A0A059QSR8_HUMAN Loading...

NADH-ubiquinone oxidoreductase chain 4

Core subunit of the mitochondrial membrane respiratory chain NADH dehydrogenase (Complex I) which catalyzes electron transfer from NADH through the respiratory chain, using ubiquinone as an electron acceptor. Essential for the catalytic activity and assembly of complex I.

AlphaFold DB , UniProt , Accession A0A059QSR8, Species HUMAN (Homo sapiens, Human), Gene ND4, Length 434 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1N79.3Confident81.8Confident144 Ų14469.2 Ų69.277%0.7737%0.369SS*.  0121.50-84.6-17.1000109.1T3 T4 H5N1-T3 VanDerWaalsContact C-N 3.26Å; N1-T3 PolarHBondContact O-N 3.31Å; N1-T4 HydrophobicContact CB-CG2 3.86Å; N1-T4 WeakPolarHBondContact CB-OG1 3.35Å; N1-T4 PolarHBondContact O-N 3.06Å; N1-T4 PolarHBondContact O-OG1 3.32Å; N1-H5 PolarHBondContact O-CD2 3.05Å; N1-H5 PolarHBondContact O-N 3.44Å
2T78.7Confident81.4Confident76 Ų7671.3 Ų71.347%0.46638%0.379SS..Hα-helixtrans-61.3-35.7-176.849.50000112.4H5 S6 L71T2-H5 PolarHBondContact O-N 3.23Å; T2-S6 WeakPolarHBondContact O-CB 3.46Å; T2-S6 PolarHBondContact O-N 3.1Å; T2-S6 PolarHBondContact O-OG 2.87Å; T2-L71 HydrophobicContact CG2-CD1 4.26Å
3T82.4Confident80.9Confident23 Ų2367 Ų6714%0.14136%0.357CS..Hα-helixtrans-60.9-43.1174.847.60000113.5N1 S6 L7 I52 M53N1-T3 VanDerWaalsContact C-N 3.26Å; N1-T3 PolarHBondContact O-N 3.31Å; T3-S6 VanDerWaalsContact C-OG 3.26Å; T3-S6 WeakPolarHBondContact CA-OG 3.34Å; T3-S6 PolarHBondContact O-N 3.49Å; T3-S6 PolarHBondContact O-OG 3.12Å; T3-L7 WeakPolarHBondContact O-CB 3.35Å; T3-L7 WeakPolarHBondContact O-CG 3.16Å; T3-L7 PolarHBondContact O-N 2.82Å; T3-I52 HydrophobicContact CG2-CB 4.2Å; T3-I52 HydrophobicContact CG2-CG2 3.5Å; T3-M53 HydrophobicContact CG2-CG 3.83Å
4T80.9Confident80.3Confident61 Ų6168.5 Ų68.537%0.37437%0.365SS..Hα-helixtrans-69.4-40.5-179.759.40000110.8N1 L7 I8N1-T4 HydrophobicContact CB-CG2 3.86Å; N1-T4 WeakPolarHBondContact CB-OG1 3.35Å; N1-T4 PolarHBondContact O-N 3.06Å; N1-T4 PolarHBondContact O-OG1 3.32Å; T4-L7 PolarHBondContact O-N 3.42Å; T4-I8 WeakPolarHBondContact O-CG1 3.49Å; T4-I8 PolarHBondContact O-N 2.95Å
5H82.3Confident79.7Confident112 Ų11273.4 Ų73.452%0.51939%0.39SS..Hα-helixtrans-64.3-42.2174.3-62-57.8000111.7N1 T2 L7 I8 I9N1-H5 PolarHBondContact O-CD2 3.05Å; N1-H5 PolarHBondContact O-N 3.44Å; T2-H5 PolarHBondContact O-N 3.23Å; H5-L7 VanDerWaalsContact C-N 3.32Å; H5-L7 PolarHBondContact O-N 2.69Å; H5-I8 PolarHBondContact O-N 3.5Å; H5-I9 VanDerWaalsContact O-CG1 3.32Å; H5-I9 WeakPolarHBondContact O-CG1 3.46Å; H5-I9 PolarHBondContact O-N 3.42Å
6S83.6Confident79.1Confident4 Ų473.9 Ų73.93%0.02839%0.388CS..Hα-helixtrans-64.3-34.8175.153.70000113.3T2 T3 I9 S10 P49T2-S6 WeakPolarHBondContact O-CB 3.46Å; T2-S6 PolarHBondContact O-N 3.1Å; T2-S6 PolarHBondContact O-OG 2.87Å; T3-S6 VanDerWaalsContact C-OG 3.26Å; T3-S6 WeakPolarHBondContact CA-OG 3.34Å; T3-S6 PolarHBondContact O-N 3.49Å; T3-S6 PolarHBondContact O-OG 3.12Å; S6-I9 PolarHBondContact O-N 3.48Å; S6-S10 PolarHBondContact O-N 3.34Å; S6-P49 WeakPolarHBondContact OG-CA 3.21Å; S6-P49 WeakPolarHBondContact OG-CB 3.06Å
7L84.7Confident78.1Confident53 Ų5372.5 Ų72.528%0.27738%0.378SS..Hα-helixtrans-66.1-43.2174.5-77.9167.7000111.2T3 T4 H5 I9 S10 I11 P49T3-L7 WeakPolarHBondContact O-CB 3.35Å; T3-L7 WeakPolarHBondContact O-CG 3.16Å; T3-L7 PolarHBondContact O-N 2.82Å; T4-L7 PolarHBondContact O-N 3.42Å; H5-L7 VanDerWaalsContact C-N 3.32Å; H5-L7 PolarHBondContact O-N 2.69Å; L7-I9 VanDerWaalsContact C-N 3.29Å; L7-I9 PolarHBondContact O-N 3.48Å; L7-S10 WeakPolarHBondContact CA-OG 3.2Å; L7-S10 PolarHBondContact O-N 3.32Å; L7-S10 VanDerWaalsContact O-N 3.14Å; L7-S10 PolarHBondContact O-OG 3.03Å; L7-I11 PolarHBondContact O-N 3.35Å; L7-P49 HydrophobicContact CD2-CB 3.61Å; L7-P49 HydrophobicContact CD2-CG 3.8Å; L7-P49 HydrophobicContact CG-CB 3.67Å; L7-P49 HydrophobicContact CG-CG 4.28Å
8I82.7Confident77.1Confident107 Ų10775.8 Ų75.855%0.54940%0.396SS..Hα-helixtrans-59.9-42.9175.1-66163000110.5T4 H5 S10 I11T4-I8 WeakPolarHBondContact O-CG1 3.49Å; T4-I8 PolarHBondContact O-N 2.95Å; H5-I8 PolarHBondContact O-N 3.5Å; I8-S10 VanDerWaalsContact C-N 3.32Å; I8-S10 PolarHBondContact O-N 3.48Å; I8-I11 PolarHBondContact O-N 3.05Å
9I81Confident76.3Confident77 Ų7773.8 Ų73.840%0.39539%0.385SS..Hα-helixtrans-63-39.1176.5-66.2163.6000111.3H5 S6 L7 I11 I12 P13H5-I9 VanDerWaalsContact O-CG1 3.32Å; H5-I9 WeakPolarHBondContact O-CG1 3.46Å; H5-I9 PolarHBondContact O-N 3.42Å; S6-I9 PolarHBondContact O-N 3.48Å; L7-I9 VanDerWaalsContact C-N 3.29Å; L7-I9 PolarHBondContact O-N 3.48Å; I9-I11 PolarHBondContact O-N 3.06Å; I9-I11 VanDerWaalsContact O-N 3.16Å; I9-I12 HydrophobicContact CG2-CD1 4.5Å; I9-I12 WeakPolarHBondContact O-CB 3.32Å; I9-I12 PolarHBondContact O-N 3.08Å; I9-I12 VanDerWaalsContact O-N 3.12Å; I9-P13 WeakPolarHBondContact O-CD 3.21Å
