å; F128-H254 AromaticContact CZ-CD2 3.86Å; S129-H254 WeakPolarHBondContact CA-NE2 3.22Å; S129-H254 PolarHBondContact OG-CE1 2.84Å; S129-H254 PolarHBondContact OG-NE2 3.28Å; S129-H254 VanDerWaalsContact OG-NE2 3.16Å; R132-H254 HydrophobicContact CG-CB 4.2Å; R250-H254 PolarHBondContact O-N 3.25Å; I251-H254 PolarHBondContact O-N 2.9Å; H254-A256 VanDerWaalsContact C-N 3.31Å; H254-A256 PolarHBondContact O-N 2.98Å; H254-M257 WeakPolarHBondContact O-CB 3.36Å; H254-M257 PolarHBondContact O-N 3.23Å; H254-T258 VanDerWaalsContact CE1-CG2 3.41Å; H254-T258 WeakPolarHBondContact CE1-CG2 3.42Å; H254-T258 PolarHBondContact O-N 3.17Å; H254-T258 PolarHBondContact O-OG1 3.2Å; H254-T258 VanDerWaalsContact O-OG1 3.14Å
255L89.1Confident87.1Confident38 Ų3835.4 Ų35.420%0.19918%0.183CC..Hα-helixtrans-61.1-41.1179-16675.2000111.3T218 I221 I251 A252 T258 T259T218-L255 HydrophobicContact CG2-CD1 3.63Å; T218-L255 HydrophobicContact CG2-CG 4.45Å; I221-L255 HydrophobicContact CG2-CD1 4.27Å; I251-L255 WeakPolarHBondContact O-CB 3.28Å; I251-L255 PolarHBondContact O-N 3.18Å; A252-L255 PolarHBondContact O-N 3.35Å; L255-T258 PolarHBondContact O-OG1 2.99Å; L255-T259 VanDerWaalsContact O-CB 3.22Å; L255-T259 WeakPolarHBondContact O-CB 3.37Å; L255-T259 PolarHBondContact O-N 3.26Å; L255-T259 PolarHBondContact O-OG1 3.11Å
256A89.3Confident87.8Confident18 Ų1837 Ų3715%0.14919%0.189CC..Hα-helixtrans-63.8-46.6174.600000111.7A252 G253 H254 T259 I260 T315 F319A252-A256 WeakPolarHBondContact O-CB 3.28Å; A252-A256 PolarHBondContact O-N 3.05Å; G253-A256 PolarHBondContact O-N 2.93Å; H254-A256 VanDerWaalsContact C-N 3.31Å; H254-A256 PolarHBondContact O-N 2.98Å; A256-T259 PolarHBondContact O-N 3.44Å; A256-I260 VanDerWaalsContact O-CG1 3.29Å; A256-I260 WeakPolarHBondContact O-CG1 3.03Å; A256-I260 PolarHBondContact O-N 3.09Å; A256-T315 HydrophobicContact CB-CG2 3.99Å; A256-F319 HydrophobicContact CB-CD2 3.72Å; A256-F319 HydrophobicContact CB-CE2 3.26Å; A256-F319 HydrophobicContact CB-CZ 3.74Å
257M88.4Confident88.4Confident6 Ų636 Ų363%0.0319%0.185CC..Hα-helixtrans-57.8-50.3176.4-175.2-173.9-170.700112.1I62 I65 L125 G253 H254 T259 I260 F261 E312 T315I62-M257 HydrophobicContact CD1-SD 4.46Å; I65-M257 HydrophobicContact CB-CE 4.39Å; I65-M257 HydrophobicContact CD1-CE 3.97Å; I65-M257 HydrophobicContact CG2-CE 3.64Å; L125-M257 HydrophobicContact CD1-CE 4.06Å; L125-M257 HydrophobicContact CD1-CG 4.37Å; L125-M257 HydrophobicContact CD1-SD 3.89Å; G253-M257 WeakPolarHBondContact O-CB 3.5Å; G253-M257 PolarHBondContact O-N 3.39Å; H254-M257 WeakPolarHBondContact O-CB 3.36Å; H254-M257 PolarHBondContact O-N 3.23Å; M257-T259 VanDerWaalsContact C-N 3.32Å; M257-T259 PolarHBondContact O-N 3.02Å; M257-I260 PolarHBondContact O-N 3.33Å; M257-F261 WeakPolarHBondContact O-CB 3.33Å; M257-F261 PolarHBondContact O-N 2.89Å; M257-E312 WeakPolarHBondContact CE-OE1 3.32Å; M257-E312 WeakPolarHBondContact CE-OE2 3.41Å; M257-T315 HydrophobicContact CB-CG2 4.46Å
258T89.3Confident88.9Confident0 Ų034.4 Ų34.40%018%0.179CC..Hα-helixtrans-67.2-32.2178.354.40000112.7L125 A214 T218 H254 L255 F262L125-T258 HydrophobicContact CD1-CG2 4.01Å; A214-T258 HydrophobicContact CB-CG2 4.46Å; T218-T258 PolarHBondContact OG1-OG1 3.43Å; H254-T258 VanDerWaalsContact CE1-CG2 3.41Å; H254-T258 WeakPolarHBondContact CE1-CG2 3.42Å; H254-T258 PolarHBondContact O-N 3.17Å; H254-T258 PolarHBondContact O-OG1 3.2Å; H254-T258 VanDerWaalsContact O-OG1 3.14Å; L255-T258 PolarHBondContact O-OG1 2.99Å; T258-F262 VanDerWaalsContact O-CB 3.27Å; T258-F262 WeakPolarHBondContact O-CB 3.14Å; T258-F262 PolarHBondContact O-N 3.31Å
259T90Very high89.2Confident51 Ų5133 Ų3331%0.31317%0.171SC..Hα-helixtrans-70-43.3176.2-58.40000111.7L255 A256 M257 F262 I263L255-T259 VanDerWaalsContact O-CB 3.22Å; L255-T259 WeakPolarHBondContact O-CB 3.37Å; L255-T259 PolarHBondContact O-N 3.26Å; L255-T259 PolarHBondContact O-OG1 3.11Å; A256-T259 PolarHBondContact O-N 3.44Å; M257-T259 VanDerWaalsContact C-N 3.32Å; M257-T259 PolarHBondContact O-N 3.02Å; T259-F262 PolarHBondContact O-N 3.09Å; T259-I263 HydrophobicContact CG2-CD1 3.78Å; T259-I263 HydrophobicContact CG2-CG1 4.44Å; T259-I263 WeakPolarHBondContact O-CB 3.42Å; T259-I263 VanDerWaalsContact O-CG1 3.28Å; T259-I263 WeakPolarHBondContact O-CG1 3.3Å; T259-I263 PolarHBondContact O-N 3.37Å
260I90.3Very high89.5Confident51 Ų5132.1 Ų32.126%0.26217%0.174SC..Hα-helixtrans-62.1-46.6174.6-67.8165.2000110.1A256 M257 F262 I263 L264A256-I260 VanDerWaalsContact O-CG1 3.29Å; A256-I260 WeakPolarHBondContact O-CG1 3.03Å; A256-I260 PolarHBondContact O-N 3.09Å; M257-I260 PolarHBondContact O-N 3.33Å; I260-F262 PolarHBondContact O-N 2.98Å; I260-I263 PolarHBondContact O-N 3.33Å; I260-L264 HydrophobicContact CG2-CD1 3.74Å; I260-L264 HydrophobicContact CG2-CG 4.44Å; I260-L264 WeakPolarHBondContact O-CB 3.46Å; I260-L264 WeakPolarHBondContact O-CG 3.41Å; I260-L264 PolarHBondContact O-N 3.45Å
261F89.7Confident89.7Confident4 Ų430.9 Ų30.92%0.01817%0.17CC..Hα-helixtrans-56.5-47.2175176-99.7000111.9T122 L125 P210 T211 A214 M257 N265 N308T122-F261 HydrophobicContact CG2-CE2 3.68Å; T122-F261 HydrophobicContact CG2-CZ 3.77Å; L125-F261 HydrophobicContact CD2-CB 4.21Å; L125-F261 HydrophobicContact CD2-CD1 3.99Å; L125-F261 HydrophobicContact CD2-CD2 4.01Å; L125-F261 HydrophobicContact CD2-CE1 4.37Å; L125-F261 HydrophobicContact CD2-CE2 4.41Å; L125-F261 HydrophobicContact CD2-CG 3.8Å; P210-F261 HydrophobicContact CB-CE1 4.38Å; P210-F261 HydrophobicContact CB-CZ 4.22Å; T211-F261 HydrophobicContact CG2-CD1 4.21Å; T211-F261 HydrophobicContact CG2-CE1 3.5Å; T211-F261 VanDerWaalsContact CG2-CE1 3.5Å; T211-F261 HydrophobicContact CG2-CZ 3.96Å; A214-F261 HydrophobicContact CB-CD1 4.1Å; A214-F261 HydrophobicContact CB-CE1 4.33Å; M257-F261 WeakPolarHBondContact O-CB 3.33Å; M257-F261 PolarHBondContact O-N 2.89Å; F261-N265 WeakPolarHBondContact CD2-ND2 3.28Å; F261-N265 VanDerWaalsContact CE2-ND2 3.26Å; F261-N265 WeakPolarHBondContact CE2-ND2 3.22Å; F261-N265 WeakPolarHBondContact O-CB 3.44Å; F261-N265 PolarHBondContact O-N 3.45Å; F261-N265 PolarHBondContact O-ND2 3.43Å; F261-N308 VanDerWaalsContact CA-OD1 3.27Å; F261-N308 WeakPolarHBondContact CA-OD1 3.47Å; F261-N308 PolarHBondContact N-OD1 3.46Å
262F88.8Confident89.9Confident55 Ų5531.1 Ų31.124%0.24117%0.172CC..Hα-helixtrans-61.6-51.5178.4179.7-117.5000112.1F215 T258 T259 I260 L264 N265 I266F215-F262 HydrophobicContact CB-CD2 4.02Å; F215-F262 HydrophobicContact CB-CE2 3.71Å; F215-F262 HydrophobicContact CB-CZ 4.18Å; F215-F262 HydrophobicContact CD2-CD1 4.25Å; F215-F262 HydrophobicContact CD2-CD2 4.32Å; F215-F262 AromaticContact CD2-CE1 3.51Å; F215-F262 HydrophobicContact CD2-CE1 3.51Å; F215-F262 AromaticContact CD2-CE2 3.62Å; F215-F262 HydrophobicContact CD2-CE2 3.62Å; F215-F262 AromaticContact CD2-CZ 3.15Å; F215-F262 HydrophobicContact CD2-CZ 3.15Å; F215-F262 AromaticContact CE2-CE1 3.85Å; F215-F262 HydrophobicContact CE2-CE1 3.85Å; F215-F262 HydrophobicContact CE2-CE2 4.42Å; F215-F262 AromaticContact CE2-CZ 3.57Å; F215-F262 HydrophobicContact CE2-CZ 3.57Å; F215-F262 AromaticContact CG-CE2 3.84Å; F215-F262 HydrophobicContact CG-CE2 3.84Å; F215-F262 AromaticContact CG-CZ 3.82Å; F215-F262 HydrophobicContact CG-CZ 3.82Å; T258-F262 VanDerWaalsContact O-CB 3.27Å; T258-F262 WeakPolarHBondContact O-CB 3.14Å; T258-F262 PolarHBondContact O-N 3.31Å; T259-F262 PolarHBondContact O-N 3.09Å; I260-F262 PolarHBondContact O-N 2.98Å; F262-L264 VanDerWaalsContact C-N 3.31Å; F262-L264 PolarHBondContact O-N 2.78Å; F262-N265 PolarHBondContact O-N 2.85Å; F262-I266 HydrophobicContact CD1-CD1 3.82Å; F262-I266 HydrophobicContact CD2-CD1 4.02Å; F262-I266 HydrophobicContact CD2-CG1 4.09Å; F262-I266 HydrophobicContact CE1-CD1 3.53Å; F262-I266 HydrophobicContact CE2-CD1 3.72Å; F262-I266 HydrophobicContact CE2-CG1 3.86Å; F262-I266 HydrophobicContact CG-CD1 4.06Å; F262-I266 HydrophobicContact CZ-CD1 3.47Å; F262-I266 VanDerWaalsContact CZ-CD1 3.47Å; F262-I266 HydrophobicContact CZ-CG1 4.11Å; F262-I266 VanDerWaalsContact O-CG1 3.31Å; F262-I266 WeakPolarHBondContact O-CG1 3.5Å; F262-I266 PolarHBondContact O-N 2.88Å; F262-I266 VanDerWaalsContact O-N 3.08Å
263I90.3Very high90.1Very high104 Ų10433.7 Ų33.753%0.53318%0.181SC..Hα-helixtrans-58.7-41.4-179.1-69.6168.6000111.7T259 I260 P267T259-I263 HydrophobicContact CG2-CD1 3.78Å; T259-I263 HydrophobicContact CG2-CG1 4.44Å; T259-I263 WeakPolarHBondContact O-CB 3.42Å; T259-I263 VanDerWaalsContact O-CG1 3.28Å; T259-I263 WeakPolarHBondContact O-CG1 3.3Å; T259-I263 PolarHBondContact O-N 3.37Å; I260-I263 PolarHBondContact O-N 3.33Å; I263-P267 VanDerWaalsContact O-CD 3.27Å; I263-P267 WeakPolarHBondContact O-CD 3.35Å
264L90Very high90.4Very high32 Ų3237 Ų3717%0.16820%0.198CC..Hα-helixtrans-77-27.8-178.4-67.2174.4000113.6I260 F262 I304 I307 N308I260-L264 HydrophobicContact CG2-CD1 3.74Å; I260-L264 HydrophobicContact CG2-CG 4.44Å; I260-L264 WeakPolarHBondContact O-CB 3.46Å; I260-L264 WeakPolarHBondContact O-CG 3.41Å; I260-L264 PolarHBondContact O-N 3.45Å; F262-L264 VanDerWaalsContact C-N 3.31Å; F262-L264 PolarHBondContact O-N 2.78Å; L264-I304 HydrophobicContact CD2-CG2 4.02Å; L264-I307 HydrophobicContact CD1-CB 4.09Å; L264-I307 HydrophobicContact CD1-CG2 4.11Å; L264-N308 HydrophobicContact CD1-CB 3.89Å
265N90.1Very high90.5Very high0 Ų040.8 Ų40.80%021%0.212CC..Hα-helixtrans-92-20.6-178.2-73.2-82.5000114.5T211 F261 F262 L268 I269T211-N265 HydrophobicContact CG2-CB 3.52Å; F261-N265 WeakPolarHBondContact CD2-ND2 3.28Å; F261-N265 VanDerWaalsContact CE2-ND2 3.26Å; F261-N265 WeakPolarHBondContact CE2-ND2 3.22Å; F261-N265 WeakPolarHBondContact O-CB 3.44Å; F261-N265 PolarHBondContact O-N 3.45Å; F261-N265 PolarHBondContact O-ND2 3.43Å; F262-N265 PolarHBondContact O-N 2.85Å; N265-L268 WeakPolarHBondContact O-CB 3.43Å; N265-L268 PolarHBondContact O-N 3.26Å; N265-I269 WeakPolarHBondContact O-CG1 3.18Å; N265-I269 PolarHBondContact O-N 3.05Å