10S83.4Confident75.1Confident4 Ų476.6 Ų76.63%0.02840%0.399CS..Hα-helixtrans-64.3-17.9179.171.70000114.1S6 L7 I8 P13 T45S6-S10 PolarHBondContact O-N 3.34Å; L7-S10 WeakPolarHBondContact CA-OG 3.2Å; L7-S10 PolarHBondContact O-N 3.32Å; L7-S10 VanDerWaalsContact O-N 3.14Å; L7-S10 PolarHBondContact O-OG 3.03Å; I8-S10 VanDerWaalsContact C-N 3.32Å; I8-S10 PolarHBondContact O-N 3.48Å; S10-P13 WeakPolarHBondContact O-CD 3.39Å; S10-T45 VanDerWaalsContact CB-O 3.29Å; S10-T45 WeakPolarHBondContact CB-O 3.46Å
11I80.7Confident74.2Confident100 Ų10078.1 Ų78.151%0.51341%0.407SS..Hα-helixtrans-81.2-26.9177-66.3165.9000111.6L7 I8 I9 L14L7-I11 PolarHBondContact O-N 3.35Å; I8-I11 PolarHBondContact O-N 3.05Å; I9-I11 PolarHBondContact O-N 3.06Å; I9-I11 VanDerWaalsContact O-N 3.16Å; I11-L14 HydrophobicContact CB-CD1 4.28Å; I11-L14 HydrophobicContact CG1-CD1 4.39Å; I11-L14 HydrophobicContact CG2-CD1 4.06Å; I11-L14 VanDerWaalsContact O-CB 3.28Å; I11-L14 WeakPolarHBondContact O-CB 3.16Å; I11-L14 PolarHBondContact O-N 2.82Å
12I77.8Confident73.3Confident94 Ų9475.5 Ų75.548%0.48239%0.393SS..G310 helixtrans-54.2-48.3-177.8-60.3171.8000112.7I9 L14 L15I9-I12 HydrophobicContact CG2-CD1 4.5Å; I9-I12 WeakPolarHBondContact O-CB 3.32Å; I9-I12 PolarHBondContact O-N 3.08Å; I9-I12 VanDerWaalsContact O-N 3.12Å; I12-L14 PolarHBondContact O-N 2.83Å; I12-L15 WeakPolarHBondContact O-CB 3.36Å; I12-L15 WeakPolarHBondContact O-CG 3.43Å; I12-L15 PolarHBondContact O-N 2.93Å
13P73.9Confident72.5Confident16 Ų1677.7 Ų77.710%0.10440%0.402CS..G310 helixtrans-71.2-10.5-178.321.7-27.2000114.5I9 S10 L15 F16 T45I9-P13 WeakPolarHBondContact O-CD 3.21Å; S10-P13 WeakPolarHBondContact O-CD 3.39Å; P13-L15 PolarHBondContact O-N 3.09Å; P13-L15 VanDerWaalsContact O-N 3.15Å; P13-F16 HydrophobicContact CB-CD2 4.37Å; P13-F16 PolarHBondContact O-N 3.26Å; P13-T45 HydrophobicContact CG-CG2 3.81Å; P13-T45 WeakPolarHBondContact CG-OG1 3.08Å
14L73.4Confident71.8Confident88 Ų8879.5 Ų79.546%0.46141%0.411SS..G310 helixtrans-60.8-23.3171.5-67.3160.3000111.6I11 I12 F16 F17 M42I11-L14 HydrophobicContact CB-CD1 4.28Å; I11-L14 HydrophobicContact CG1-CD1 4.39Å; I11-L14 HydrophobicContact CG2-CD1 4.06Å; I11-L14 VanDerWaalsContact O-CB 3.28Å; I11-L14 WeakPolarHBondContact O-CB 3.16Å; I11-L14 PolarHBondContact O-N 2.82Å; I12-L14 PolarHBondContact O-N 2.83Å; L14-F16 PolarHBondContact O-N 3.29Å; L14-F17 HydrophobicContact CB-CD2 4.08Å; L14-F17 HydrophobicContact CB-CE2 4.42Å; L14-F17 HydrophobicContact CD2-CD2 3.62Å; L14-F17 HydrophobicContact CD2-CE2 3.38Å; L14-F17 HydrophobicContact CG-CD2 4.36Å; L14-F17 HydrophobicContact CG-CE2 4.26Å; L14-F17 WeakPolarHBondContact O-CB 3.22Å; L14-F17 WeakPolarHBondContact O-CD2 3.33Å; L14-F17 PolarHBondContact O-N 3.08Å; L14-M42 HydrophobicContact CD2-SD 4.47Å
15L71.4Confident71.2Confident142 Ų14281.6 Ų81.674%0.74342%0.415SS*.G310 helixtrans-64.8-22.9175.8-62.3170.9000112.9I12 P13 F17I12-L15 WeakPolarHBondContact O-CB 3.36Å; I12-L15 WeakPolarHBondContact O-CG 3.43Å; I12-L15 PolarHBondContact O-N 2.93Å; P13-L15 PolarHBondContact O-N 3.09Å; P13-L15 VanDerWaalsContact O-N 3.15Å; L15-F17 VanDerWaalsContact C-N 3.33Å
16F69.1Low70.7Confident81 Ų8179.9 Ų79.936%0.35542%0.415SS..G310 helixtrans-871.4177.8-61-71.2000113.3P13 L14 N18 F25 T38P13-F16 HydrophobicContact CB-CD2 4.37Å; P13-F16 PolarHBondContact O-N 3.26Å; L14-F16 PolarHBondContact O-N 3.29Å; F16-N18 VanDerWaalsContact C-N 3.28Å; F16-N18 PolarHBondContact O-N 3.34Å; F16-F25 HydrophobicContact CD1-CD1 4.43Å; F16-F25 HydrophobicContact CD1-CE1 4.41Å; F16-F25 HydrophobicContact CE1-CD1 4.28Å; F16-F25 AromaticContact CE1-CE1 3.94Å; F16-F25 HydrophobicContact CE1-CE1 3.94Å; F16-T38 HydrophobicContact CB-CG2 4.26Å
17F63.2Low70.1Confident51 Ų5183.5 Ų83.522%0.22444%0.44CS..G310 helixtrans-66.4-28.4-179.7-92.8-58.6000114.5L14 L15 Q19 M42 I428L14-F17 HydrophobicContact CB-CD2 4.08Å; L14-F17 HydrophobicContact CB-CE2 4.42Å; L14-F17 HydrophobicContact CD2-CD2 3.62Å; L14-F17 HydrophobicContact CD2-CE2 3.38Å; L14-F17 HydrophobicContact CG-CD2 4.36Å; L14-F17 HydrophobicContact CG-CE2 4.26Å; L14-F17 WeakPolarHBondContact O-CB 3.22Å; L14-F17 WeakPolarHBondContact O-CD2 3.33Å; L14-F17 PolarHBondContact O-N 3.08Å; L15-F17 VanDerWaalsContact C-N 3.33Å; F17-Q19 PolarHBondContact O-N 3.22Å; F17-M42 HydrophobicContact CE1-SD 4.39Å; F17-M42 HydrophobicContact CE2-CB 4.26Å; F17-M42 HydrophobicContact CE2-CG 3.91Å; F17-M42 HydrophobicContact CE2-SD 3.47Å; F17-M42 WeakPolarHBondContact CE2-SD 3.46Å; F17-M42 HydrophobicContact CZ-CB 3.82Å; F17-M42 HydrophobicContact CZ-CE 3.73Å; F17-M42 HydrophobicContact CZ-CG 3.77Å; F17-M42 HydrophobicContact CZ-SD 3.19Å; F17-M42 WeakPolarHBondContact CZ-SD 3.25Å; F17-I428 HydrophobicContact CD1-CB 4.41Å; F17-I428 HydrophobicContact CD1-CG2 3.14Å; F17-I428 HydrophobicContact CE1-CG2 3.03Å; F17-I428 HydrophobicContact CG-CG2 4.37Å; F17-I428 HydrophobicContact CZ-CG2 4.21Å
18N59.3Low70.1Confident131 Ų13182.9 Ų82.970%0.70144%0.44SS*.  trans-89.446-172.1-151.423.7000112F16 I20F16-N18 VanDerWaalsContact C-N 3.28Å; F16-N18 PolarHBondContact O-N 3.34Å; N18-I20 VanDerWaalsContact C-N 3.34Å; N18-I20 PolarHBondContact O-N 3.28Å; N18-I20 WeakPolarHBondContact OD1-CG1 3.37Å
19Q61.2Low70.1Confident38 Ų3883.1 Ų83.118%0.17845%0.449CS..  trans-84.684.2169.6-71.4-177.13.300108.2F17 N21 F25 S33F17-Q19 PolarHBondContact O-N 3.22Å; Q19-N21 PolarHBondContact O-N 3.44Å; Q19-F25 VanDerWaalsContact NE2-CB 3.33Å; Q19-S33 PolarHBondContact NE2-OG 3Å
20I52.8Low70.4Confident130 Ų13082.3 Ų82.367%0.66745%0.447SS*.  trans-71-18-179.9-62.6164.7000111.5N18N18-I20 VanDerWaalsContact C-N 3.34Å; N18-I20 PolarHBondContact O-N 3.28Å; N18-I20 WeakPolarHBondContact OD1-CG1 3.37Å
21N57.4Low70.7Confident108 Ų10884.5 Ų84.558%0.57846%0.456SS*.SBendtrans-114.6140.8-176.8-72.7-7.4000111.4Q19 N23Q19-N21 PolarHBondContact O-N 3.44Å; N21-N23 HydrophobicContact CB-CB 4.46Å; N21-N23 PolarHBondContact O-N 2.86Å
22N58.9Low71.1Confident89 Ų8980 Ų8048%0.47643%0.434SS..SBendtrans-58.33.8169.8-75.1-32.5000114.9S434N22-S434 PolarHBondContact ND2-O 2.85Å
23N63.4Low71.6Confident123 Ų12375.8 Ų75.866%0.65841%0.413SS*.SBendtrans-79.2131.1177.7-72.6-4.7000110N21 F25N21-N23 HydrophobicContact CB-CB 4.46Å; N21-N23 PolarHBondContact O-N 2.86Å; N23-F25 PolarHBondContact O-N 3.31Å; N23-F25 VanDerWaalsContact O-N 3.16Å
24L67.3Low72.2Confident60 Ų6075.3 Ų75.331%0.31441%0.409SS..  trans-55.8120.4169.9-76.2119000109.9S26 S33 D34 L152L24-S26 PolarHBondContact O-N 3.32Å; L24-S26 VanDerWaalsContact O-N 3.12Å; L24-S33 CarbonylContact C-O 3.51Å; L24-D34 HydrophobicContact CD2-CB 3.73Å; L24-D34 HydrophobicContact CG-CB 3.95Å; L24-L152 HydrophobicContact CB-CD2 4.13Å; L24-L152 HydrophobicContact CD1-CD2 3.39Å; L24-L152 HydrophobicContact CD2-CD2 4.2Å; L24-L152 HydrophobicContact CG-CD2 4.08Å
25F67.5Low72.8Confident105 Ų10571.8 Ų71.846%0.46139%0.392SS..EExtended strand (participates in β ladder)trans-77.495.1168.8-173-97.8000108.4F16 Q19 N23 C27 S32 S33F16-F25 HydrophobicContact CD1-CD1 4.43Å; F16-F25 HydrophobicContact CD1-CE1 4.41Å; F16-F25 HydrophobicContact CE1-CD1 4.28Å; F16-F25 AromaticContact CE1-CE1 3.94Å; F16-F25 HydrophobicContact CE1-CE1 3.94Å; Q19-F25 VanDerWaalsContact NE2-CB 3.33Å; N23-F25 PolarHBondContact O-N 3.31Å; N23-F25 VanDerWaalsContact O-N 3.16Å; F25-C27 WeakPolarHBondContact CE1-SG 3.25Å; F25-C27 PolarHBondContact O-N 2.89Å; F25-S32 WeakPolarHBondContact O-CA 3.33Å; F25-S33 PolarHBondContact N-O 3.23Å; F25-S33 PolarHBondContact O-N 3.2Å; F25-S33 PolarHBondContact O-OG 3.28Å
26S71.5Confident73.6Confident76 Ų7665.1 Ų65.153%0.53136%0.357SS..EExtended strand (participates in β ladder)trans-81.3112.2174580000110.2L24L24-S26 PolarHBondContact O-N 3.32Å; L24-S26 VanDerWaalsContact O-N 3.12Å
27C71Confident74.6Confident80 Ų8061.2 Ų61.254%0.54134%0.34SS..SBendtrans-77.8-39.2172.4-66.10000111.4F25 F31F25-C27 WeakPolarHBondContact CE1-SG 3.25Å; F25-C27 PolarHBondContact O-N 2.89Å; C27-F31 PolarHBondContact N-O 2.98Å
28S84.2Confident75.9Confident40 Ų4059.5 Ų59.528%0.2833%0.333SS..SBendtrans-152.6168.6-178.370.60000108.9T30 F31S28-T30 PolarHBondContact O-N 3.02Å; S28-T30 VanDerWaalsContact O-N 3.11Å; S28-T30 PolarHBondContact OG-N 3.27Å; S28-T30 PolarHBondContact OG-OG1 2.88Å; S28-F31 PolarHBondContact N-O 3.33Å; S28-F31 VanDerWaalsContact N-O 3.14Å; S28-F31 PolarHBondContact O-N 3.21Å; S28-F31 VanDerWaalsContact O-O 3.09Å; S28-F31 PolarHBondContact OG-N 3.33Å
29P82.7Confident77.4Confident113 Ų11353.2 Ų53.273%0.73430%0.3SS*.SBendtrans-59.4-21.3172.424.2-35.5000112.9T88P29-T88 PolarHBondContact O-OG1 3.48Å
30T88.1Confident78.9Confident59 Ų5951.5 Ų51.536%0.36229%0.292SS..SBendtrans-92.9-33.3-18058.50000113.1S28 T88 M92S28-T30 PolarHBondContact O-N 3.02Å; S28-T30 VanDerWaalsContact O-N 3.11Å; S28-T30 PolarHBondContact OG-N 3.27Å; S28-T30 PolarHBondContact OG-OG1 2.88Å; T30-T88 WeakPolarHBondContact CA-OG1 3.31Å; T30-T88 WeakPolarHBondContact O-CB 3.1Å; T30-T88 WeakPolarHBondContact O-CG2 3.4Å; T30-T88 PolarHBondContact O-N 2.87Å; T30-T88 PolarHBondContact O-OG1 3.44Å; T30-M92 WeakPolarHBondContact O-CE 3.37Å
31F90.8Very high80.8Confident51 Ų5146 Ų4622%0.22426%0.264CS..BIsolated β-bridgetrans-123.7126.8-173.9-58.1-62000112.7C27 S28 M83 T86 M92C27-F31 PolarHBondContact N-O 2.98Å; S28-F31 PolarHBondContact N-O 3.33Å; S28-F31 VanDerWaalsContact N-O 3.14Å; S28-F31 PolarHBondContact O-N 3.21Å; S28-F31 VanDerWaalsContact O-O 3.09Å; S28-F31 PolarHBondContact OG-N 3.33Å; F31-M83 HydrophobicContact CE1-CE 3.54Å; F31-M83 HydrophobicContact CE1-SD 3.86Å; F31-M83 HydrophobicContact CE2-CE 3.86Å; F31-M83 HydrophobicContact CZ-CE 3.07Å; F31-M83 HydrophobicContact CZ-SD 3.88Å; F31-T86 VanDerWaalsContact CA-O 3.26Å; F31-T86 WeakPolarHBondContact CA-O 3.32Å; F31-T86 WeakPolarHBondContact CD1-OG1 3.13Å; F31-M92 HydrophobicContact CD1-CE 4.48Å; F31-M92 HydrophobicContact CE1-CE 4.08Å; F31-M92 HydrophobicContact CE1-SD 4.18Å; F31-M92 HydrophobicContact CZ-SD 4.3Å