266I91.3Very high90.5Very high63 Ų6341.2 Ų41.232%0.32321%0.213SC..Hα-helixtrans-55.8-49.7175.3-69.3157.4000112.4F262 L268 I269 I270F262-I266 HydrophobicContact CD1-CD1 3.82Å; F262-I266 HydrophobicContact CD2-CD1 4.02Å; F262-I266 HydrophobicContact CD2-CG1 4.09Å; F262-I266 HydrophobicContact CE1-CD1 3.53Å; F262-I266 HydrophobicContact CE2-CD1 3.72Å; F262-I266 HydrophobicContact CE2-CG1 3.86Å; F262-I266 HydrophobicContact CG-CD1 4.06Å; F262-I266 HydrophobicContact CZ-CD1 3.47Å; F262-I266 VanDerWaalsContact CZ-CD1 3.47Å; F262-I266 HydrophobicContact CZ-CG1 4.11Å; F262-I266 VanDerWaalsContact O-CG1 3.31Å; F262-I266 WeakPolarHBondContact O-CG1 3.5Å; F262-I266 PolarHBondContact O-N 2.88Å; F262-I266 VanDerWaalsContact O-N 3.08Å; I266-L268 VanDerWaalsContact C-N 3.27Å; I266-L268 PolarHBondContact O-N 3.29Å; I266-I269 PolarHBondContact O-N 2.93Å; I266-I270 HydrophobicContact CG2-CD1 3.66Å; I266-I270 HydrophobicContact CG2-CG1 4.3Å; I266-I270 WeakPolarHBondContact O-CG1 3.47Å; I266-I270 PolarHBondContact O-N 3.04Å
267P92.5Very high90.5Very high41 Ų4145.1 Ų45.127%0.26623%0.228SC..Hα-helixtrans-62.4-36.8179.8-22.635.1000112.2I263 V271 F301I263-P267 VanDerWaalsContact O-CD 3.27Å; I263-P267 WeakPolarHBondContact O-CD 3.35Å; P267-V271 WeakPolarHBondContact O-CB 3.36Å; P267-V271 VanDerWaalsContact O-CG2 3.27Å; P267-V271 WeakPolarHBondContact O-CG2 3.4Å; P267-V271 PolarHBondContact O-N 3.39Å; P267-V271 VanDerWaalsContact O-N 3.09Å; P267-F301 HydrophobicContact CB-CD1 3.73Å; P267-F301 HydrophobicContact CB-CD2 4.16Å; P267-F301 HydrophobicContact CB-CE1 3.47Å; P267-F301 VanDerWaalsContact CB-CE1 3.47Å; P267-F301 HydrophobicContact CB-CE2 3.89Å; P267-F301 HydrophobicContact CB-CG 4.1Å; P267-F301 HydrophobicContact CB-CZ 3.56Å; P267-F301 HydrophobicContact CG-CE1 4.24Å
268L91.5Very high90.7Very high13 Ų1344.9 Ų44.97%0.06823%0.227CC..Hα-helixtrans-60.8-48.1174.3-179.257.7000111.1T207 N265 I266 V271 V272 F301 K305T207-L268 HydrophobicContact CG2-CD2 4.36Å; N265-L268 WeakPolarHBondContact O-CB 3.43Å; N265-L268 PolarHBondContact O-N 3.26Å; I266-L268 VanDerWaalsContact C-N 3.27Å; I266-L268 PolarHBondContact O-N 3.29Å; L268-V271 PolarHBondContact O-N 2.96Å; L268-V272 HydrophobicContact CD1-CG2 3.99Å; L268-V272 HydrophobicContact CG-CG2 4.35Å; L268-V272 WeakPolarHBondContact O-CB 3.43Å; L268-V272 VanDerWaalsContact O-CG2 3.23Å; L268-V272 WeakPolarHBondContact O-CG2 3.49Å; L268-V272 PolarHBondContact O-N 3.16Å; L268-F301 HydrophobicContact CB-CB 3.97Å; L268-F301 HydrophobicContact CD1-CB 3.89Å; L268-K305 HydrophobicContact CD2-CD 4.33Å
269I90.4Very high90.6Very high25 Ų2547.9 Ų47.913%0.12824%0.243CC..Hα-helixtrans-60.9-47.8179-69.8163.1000111.3T207 I208 T211 N265 I266 V271 V272 L273T207-I269 HydrophobicContact CG2-CD1 4.09Å; T207-I269 HydrophobicContact CG2-CG1 3.62Å; I208-I269 HydrophobicContact CG1-CD1 4.49Å; I208-I269 HydrophobicContact CG1-CG1 4.19Å; I208-I269 HydrophobicContact CG1-CG2 4.02Å; T211-I269 HydrophobicContact CG2-CD1 3.79Å; T211-I269 WeakPolarHBondContact OG1-CD1 3.46Å; N265-I269 WeakPolarHBondContact O-CG1 3.18Å; N265-I269 PolarHBondContact O-N 3.05Å; I266-I269 PolarHBondContact O-N 2.93Å; I269-V271 VanDerWaalsContact C-N 3.3Å; I269-V271 PolarHBondContact O-N 2.85Å; I269-V272 PolarHBondContact O-N 3.49Å; I269-L273 HydrophobicContact CG2-CD1 3.82Å; I269-L273 HydrophobicContact CG2-CG 4.28Å; I269-L273 WeakPolarHBondContact O-CB 3.34Å; I269-L273 VanDerWaalsContact O-CG 3.31Å; I269-L273 WeakPolarHBondContact O-CG 3.41Å; I269-L273 PolarHBondContact O-N 3.02Å
270I92.9Very high90.5Very high92 Ų9254.5 Ų54.547%0.47226%0.263SS..Hα-helixtrans-56.8-47179-67.7168000110.1I266 L273 L274I266-I270 HydrophobicContact CG2-CD1 3.66Å; I266-I270 HydrophobicContact CG2-CG1 4.3Å; I266-I270 WeakPolarHBondContact O-CG1 3.47Å; I266-I270 PolarHBondContact O-N 3.04Å; I270-L273 PolarHBondContact O-N 2.91Å; I270-L274 HydrophobicContact CG2-CD1 3.99Å; I270-L274 WeakPolarHBondContact O-CB 3.24Å; I270-L274 VanDerWaalsContact O-CG 3.29Å; I270-L274 WeakPolarHBondContact O-CG 3.49Å; I270-L274 PolarHBondContact O-N 3.43Å
271V93Very high90.5Very high7 Ų753.7 Ų53.74%0.04226%0.262CS..Hα-helixtrans-72.3-33.7-177.9176.30000112.3P267 L268 I269 R275 L294 L297 F301P267-V271 WeakPolarHBondContact O-CB 3.36Å; P267-V271 VanDerWaalsContact O-CG2 3.27Å; P267-V271 WeakPolarHBondContact O-CG2 3.4Å; P267-V271 PolarHBondContact O-N 3.39Å; P267-V271 VanDerWaalsContact O-N 3.09Å; L268-V271 PolarHBondContact O-N 2.96Å; I269-V271 VanDerWaalsContact C-N 3.3Å; I269-V271 PolarHBondContact O-N 2.85Å; V271-R275 WeakPolarHBondContact O-CB 3.32Å; V271-R275 PolarHBondContact O-N 3.48Å; V271-L294 HydrophobicContact CG1-CD2 4.33Å; V271-L297 HydrophobicContact CB-CD2 4.48Å; V271-L297 HydrophobicContact CG1-CB 3.95Å; V271-L297 HydrophobicContact CG1-CD2 4.05Å; V271-L297 HydrophobicContact CG1-CG 3.95Å; V271-L297 HydrophobicContact CG2-CD2 3.51Å; V271-L297 HydrophobicContact CG2-CG 3.85Å; V271-F301 HydrophobicContact CB-CD2 4.39Å; V271-F301 HydrophobicContact CG2-CD2 3.89Å; V271-F301 HydrophobicContact CG2-CE2 3.87Å
272V89.3Confident90.5Very high20 Ų2060.7 Ų60.712%0.12129%0.29CS..Hα-helixtrans-64.5-44.8172.5163.90000111.1N203 L268 I269 R275 Q276N203-V272 HydrophobicContact CB-CG1 3.94Å; N203-V272 WeakPolarHBondContact ND2-CG1 3.25Å; N203-V272 WeakPolarHBondContact OD1-CG1 3.45Å; L268-V272 HydrophobicContact CD1-CG2 3.99Å; L268-V272 HydrophobicContact CG-CG2 4.35Å; L268-V272 WeakPolarHBondContact O-CB 3.43Å; L268-V272 VanDerWaalsContact O-CG2 3.23Å; L268-V272 WeakPolarHBondContact O-CG2 3.49Å; L268-V272 PolarHBondContact O-N 3.16Å; I269-V272 PolarHBondContact O-N 3.49Å; V272-R275 PolarHBondContact O-N 3.14Å; V272-Q276 WeakPolarHBondContact O-CG 3.07Å; V272-Q276 PolarHBondContact O-N 3.35Å
273L90.9Very high90.6Very high87 Ų8761.2 Ų61.246%0.45529%0.291SS..Hα-helixtrans-65.1-44.7176.9-69.5173.2000111.7I208 I269 I270 R275 Q276 H277I208-L273 HydrophobicContact CD1-CD2 4.2Å; I269-L273 HydrophobicContact CG2-CD1 3.82Å; I269-L273 HydrophobicContact CG2-CG 4.28Å; I269-L273 WeakPolarHBondContact O-CB 3.34Å; I269-L273 VanDerWaalsContact O-CG 3.31Å; I269-L273 WeakPolarHBondContact O-CG 3.41Å; I269-L273 PolarHBondContact O-N 3.02Å; I270-L273 PolarHBondContact O-N 2.91Å; L273-R275 VanDerWaalsContact C-N 3.29Å; L273-R275 PolarHBondContact O-N 2.82Å; L273-Q276 PolarHBondContact O-N 3.46Å; L273-H277 WeakPolarHBondContact O-CB 3.3Å; L273-H277 PolarHBondContact O-N 2.93Å
274L93Very high90.5Very high69 Ų6960.3 Ų60.336%0.36128%0.284SS..Hα-helixtrans-59.6-40.5173.8-73.5172.2000111.8I270 H277 S278 L294I270-L274 HydrophobicContact CG2-CD1 3.99Å; I270-L274 WeakPolarHBondContact O-CB 3.24Å; I270-L274 VanDerWaalsContact O-CG 3.29Å; I270-L274 WeakPolarHBondContact O-CG 3.49Å; I270-L274 PolarHBondContact O-N 3.43Å; L274-H277 PolarHBondContact O-N 3.26Å; L274-S278 VanDerWaalsContact O-CB 3.28Å; L274-S278 WeakPolarHBondContact O-CB 3.38Å; L274-S278 PolarHBondContact O-N 2.98Å; L274-L294 HydrophobicContact CB-CD1 4.25Å; L274-L294 HydrophobicContact CB-CD2 3.88Å; L274-L294 HydrophobicContact CD1-CD2 4.38Å
275R90.5Very high90.5Very high81 Ų8164.9 Ų64.931%0.30631%0.308SS..Hα-helixtrans-66-45.5175.8-179.4174.9164.7-165.7-11112.2V271 V272 L273 H277 S278 D279 L294 S298V271-R275 WeakPolarHBondContact O-CB 3.32Å; V271-R275 PolarHBondContact O-N 3.48Å; V272-R275 PolarHBondContact O-N 3.14Å; L273-R275 VanDerWaalsContact C-N 3.29Å; L273-R275 PolarHBondContact O-N 2.82Å; R275-H277 VanDerWaalsContact C-N 3.3Å; R275-H277 PolarHBondContact O-N 2.86Å; R275-S278 WeakPolarHBondContact O-CB 3.47Å; R275-S278 PolarHBondContact O-N 3.44Å; R275-D279 IonicContact NE-OD2 3.26Å; R275-D279 WeakPolarHBondContact O-CB 3.38Å; R275-D279 PolarHBondContact O-N 2.97Å; R275-L294 HydrophobicContact CB-CB 4.34Å; R275-S298 PolarHBondContact NH1-OG 2.95Å; R275-S298 VanDerWaalsContact NH1-OG 3.1Å
276Q88.4Confident90.6Very high47 Ų4769.7 Ų69.722%0.2233%0.332CS..Hα-helixtrans-60.8-40.3175.8-74.7-178.8-49.800111.8N203 V272 L273 Y280N203-Q276 PolarHBondContact ND2-NE2 3.48Å; V272-Q276 WeakPolarHBondContact O-CG 3.07Å; V272-Q276 PolarHBondContact O-N 3.35Å; L273-Q276 PolarHBondContact O-N 3.46Å; Q276-Y280 WeakPolarHBondContact O-CB 3.47Å; Q276-Y280 PolarHBondContact O-N 3.01Å
277H90.6Very high90.6Very high100 Ų10073.1 Ų73.146%0.46334%0.342SS..Hα-helixtrans-65.1-44.1173.4179.869.6000112.1L273 L274 R275 D279 Y280 S281L273-H277 WeakPolarHBondContact O-CB 3.3Å; L273-H277 PolarHBondContact O-N 2.93Å; L274-H277 PolarHBondContact O-N 3.26Å; R275-H277 VanDerWaalsContact C-N 3.3Å; R275-H277 PolarHBondContact O-N 2.86Å; H277-D279 VanDerWaalsContact C-N 3.34Å; H277-D279 PolarHBondContact O-N 3.22Å; H277-Y280 PolarHBondContact O-N 2.88Å; H277-S281 PolarHBondContact CE1-OG 3.49Å; H277-S281 VanDerWaalsContact CE1-OG 3.28Å; H277-S281 WeakPolarHBondContact O-CB 3.37Å; H277-S281 PolarHBondContact O-N 3.4Å; H277-S281 PolarHBondContact O-OG 3.08Å; H277-S281 VanDerWaalsContact O-OG 3.1Å
278S91.3Very high90.4Very high1 Ų174.1 Ų74.11%0.00735%0.349CS..Hα-helixtrans-59.9-41.5176-174.20000112.2L274 R275 Y283 T291L274-S278 VanDerWaalsContact O-CB 3.28Å; L274-S278 WeakPolarHBondContact O-CB 3.38Å; L274-S278 PolarHBondContact O-N 2.98Å; R275-S278 WeakPolarHBondContact O-CB 3.47Å; R275-S278 PolarHBondContact O-N 3.44Å; S278-Y283 WeakPolarHBondContact O-CB 3.45Å; S278-Y283 PolarHBondContact O-N 3.39Å; S278-Y283 WeakPolarHBondContact OG-CB 3.28Å; S278-T291 PolarHBondContact OG-OG1 3.26Å