32S88.7Confident82.4Confident6 Ų642.1 Ų42.14%0.04224%0.242CC..EExtended strand (participates in β ladder)trans-131.2160.5173.966.70000111F25 T86 T88F25-S32 WeakPolarHBondContact O-CA 3.33Å; S32-T86 PolarHBondContact N-O 3.39Å; S32-T86 WeakPolarHBondContact O-CA 3.45Å; S32-T88 VanDerWaalsContact OG-CG2 3.3Å; S32-T88 WeakPolarHBondContact OG-CG2 3.38Å
33S87.5Confident84Confident5 Ų538 Ų384%0.03522%0.22CC..EExtended strand (participates in β ladder)trans-135.6149.3170.860.10000109.9Q19 L24 F25 T37Q19-S33 PolarHBondContact NE2-OG 3Å; L24-S33 CarbonylContact C-O 3.51Å; F25-S33 PolarHBondContact N-O 3.23Å; F25-S33 PolarHBondContact O-N 3.2Å; F25-S33 PolarHBondContact O-OG 3.28Å; S33-T37 VanDerWaalsContact CA-OG1 3.3Å; S33-T37 WeakPolarHBondContact CA-OG1 3.43Å
34D86.6Confident85.5Confident5 Ų532.4 Ų32.43%0.02719%0.19CC..  trans-150.6171.3-176.468.2-18.2000109.1L24 L36 T37 T38 R220L24-D34 HydrophobicContact CD2-CB 3.73Å; L24-D34 HydrophobicContact CG-CB 3.95Å; D34-L36 PolarHBondContact O-N 2.97Å; D34-T37 PolarHBondContact N-OG1 3.21Å; D34-T37 PolarHBondContact O-N 3.3Å; D34-T37 PolarHBondContact O-OG1 3.08Å; D34-T37 VanDerWaalsContact OD1-CB 3.31Å; D34-T37 WeakPolarHBondContact OD1-CB 3.47Å; D34-T37 WeakPolarHBondContact OD1-CG2 3.49Å; D34-T37 PolarHBondContact OD1-N 3.36Å; D34-T37 PolarHBondContact OD1-OG1 2.86Å; D34-T38 WeakPolarHBondContact O-CG2 3.22Å; D34-T38 PolarHBondContact O-N 3.46Å; D34-T38 PolarHBondContact O-OG1 3.39Å; D34-R220 IonicContact OD1-CZ 2.83Å; D34-R220 IonicContact OD1-NH2 3.01Å; D34-R220 PolarHBondContact OD1-NH2 3.37Å; D34-R220 IonicContact OD2-CZ 3.88Å; D34-R220 IonicContact OD2-NH1 3.91Å; D34-R220 PolarHBondContact OD2-NH1 2.98Å; D34-R220 IonicContact OD2-NH2 3Å; D34-R220 PolarHBondContact OD2-NH2 3.29Å
35P85.9Confident86.7Confident15 Ų1529.9 Ų29.910%0.09718%0.178CC..THydrogen-bonded Turntrans-58.4-17.5-177.4-27.336.2000115.1P39 G431P35-P39 WeakPolarHBondContact O-CD 3.48Å; P35-P39 WeakPolarHBondContact O-CG 3.3Å; P35-G431 VanDerWaalsContact CB-O 3.32Å; P35-G431 WeakPolarHBondContact CB-O 3.15Å
36L89.1Confident88Confident1 Ų127.4 Ų27.41%0.00517%0.165CC..THydrogen-bonded Turntrans-79.8-43.1172.5175.364.4000112.2D34 Y216 M219 V288 F432D34-L36 PolarHBondContact O-N 2.97Å; L36-Y216 HydrophobicContact CD2-CD2 3.73Å; L36-Y216 HydrophobicContact CD2-CE2 3.79Å; L36-Y216 HydrophobicContact CG-CD2 3.91Å; L36-Y216 HydrophobicContact CG-CE2 4.09Å; L36-M219 HydrophobicContact CD1-SD 3.43Å; L36-M219 WeakPolarHBondContact CD1-SD 3.43Å; L36-M219 HydrophobicContact CD2-CB 4.03Å; L36-M219 HydrophobicContact CD2-SD 4.2Å; L36-M219 HydrophobicContact CG-SD 4.48Å; L36-V288 HydrophobicContact CD1-CG2 3.4Å; L36-V288 VanDerWaalsContact CD1-CG2 3.4Å; L36-F432 HydrophobicContact CB-CE2 4.1Å; L36-F432 HydrophobicContact CB-CZ 4.21Å; L36-F432 HydrophobicContact CD2-CE2 4.37Å
37T90.1Very high89.1Confident0 Ų024 Ų240%014%0.141CC..Hα-helixtrans-80.9-35.6-174.748.30000112.7S33 D34 L40 L41 F85 Y216S33-T37 VanDerWaalsContact CA-OG1 3.3Å; S33-T37 WeakPolarHBondContact CA-OG1 3.43Å; D34-T37 PolarHBondContact N-OG1 3.21Å; D34-T37 PolarHBondContact O-N 3.3Å; D34-T37 PolarHBondContact O-OG1 3.08Å; D34-T37 VanDerWaalsContact OD1-CB 3.31Å; D34-T37 WeakPolarHBondContact OD1-CB 3.47Å; D34-T37 WeakPolarHBondContact OD1-CG2 3.49Å; D34-T37 PolarHBondContact OD1-N 3.36Å; D34-T37 PolarHBondContact OD1-OG1 2.86Å; T37-L40 PolarHBondContact O-N 2.96Å; T37-L41 WeakPolarHBondContact O-CB 3.48Å; T37-L41 VanDerWaalsContact O-CG 3.32Å; T37-L41 WeakPolarHBondContact O-CG 3.43Å; T37-L41 PolarHBondContact O-N 3.19Å; T37-F85 WeakPolarHBondContact CG2-O 3.48Å; T37-Y216 HydrophobicContact CG2-CD2 4.38Å; T37-Y216 HydrophobicContact CG2-CE2 3.35Å; T37-Y216 WeakPolarHBondContact CG2-OH 3.49Å
38T89.3Confident90.1Very high14 Ų1420.8 Ų20.89%0.08612%0.118CC..Hα-helixtrans-58.8-42.9-17555.90000113.4F16 D34 L40 L41 M42F16-T38 HydrophobicContact CB-CG2 4.26Å; D34-T38 WeakPolarHBondContact O-CG2 3.22Å; D34-T38 PolarHBondContact O-N 3.46Å; D34-T38 PolarHBondContact O-OG1 3.39Å; T38-L40 PolarHBondContact O-N 3.22Å; T38-L41 PolarHBondContact O-N 3.46Å; T38-M42 PolarHBondContact O-N 3.13Å
39P91.2Very high90.6Very high0 Ų019 Ų190%011%0.106CC..Hα-helixtrans-71-35179.4-19.535.9000112.7P35 M42 L43 I292 I429P35-P39 WeakPolarHBondContact O-CD 3.48Å; P35-P39 WeakPolarHBondContact O-CG 3.3Å; P39-M42 PolarHBondContact O-N 3.46Å; P39-L43 WeakPolarHBondContact O-CB 3.43Å; P39-L43 PolarHBondContact O-N 2.79Å; P39-I292 HydrophobicContact CB-CD1 3.27Å; P39-I292 HydrophobicContact CB-CG1 3.95Å; P39-I292 HydrophobicContact CG-CD1 4.08Å; P39-I429 HydrophobicContact CB-CG2 4.1Å; P39-I429 HydrophobicContact CG-CG2 4.38Å