279D87.3Confident90.2Very high62 Ų6279.2 Ų79.233%0.33238%0.376SS..Hα-helixtrans-70.2-41.4178.5-70.6-29.1000110.8R275 H277 Y282R275-D279 IonicContact NE-OD2 3.26Å; R275-D279 WeakPolarHBondContact O-CB 3.38Å; R275-D279 PolarHBondContact O-N 2.97Å; H277-D279 VanDerWaalsContact C-N 3.34Å; H277-D279 PolarHBondContact O-N 3.22Å; D279-Y282 PolarHBondContact O-N 2.95Å
280Y87.7Confident90.2Very high190 Ų19082.1 Ų82.175%0.74539%0.386SS*.Hα-helixtrans-66.7-40.3176.1-177.5-92.7000113.5Q276 H277 Y282Q276-Y280 WeakPolarHBondContact O-CB 3.47Å; Q276-Y280 PolarHBondContact O-N 3.01Å; H277-Y280 PolarHBondContact O-N 2.88Å; Y280-Y282 VanDerWaalsContact O-CD2 3.28Å; Y280-Y282 WeakPolarHBondContact O-CD2 3.19Å; Y280-Y282 WeakPolarHBondContact O-CE2 3.27Å; Y280-Y282 PolarHBondContact O-N 3.45Å
281S90.8Very high90.1Very high34 Ų3477.9 Ų77.924%0.23836%0.364CS..THydrogen-bonded Turntrans-8113.6179.8-58.90000113.6H277 Y283H277-S281 PolarHBondContact CE1-OG 3.49Å; H277-S281 VanDerWaalsContact CE1-OG 3.28Å; H277-S281 WeakPolarHBondContact O-CB 3.37Å; H277-S281 PolarHBondContact O-N 3.4Å; H277-S281 PolarHBondContact O-OG 3.08Å; H277-S281 VanDerWaalsContact O-OG 3.1Å; S281-Y283 VanDerWaalsContact O-CD1 3.28Å; S281-Y283 WeakPolarHBondContact O-CD1 3.41Å; S281-Y283 PolarHBondContact O-N 3.14Å; S281-Y283 VanDerWaalsContact O-N 3.13Å
282Y89.7Confident89.9Confident152 Ų15279.2 Ų79.260%0.59637%0.371SS*.THydrogen-bonded Turntrans55.227.1-179.7-61.2-93.4000114.9D279 Y280 H284 L285D279-Y282 PolarHBondContact O-N 2.95Å; Y280-Y282 VanDerWaalsContact O-CD2 3.28Å; Y280-Y282 WeakPolarHBondContact O-CD2 3.19Å; Y280-Y282 WeakPolarHBondContact O-CE2 3.27Å; Y280-Y282 PolarHBondContact O-N 3.45Å; Y282-H284 AromaticContact CD1-CE1 3.74Å; Y282-H284 PolarHBondContact O-N 3.04Å; Y282-L285 PolarHBondContact O-N 2.97Å
283Y91.5Very high90Very high66 Ų6681.6 Ų81.626%0.25938%0.381SS..Hα-helixtrans-65.2-11.3-178.7-72.93000113.5S278 S281 L285 I286 Y287 Y290 T291S278-Y283 WeakPolarHBondContact O-CB 3.45Å; S278-Y283 PolarHBondContact O-N 3.39Å; S278-Y283 WeakPolarHBondContact OG-CB 3.28Å; S281-Y283 VanDerWaalsContact O-CD1 3.28Å; S281-Y283 WeakPolarHBondContact O-CD1 3.41Å; S281-Y283 PolarHBondContact O-N 3.14Å; S281-Y283 VanDerWaalsContact O-N 3.13Å; Y283-L285 PolarHBondContact O-N 3.04Å; Y283-I286 PolarHBondContact O-N 3.43Å; Y283-Y287 HydrophobicContact CD1-CD2 4.31Å; Y283-Y287 HydrophobicContact CG-CD2 4.29Å; Y283-Y287 CarbonylContact O-C 3.55Å; Y283-Y287 VanDerWaalsContact O-CA 3.3Å; Y283-Y287 WeakPolarHBondContact O-CA 3.49Å; Y283-Y287 PolarHBondContact O-N 2.89Å; Y283-Y287 VanDerWaalsContact O-O 3.13Å; Y283-Y290 HydrophobicContact CD2-CD1 4Å; Y283-Y290 HydrophobicContact CD2-CE1 4.03Å; Y283-Y290 HydrophobicContact CE2-CE1 4.36Å; Y283-T291 VanDerWaalsContact C-OG1 3.24Å; Y283-T291 PolarHBondContact O-OG1 3.26Å; Y283-T291 VanDerWaalsContact O-OG1 3.13Å
284H87.6Confident90.1Very high85 Ų8577.9 Ų77.939%0.39436%0.362SS..Hα-helixtrans-64-25.817064.7-91.7000113Y282 T291Y282-H284 AromaticContact CD1-CE1 3.74Å; Y282-H284 PolarHBondContact O-N 3.04Å; H284-T291 HydrophobicContact CB-CG2 4.18Å; H284-T291 PolarHBondContact N-OG1 3.47Å
285L90.4Very high90Very high127 Ų12777.8 Ų77.867%0.66536%0.359SS*.Hα-helixtrans-86.8-42.5173.9-56.9177.4000111.8Y282 Y283Y282-L285 PolarHBondContact O-N 2.97Å; Y283-L285 PolarHBondContact O-N 3.04Å
286I91.7Very high90.1Very high101 Ų10174.3 Ų74.352%0.51835%0.346SS..Hα-helixtrans-87.2-41.2-169.6-47174.9000111.8Y283Y283-I286 PolarHBondContact O-N 3.43Å
287Y90.9Very high90.4Very high135 Ų13574.3 Ų74.353%0.52935%0.347SS..  trans-135.866.2-174.9-59.4-64.7000111.3Y283 N289 Y290 T291Y283-Y287 HydrophobicContact CD1-CD2 4.31Å; Y283-Y287 HydrophobicContact CG-CD2 4.29Å; Y283-Y287 CarbonylContact O-C 3.55Å; Y283-Y287 VanDerWaalsContact O-CA 3.3Å; Y283-Y287 WeakPolarHBondContact O-CA 3.49Å; Y283-Y287 PolarHBondContact O-N 2.89Å; Y283-Y287 VanDerWaalsContact O-O 3.13Å; Y287-N289 VanDerWaalsContact C-N 3.27Å; Y287-N289 PolarHBondContact O-N 3.18Å; Y287-Y290 PolarHBondContact O-N 2.87Å; Y287-T291 PolarHBondContact O-N 3Å; Y287-T291 VanDerWaalsContact O-N 3.11Å; Y287-T291 PolarHBondContact O-OG1 3.27Å
288P88.6Confident90.5Very high63 Ų6370 Ų7041%0.40933%0.328SS..Hα-helixtrans-59.8-35.3-175.722.7-33.9000113T291 N292P288-T291 PolarHBondContact O-N 3.42Å; P288-N292 WeakPolarHBondContact O-CB 3.33Å; P288-N292 PolarHBondContact O-N 3.29Å; P288-N292 PolarHBondContact O-ND2 3Å
289N88.3Confident90.5Very high120 Ų12073.6 Ų73.664%0.64234%0.343SS*.Hα-helixtrans-62.6-48.4177.7-70.3-9000111.8Y287 T291 N292 Q293Y287-N289 VanDerWaalsContact C-N 3.27Å; Y287-N289 PolarHBondContact O-N 3.18Å; N289-T291 VanDerWaalsContact C-N 3.34Å; N289-T291 PolarHBondContact O-N 2.98Å; N289-N292 PolarHBondContact O-N 3.04Å; N289-N292 VanDerWaalsContact O-N 3.14Å; N289-Q293 WeakPolarHBondContact O-CG 3.45Å; N289-Q293 PolarHBondContact O-N 2.94Å
290Y90.7Very high90.8Very high85 Ų8571.5 Ų71.533%0.33333%0.332SS..Hα-helixtrans-61.4-43.2177.1178.6-107.1000111.7Y283 Y287 N292 Q293 L294Y283-Y290 HydrophobicContact CD2-CD1 4Å; Y283-Y290 HydrophobicContact CD2-CE1 4.03Å; Y283-Y290 HydrophobicContact CE2-CE1 4.36Å; Y287-Y290 PolarHBondContact O-N 2.87Å; Y290-N292 VanDerWaalsContact C-N 3.29Å; Y290-N292 PolarHBondContact O-N 3.5Å; Y290-Q293 WeakPolarHBondContact O-CB 3.44Å; Y290-Q293 PolarHBondContact O-N 3.42Å; Y290-L294 HydrophobicContact CD1-CD1 3.98Å; Y290-L294 HydrophobicContact CE1-CD1 3.39Å; Y290-L294 HydrophobicContact CE1-CG 4.17Å; Y290-L294 HydrophobicContact CE2-CD1 4.42Å; Y290-L294 HydrophobicContact CE2-CG 4.38Å; Y290-L294 PolarHBondContact O-N 3.41Å
291T89.7Confident91.1Very high3 Ų364.5 Ų64.52%0.01831%0.306CS..Hα-helixtrans-58.9-40174.7-58.40000111.7S278 Y283 H284 Y287 P288 N289 K295S278-T291 PolarHBondContact OG-OG1 3.26Å; Y283-T291 VanDerWaalsContact C-OG1 3.24Å; Y283-T291 PolarHBondContact O-OG1 3.26Å; Y283-T291 VanDerWaalsContact O-OG1 3.13Å; H284-T291 HydrophobicContact CB-CG2 4.18Å; H284-T291 PolarHBondContact N-OG1 3.47Å; Y287-T291 PolarHBondContact O-N 3Å; Y287-T291 VanDerWaalsContact O-N 3.11Å; Y287-T291 PolarHBondContact O-OG1 3.27Å; P288-T291 PolarHBondContact O-N 3.42Å; N289-T291 VanDerWaalsContact C-N 3.34Å; N289-T291 PolarHBondContact O-N 2.98Å; T291-K295 HydrophobicContact CG2-CD 4.37Å; T291-K295 VanDerWaalsContact O-CG 3.3Å; T291-K295 WeakPolarHBondContact O-CG 3.29Å; T291-K295 PolarHBondContact O-N 2.71Å
292N89.3Confident91.2Very high35 Ų3564.9 Ų64.919%0.18731%0.308CS..Hα-helixtrans-71.2-38.2176.6-72.9-20.2000112.7P288 N289 Y290 K295 H296P288-N292 WeakPolarHBondContact O-CB 3.33Å; P288-N292 PolarHBondContact O-N 3.29Å; P288-N292 PolarHBondContact O-ND2 3Å; N289-N292 PolarHBondContact O-N 3.04Å; N289-N292 VanDerWaalsContact O-N 3.14Å; Y290-N292 VanDerWaalsContact C-N 3.29Å; Y290-N292 PolarHBondContact O-N 3.5Å; N292-K295 PolarHBondContact O-N 3.16Å; N292-H296 PolarHBondContact O-CD2 3Å; N292-H296 PolarHBondContact O-N 3.5Å
293Q91.8Very high91.4Very high71 Ų7157.6 Ų57.633%0.33228%0.28SS..Hα-helixtrans-58.7-48.7172.4-69.5177.5-56.700111.1E17 N289 Y290 K295 H296 L297E17-Q293 HydrophobicContact CG-CB 4.38Å; E17-Q293 HydrophobicContact CG-CG 4.42Å; E17-Q293 PolarHBondContact OE1-NE2 3.31Å; N289-Q293 WeakPolarHBondContact O-CG 3.45Å; N289-Q293 PolarHBondContact O-N 2.94Å; Y290-Q293 WeakPolarHBondContact O-CB 3.44Å; Y290-Q293 PolarHBondContact O-N 3.42Å; Q293-K295 VanDerWaalsContact C-N 3.33Å; Q293-K295 PolarHBondContact O-N 3.03Å; Q293-H296 PolarHBondContact O-N 3.38Å; Q293-L297 WeakPolarHBondContact O-CB 3.35Å; Q293-L297 PolarHBondContact O-N 2.87Å
294L92.8Very high91.5Very high8 Ų856 Ų564%0.04228%0.275CS..Hα-helixtrans-61.2-38.7176.4-71.5178.6000112.7V271 L274 R275 Y290 S298V271-L294 HydrophobicContact CG1-CD2 4.33Å; L274-L294 HydrophobicContact CB-CD1 4.25Å; L274-L294 HydrophobicContact CB-CD2 3.88Å; L274-L294 HydrophobicContact CD1-CD2 4.38Å; R275-L294 HydrophobicContact CB-CB 4.34Å; Y290-L294 HydrophobicContact CD1-CD1 3.98Å; Y290-L294 HydrophobicContact CE1-CD1 3.39Å; Y290-L294 HydrophobicContact CE1-CG 4.17Å; Y290-L294 HydrophobicContact CE2-CD1 4.42Å; Y290-L294 HydrophobicContact CE2-CG 4.38Å; Y290-L294 PolarHBondContact O-N 3.41Å; L294-S298 VanDerWaalsContact O-CB 3.31Å; L294-S298 WeakPolarHBondContact O-CB 3.4Å; L294-S298 PolarHBondContact O-N 2.99Å; L294-S298 PolarHBondContact O-OG 2.7Å
295K90.3Very high91.7Very high68 Ų6853 Ų5330%0.29626%0.261SS..Hα-helixtrans-60.6-51.1174-75.9167-177.1170.20111.4T291 N292 Q293 S298 K299T291-K295 HydrophobicContact CG2-CD 4.37Å; T291-K295 VanDerWaalsContact O-CG 3.3Å; T291-K295 WeakPolarHBondContact O-CG 3.29Å; T291-K295 PolarHBondContact O-N 2.71Å; N292-K295 PolarHBondContact O-N 3.16Å; Q293-K295 VanDerWaalsContact C-N 3.33Å; Q293-K295 PolarHBondContact O-N 3.03Å; K295-S298 PolarHBondContact O-N 3.14Å; K295-S298 PolarHBondContact O-OG 2.96Å; K295-K299 WeakPolarHBondContact O-CG 3.42Å; K295-K299 PolarHBondContact O-N 3.19Å; K295-K299 VanDerWaalsContact O-N 3.14Å
296H92.2Very high91.8Very high7 Ų747 Ų473%0.03223%0.229CC..Hα-helixtrans-65.5-40.7178.9-71.1-55.3000112.8T12 D13 T15 E17 N292 Q293 K299 L300T12-H296 PolarHBondContact O-NE2 2.9Å; D13-H296 IonicContact OD1-CE1 2.66Å; T15-H296 PolarHBondContact OG1-CD2 2.92Å; E17-H296 HydrophobicContact CB-CB 3.97Å; N292-H296 PolarHBondContact O-CD2 3Å; N292-H296 PolarHBondContact O-N 3.5Å; Q293-H296 PolarHBondContact O-N 3.38Å; H296-K299 PolarHBondContact O-N 3.4Å; H296-L300 WeakPolarHBondContact O-CB 3.49Å; H296-L300 PolarHBondContact O-N 3.45Å
297L94.3Very high92Very high48 Ų4844.5 Ų44.525%0.25122%0.217SC..Hα-helixtrans-65.5-39.3178-168.163.8000111.7V271 Q293 K299 L300 F301V271-L297 HydrophobicContact CB-CD2 4.48Å; V271-L297 HydrophobicContact CG1-CB 3.95Å; V271-L297 HydrophobicContact CG1-CD2 4.05Å; V271-L297 HydrophobicContact CG1-CG 3.95Å; V271-L297 HydrophobicContact CG2-CD2 3.51Å; V271-L297 HydrophobicContact CG2-CG 3.85Å; Q293-L297 WeakPolarHBondContact O-CB 3.35Å; Q293-L297 PolarHBondContact O-N 2.87Å; L297-K299 PolarHBondContact O-N 2.76Å; L297-L300 HydrophobicContact CD1-CD2 4.35Å; L297-L300 PolarHBondContact O-N 3.33Å; L297-F301 HydrophobicContact CD1-CD2 4Å; L297-F301 HydrophobicContact CD1-CE2 3.48Å; L297-F301 VanDerWaalsContact CD1-CE2 3.48Å; L297-F301 HydrophobicContact CD1-CZ 4.19Å; L297-F301 HydrophobicContact CD2-CE2 4.19Å; L297-F301 HydrophobicContact CG-CD2 3.88Å; L297-F301 HydrophobicContact CG-CE2 3.63Å; L297-F301 WeakPolarHBondContact O-CD2 3.16Å; L297-F301 PolarHBondContact O-N 2.92Å
298S92.7Very high92.1Very high8 Ų838.5 Ų38.56%0.05619%0.194CC..Hα-helixtrans-63.2-40.917469.30000112R275 L294 K295 S302R275-S298 PolarHBondContact NH1-OG 2.95Å; R275-S298 VanDerWaalsContact NH1-OG 3.1Å; L294-S298 VanDerWaalsContact O-CB 3.31Å; L294-S298 WeakPolarHBondContact O-CB 3.4Å; L294-S298 PolarHBondContact O-N 2.99Å; L294-S298 PolarHBondContact O-OG 2.7Å; K295-S298 PolarHBondContact O-N 3.14Å; K295-S298 PolarHBondContact O-OG 2.96Å; S298-S302 VanDerWaalsContact O-CB 3.32Å; S298-S302 WeakPolarHBondContact O-CB 3.31Å; S298-S302 PolarHBondContact O-N 3.01Å
299K92Very high92.3Very high77 Ų7735.5 Ų35.534%0.33517%0.174SC..Hα-helixtrans-68-36.3175.2-70.1174.8-179.9179.20112.8M21 R25 K295 H296 L297 S303M21-K299 HydrophobicContact CG-CB 4.17Å; M21-K299 HydrophobicContact SD-CB 3.41Å; M21-K299 WeakPolarHBondContact SD-CB 3.32Å; M21-K299 HydrophobicContact SD-CD 3.68Å; M21-K299 HydrophobicContact SD-CG 4.21Å; R25-K299 PolarHBondContact NH2-O 2.9Å; K295-K299 WeakPolarHBondContact O-CG 3.42Å; K295-K299 PolarHBondContact O-N 3.19Å; K295-K299 VanDerWaalsContact O-N 3.14Å; H296-K299 PolarHBondContact O-N 3.4Å; L297-K299 PolarHBondContact O-N 2.76Å; K299-S303 PolarHBondContact O-N 3.23Å; K299-S303 PolarHBondContact O-OG 3.42Å; K299-S303 VanDerWaalsContact O-OG 3.07Å
300L94.8Very high92.7Very high18 Ų1829.8 Ų29.89%0.09414%0.144CC..Hα-helixtrans-66.1-48.8175.217260.7000111M20 M21 F24 H296 L297 S302 S303 I304M20-L300 HydrophobicContact CB-CD2 4.21Å; M21-L300 HydrophobicContact CB-CB 4.14Å; M21-L300 HydrophobicContact CG-CB 4.25Å; F24-L300 HydrophobicContact CB-CD1 3.83Å; F24-L300 HydrophobicContact CD1-CD1 4.45Å; F24-L300 HydrophobicContact CD2-CD1 4.39Å; F24-L300 HydrophobicContact CG-CD1 3.98Å; H296-L300 WeakPolarHBondContact O-CB 3.49Å; H296-L300 PolarHBondContact O-N 3.45Å; L297-L300 HydrophobicContact CD1-CD2 4.35Å; L297-L300 PolarHBondContact O-N 3.33Å; L300-S302 VanDerWaalsContact C-N 3.31Å; L300-S302 PolarHBondContact O-N 3.42Å; L300-S303 WeakPolarHBondContact O-CB 3.39Å; L300-S303 PolarHBondContact O-N 3.44Å; L300-S303 VanDerWaalsContact O-N 3.15Å; L300-I304 HydrophobicContact CD1-CD1 3.89Å; L300-I304 HydrophobicContact CD1-CG1 4.27Å; L300-I304 HydrophobicContact CG-CD1 3.89Å; L300-I304 WeakPolarHBondContact O-CG1 3.21Å; L300-I304 PolarHBondContact O-N 3.01Å
301F93.8Very high92.9Very high44 Ų4428.6 Ų28.619%0.19314%0.142CC..Hα-helixtrans-67.1-32.3177.5-74.8-56.4000112.8P267 L268 V271 L297 I304 K305P267-F301 HydrophobicContact CB-CD1 3.73Å; P267-F301 HydrophobicContact CB-CD2 4.16Å; P267-F301 HydrophobicContact CB-CE1 3.47Å; P267-F301 VanDerWaalsContact CB-CE1 3.47Å; P267-F301 HydrophobicContact CB-CE2 3.89Å; P267-F301 HydrophobicContact CB-CG 4.1Å; P267-F301 HydrophobicContact CB-CZ 3.56Å; P267-F301 HydrophobicContact CG-CE1 4.24Å; L268-F301 HydrophobicContact CB-CB 3.97Å; L268-F301 HydrophobicContact CD1-CB 3.89Å; V271-F301 HydrophobicContact CB-CD2 4.39Å; V271-F301 HydrophobicContact CG2-CD2 3.89Å; V271-F301 HydrophobicContact CG2-CE2 3.87Å; L297-F301 HydrophobicContact CD1-CD2 4Å; L297-F301 HydrophobicContact CD1-CE2 3.48Å; L297-F301 VanDerWaalsContact CD1-CE2 3.48Å; L297-F301 HydrophobicContact CD1-CZ 4.19Å; L297-F301 HydrophobicContact CD2-CE2 4.19Å; L297-F301 HydrophobicContact CG-CD2 3.88Å; L297-F301 HydrophobicContact CG-CE2 3.63Å; L297-F301 WeakPolarHBondContact O-CD2 3.16Å; L297-F301 PolarHBondContact O-N 2.92Å; F301-I304 HydrophobicContact CD1-CD1 3.81Å; F301-I304 HydrophobicContact CE1-CD1 4.1Å; F301-I304 PolarHBondContact O-N 2.9Å; F301-K305 PolarHBondContact O-N 3.19Å
302S91.1Very high93.1Very high41 Ų4128.6 Ų28.629%0.28714%0.142SC..Hα-helixtrans-61.9-42.2169.4-1730000112S298 L300 K305S298-S302 VanDerWaalsContact O-CB 3.32Å; S298-S302 WeakPolarHBondContact O-CB 3.31Å; S298-S302 PolarHBondContact O-N 3.01Å; L300-S302 VanDerWaalsContact C-N 3.31Å; L300-S302 PolarHBondContact O-N 3.42Å; S302-K305 WeakPolarHBondContact O-CB 3.41Å; S302-K305 PolarHBondContact O-N 2.87Å
303S94.1Very high93.4Very high0 Ų028.4 Ų28.40%014%0.139CC..Hα-helixtrans-62.4-42.7171.6-60.80000112.5R25 D81 K299 L300 K305 S306R25-S303 PolarHBondContact NE-OG 3.28Å; R25-S303 PolarHBondContact NH2-OG 3.37Å; D81-S303 WeakPolarHBondContact OD2-CA 3.26Å; D81-S303 WeakPolarHBondContact OD2-CB 3.2Å; D81-S303 PolarHBondContact OD2-OG 2.96Å; K299-S303 PolarHBondContact O-N 3.23Å; K299-S303 PolarHBondContact O-OG 3.42Å; K299-S303 VanDerWaalsContact O-OG 3.07Å; L300-S303 WeakPolarHBondContact O-CB 3.39Å; L300-S303 PolarHBondContact O-N 3.44Å; L300-S303 VanDerWaalsContact O-N 3.15Å; S303-K305 VanDerWaalsContact C-N 3.28Å; S303-K305 PolarHBondContact O-N 3.14Å; S303-S306 WeakPolarHBondContact O-CB 3.47Å; S303-S306 PolarHBondContact O-N 3.31Å; S303-S306 VanDerWaalsContact O-N 3.13Å; S303-S306 PolarHBondContact O-OG 3.28Å
304I94.3Very high93.6Very high31 Ų3126.3 Ų26.316%0.15913%0.132CC..Hα-helixtrans-62.7-31.6179.1-72.9166.8000111.9F24 L264 L300 F301 S306 I307F24-I304 HydrophobicContact CD2-CG1 4.34Å; F24-I304 HydrophobicContact CE1-CG1 4.19Å; F24-I304 HydrophobicContact CE2-CG1 3.8Å; F24-I304 HydrophobicContact CZ-CB 4.46Å; F24-I304 HydrophobicContact CZ-CG1 3.72Å; L264-I304 HydrophobicContact CD2-CG2 4.02Å; L300-I304 HydrophobicContact CD1-CD1 3.89Å; L300-I304 HydrophobicContact CD1-CG1 4.27Å; L300-I304 HydrophobicContact CG-CD1 3.89Å; L300-I304 WeakPolarHBondContact O-CG1 3.21Å; L300-I304 PolarHBondContact O-N 3.01Å; F301-I304 HydrophobicContact CD1-CD1 3.81Å; F301-I304 HydrophobicContact CE1-CD1 4.1Å; F301-I304 PolarHBondContact O-N 2.9Å; I304-S306 PolarHBondContact O-N 2.9Å; I304-S306 VanDerWaalsContact O-N 3.11Å; I304-I307 HydrophobicContact CG2-CD1 4.24Å; I304-I307 VanDerWaalsContact O-CB 3.26Å; I304-I307 WeakPolarHBondContact O-CB 3.38Å; I304-I307 WeakPolarHBondContact O-CG1 3.45Å; I304-I307 PolarHBondContact O-N 3.11Å
305K91.1Very high93.6Very high23 Ų2326.2 Ų26.210%0.113%0.132CC..Hα-helixtrans-53-31.3173.4-175.9179172.8-101.30112.5E72 L268 F301 S302 S303 I307 N308E72-K305 IonicContact OE1-NZ 2.6Å; E72-K305 PolarHBondContact OE1-NZ 3.25Å; E72-K305 IonicContact OE2-NZ 3.74Å; E72-K305 PolarHBondContact OE2-NZ 2.8Å; L268-K305 HydrophobicContact CD2-CD 4.33Å; F301-K305 PolarHBondContact O-N 3.19Å; S302-K305 WeakPolarHBondContact O-CB 3.41Å; S302-K305 PolarHBondContact O-N 2.87Å; S303-K305 VanDerWaalsContact C-N 3.28Å; S303-K305 PolarHBondContact O-N 3.14Å; K305-I307 PolarHBondContact O-N 3.03Å; K305-I307 VanDerWaalsContact O-N 3.1Å; K305-N308 WeakPolarHBondContact O-CB 3.17Å; K305-N308 PolarHBondContact O-N 2.72Å
306S93.4Very high93.8Very high0 Ų023 Ų230%012%0.118CC..Hα-helixtrans-58.5-22.5175.5-50.10000113.8S303 I304 N308 A309 A310S303-S306 WeakPolarHBondContact O-CB 3.47Å; S303-S306 PolarHBondContact O-N 3.31Å; S303-S306 VanDerWaalsContact O-N 3.13Å; S303-S306 PolarHBondContact O-OG 3.28Å; I304-S306 PolarHBondContact O-N 2.9Å; I304-S306 VanDerWaalsContact O-N 3.11Å; S306-N308 VanDerWaalsContact C-N 3.29Å; S306-N308 PolarHBondContact O-N 3.44Å; S306-A309 PolarHBondContact O-N 2.93Å; S306-A310 PolarHBondContact O-N 2.88Å; S306-A310 VanDerWaalsContact O-N 3.16Å
307I94.9Very high93.9Very high49 Ų4925.5 Ų25.525%0.25113%0.129SC..Hα-helixtrans-61.2-39.9171.5-62.4176.9000110.3F24 I32 L264 I304 K305 A309 A310 M311F24-I307 HydrophobicContact CZ-CD1 4.26Å; I32-I307 HydrophobicContact CD1-CD1 4.22Å; I32-I307 HydrophobicContact CD1-CG1 3.52Å; I32-I307 HydrophobicContact CG1-CG1 4.25Å; L264-I307 HydrophobicContact CD1-CB 4.09Å; L264-I307 HydrophobicContact CD1-CG2 4.11Å; I304-I307 HydrophobicContact CG2-CD1 4.24Å; I304-I307 VanDerWaalsContact O-CB 3.26Å; I304-I307 WeakPolarHBondContact O-CB 3.38Å; I304-I307 WeakPolarHBondContact O-CG1 3.45Å; I304-I307 PolarHBondContact O-N 3.11Å; K305-I307 PolarHBondContact O-N 3.03Å; K305-I307 VanDerWaalsContact O-N 3.1Å; I307-A309 VanDerWaalsContact C-N 3.33Å; I307-A309 PolarHBondContact O-N 3.36Å; I307-A310 CarbonylContact O-C 3.59Å; I307-A310 PolarHBondContact O-N 2.79Å; I307-M311 HydrophobicContact CG2-CG 3.93Å; I307-M311 VanDerWaalsContact O-CG 3.28Å; I307-M311 WeakPolarHBondContact O-CG 3.46Å; I307-M311 PolarHBondContact O-N 2.91Å
308N93.1Very high93.8Very high9 Ų928.1 Ų28.15%0.04814%0.142CC..Hα-helixtrans-57.8-47.7177.1-17373000111.1F261 L264 K305 S306 A310 M311F261-N308 VanDerWaalsContact CA-OD1 3.27Å; F261-N308 WeakPolarHBondContact CA-OD1 3.47Å; F261-N308 PolarHBondContact N-OD1 3.46Å; L264-N308 HydrophobicContact CD1-CB 3.89Å; K305-N308 WeakPolarHBondContact O-CB 3.17Å; K305-N308 PolarHBondContact O-N 2.72Å; S306-N308 VanDerWaalsContact C-N 3.29Å; S306-N308 PolarHBondContact O-N 3.44Å; N308-A310 PolarHBondContact O-N 3.36Å; N308-M311 PolarHBondContact O-N 3.24Å