40L93.4Very high91.1Very high2 Ų213.8 Ų13.81%0.017%0.072CC..Hα-helixtrans-67.4-41.2176.8-67.1172.1000110.8T37 T38 L43 T44 F85 K212 Y216T37-L40 PolarHBondContact O-N 2.96Å; T38-L40 PolarHBondContact O-N 3.22Å; L40-L43 PolarHBondContact O-N 2.98Å; L40-T44 WeakPolarHBondContact O-CG2 3.38Å; L40-T44 PolarHBondContact O-N 2.96Å; L40-F85 HydrophobicContact CB-CD1 4.01Å; L40-F85 HydrophobicContact CB-CD2 4.41Å; L40-F85 HydrophobicContact CB-CE1 3.97Å; L40-F85 HydrophobicContact CB-CE2 4.39Å; L40-F85 HydrophobicContact CB-CG 4.24Å; L40-F85 HydrophobicContact CB-CZ 4.16Å; L40-F85 HydrophobicContact CD1-CD1 3.92Å; L40-F85 HydrophobicContact CD1-CE1 3.66Å; L40-F85 HydrophobicContact CD1-CZ 4.45Å; L40-F85 HydrophobicContact CG-CE1 4.3Å; L40-K212 HydrophobicContact CD2-CB 3.9Å; L40-K212 HydrophobicContact CD2-CG 4.16Å; L40-Y216 HydrophobicContact CD1-CD2 3.92Å; L40-Y216 HydrophobicContact CD1-CG 4.25Å
41L92.8Very high91.5Very high15 Ų1511 Ų118%0.0796%0.055CC..Hα-helixtrans-61.5-44.9173-74.8167.4000111.8T37 T38 L43 T44 T45 I82 F85 T86T37-L41 WeakPolarHBondContact O-CB 3.48Å; T37-L41 VanDerWaalsContact O-CG 3.32Å; T37-L41 WeakPolarHBondContact O-CG 3.43Å; T37-L41 PolarHBondContact O-N 3.19Å; T38-L41 PolarHBondContact O-N 3.46Å; L41-L43 VanDerWaalsContact C-N 3.35Å; L41-L43 PolarHBondContact O-N 3.16Å; L41-T44 PolarHBondContact O-N 3.32Å; L41-T44 PolarHBondContact O-OG1 3.23Å; L41-T45 WeakPolarHBondContact O-CG2 3.38Å; L41-T45 PolarHBondContact O-N 3.49Å; L41-T45 VanDerWaalsContact O-N 3.12Å; L41-T45 PolarHBondContact O-OG1 3.39Å; L41-T45 VanDerWaalsContact O-OG1 3.04Å; L41-I82 HydrophobicContact CD2-CB 4.31Å; L41-I82 HydrophobicContact CD2-CG1 4.46Å; L41-I82 HydrophobicContact CD2-CG2 4.01Å; L41-F85 HydrophobicContact CD2-CB 3.79Å; L41-F85 HydrophobicContact CD2-CD2 4.46Å; L41-F85 HydrophobicContact CG-CB 3.92Å; L41-T86 HydrophobicContact CD1-CG2 3.58Å; L41-T86 HydrophobicContact CD2-CG2 3.99Å; L41-T86 HydrophobicContact CG-CG2 4.4Å
42M90.6Very high91.6Very high25 Ų258.9 Ų8.912%0.1235%0.046CC..Hα-helixtrans-58.4-49.6173.8-175.5-159.741.400110.5L14 F17 T38 P39 T44 T45 W46 L422L14-M42 HydrophobicContact CD2-SD 4.47Å; F17-M42 HydrophobicContact CE1-SD 4.39Å; F17-M42 HydrophobicContact CE2-CB 4.26Å; F17-M42 HydrophobicContact CE2-CG 3.91Å; F17-M42 HydrophobicContact CE2-SD 3.47Å; F17-M42 WeakPolarHBondContact CE2-SD 3.46Å; F17-M42 HydrophobicContact CZ-CB 3.82Å; F17-M42 HydrophobicContact CZ-CE 3.73Å; F17-M42 HydrophobicContact CZ-CG 3.77Å; F17-M42 HydrophobicContact CZ-SD 3.19Å; F17-M42 WeakPolarHBondContact CZ-SD 3.25Å; T38-M42 PolarHBondContact O-N 3.13Å; P39-M42 PolarHBondContact O-N 3.46Å; M42-T44 VanDerWaalsContact C-N 3.28Å; M42-T44 PolarHBondContact O-N 3.37Å; M42-T45 PolarHBondContact O-N 2.88Å; M42-T45 PolarHBondContact O-OG1 3.48Å; M42-W46 VanDerWaalsContact O-CB 3.24Å; M42-W46 WeakPolarHBondContact O-CB 3.16Å; M42-W46 PolarHBondContact O-N 3.21Å; M42-L422 HydrophobicContact CE-CD1 4.41Å
43L93.4Very high91.9Very high2 Ų210 Ų101%0.015%0.051CC..Hα-helixtrans-57.4-42.6-179.8-175.866.6000111.5P39 L40 L41 T45 L47 A208 L296P39-L43 WeakPolarHBondContact O-CB 3.43Å; P39-L43 PolarHBondContact O-N 2.79Å; L40-L43 PolarHBondContact O-N 2.98Å; L41-L43 VanDerWaalsContact C-N 3.35Å; L41-L43 PolarHBondContact O-N 3.16Å; L43-T45 PolarHBondContact O-N 3.35Å; L43-L47 WeakPolarHBondContact O-CB 3.41Å; L43-L47 PolarHBondContact O-N 3.03Å; L43-L47 VanDerWaalsContact O-N 3.1Å; L43-A208 VanDerWaalsContact CD2-O 3.3Å; L43-A208 WeakPolarHBondContact CD2-O 3.25Å; L43-L296 HydrophobicContact CD1-CD2 3.59Å; L43-L296 HydrophobicContact CD1-CG 3.8Å
44T94.4Very high92.2Very high6 Ų69.8 Ų9.84%0.0375%0.049CC..Hα-helixtrans-62.9-43.818066.60000113.3L40 L41 M42 L47 L81 F85 V209L40-T44 WeakPolarHBondContact O-CG2 3.38Å; L40-T44 PolarHBondContact O-N 2.96Å; L41-T44 PolarHBondContact O-N 3.32Å; L41-T44 PolarHBondContact O-OG1 3.23Å; M42-T44 VanDerWaalsContact C-N 3.28Å; M42-T44 PolarHBondContact O-N 3.37Å; T44-L47 PolarHBondContact O-N 2.94Å; T44-L81 HydrophobicContact CG2-CB 4.33Å; T44-F85 HydrophobicContact CG2-CD2 3.79Å; T44-F85 HydrophobicContact CG2-CE2 3.41Å; T44-F85 VanDerWaalsContact CG2-CE2 3.41Å; T44-F85 HydrophobicContact CG2-CZ 4.5Å; T44-V209 HydrophobicContact CG2-CB 4.36Å; T44-V209 HydrophobicContact CG2-CG1 3.44Å; T44-V209 VanDerWaalsContact CG2-CG1 3.44Å; T44-V209 HydrophobicContact CG2-CG2 3.92Å
45T92.5Very high92.5Very high8 Ų89.7 Ų9.75%0.0495%0.049CC..Hα-helixtrans-77.3-34.5-176.655.20000112.1S10 P13 L41 M42 L43 L47 P49 I82S10-T45 VanDerWaalsContact CB-O 3.29Å; S10-T45 WeakPolarHBondContact CB-O 3.46Å; P13-T45 HydrophobicContact CG-CG2 3.81Å; P13-T45 WeakPolarHBondContact CG-OG1 3.08Å; L41-T45 WeakPolarHBondContact O-CG2 3.38Å; L41-T45 PolarHBondContact O-N 3.49Å; L41-T45 VanDerWaalsContact O-N 3.12Å; L41-T45 PolarHBondContact O-OG1 3.39Å; L41-T45 VanDerWaalsContact O-OG1 3.04Å; M42-T45 PolarHBondContact O-N 2.88Å; M42-T45 PolarHBondContact O-OG1 3.48Å; L43-T45 PolarHBondContact O-N 3.35Å; T45-L47 VanDerWaalsContact C-N 3.3Å; T45-L47 PolarHBondContact O-N 3.23Å; T45-P49 VanDerWaalsContact O-CD 3.3Å; T45-P49 WeakPolarHBondContact O-CD 3.13Å; T45-I82 HydrophobicContact CG2-CD1 3.86Å; T45-I82 HydrophobicContact CG2-CG1 4.14Å
46W93.9Very high92.7Very high53 Ų5313.1 Ų13.120%0.2016%0.064CC..Hα-helixtrans-62.8-36.2171.8-174.4-112.8000112.3M42 L48 P49 L50 M414 P418M42-W46 VanDerWaalsContact O-CB 3.24Å; M42-W46 WeakPolarHBondContact O-CB 3.16Å; M42-W46 PolarHBondContact O-N 3.21Å; W46-L48 PolarHBondContact O-N 3.39Å; W46-P49 VanDerWaalsContact O-CD 3.23Å; W46-P49 WeakPolarHBondContact O-CD 3.43Å; W46-P49 VanDerWaalsContact O-CG 3.22Å; W46-P49 WeakPolarHBondContact O-CG 3.34Å; W46-L50 VanDerWaalsContact CD1-CD1 3.49Å; W46-L50 HydrophobicContact CG-CD1 4.26Å; W46-L50 WeakPolarHBondContact O-CD1 3.45Å; W46-M414 HydrophobicContact CH2-SD 3.76Å; W46-M414 HydrophobicContact CZ2-CB 4.08Å; W46-M414 VanDerWaalsContact CZ2-O 3.28Å; W46-M414 WeakPolarHBondContact CZ2-O 3.27Å; W46-M414 HydrophobicContact CZ2-SD 3.87Å; W46-M414 PolarHBondContact NE1-O 3.46Å; W46-M414 VanDerWaalsContact NE1-O 3.07Å; W46-P418 HydrophobicContact CZ2-CG 4.01Å
47L94.2Very high92.7Very high4 Ų419 Ų192%0.0219%0.086CC..Hα-helixtrans-73.3-26.8-175.3-158.577.6000114L43 T44 T45 L50 T51 M204 V205 A208 V209L43-L47 WeakPolarHBondContact O-CB 3.41Å; L43-L47 PolarHBondContact O-N 3.03Å; L43-L47 VanDerWaalsContact O-N 3.1Å; T44-L47 PolarHBondContact O-N 2.94Å; T45-L47 VanDerWaalsContact C-N 3.3Å; T45-L47 PolarHBondContact O-N 3.23Å; L47-L50 HydrophobicContact CD1-CD1 4.41Å; L47-L50 WeakPolarHBondContact O-CB 3.36Å; L47-L50 PolarHBondContact O-N 3.06Å; L47-T51 HydrophobicContact CD2-CG2 4.25Å; L47-T51 HydrophobicContact CG-CG2 3.91Å; L47-T51 WeakPolarHBondContact O-CG2 3.42Å; L47-T51 PolarHBondContact O-N 2.69Å; L47-T51 PolarHBondContact O-OG1 3.1Å; L47-M204 HydrophobicContact CD1-CE 4.35Å; L47-V205 HydrophobicContact CD2-CB 4.29Å; L47-V205 HydrophobicContact CD2-CG2 3.93Å; L47-A208 HydrophobicContact CD1-CB 3.95Å; L47-A208 HydrophobicContact CD2-CB 3.59Å; L47-A208 HydrophobicContact CG-CB 4.41Å; L47-V209 HydrophobicContact CD2-CG2 4.12Å
48L93.4Very high92.5Very high12 Ų1222 Ų226%0.06310%0.099CC..Hα-helixtrans-57-56.8179.6-17494000112.4W46 L50 T51 I52 L74 I75 Q78W46-L48 PolarHBondContact O-N 3.39Å; L48-L50 PolarHBondContact O-N 3.13Å; L48-T51 PolarHBondContact O-N 3.11Å; L48-T51 VanDerWaalsContact O-N 3.17Å; L48-T51 PolarHBondContact O-OG1 3.04Å; L48-I52 HydrophobicContact CD2-CD1 3.91Å; L48-I52 HydrophobicContact CG-CD1 3.93Å; L48-I52 HydrophobicContact CG-CG1 4.5Å; L48-I52 WeakPolarHBondContact O-CG1 3.25Å; L48-I52 PolarHBondContact O-N 2.81Å; L48-L74 HydrophobicContact CD1-CB 4.28Å; L48-I75 HydrophobicContact CD1-CG1 4.43Å; L48-Q78 HydrophobicContact CD1-CB 3.98Å; L48-Q78 HydrophobicContact CD1-CG 4.47Å; L48-Q78 VanDerWaalsContact CD1-OE1 3.28Å
49P93.6Very high92.5Very high2 Ų221.7 Ų21.71%0.01310%0.097CC..Hα-helixtrans-58-38.4179.220.9-32.1000112.7S6 L7 T45 W46 I52 M53S6-P49 WeakPolarHBondContact OG-CA 3.21Å; S6-P49 WeakPolarHBondContact OG-CB 3.06Å; L7-P49 HydrophobicContact CD2-CB 3.61Å; L7-P49 HydrophobicContact CD2-CG 3.8Å; L7-P49 HydrophobicContact CG-CB 3.67Å; L7-P49 HydrophobicContact CG-CG 4.28Å; T45-P49 VanDerWaalsContact O-CD 3.3Å; T45-P49 WeakPolarHBondContact O-CD 3.13Å; W46-P49 VanDerWaalsContact O-CD 3.23Å; W46-P49 WeakPolarHBondContact O-CD 3.43Å; W46-P49 VanDerWaalsContact O-CG 3.22Å; W46-P49 WeakPolarHBondContact O-CG 3.34Å; P49-I52 PolarHBondContact O-N 3.37Å; P49-M53 WeakPolarHBondContact O-CG 3.49Å; P49-M53 PolarHBondContact O-N 2.99Å
50L94.8Very high92.5Very high4 Ų424.7 Ų24.72%0.02112%0.119CC..Hα-helixtrans-61-46.7176.1-73.6160.2000112.1W46 L47 L48 I52 M53 A54 M204 L411 M414W46-L50 VanDerWaalsContact CD1-CD1 3.49Å; W46-L50 HydrophobicContact CG-CD1 4.26Å; W46-L50 WeakPolarHBondContact O-CD1 3.45Å; L47-L50 HydrophobicContact CD1-CD1 4.41Å; L47-L50 WeakPolarHBondContact O-CB 3.36Å; L47-L50 PolarHBondContact O-N 3.06Å; L48-L50 PolarHBondContact O-N 3.13Å; L50-I52 VanDerWaalsContact C-N 3.35Å; L50-I52 PolarHBondContact O-N 2.85Å; L50-M53 PolarHBondContact O-N 3.08Å; L50-A54 WeakPolarHBondContact O-CB 3.29Å; L50-A54 PolarHBondContact O-N 3.42Å; L50-M204 HydrophobicContact CB-CE 3.87Å; L50-L411 HydrophobicContact CD2-CG 4.23Å; L50-M414 HydrophobicContact CD2-CB 3.62Å
51T94.7Very high92.4Very high1 Ų129.4 Ų29.41%0.00615%0.152CC..Hα-helixtrans-66.9-35.6179.360.40000112.6L47 L48 A54 S55 A201 M204 V205L47-T51 HydrophobicContact CD2-CG2 4.25Å; L47-T51 HydrophobicContact CG-CG2 3.91Å; L47-T51 WeakPolarHBondContact O-CG2 3.42Å; L47-T51 PolarHBondContact O-N 2.69Å; L47-T51 PolarHBondContact O-OG1 3.1Å; L48-T51 PolarHBondContact O-N 3.11Å; L48-T51 VanDerWaalsContact O-N 3.17Å; L48-T51 PolarHBondContact O-OG1 3.04Å; T51-A54 PolarHBondContact O-N 3.03Å; T51-S55 WeakPolarHBondContact O-CB 3.5Å; T51-S55 PolarHBondContact O-N 2.93Å; T51-S55 VanDerWaalsContact O-N 3.09Å; T51-S55 PolarHBondContact O-OG 3.13Å; T51-A201 HydrophobicContact CG2-CB 4.31Å; T51-M204 HydrophobicContact CG2-CB 3.91Å; T51-M204 HydrophobicContact CG2-CE 3.95Å; T51-M204 HydrophobicContact CG2-SD 3.96Å; T51-V205 HydrophobicContact CG2-CG2 3.77Å