309A94.2Very high93.7Very high0 Ų031.5 Ų31.50%016%0.156CC..Hα-helixtrans-61.7-28.5177.100000112.9N40 H69 L73 S306 I307N40-A309 PolarHBondContact ND2-O 3.15Å; N40-A309 PolarHBondContact OD1-O 2.98Å; H69-A309 HydrophobicContact CB-CB 3.82Å; L73-A309 HydrophobicContact CD1-CB 4.3Å; L73-A309 HydrophobicContact CD2-CB 4.14Å; L73-A309 HydrophobicContact CG-CB 3.92Å; S306-A309 PolarHBondContact O-N 2.93Å; I307-A309 VanDerWaalsContact C-N 3.33Å; I307-A309 PolarHBondContact O-N 3.36Å
310A96.2Very high93.7Very high1 Ų128 Ų281%0.00814%0.14CC..Hα-helixtrans-87.9-16.3177.600000114.7I32 L73 S306 I307 N308I32-A310 HydrophobicContact CG2-CB 3.76Å; L73-A310 HydrophobicContact CD2-CB 4.49Å; S306-A310 PolarHBondContact O-N 2.88Å; S306-A310 VanDerWaalsContact O-N 3.16Å; I307-A310 CarbonylContact O-C 3.59Å; I307-A310 PolarHBondContact O-N 2.79Å; N308-A310 PolarHBondContact O-N 3.36Å
311M94.5Very high93.4Very high59 Ų5927.9 Ų27.929%0.29114%0.142SC..SBendtrans-85.3-2-176.2-74.9-58.5103.500114.9F35 I307 N308 P314 T315F35-M311 HydrophobicContact CD1-CE 4.35Å; F35-M311 HydrophobicContact CE1-CE 4.03Å; I307-M311 HydrophobicContact CG2-CG 3.93Å; I307-M311 VanDerWaalsContact O-CG 3.28Å; I307-M311 WeakPolarHBondContact O-CG 3.46Å; I307-M311 PolarHBondContact O-N 2.91Å; N308-M311 PolarHBondContact O-N 3.24Å; M311-P314 HydrophobicContact CE-CG 4.2Å; M311-P314 WeakPolarHBondContact O-CD 3.42Å; M311-P314 HydrophobicContact SD-CB 4.4Å; M311-P314 HydrophobicContact SD-CG 4.05Å; M311-T315 VanDerWaalsContact O-CB 3.31Å; M311-T315 WeakPolarHBondContact O-CB 3.39Å; M311-T315 PolarHBondContact O-N 2.86Å; M311-T315 PolarHBondContact O-OG1 3.41Å
312E93.8Very high93.2Very high4 Ų427 Ų272%0.01914%0.14CC..Hα-helixtrans-54.6-54.3176.4-64.9-80.4-145.400112.4N40 H69 M257 T315 F316N40-E312 WeakPolarHBondContact OD1-CB 3.45Å; H69-E312 IonicContact CE1-OE1 3.88Å; H69-E312 PolarHBondContact CE1-OE1 3.34Å; H69-E312 VanDerWaalsContact CE1-OE1 3.26Å; H69-E312 IonicContact ND1-OE1 2.95Å; H69-E312 PolarHBondContact ND1-OE1 2.99Å; M257-E312 WeakPolarHBondContact CE-OE1 3.32Å; M257-E312 WeakPolarHBondContact CE-OE2 3.41Å; E312-T315 WeakPolarHBondContact O-CB 3.29Å; E312-T315 PolarHBondContact O-N 3.33Å; E312-T315 VanDerWaalsContact O-N 3.15Å; E312-F316 HydrophobicContact CB-CD2 4.42Å; E312-F316 HydrophobicContact CB-CE2 3.96Å; E312-F316 WeakPolarHBondContact O-CD2 3.46Å; E312-F316 PolarHBondContact O-N 3.37Å; E312-F316 WeakPolarHBondContact OE2-CE2 3.33Å; E312-F316 VanDerWaalsContact OE2-CZ 3.3Å; E312-F316 WeakPolarHBondContact OE2-CZ 3.39Å
313F95.9Very high93.3Very high30 Ų3025 Ų2513%0.13213%0.127CC..Hα-helixtrans-60.7-50.5-178.6177.5-85.1000112.7F35 L42 V43 T315 F316 F317 F323 F327F35-F313 HydrophobicContact CZ-CD1 4.49Å; L42-F313 HydrophobicContact CB-CD2 4.16Å; L42-F313 HydrophobicContact CB-CE2 4.16Å; L42-F313 HydrophobicContact CD1-CE2 4.11Å; V43-F313 HydrophobicContact CG2-CB 3.86Å; V43-F313 HydrophobicContact CG2-CD2 4.12Å; V43-F313 HydrophobicContact CG2-CG 4.49Å; F313-T315 VanDerWaalsContact C-N 3.3Å; F313-T315 PolarHBondContact O-N 2.92Å; F313-F316 PolarHBondContact O-N 3.38Å; F313-F317 HydrophobicContact CE1-CB 4.43Å; F313-F317 HydrophobicContact CZ-CD2 4.28Å; F313-F317 WeakPolarHBondContact O-CB 3.39Å; F313-F317 PolarHBondContact O-N 2.97Å; F313-F323 HydrophobicContact CD2-CE1 4.03Å; F313-F323 AromaticContact CD2-CZ 3.83Å; F313-F323 HydrophobicContact CD2-CZ 3.83Å; F313-F323 AromaticContact CE2-CE1 3.89Å; F313-F323 HydrophobicContact CE2-CE1 3.89Å; F313-F323 AromaticContact CE2-CZ 3.99Å; F313-F323 HydrophobicContact CE2-CZ 3.99Å; F313-F327 HydrophobicContact CE2-CD2 4.22Å; F313-F327 HydrophobicContact CE2-CE2 4.13Å; F313-F327 HydrophobicContact CZ-CD2 4.37Å; F313-F327 HydrophobicContact CZ-CE2 4.02Å; F313-F327 HydrophobicContact CZ-CZ 4.15Å
314P95.3Very high93.3Very high28 Ų2828.7 Ų28.718%0.18214%0.141CC..Hα-helixtrans-51.2-46.4169.8-29.234.5000113.5F35 M311 F317 I318F35-P314 HydrophobicContact CE1-CG 3.63Å; F35-P314 HydrophobicContact CZ-CG 3.68Å; M311-P314 HydrophobicContact CE-CG 4.2Å; M311-P314 WeakPolarHBondContact O-CD 3.42Å; M311-P314 HydrophobicContact SD-CB 4.4Å; M311-P314 HydrophobicContact SD-CG 4.05Å; P314-F317 PolarHBondContact O-N 3.16Å; P314-I318 WeakPolarHBondContact O-CB 3.48Å; P314-I318 VanDerWaalsContact O-CG1 3.26Å; P314-I318 WeakPolarHBondContact O-CG1 3.31Å; P314-I318 PolarHBondContact O-N 3.45Å
315T93.5Very high93.2Very high6 Ų633.4 Ų33.44%0.03716%0.162CC..Hα-helixtrans-61.6-52-176.8-59.40000110.8A256 M257 M311 E312 F313 F317 I318 F319A256-T315 HydrophobicContact CB-CG2 3.99Å; M257-T315 HydrophobicContact CB-CG2 4.46Å; M311-T315 VanDerWaalsContact O-CB 3.31Å; M311-T315 WeakPolarHBondContact O-CB 3.39Å; M311-T315 PolarHBondContact O-N 2.86Å; M311-T315 PolarHBondContact O-OG1 3.41Å; E312-T315 WeakPolarHBondContact O-CB 3.29Å; E312-T315 PolarHBondContact O-N 3.33Å; E312-T315 VanDerWaalsContact O-N 3.15Å; F313-T315 VanDerWaalsContact C-N 3.3Å; F313-T315 PolarHBondContact O-N 2.92Å; T315-F317 VanDerWaalsContact C-N 3.35Å; T315-F317 PolarHBondContact O-N 2.82Å; T315-I318 PolarHBondContact O-N 3.39Å; T315-F319 HydrophobicContact CG2-CD2 3.98Å; T315-F319 HydrophobicContact CG2-CE2 4.44Å; T315-F319 VanDerWaalsContact O-CD2 3.26Å; T315-F319 WeakPolarHBondContact O-CD2 3.46Å; T315-F319 PolarHBondContact O-N 2.81Å
316F94.3Very high93.3Very high1 Ų134 Ų340%0.00417%0.165CC..Hα-helixtrans-68.3-34178.1-56.7-53000112.6V43 F47 F58 I62 E312 F313 L320 F323V43-F316 HydrophobicContact CG1-CD2 3.92Å; V43-F316 HydrophobicContact CG1-CE2 3.97Å; V43-F316 HydrophobicContact CG2-CD2 3.98Å; F47-F316 HydrophobicContact CE2-CB 4.28Å; F47-F316 HydrophobicContact CE2-CD1 4.24Å; F47-F316 AromaticContact CE2-CD2 3.78Å; F47-F316 HydrophobicContact CE2-CD2 3.78Å; F47-F316 HydrophobicContact CE2-CE2 4.23Å; F47-F316 AromaticContact CE2-CG 3.81Å; F47-F316 HydrophobicContact CE2-CG 3.81Å; F47-F316 HydrophobicContact CZ-CB 4.42Å; F47-F316 HydrophobicContact CZ-CD1 4.03Å; F47-F316 HydrophobicContact CZ-CD2 4.39Å; F47-F316 AromaticContact CZ-CG 4Å; F47-F316 HydrophobicContact CZ-CG 4Å; F58-F316 HydrophobicContact CZ-CE1 4.29Å; I62-F316 HydrophobicContact CB-CZ 4.38Å; I62-F316 HydrophobicContact CD1-CE1 3.78Å; I62-F316 HydrophobicContact CD1-CZ 3.49Å; I62-F316 VanDerWaalsContact CD1-CZ 3.49Å; I62-F316 HydrophobicContact CG1-CE1 4.01Å; I62-F316 HydrophobicContact CG1-CZ 3.84Å; I62-F316 HydrophobicContact CG2-CD2 4.3Å; I62-F316 HydrophobicContact CG2-CE1 4.38Å; I62-F316 HydrophobicContact CG2-CE2 3.51Å; I62-F316 HydrophobicContact CG2-CZ 3.6Å; E312-F316 HydrophobicContact CB-CD2 4.42Å; E312-F316 HydrophobicContact CB-CE2 3.96Å; E312-F316 WeakPolarHBondContact O-CD2 3.46Å; E312-F316 PolarHBondContact O-N 3.37Å; E312-F316 WeakPolarHBondContact OE2-CE2 3.33Å; E312-F316 VanDerWaalsContact OE2-CZ 3.3Å; E312-F316 WeakPolarHBondContact OE2-CZ 3.39Å; F313-F316 PolarHBondContact O-N 3.38Å; F316-L320 HydrophobicContact CD1-CD1 4.18Å; F316-L320 HydrophobicContact CD1-CD2 4.17Å; F316-L320 WeakPolarHBondContact O-CA 3.31Å; F316-L320 WeakPolarHBondContact O-CB 3.47Å; F316-L320 PolarHBondContact O-N 3.43Å; F316-F323 HydrophobicContact CB-CB 4.39Å; F316-F323 HydrophobicContact CB-CD1 4Å; F316-F323 HydrophobicContact CB-CD2 3.81Å; F316-F323 HydrophobicContact CB-CE1 4.17Å; F316-F323 HydrophobicContact CB-CE2 4Å; F316-F323 HydrophobicContact CB-CG 3.81Å; F316-F323 HydrophobicContact CB-CZ 4.17Å
317F94.6Very high93.4Very high58 Ų5835.9 Ų35.925%0.25417%0.173SC..Hα-helixtrans-65-39.7175.9-171.6-91.4000112.6F313 P314 T315 F323 R324 F327F313-F317 HydrophobicContact CE1-CB 4.43Å; F313-F317 HydrophobicContact CZ-CD2 4.28Å; F313-F317 WeakPolarHBondContact O-CB 3.39Å; F313-F317 PolarHBondContact O-N 2.97Å; P314-F317 PolarHBondContact O-N 3.16Å; T315-F317 VanDerWaalsContact C-N 3.35Å; T315-F317 PolarHBondContact O-N 2.82Å; F317-F323 HydrophobicContact CB-CD1 4.38Å; F317-F323 HydrophobicContact CB-CE1 4.26Å; F317-R324 HydrophobicContact CD2-CG 3.9Å; F317-R324 HydrophobicContact CE2-CG 3.95Å; F317-R324 HydrophobicContact CG-CG 4.25Å; F317-R324 HydrophobicContact CZ-CG 4.34Å; F317-R324 WeakPolarHBondContact O-CD 3.22Å; F317-R324 WeakPolarHBondContact O-CG 3.48Å; F317-R324 PolarHBondContact O-NH1 3.32Å; F317-F327 HydrophobicContact CD2-CD1 4.37Å; F317-F327 AromaticContact CE2-CD1 3.88Å; F317-F327 HydrophobicContact CE2-CD1 3.88Å; F317-F327 HydrophobicContact CE2-CE1 4.13Å
318I93.2Very high93.3Very high103 Ų10339.6 Ų39.653%0.52819%0.185SC..Hα-helixtrans-73.5-52.9178.9-69.2165.6000110.8P314 T315 R324P314-I318 WeakPolarHBondContact O-CB 3.48Å; P314-I318 VanDerWaalsContact O-CG1 3.26Å; P314-I318 WeakPolarHBondContact O-CG1 3.31Å; P314-I318 PolarHBondContact O-N 3.45Å; T315-I318 PolarHBondContact O-N 3.39Å; I318-R324 PolarHBondContact O-NH1 3.36Å
319F90.7Very high93.2Very high80 Ų8046.2 Ų46.235%0.35121%0.21SC..Hα-helixtrans-88.4-28.5-168-65.2-73.5000114.6A252 A256 T315A252-F319 HydrophobicContact CB-CD1 4.26Å; A256-F319 HydrophobicContact CB-CD2 3.72Å; A256-F319 HydrophobicContact CB-CE2 3.26Å; A256-F319 HydrophobicContact CB-CZ 3.74Å; T315-F319 HydrophobicContact CG2-CD2 3.98Å; T315-F319 HydrophobicContact CG2-CE2 4.44Å; T315-F319 VanDerWaalsContact O-CD2 3.26Å; T315-F319 WeakPolarHBondContact O-CD2 3.46Å; T315-F319 PolarHBondContact O-N 2.81Å