52I94Very high92.4Very high6 Ų631.1 Ų31.13%0.03116%0.159CC..Hα-helixtrans-65.8-46.6173.3-63.5171000109.5T3 L48 P49 L50 A54 S55 Q56 L71 L74T3-I52 HydrophobicContact CG2-CB 4.2Å; T3-I52 HydrophobicContact CG2-CG2 3.5Å; L48-I52 HydrophobicContact CD2-CD1 3.91Å; L48-I52 HydrophobicContact CG-CD1 3.93Å; L48-I52 HydrophobicContact CG-CG1 4.5Å; L48-I52 WeakPolarHBondContact O-CG1 3.25Å; L48-I52 PolarHBondContact O-N 2.81Å; P49-I52 PolarHBondContact O-N 3.37Å; L50-I52 VanDerWaalsContact C-N 3.35Å; L50-I52 PolarHBondContact O-N 2.85Å; I52-A54 VanDerWaalsContact C-N 3.33Å; I52-A54 PolarHBondContact O-N 3.45Å; I52-S55 PolarHBondContact O-N 3.23Å; I52-S55 PolarHBondContact O-OG 2.9Å; I52-Q56 WeakPolarHBondContact O-CG 3.32Å; I52-Q56 PolarHBondContact O-N 3.34Å; I52-L71 HydrophobicContact CB-CD2 4.49Å; I52-L71 HydrophobicContact CD1-CD2 4.29Å; I52-L71 HydrophobicContact CG1-CD2 3.88Å; I52-L71 HydrophobicContact CG2-CD2 3.99Å; I52-L74 HydrophobicContact CG1-CD1 4.5Å
53M94.1Very high92.6Very high30 Ų3032.9 Ų32.915%0.14817%0.173CC..Hα-helixtrans-60.1-42.6175.6-73.7-179.770.300111.8T3 P49 L50 S55 R407 T410 L411T3-M53 HydrophobicContact CG2-CG 3.83Å; P49-M53 WeakPolarHBondContact O-CG 3.49Å; P49-M53 PolarHBondContact O-N 2.99Å; L50-M53 PolarHBondContact O-N 3.08Å; M53-S55 PolarHBondContact O-N 2.88Å; M53-R407 WeakPolarHBondContact O-CD 3.3Å; M53-R407 PolarHBondContact O-NH1 3.43Å; M53-T410 WeakPolarHBondContact CE-OG1 3.44Å; M53-L411 HydrophobicContact CB-CD1 4.39Å
54A94.4Very high92.7Very high1 Ų138.5 Ų38.51%0.00820%0.202CC..Hα-helixtrans-61.8-43.7-179.300000112.8L50 T51 I52 I200 M204 R407 L411L50-A54 WeakPolarHBondContact O-CB 3.29Å; L50-A54 PolarHBondContact O-N 3.42Å; T51-A54 PolarHBondContact O-N 3.03Å; I52-A54 VanDerWaalsContact C-N 3.33Å; I52-A54 PolarHBondContact O-N 3.45Å; A54-I200 HydrophobicContact CB-CG1 3.89Å; A54-I200 HydrophobicContact CB-CG2 3.89Å; A54-M204 HydrophobicContact CB-CE 4.41Å; A54-M204 HydrophobicContact CB-SD 3.6Å; A54-M204 VanDerWaalsContact CB-SD 3.6Å; A54-R407 PolarHBondContact O-NH1 3.48Å; A54-L411 HydrophobicContact CB-CD1 3.63Å
55S93.6Very high92.8Very high2 Ų241.8 Ų41.81%0.01423%0.225CC..Hα-helixtrans-82.2-14.7-170.655.70000115.2T51 I52 M53 R57 H58 L59 Y70T51-S55 WeakPolarHBondContact O-CB 3.5Å; T51-S55 PolarHBondContact O-N 2.93Å; T51-S55 VanDerWaalsContact O-N 3.09Å; T51-S55 PolarHBondContact O-OG 3.13Å; I52-S55 PolarHBondContact O-N 3.23Å; I52-S55 PolarHBondContact O-OG 2.9Å; M53-S55 PolarHBondContact O-N 2.88Å; S55-R57 VanDerWaalsContact C-N 3.33Å; S55-R57 PolarHBondContact O-N 3.44Å; S55-H58 PolarHBondContact O-N 2.73Å; S55-L59 WeakPolarHBondContact O-CB 3.38Å; S55-L59 WeakPolarHBondContact O-CG 3.45Å; S55-L59 PolarHBondContact O-N 3.21Å; S55-Y70 WeakPolarHBondContact CB-OH 3.32Å
56Q89Confident92.9Very high88 Ų8846.1 Ų46.141%0.41124%0.24SC..THydrogen-bonded Turntrans-54.3-42-175.9-83.6167.512.600114.6I52 S60I52-Q56 WeakPolarHBondContact O-CG 3.32Å; I52-Q56 PolarHBondContact O-N 3.34Å; Q56-S60 PolarHBondContact O-N 2.9Å
57R88.6Confident92.9Very high125 Ų12546.7 Ų46.747%0.47224%0.244SC..THydrogen-bonded Turntrans-69-48.3-176.7-178.760-179.3170.89.3111.2S55 L59 S60 E310S55-R57 VanDerWaalsContact C-N 3.33Å; S55-R57 PolarHBondContact O-N 3.44Å; R57-L59 VanDerWaalsContact C-N 3.29Å; R57-L59 PolarHBondContact O-N 2.92Å; R57-S60 WeakPolarHBondContact O-CB 3.48Å; R57-S60 PolarHBondContact O-N 3.14Å; R57-S60 VanDerWaalsContact O-N 3.14Å; R57-S60 PolarHBondContact O-OG 3.47Å; R57-E310 WeakPolarHBondContact CG-OE2 3.19Å
58H86.3Confident92.9Very high61 Ų6153 Ų5328%0.28227%0.272SS..G310 helixtrans-59.6-40177.5177.863.1000111.9S55 S60 N113S55-H58 PolarHBondContact O-N 2.73Å; H58-S60 VanDerWaalsContact C-N 3.26Å; H58-S60 PolarHBondContact O-N 3.44Å; H58-N113 PolarHBondContact CE1-OD1 3.42Å
59L90.7Very high93Very high8 Ų857 Ų574%0.04229%0.293CS..G310 helixtrans-81.52.4179.3-66.2167.5000114.2S55 R57 S61 E62 K67 Y70S55-L59 WeakPolarHBondContact O-CB 3.38Å; S55-L59 WeakPolarHBondContact O-CG 3.45Å; S55-L59 PolarHBondContact O-N 3.21Å; R57-L59 VanDerWaalsContact C-N 3.29Å; R57-L59 PolarHBondContact O-N 2.92Å; L59-S61 VanDerWaalsContact C-N 3.27Å; L59-S61 PolarHBondContact O-N 3.5Å; L59-E62 HydrophobicContact CD2-CG 4.22Å; L59-E62 PolarHBondContact O-N 3.26Å; L59-K67 WeakPolarHBondContact O-CD 3.42Å; L59-K67 WeakPolarHBondContact O-CE 3.33Å; L59-K67 PolarHBondContact O-NZ 3.5Å; L59-Y70 HydrophobicContact CD1-CD1 3.28Å; L59-Y70 HydrophobicContact CD1-CE1 3.46Å; L59-Y70 VanDerWaalsContact CD1-CE1 3.46Å; L59-Y70 HydrophobicContact CD1-CG 3.82Å; L59-Y70 HydrophobicContact CD2-CD1 4.46Å; L59-Y70 HydrophobicContact CD2-CD2 4.37Å; L59-Y70 HydrophobicContact CD2-CG 4.19Å; L59-Y70 HydrophobicContact CG-CD1 4.44Å