320L91.3Very high93Very high2 Ų248.2 Ų48.21%0.0122%0.221CC..  trans-105.5105.9-175.1-79.966.3000112.5F47 F58 F316 S322 F323 R324F47-L320 HydrophobicContact CE1-CD2 4.23Å; F47-L320 HydrophobicContact CZ-CD2 3.9Å; F58-L320 HydrophobicContact CE1-CD2 3.61Å; F58-L320 HydrophobicContact CZ-CD1 4.49Å; F58-L320 HydrophobicContact CZ-CD2 3.74Å; F316-L320 HydrophobicContact CD1-CD1 4.18Å; F316-L320 HydrophobicContact CD1-CD2 4.17Å; F316-L320 WeakPolarHBondContact O-CA 3.31Å; F316-L320 WeakPolarHBondContact O-CB 3.47Å; F316-L320 PolarHBondContact O-N 3.43Å; L320-S322 VanDerWaalsContact C-N 3.29Å; L320-S322 PolarHBondContact O-N 3.43Å; L320-F323 HydrophobicContact CB-CB 3.71Å; L320-F323 WeakPolarHBondContact O-CB 3.26Å; L320-F323 PolarHBondContact O-N 3.21Å; L320-R324 PolarHBondContact O-N 3.46Å
321S88.8Confident92.5Very high17 Ų1750.5 Ų50.512%0.11924%0.236CC..Hα-helixtrans-60.7-35.6173.652.40000113.5R249 R324 Q325R249-S321 PolarHBondContact NH1-OG 3.26Å; S321-R324 PolarHBondContact O-N 3.04Å; S321-Q325 WeakPolarHBondContact O-CG 3.19Å; S321-Q325 PolarHBondContact O-N 3.3Å
322S89.6Confident91.9Very high24 Ų2450.7 Ų50.717%0.16824%0.243CC..Hα-helixtrans-66.1-37.4176.848.20000112.1L320 Q325 H326L320-S322 VanDerWaalsContact C-N 3.29Å; L320-S322 PolarHBondContact O-N 3.43Å; S322-Q325 PolarHBondContact O-N 3.08Å; S322-H326 PolarHBondContact O-N 3.36Å; S322-H326 PolarHBondContact O-ND1 2.9Å
323F93Very high90.6Very high0 Ų053.6 Ų53.60%026%0.256CS..Hα-helixtrans-61.9-50.3173.3-176.5-91.2000110.7V43 I46 F47 F313 F316 F317 L320 Q325 H326 F327V43-F323 HydrophobicContact CB-CE2 4.43Å; V43-F323 HydrophobicContact CG2-CE2 4.03Å; V43-F323 HydrophobicContact CG2-CZ 3.82Å; I46-F323 HydrophobicContact CB-CD2 4.12Å; I46-F323 HydrophobicContact CB-CE2 3.82Å; I46-F323 HydrophobicContact CD1-CD2 4.3Å; I46-F323 HydrophobicContact CD1-CE1 3.99Å; I46-F323 HydrophobicContact CD1-CE2 3.66Å; I46-F323 HydrophobicContact CD1-CZ 3.48Å; I46-F323 VanDerWaalsContact CD1-CZ 3.48Å; I46-F323 HydrophobicContact CG1-CE2 4.37Å; I46-F323 HydrophobicContact CG2-CD2 3.46Å; I46-F323 VanDerWaalsContact CG2-CD2 3.46Å; I46-F323 HydrophobicContact CG2-CE2 3.71Å; I46-F323 HydrophobicContact CG2-CG 4.16Å; F47-F323 HydrophobicContact CD2-CD2 4.23Å; F47-F323 HydrophobicContact CD2-CE2 4.15Å; F47-F323 AromaticContact CE2-CD2 3.59Å; F47-F323 HydrophobicContact CE2-CD2 3.59Å; F47-F323 AromaticContact CE2-CE2 3.73Å; F47-F323 HydrophobicContact CE2-CE2 3.73Å; F47-F323 AromaticContact CZ-CD2 3.92Å; F47-F323 HydrophobicContact CZ-CD2 3.92Å; F313-F323 HydrophobicContact CD2-CE1 4.03Å; F313-F323 AromaticContact CD2-CZ 3.83Å; F313-F323 HydrophobicContact CD2-CZ 3.83Å; F313-F323 AromaticContact CE2-CE1 3.89Å; F313-F323 HydrophobicContact CE2-CE1 3.89Å; F313-F323 AromaticContact CE2-CZ 3.99Å; F313-F323 HydrophobicContact CE2-CZ 3.99Å; F316-F323 HydrophobicContact CB-CB 4.39Å; F316-F323 HydrophobicContact CB-CD1 4Å; F316-F323 HydrophobicContact CB-CD2 3.81Å; F316-F323 HydrophobicContact CB-CE1 4.17Å; F316-F323 HydrophobicContact CB-CE2 4Å; F316-F323 HydrophobicContact CB-CG 3.81Å; F316-F323 HydrophobicContact CB-CZ 4.17Å; F317-F323 HydrophobicContact CB-CD1 4.38Å; F317-F323 HydrophobicContact CB-CE1 4.26Å; L320-F323 HydrophobicContact CB-CB 3.71Å; L320-F323 WeakPolarHBondContact O-CB 3.26Å; L320-F323 PolarHBondContact O-N 3.21Å; F323-Q325 VanDerWaalsContact C-N 3.34Å; F323-Q325 PolarHBondContact O-N 2.86Å; F323-H326 PolarHBondContact O-N 2.86Å; F323-F327 WeakPolarHBondContact O-CB 3.26Å; F323-F327 PolarHBondContact O-N 3.01Å
324R94.2Very high88.8Confident78 Ų7859.1 Ų59.129%0.29428%0.28SS..Hα-helixtrans-55.5-45.3175.2-68.5-157.6-68.9-99.59.1112.7F317 I318 L320 S321 H326 F327 Y328F317-R324 HydrophobicContact CD2-CG 3.9Å; F317-R324 HydrophobicContact CE2-CG 3.95Å; F317-R324 HydrophobicContact CG-CG 4.25Å; F317-R324 HydrophobicContact CZ-CG 4.34Å; F317-R324 WeakPolarHBondContact O-CD 3.22Å; F317-R324 WeakPolarHBondContact O-CG 3.48Å; F317-R324 PolarHBondContact O-NH1 3.32Å; I318-R324 PolarHBondContact O-NH1 3.36Å; L320-R324 PolarHBondContact O-N 3.46Å; S321-R324 PolarHBondContact O-N 3.04Å; R324-H326 PolarHBondContact O-N 2.82Å; R324-F327 PolarHBondContact O-N 3.37Å; R324-Y328 HydrophobicContact CB-CD2 4.28Å; R324-Y328 HydrophobicContact CB-CE2 3.99Å; R324-Y328 WeakPolarHBondContact O-CD2 3.22Å; R324-Y328 PolarHBondContact O-N 3.38Å
325Q92.4Very high87Confident130 Ų13065.3 Ų65.361%0.60730%0.304SS*.Hα-helixtrans-58.9-45.4178.8-75.9170.7-16.200112.4S321 S322 F323 Y329S321-Q325 WeakPolarHBondContact O-CG 3.19Å; S321-Q325 PolarHBondContact O-N 3.3Å; S322-Q325 PolarHBondContact O-N 3.08Å; F323-Q325 VanDerWaalsContact C-N 3.34Å; F323-Q325 PolarHBondContact O-N 2.86Å; Q325-Y329 WeakPolarHBondContact O-CB 3.48Å; Q325-Y329 PolarHBondContact O-N 3.2Å
326H92.9Very high85.2Confident34 Ų3471.1 Ų71.116%0.15733%0.331CS..Hα-helixtrans-72.3-35178.7-68.887.7000112.3I46 M50 S322 F323 R324 Y329 L330I46-H326 HydrophobicContact CG2-CB 3.89Å; M50-H326 HydrophobicContact CG-CB 4.46Å; S322-H326 PolarHBondContact O-N 3.36Å; S322-H326 PolarHBondContact O-ND1 2.9Å; F323-H326 PolarHBondContact O-N 2.86Å; R324-H326 PolarHBondContact O-N 2.82Å; H326-Y329 PolarHBondContact O-N 3.35Å; H326-L330 WeakPolarHBondContact O-CB 3.28Å; H326-L330 PolarHBondContact O-N 2.88Å
327F94.7Very high83.4Confident40 Ų4076 Ų7618%0.17535%0.354CS..Hα-helixtrans-60.9-50.6171.1177.4-107.5000111.9L42 I46 F313 F317 F323 R324 Y329 L330 C331L42-F327 HydrophobicContact CD1-CE2 4.26Å; I46-F327 HydrophobicContact CD1-CB 3.85Å; I46-F327 HydrophobicContact CD1-CD2 4Å; I46-F327 HydrophobicContact CD1-CG 4.4Å; F313-F327 HydrophobicContact CE2-CD2 4.22Å; F313-F327 HydrophobicContact CE2-CE2 4.13Å; F313-F327 HydrophobicContact CZ-CD2 4.37Å; F313-F327 HydrophobicContact CZ-CE2 4.02Å; F313-F327 HydrophobicContact CZ-CZ 4.15Å; F317-F327 HydrophobicContact CD2-CD1 4.37Å; F317-F327 AromaticContact CE2-CD1 3.88Å; F317-F327 HydrophobicContact CE2-CD1 3.88Å; F317-F327 HydrophobicContact CE2-CE1 4.13Å; F323-F327 WeakPolarHBondContact O-CB 3.26Å; F323-F327 PolarHBondContact O-N 3.01Å; R324-F327 PolarHBondContact O-N 3.37Å; F327-Y329 VanDerWaalsContact C-N 3.31Å; F327-Y329 PolarHBondContact O-N 3.34Å; F327-L330 WeakPolarHBondContact O-CB 3.44Å; F327-L330 PolarHBondContact O-N 3.1Å; F327-L330 VanDerWaalsContact O-N 3.16Å; F327-C331 PolarHBondContact O-N 2.98Å; F327-C331 PolarHBondContact O-SG 2.94Å
328Y93.6Very high81.5Confident127 Ų12781.2 Ų81.250%0.49838%0.376SS..Hα-helixtrans-61.3-39.2176.6-69.5-51.1000111.9R324 C331 C332R324-Y328 HydrophobicContact CB-CD2 4.28Å; R324-Y328 HydrophobicContact CB-CE2 3.99Å; R324-Y328 WeakPolarHBondContact O-CD2 3.22Å; R324-Y328 PolarHBondContact O-N 3.38Å; Y328-C331 PolarHBondContact O-N 2.94Å; Y328-C332 WeakPolarHBondContact O-CB 3.37Å; Y328-C332 PolarHBondContact O-N 2.87Å; Y328-C332 PolarHBondContact O-SG 3.12Å; Y328-C332 VanDerWaalsContact O-SG 3.36Å
329Y90.2Very high79.8Confident148 Ų14883.4 Ų83.458%0.5838%0.382SS*.Hα-helixtrans-60.9-46.3173.4-177.8-100.8000111.6Q325 H326 F327 C331 C332 H333Q325-Y329 WeakPolarHBondContact O-CB 3.48Å; Q325-Y329 PolarHBondContact O-N 3.2Å; H326-Y329 PolarHBondContact O-N 3.35Å; F327-Y329 VanDerWaalsContact C-N 3.31Å; F327-Y329 PolarHBondContact O-N 3.34Å; Y329-C331 VanDerWaalsContact C-N 3.33Å; Y329-C331 PolarHBondContact O-N 3.02Å; Y329-C332 PolarHBondContact O-N 3.49Å; Y329-H333 AromaticContact CE2-CD2 3.84Å; Y329-H333 AromaticContact CZ-CD2 3.57Å; Y329-H333 WeakPolarHBondContact O-CB 3.44Å; Y329-H333 PolarHBondContact O-N 2.92Å; Y329-H333 PolarHBondContact OH-CD2 3.15Å; Y329-H333 VanDerWaalsContact OH-CD2 3.3Å
330L89.3Confident78.2Confident43 Ų4382.9 Ų82.923%0.22539%0.386CS..Hα-helixtrans-58.9-42177-164101.2000112.3L42 I45 I49 H326 F327L42-L330 HydrophobicContact CD2-CD2 4.27Å; I45-L330 HydrophobicContact CG2-CD1 4.14Å; I49-L330 HydrophobicContact CD1-CD1 3.93Å; H326-L330 WeakPolarHBondContact O-CB 3.28Å; H326-L330 PolarHBondContact O-N 2.88Å; F327-L330 WeakPolarHBondContact O-CB 3.44Å; F327-L330 PolarHBondContact O-N 3.1Å; F327-L330 VanDerWaalsContact O-N 3.16Å
331C87.5Confident76.5Confident49 Ų4987.7 Ų87.733%0.33141%0.411SS..Hα-helixtrans-72.7-40.4177.6-66.90000113.1F327 Y328 Y329 K335F327-C331 PolarHBondContact O-N 2.98Å; F327-C331 PolarHBondContact O-SG 2.94Å; Y328-C331 PolarHBondContact O-N 2.94Å; Y329-C331 VanDerWaalsContact C-N 3.33Å; Y329-C331 PolarHBondContact O-N 3.02Å; C331-K335 PolarHBondContact O-N 3.01Å
332C81.6Confident75.4Confident63 Ų6391.6 Ų91.643%0.42643%0.43SS..Hα-helixtrans-82.2-31.9-175.5-71.50000113.3Y328 Y329 K334 K335 Q336Y328-C332 WeakPolarHBondContact O-CB 3.37Å; Y328-C332 PolarHBondContact O-N 2.87Å; Y328-C332 PolarHBondContact O-SG 3.12Å; Y328-C332 VanDerWaalsContact O-SG 3.36Å; Y329-C332 PolarHBondContact O-N 3.49Å; C332-K334 VanDerWaalsContact C-N 3.32Å; C332-K334 PolarHBondContact O-N 2.71Å; C332-K335 CarbonylContact O-C 3.6Å; C332-K335 WeakPolarHBondContact O-CA 3.4Å; C332-K335 WeakPolarHBondContact O-CB 3.48Å; C332-K335 PolarHBondContact O-N 2.65Å; C332-K335 VanDerWaalsContact O-N 3.08Å; C332-Q336 PolarHBondContact O-N 2.93Å
333H66.9Low74.4Confident64 Ų6497.3 Ų97.330%0.29645%0.452SS..Hα-helixtrans-64.7-39.3174.6-157.5-86.3000111Y329 K335 Q336 Q337Y329-H333 AromaticContact CE2-CD2 3.84Å; Y329-H333 AromaticContact CZ-CD2 3.57Å; Y329-H333 WeakPolarHBondContact O-CB 3.44Å; Y329-H333 PolarHBondContact O-N 2.92Å; Y329-H333 PolarHBondContact OH-CD2 3.15Å; Y329-H333 VanDerWaalsContact OH-CD2 3.3Å; H333-K335 VanDerWaalsContact C-N 3.32Å; H333-K335 PolarHBondContact O-N 3.24Å; H333-Q336 PolarHBondContact O-N 3.24Å; H333-Q337 PolarHBondContact O-N 3.31Å
334K58.3Low73.3Confident146 Ų146101.3 Ų101.364%0.63547%0.473SS*.Hα-helixtrans-59.9-39169.4-74.7-175.3176.1-175.20112.4C332 K338C332-K334 VanDerWaalsContact C-N 3.32Å; C332-K334 PolarHBondContact O-N 2.71Å; K334-K338 VanDerWaalsContact O-CB 3.28Å; K334-K338 WeakPolarHBondContact O-CB 3.26Å; K334-K338 PolarHBondContact O-N 2.66Å
335K57.4Low72.1Confident158 Ų158103 Ų10369%0.68749%0.487SS*.Hα-helixtrans-66.5-40.1173.8-74.1-179.3174-179.10112.4C331 C332 H333 K339C331-K335 PolarHBondContact O-N 3.01Å; C332-K335 CarbonylContact O-C 3.6Å; C332-K335 WeakPolarHBondContact O-CA 3.4Å; C332-K335 WeakPolarHBondContact O-CB 3.48Å; C332-K335 PolarHBondContact O-N 2.65Å; C332-K335 VanDerWaalsContact O-N 3.08Å; H333-K335 VanDerWaalsContact C-N 3.32Å; H333-K335 PolarHBondContact O-N 3.24Å; K335-K339 WeakPolarHBondContact O-CB 3.36Å; K335-K339 PolarHBondContact O-N 2.85Å
336Q55.7Low71.3Confident128 Ų128103 Ų10360%0.59849%0.485SS*.Hα-helixtrans-67.9-48.4177.9-76.3-178.2-19.200111.9C332 H333 K338 K339 T340C332-Q336 PolarHBondContact O-N 2.93Å; H333-Q336 PolarHBondContact O-N 3.24Å; Q336-K338 VanDerWaalsContact C-N 3.33Å; Q336-K338 PolarHBondContact O-N 2.88Å; Q336-K339 CarbonylContact O-C 3.54Å; Q336-K339 WeakPolarHBondContact O-CA 3.48Å; Q336-K339 PolarHBondContact O-N 3.3Å; Q336-T340 PolarHBondContact O-N 3.34Å; Q336-T340 PolarHBondContact O-OG1 2.92Å
337Q55.5Low70.4Confident104 Ų104108 Ų10849%0.48651%0.506SS..Hα-helixtrans-60.8-38.5175.4-75.5178.3-4100112.7H333 K339 T340 N341H333-Q337 PolarHBondContact O-N 3.31Å; Q337-K339 VanDerWaalsContact C-N 3.29Å; Q337-K339 PolarHBondContact O-N 3.43Å; Q337-T340 WeakPolarHBondContact CA-OG1 3.15Å; Q337-T340 PolarHBondContact O-N 2.73Å; Q337-T340 PolarHBondContact O-OG1 3.02Å; Q337-N341 WeakPolarHBondContact O-CB 3.25Å; Q337-N341 PolarHBondContact O-N 3.36Å
338K55.2Low69.4Low168 Ų168111.3 Ų111.373%0.7353%0.526SS*.Hα-helixtrans-66.4-32174-163.8170.9-174.8177.90111.9K334 Q336 L342K334-K338 VanDerWaalsContact O-CB 3.28Å; K334-K338 WeakPolarHBondContact O-CB 3.26Å; K334-K338 PolarHBondContact O-N 2.66Å; Q336-K338 VanDerWaalsContact C-N 3.33Å; Q336-K338 PolarHBondContact O-N 2.88Å; K338-L342 WeakPolarHBondContact O-CB 3.35Å; K338-L342 PolarHBondContact O-N 3.38Å; K338-L342 VanDerWaalsContact O-N 3.14Å
339K56.7Low68.4Low149 Ų149110 Ų11065%0.64852%0.524SS*.Hα-helixtrans-79.2-29.9177.9-159.9173.7-171.5178.30113.1K335 Q336 Q337 K343K335-K339 WeakPolarHBondContact O-CB 3.36Å; K335-K339 PolarHBondContact O-N 2.85Å; Q336-K339 CarbonylContact O-C 3.54Å; Q336-K339 WeakPolarHBondContact O-CA 3.48Å; Q336-K339 PolarHBondContact O-N 3.3Å; Q337-K339 VanDerWaalsContact C-N 3.29Å; Q337-K339 PolarHBondContact O-N 3.43Å; K339-K343 WeakPolarHBondContact O-CB 3.18Å; K339-K343 WeakPolarHBondContact O-CG 3.42Å; K339-K343 PolarHBondContact O-N 3.29Å
340T56.6Low67.8Low69 Ų69108.2 Ų108.242%0.42352%0.524SS..Hα-helixtrans-70.4-53.2169.753.10000110.4Q336 Q337 L342 K343 D344Q336-T340 PolarHBondContact O-N 3.34Å; Q336-T340 PolarHBondContact O-OG1 2.92Å; Q337-T340 WeakPolarHBondContact CA-OG1 3.15Å; Q337-T340 PolarHBondContact O-N 2.73Å; Q337-T340 PolarHBondContact O-OG1 3.02Å; T340-L342 VanDerWaalsContact C-N 3.26Å; T340-L342 PolarHBondContact O-N 2.92Å; T340-L342 VanDerWaalsContact O-N 3.16Å; T340-K343 CarbonylContact O-C 3.45Å; T340-K343 WeakPolarHBondContact O-CA 3.04Å; T340-K343 WeakPolarHBondContact O-CB 3.35Å; T340-K343 PolarHBondContact O-N 3.42Å; T340-D344 PolarHBondContact O-N 3.14Å; T340-D344 VanDerWaalsContact O-OD2 3.06Å
341N55.6Low67.3Low102 Ų102110.1 Ų110.155%0.54553%0.534SS..Hα-helixtrans-55-40.9178-76.86.7000112.5Q337 D344 I345Q337-N341 WeakPolarHBondContact O-CB 3.25Å; Q337-N341 PolarHBondContact O-N 3.36Å; N341-D344 PolarHBondContact O-N 2.97Å; N341-I345 WeakPolarHBondContact O-CD1 3.22Å; N341-I345 VanDerWaalsContact O-CG1 3.24Å; N341-I345 WeakPolarHBondContact O-CG1 3.5Å; N341-I345 PolarHBondContact O-N 2.99Å
342L65.8Low66.8Low100 Ų100113.1 Ų113.152%0.52454%0.543SS..Hα-helixtrans-64.3-42.8175.3-162.280.3000112.2K338 T340 D344 I345 F346K338-L342 WeakPolarHBondContact O-CB 3.35Å; K338-L342 PolarHBondContact O-N 3.38Å; K338-L342 VanDerWaalsContact O-N 3.14Å; T340-L342 VanDerWaalsContact C-N 3.26Å; T340-L342 PolarHBondContact O-N 2.92Å; T340-L342 VanDerWaalsContact O-N 3.16Å; L342-D344 VanDerWaalsContact C-N 3.34Å; L342-I345 PolarHBondContact O-N 2.79Å; L342-F346 HydrophobicContact CD1-CE2 4.37Å; L342-F346 HydrophobicContact CD2-CE2 4.01Å; L342-F346 HydrophobicContact CG-CD2 4.05Å; L342-F346 HydrophobicContact CG-CE2 3.82Å; L342-F346 WeakPolarHBondContact O-CD2 3.24Å; L342-F346 PolarHBondContact O-N 3.43Å
343K68.2Low66.7Low144 Ų144113.2 Ų113.263%0.62654%0.537SS*.Hα-helixtrans-62.4-39.9174.3-83.6-176.4166.3-167.90112.1K339 T340 F346 K347K339-K343 WeakPolarHBondContact O-CB 3.18Å; K339-K343 WeakPolarHBondContact O-CG 3.42Å; K339-K343 PolarHBondContact O-N 3.29Å; T340-K343 CarbonylContact O-C 3.45Å; T340-K343 WeakPolarHBondContact O-CA 3.04Å; T340-K343 WeakPolarHBondContact O-CB 3.35Å; T340-K343 PolarHBondContact O-N 3.42Å; K343-F346 PolarHBondContact O-N 2.84Å; K343-K347 VanDerWaalsContact O-CB 3.31Å; K343-K347 WeakPolarHBondContact O-CB 3.34Å; K343-K347 PolarHBondContact O-N 2.91Å
344D70.3Confident67.5Low83 Ų83117.2 Ų117.244%0.44455%0.554SS.*Hα-helixtrans-70.3-38.2-178.9-63.4-40000111.2T340 N341 L342 K347 L348T340-D344 PolarHBondContact O-N 3.14Å; T340-D344 VanDerWaalsContact O-OD2 3.06Å; N341-D344 PolarHBondContact O-N 2.97Å; L342-D344 VanDerWaalsContact C-N 3.34Å; D344-K347 PolarHBondContact O-N 3.21Å; D344-L348 PolarHBondContact O-N 3.35Å
345I70.1Confident68.4Low113 Ų113117.8 Ų117.858%0.57955%0.552SS**Hα-helixtrans-59.7-48.8169.1-69.3163.4000111N341 L342 K347 L348 H349N341-I345 WeakPolarHBondContact O-CD1 3.22Å; N341-I345 VanDerWaalsContact O-CG1 3.24Å; N341-I345 WeakPolarHBondContact O-CG1 3.5Å; N341-I345 PolarHBondContact O-N 2.99Å; L342-I345 PolarHBondContact O-N 2.79Å; I345-K347 VanDerWaalsContact C-N 3.29Å; I345-K347 PolarHBondContact O-N 2.78Å; I345-L348 PolarHBondContact O-N 3.41Å; I345-H349 PolarHBondContact O-N 3.18Å
346F74Confident69.5Low131 Ų131116.2 Ų116.258%0.57555%0.545SS*.Hα-helixtrans-63.2-34.2175.9-82.6-62.6000112.9L342 K343 H349 N350L342-F346 HydrophobicContact CD1-CE2 4.37Å; L342-F346 HydrophobicContact CD2-CE2 4.01Å; L342-F346 HydrophobicContact CG-CD2 4.05Å; L342-F346 HydrophobicContact CG-CE2 3.82Å; L342-F346 WeakPolarHBondContact O-CD2 3.24Å; L342-F346 PolarHBondContact O-N 3.43Å; K343-F346 PolarHBondContact O-N 2.84Å; F346-H349 PolarHBondContact O-N 3.01Å; F346-N350 WeakPolarHBondContact O-CB 3.41Å; F346-N350 PolarHBondContact O-N 3.38Å
347K76.1Confident70.8Confident138 Ų138114.6 Ų114.660%0.654%0.54SS*.Hα-helixtrans-68.1-41.8175.8-163179.4-176.6-173.20110.9K343 D344 I345 N350 I351K343-K347 VanDerWaalsContact O-CB 3.31Å; K343-K347 WeakPolarHBondContact O-CB 3.34Å; K343-K347 PolarHBondContact O-N 2.91Å; D344-K347 PolarHBondContact O-N 3.21Å; I345-K347 VanDerWaalsContact C-N 3.29Å; I345-K347 PolarHBondContact O-N 2.78Å; K347-N350 PolarHBondContact O-N 3.18Å; K347-I351 HydrophobicContact CG-CD1 4.37Å; K347-I351 WeakPolarHBondContact O-CD1 3.41Å; K347-I351 VanDerWaalsContact O-CG1 3.24Å; K347-I351 WeakPolarHBondContact O-CG1 3.04Å; K347-I351 PolarHBondContact O-N 3.44Å
348L72.4Confident72Confident111 Ų111113.6 Ų113.658%0.58154%0.537SS*.Hα-helixtrans-61.7-45.1173.1-122109000111.7D344 I345 N350 I351 Q352D344-L348 PolarHBondContact O-N 3.35Å; I345-L348 PolarHBondContact O-N 3.41Å; L348-N350 PolarHBondContact O-N 2.97Å; L348-I351 WeakPolarHBondContact O-CB 3.31Å; L348-I351 PolarHBondContact O-N 3.44Å; L348-I351 VanDerWaalsContact O-N 3.14Å; L348-Q352 PolarHBondContact O-N 2.82Å
349H73.8Confident73Confident99 Ų99110.6 Ų110.646%0.45853%0.528SS..Hα-helixtrans-61.4-44.4177.3-169.3-78.3000111.9I345 F346 I351 Q352 E353I345-H349 PolarHBondContact O-N 3.18Å; F346-H349 PolarHBondContact O-N 3.01Å; H349-I351 VanDerWaalsContact C-N 3.3Å; H349-I351 PolarHBondContact O-N 3.49Å; H349-Q352 PolarHBondContact O-N 2.97Å; H349-E353 PolarHBondContact O-N 2.76Å
350N77.1Confident73.9Confident110 Ų110113 Ų11359%0.58853%0.533SS*.Hα-helixtrans-64.9-31.2174.4-97.3-6.2000113.2F346 K347 L348 K354F346-N350 WeakPolarHBondContact O-CB 3.41Å; F346-N350 PolarHBondContact O-N 3.38Å; K347-N350 PolarHBondContact O-N 3.18Å; L348-N350 PolarHBondContact O-N 2.97Å; N350-K354 WeakPolarHBondContact O-CB 3.3Å; N350-K354 WeakPolarHBondContact O-CG 3.44Å; N350-K354 PolarHBondContact O-N 2.97Å; N350-K354 VanDerWaalsContact O-N 3.08Å
351I78.8Confident74.7Confident84 Ų84118.5 Ų118.543%0.43155%0.546SS..Hα-helixtrans-68.9-44.8172.6-71164000109.9K347 L348 H349 E353 K354 W355K347-I351 HydrophobicContact CG-CD1 4.37Å; K347-I351 WeakPolarHBondContact O-CD1 3.41Å; K347-I351 VanDerWaalsContact O-CG1 3.24Å; K347-I351 WeakPolarHBondContact O-CG1 3.04Å; K347-I351 PolarHBondContact O-N 3.44Å; L348-I351 WeakPolarHBondContact O-CB 3.31Å; L348-I351 PolarHBondContact O-N 3.44Å; L348-I351 VanDerWaalsContact O-N 3.14Å; H349-I351 VanDerWaalsContact C-N 3.3Å; H349-I351 PolarHBondContact O-N 3.49Å; I351-E353 PolarHBondContact O-N 3.38Å; I351-K354 PolarHBondContact O-N 2.91Å; I351-W355 VanDerWaalsContact O-CD1 3.32Å; I351-W355 PolarHBondContact O-N 3.35Å
352Q76.6Confident75.5Confident111 Ų111118.6 Ų118.652%0.51955%0.546SS..Hα-helixtrans-59.9-44176-74.6179.3-38.300112.3L348 H349 W355 K356L348-Q352 PolarHBondContact O-N 2.82Å; H349-Q352 PolarHBondContact O-N 2.97Å; Q352-W355 PolarHBondContact O-N 3.24Å; Q352-K356 WeakPolarHBondContact O-CG 3.22Å; Q352-K356 PolarHBondContact O-N 3.49Å
353E79.5Confident75.7Confident65 Ų65121.5 Ų121.530%0.30455%0.552SS.*Hα-helixtrans-64.6-40.6175.4-72.5-54.8130.400112.6H349 I351 W355 K356 I357H349-E353 PolarHBondContact O-N 2.76Å; I351-E353 PolarHBondContact O-N 3.38Å; E353-W355 VanDerWaalsContact C-N 3.34Å; E353-W355 PolarHBondContact O-N 3.23Å; E353-K356 PolarHBondContact O-N 3.12Å; E353-K356 WeakPolarHBondContact OE1-CD 3.15Å; E353-K356 WeakPolarHBondContact OE1-CE 3.29Å; E353-K356 IonicContact OE1-NZ 3.76Å; E353-K356 PolarHBondContact OE1-NZ 2.88Å; E353-I357 WeakPolarHBondContact O-CG1 3.31Å; E353-I357 PolarHBondContact O-N 3.22Å
354K83.5Confident75.5Confident149 Ų149118.9 Ų118.965%0.64855%0.548SS*.Hα-helixtrans-60.6-42.1171.7-80.1-174.3174.6-171.10112.3N350 I351 I357 I358N350-K354 WeakPolarHBondContact O-CB 3.3Å; N350-K354 WeakPolarHBondContact O-CG 3.44Å; N350-K354 PolarHBondContact O-N 2.97Å; N350-K354 VanDerWaalsContact O-N 3.08Å; I351-K354 PolarHBondContact O-N 2.91Å; K354-I357 PolarHBondContact O-N 3.09Å; K354-I358 VanDerWaalsContact O-CG1 3.3Å; K354-I358 WeakPolarHBondContact O-CG1 3.15Å; K354-I358 PolarHBondContact O-N 3.35Å
355W77.8Confident75Confident158 Ų158122.1 Ų122.160%0.59856%0.558SS**Hα-helixtrans-64.1-41.7176.2-91.189.3000112.3I351 Q352 E353 I357 I358 L359I351-W355 VanDerWaalsContact O-CD1 3.32Å; I351-W355 PolarHBondContact O-N 3.35Å; Q352-W355 PolarHBondContact O-N 3.24Å; E353-W355 VanDerWaalsContact C-N 3.34Å; E353-W355 PolarHBondContact O-N 3.23Å; W355-I357 VanDerWaalsContact C-N 3.33Å; W355-I357 PolarHBondContact O-N 2.99Å; W355-I358 PolarHBondContact O-N 2.69Å; W355-L359 WeakPolarHBondContact O-CB 3.35Å; W355-L359 VanDerWaalsContact O-CG 3.31Å; W355-L359 WeakPolarHBondContact O-CG 3.34Å; W355-L359 PolarHBondContact O-N 3.41Å
356K80.3Confident74.3Confident124 Ų124120.1 Ų120.154%0.53955%0.554SS.*Hα-helixtrans-56.4-45.8171.7-72.4176.6-173.7170.70111.8Q352 E353 L359 R360Q352-K356 WeakPolarHBondContact O-CG 3.22Å; Q352-K356 PolarHBondContact O-N 3.49Å; E353-K356 PolarHBondContact O-N 3.12Å; E353-K356 WeakPolarHBondContact OE1-CD 3.15Å; E353-K356 WeakPolarHBondContact OE1-CE 3.29Å; E353-K356 IonicContact OE1-NZ 3.76Å; E353-K356 PolarHBondContact OE1-NZ 2.88Å; K356-L359 PolarHBondContact O-N 2.84Å; K356-R360 WeakPolarHBondContact O-CB 3.37Å; K356-R360 PolarHBondContact O-N 3.48Å
357I82.1Confident73.4Confident95 Ų95119 Ų11949%0.48755%0.554SS.*Hα-helixtrans-64.2-41.7179.1-66.2164.5000111.5E353 K354 W355 R360 R361E353-I357 WeakPolarHBondContact O-CG1 3.31Å; E353-I357 PolarHBondContact O-N 3.22Å; K354-I357 PolarHBondContact O-N 3.09Å; W355-I357 VanDerWaalsContact C-N 3.33Å; W355-I357 PolarHBondContact O-N 2.99Å; I357-R360 PolarHBondContact O-N 2.72Å; I357-R361 PolarHBondContact O-N 3.06Å
358I81Confident72.4Confident82 Ų82117 Ų11742%0.42155%0.553SS.*Hα-helixtrans-66-46.4178.3-68.6163.9000110.9K354 W355 R360 R361 N362K354-I358 VanDerWaalsContact O-CG1 3.3Å; K354-I358 WeakPolarHBondContact O-CG1 3.15Å; K354-I358 PolarHBondContact O-N 3.35Å; W355-I358 PolarHBondContact O-N 2.69Å; I358-R360 VanDerWaalsContact C-N 3.3Å; I358-R360 PolarHBondContact O-N 2.94Å; I358-R361 PolarHBondContact O-N 3.4Å; I358-N362 PolarHBondContact O-N 3.32Å
359L75.9Confident71.3Confident105 Ų105117.2 Ų117.255%0.5556%0.559SS.*Hα-helixtrans-59.6-41.5176.1-71.9167.1000111.4W355 K356 R361 N362 Y363W355-L359 WeakPolarHBondContact O-CB 3.35Å; W355-L359 VanDerWaalsContact O-CG 3.31Å; W355-L359 WeakPolarHBondContact O-CG 3.34Å; W355-L359 PolarHBondContact O-N 3.41Å; K356-L359 PolarHBondContact O-N 2.84Å; L359-R361 PolarHBondContact O-N 3.05Å; L359-N362 PolarHBondContact O-N 3.13Å; L359-Y363 PolarHBondContact O-N 2.94Å
360R77.2Confident69.9Low200 Ų200118 Ų11876%0.75557%0.571SS**Hα-helixtrans-62.6-40.7175.6-136.8179.4-157.7-179.45.9112.6K356 I357 I358 V364K356-R360 WeakPolarHBondContact O-CB 3.37Å; K356-R360 PolarHBondContact O-N 3.48Å; I357-R360 PolarHBondContact O-N 2.72Å; I358-R360 VanDerWaalsContact C-N 3.3Å; I358-R360 PolarHBondContact O-N 2.94Å; R360-V364 WeakPolarHBondContact O-CG2 3.42Å; R360-V364 PolarHBondContact O-N 3.2Å
361R73.3Confident68.4Low185 Ų185118.7 Ų118.770%0.69858%0.58SS**Hα-helixtrans-65.6-41.5175.9-81.8-175.6175.2172-1.2112.5I357 I358 L359 V364 K365I357-R361 PolarHBondContact O-N 3.06Å; I358-R361 PolarHBondContact O-N 3.4Å; L359-R361 PolarHBondContact O-N 3.05Å; R361-V364 PolarHBondContact O-N 3.03Å; R361-K365 WeakPolarHBondContact O-CB 3.48Å; R361-K365 PolarHBondContact O-N 2.66Å
362N71.4Confident66.6Low103 Ų103120.3 Ų120.355%0.55159%0.594SS**Hα-helixtrans-68-38-179.6-71.2-4.7000111.6I358 L359 K365 S366I358-N362 PolarHBondContact O-N 3.32Å; L359-N362 PolarHBondContact O-N 3.13Å; N362-K365 PolarHBondContact O-N 3.41Å; N362-S366 PolarHBondContact O-N 3.46Å; N362-S366 PolarHBondContact O-OG 2.92Å
363Y69.4Low64.7Low162 Ų162120.3 Ų120.364%0.63560%0.602SS**Hα-helixtrans-62.2-44.4173.9-169.5-84.8000112.6L359 K365 S366L359-Y363 PolarHBondContact O-N 2.94Å; Y363-K365 VanDerWaalsContact C-N 3.27Å; Y363-K365 PolarHBondContact O-N 3.03Å; Y363-S366 PolarHBondContact O-OG 2.99Å
364V66Low62.8Low89 Ų89123.6 Ų123.654%0.53962%0.621SS.*Hα-helixtrans-68-28.4176.41740000112.2R360 R361 T368R360-V364 WeakPolarHBondContact O-CG2 3.42Å; R360-V364 PolarHBondContact O-N 3.2Å; R361-V364 PolarHBondContact O-N 3.03Å; V364-T368 PolarHBondContact O-OG1 2.98Å
365K57.9Low60.8Low150 Ų150123 Ų12365%0.65263%0.625SS**Hα-helixtrans-77.6-29.5-178.8-161.4174.9-177.5-174.70113.2R361 N362 Y363 D367 T368 T369R361-K365 WeakPolarHBondContact O-CB 3.48Å; R361-K365 PolarHBondContact O-N 2.66Å; N362-K365 PolarHBondContact O-N 3.41Å; Y363-K365 VanDerWaalsContact C-N 3.27Å; Y363-K365 PolarHBondContact O-N 3.03Å; K365-D367 VanDerWaalsContact C-N 3.28Å; K365-D367 PolarHBondContact O-N 3.48Å; K365-T368 PolarHBondContact O-N 2.75Å; K365-T368 PolarHBondContact O-OG1 3.14Å; K365-T369 PolarHBondContact O-OG1 3.46Å
366S56.6Low59Low72 Ų72121.6 Ų121.650%0.50363%0.629SS.*Hα-helixtrans-62.2-37.9172.536.10000112N362 Y363 T368 T369N362-S366 PolarHBondContact O-N 3.46Å; N362-S366 PolarHBondContact O-OG 2.92Å; Y363-S366 PolarHBondContact O-OG 2.99Å; S366-T368 VanDerWaalsContact C-N 3.28Å; S366-T368 PolarHBondContact O-N 3.12Å; S366-T369 PolarHBondContact O-OG1 2.68Å
367D54.9Low56.9Low106 Ų106121.3 Ų121.357%0.56763%0.634SS**THydrogen-bonded Turntrans-74.4-14.7-177.2-62.1-10.3000113.8K365K365-D367 VanDerWaalsContact C-N 3.28Å; K365-D367 PolarHBondContact O-N 3.48Å
368T54.5Low54.8Low97 Ų97122.7 Ų122.760%0.59564%0.642SS**THydrogen-bonded Turntrans-107.33.7-175.634.60000114.6V364 K365 S366 T370V364-T368 PolarHBondContact O-OG1 2.98Å; K365-T368 PolarHBondContact O-N 2.75Å; K365-T368 PolarHBondContact O-OG1 3.14Å; S366-T368 VanDerWaalsContact C-N 3.28Å; S366-T368 PolarHBondContact O-N 3.12Å; T368-T370 PolarHBondContact O-N 3.38Å
369T49.2Very low52.8Low115 Ų115124.8 Ų124.871%0.70665%0.654SS**  trans-79.538.3175.4-1.60000113.9K365 S366K365-T369 PolarHBondContact O-OG1 3.46Å; S366-T369 PolarHBondContact O-OG1 2.68Å
370T45.2Very low51Low115 Ų115125.6 Ų125.671%0.70666%0.659SS**  trans-141.148.1-17512.70000112.5T368T368-T370 PolarHBondContact O-N 3.38Å
371T45.7Very low49.2Very low126 Ų126122 Ų12277%0.77366%0.655SS**  trans-163.5106.9154.95.70000109.2
372T40.4Very low47.4Very low118 Ų118118.9 Ų118.972%0.72465%0.652SS**  79.885.386.5-51.70000114.3
373T37.6Very low45.7Very low111 Ų111120.1 Ų120.168%0.68166%0.658SS**  57.9133.2128.4-11.50000123.5
374N39.5Very low44.2Very low133 Ų133123 Ų12371%0.71167%0.668SS**  trans92.2136137.9-86.5-10.8000123
375N40.7Very low42.8Very low136 Ų136123.2 Ų123.273%0.72767%0.674SS**  trans71.5148150.9-67.1-12.7000119.6
376N39.9Very low41.5Very low129 Ų129124.4 Ų124.469%0.6968%0.684SS**  cis-165.4169.1-34.4-143.5-10.9000109
377N37.6Very low40.6Very low119 Ų119127.8 Ų127.864%0.63670%0.696SS**  trans72117.6153.9-68.1-9.3000122.5
378N37.2Very low39.8Very low123 Ų123130.2 Ų130.266%0.65871%0.706SS**  84.8108118.3-67.1-2.6000123.3
379N38.8Very low38.7Very low126 Ų126132.4 Ų132.467%0.67471%0.712SS**  114.6131.8104.2-83.8-6.2000121.3
380N38.5Very low37.9Very low123 Ų123134.6 Ų134.666%0.65872%0.715SS**  trans72.8121.9153.5-66.4-27.5000118.7
381N38.5Very low37.6Very low125 Ų125137.7 Ų137.767%0.66872%0.72SS**  69.4135.458-66.5-31.8000111.5
382N36.3Very low37.2Very low118 Ų118137.6 Ų137.663%0.63172%0.72SS**  cis-168.9160.94.6-120.3-21.3000111.1
383N35.9Very low37.5Very low129 Ų129138 Ų13869%0.6973%0.728SS**  trans68.4154.8150.6-64.1-24.4000119.1
384R38.7Very low37.3Very low222 Ų222143.5 Ų143.584%0.83874%0.736SS**  cis-156.2160.811.5-136.3169.8-175.3165.1-1.2113.7
385S36.2Very low37Very low94 Ų94143.9 Ų143.966%0.65774%0.738SS**  trans-19.4148.6161.558.10000119.6
386M30.9Very low37.1Very low176 Ų176143.5 Ų143.587%0.86774%0.74SS**  cis74.6108.433.8-164.6176.5-168.500115.2
387D37.6Very low37.6Very low142 Ų142149.5 Ų149.576%0.75976%0.764SS**  trans-174.3151.5144.8-108-29.3000116.6
388M37Very low37.6Very low158 Ų158151 Ų15178%0.77877%0.77SS**  trans40.4140.7158.8-55-170.3-169.200122.9
389I31.8Very low37.6Very low142 Ų142152.5 Ų152.573%0.72878%0.776SS**  cis100.8131.217.6-64.2178.2000116.5
390H31.6Very low37.5Very low162 Ų162153.9 Ų153.975%0.7578%0.782SS**  trans69.3146.3174-70-46.4000116.6
391H40.3Very low37.5Very low179 Ų179155.8 Ų155.883%0.82979%0.789SS**  cis-146.6157.836.6-125.5-81.7000114.9
392T36.9Very low37.4Very low125 Ų125157.7 Ų157.777%0.76780%0.797SS**  trans-100.8144.9164.919.60000111.2
393S45.3Very low37.5Very low127 Ų127160.3 Ų160.389%0.88881%0.808SS**  trans-148.8161.2162.558.20000111.2
394R34.2Very low37.6Very low225 Ų225162.6 Ų162.685%0.84982%0.817SS**  trans-130.4167.7-158.9-131.4-175.4-169.6170.1-0.1109.9
395N32.6Very low37.5Very low142 Ų142158 Ų15876%0.75982%0.815SS**  trans68.4165.3176-37.4-25.2000111.3
396V43.7Very low37.6Very low127 Ų127163.3 Ų163.377%0.7783%0.828SS**  cis-127.61486.3-178.40000105.6
397Q49.3Very low38.2Very low255 Ų255162.2 Ų162.2100%1.19282%0.824SS**  cis-119.2017.1-156.7144.90.100112.6

Retrieved 397 of 397 residues in 204.8 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).