60S90.4Very high93.1Very high64 Ų6457 Ų5745%0.44829%0.292SS..G310 helixtrans-60.6-36.6-173.6680000112.7Q56 R57 H58 K67Q56-S60 PolarHBondContact O-N 2.9Å; R57-S60 WeakPolarHBondContact O-CB 3.48Å; R57-S60 PolarHBondContact O-N 3.14Å; R57-S60 VanDerWaalsContact O-N 3.14Å; R57-S60 PolarHBondContact O-OG 3.47Å; H58-S60 VanDerWaalsContact C-N 3.26Å; H58-S60 PolarHBondContact O-N 3.44Å; S60-K67 PolarHBondContact O-NZ 2.9Å
61S91.1Very high93.1Very high101 Ų10158.5 Ų58.571%0.70630%0.3SS*.G310 helixtrans-84.6-12.3-179.3520000115.1L59L59-S61 VanDerWaalsContact C-N 3.27Å; L59-S61 PolarHBondContact O-N 3.5Å
62E93.3Very high93.1Very high51 Ų5161 Ų6124%0.23832%0.318CS..SBendtrans-74.5150.3-179-73.6-67.5151.800111.8L59 R66 K67L59-E62 HydrophobicContact CD2-CG 4.22Å; L59-E62 PolarHBondContact O-N 3.26Å; E62-R66 HydrophobicContact CB-CB 4.48Å; E62-R66 WeakPolarHBondContact OE2-CD 3.35Å; E62-R66 IonicContact OE2-CZ 3.86Å; E62-R66 IonicContact OE2-NE 3.11Å; E62-R66 IonicContact OE2-NH1 3.03Å; E62-R66 PolarHBondContact OE2-NH1 3.17Å; E62-K67 HydrophobicContact CB-CG 4.14Å; E62-K67 WeakPolarHBondContact O-CE 3.47Å
63P95.4Very high93.2Very high62 Ų6263 Ų6340%0.40333%0.328SS..  trans-64.9152.817328-35.3000111.7S65 R66 K67P63-S65 VanDerWaalsContact C-N 3.27Å; P63-S65 PolarHBondContact O-N 3.49Å; P63-R66 HydrophobicContact CG-CB 4.06Å; P63-R66 HydrophobicContact CG-CG 3.82Å; P63-R66 PolarHBondContact O-N 2.89Å; P63-K67 PolarHBondContact O-N 3.26Å
64L94.6Very high93.3Very high120 Ų12061.7 Ų61.763%0.62832%0.321SS*.Hα-helixtrans-54.1-40.5-174.5-175.768.8000113.3R66 K67 K68L64-R66 VanDerWaalsContact C-N 3.34Å; L64-R66 PolarHBondContact O-N 3.45Å; L64-K67 PolarHBondContact O-N 3.09Å; L64-K68 WeakPolarHBondContact O-CG 3.41Å; L64-K68 PolarHBondContact O-N 3.35Å
65S95.9Very high93.3Very high75 Ų7565.3 Ų65.352%0.52434%0.34SS..Hα-helixtrans-60.3-43.1178.255.70000111.9P63 K68 L69P63-S65 VanDerWaalsContact C-N 3.27Å; P63-S65 PolarHBondContact O-N 3.49Å; S65-K68 PolarHBondContact O-N 2.66Å; S65-L69 WeakPolarHBondContact O-CG 3.46Å; S65-L69 PolarHBondContact O-N 3.49Å
66R94.6Very high93.4Very high98 Ų9867.3 Ų67.337%0.3735%0.354SS..Hα-helixtrans-71.1-34.6177.6-68.1-178-169.9173.52.4112.5E62 P63 L64 L69 Y70E62-R66 HydrophobicContact CB-CB 4.48Å; E62-R66 WeakPolarHBondContact OE2-CD 3.35Å; E62-R66 IonicContact OE2-CZ 3.86Å; E62-R66 IonicContact OE2-NE 3.11Å; E62-R66 IonicContact OE2-NH1 3.03Å; E62-R66 PolarHBondContact OE2-NH1 3.17Å; P63-R66 HydrophobicContact CG-CB 4.06Å; P63-R66 HydrophobicContact CG-CG 3.82Å; P63-R66 PolarHBondContact O-N 2.89Å; L64-R66 VanDerWaalsContact C-N 3.34Å; L64-R66 PolarHBondContact O-N 3.45Å; R66-L69 PolarHBondContact O-N 3Å; R66-Y70 WeakPolarHBondContact O-CB 3.29Å; R66-Y70 PolarHBondContact O-N 3.23Å
67K93.9Very high93.8Very high65 Ų6563.3 Ų63.328%0.28334%0.335SS..Hα-helixtrans-62.1-44171.5-60-168.2-158.1-161.70111.3L59 S60 E62 P63 L64 Y70 L71L59-K67 WeakPolarHBondContact O-CD 3.42Å; L59-K67 WeakPolarHBondContact O-CE 3.33Å; L59-K67 PolarHBondContact O-NZ 3.5Å; S60-K67 PolarHBondContact O-NZ 2.9Å; E62-K67 HydrophobicContact CB-CG 4.14Å; E62-K67 WeakPolarHBondContact O-CE 3.47Å; P63-K67 PolarHBondContact O-N 3.26Å; L64-K67 PolarHBondContact O-N 3.09Å; K67-Y70 PolarHBondContact O-N 3.01Å; K67-L71 WeakPolarHBondContact O-CG 3.4Å; K67-L71 PolarHBondContact O-N 3.37Å; K67-L71 VanDerWaalsContact O-N 3.07Å
68K93.9Very high94.1Very high137 Ų13758 Ų5860%0.59632%0.316SS*.Hα-helixtrans-62.3-44.6175.6-73.1-175.7178.9-175.30111.6L64 S65 Y70 L71 S72L64-K68 WeakPolarHBondContact O-CG 3.41Å; L64-K68 PolarHBondContact O-N 3.35Å; S65-K68 PolarHBondContact O-N 2.66Å; K68-Y70 PolarHBondContact O-N 2.9Å; K68-L71 PolarHBondContact O-N 3.21Å; K68-S72 PolarHBondContact O-N 3.49Å; K68-S72 PolarHBondContact O-OG 3.21Å
69L96.2Very high94.5Very high97 Ų9759.9 Ų59.951%0.50833%0.327SS..Hα-helixtrans-60.3-43.8175.6-74.5167.8000112S65 R66 L71 S72 M73 W111S65-L69 WeakPolarHBondContact O-CG 3.46Å; S65-L69 PolarHBondContact O-N 3.49Å; R66-L69 PolarHBondContact O-N 3Å; L69-L71 VanDerWaalsContact C-N 3.35Å; L69-L71 PolarHBondContact O-N 3.48Å; L69-S72 WeakPolarHBondContact CA-OG 3.44Å; L69-S72 PolarHBondContact O-N 2.71Å; L69-S72 PolarHBondContact O-OG 3.09Å; L69-M73 VanDerWaalsContact O-CG 3.31Å; L69-M73 WeakPolarHBondContact O-CG 3.35Å; L69-M73 PolarHBondContact O-N 3.47Å; L69-W111 HydrophobicContact CB-CH2 4.35Å; L69-W111 HydrophobicContact CB-CZ2 4.32Å
70Y95.7Very high94.7Very high0 Ų060 Ų600%033%0.328CS..Hα-helixtrans-59.5-46.6176.7-176.9-97000112S55 L59 R66 K67 K68 M73 L74 I107 W111 P199 A201S55-Y70 WeakPolarHBondContact CB-OH 3.32Å; L59-Y70 HydrophobicContact CD1-CD1 3.28Å; L59-Y70 HydrophobicContact CD1-CE1 3.46Å; L59-Y70 VanDerWaalsContact CD1-CE1 3.46Å; L59-Y70 HydrophobicContact CD1-CG 3.82Å; L59-Y70 HydrophobicContact CD2-CD1 4.46Å; L59-Y70 HydrophobicContact CD2-CD2 4.37Å; L59-Y70 HydrophobicContact CD2-CG 4.19Å; L59-Y70 HydrophobicContact CG-CD1 4.44Å; R66-Y70 WeakPolarHBondContact O-CB 3.29Å; R66-Y70 PolarHBondContact O-N 3.23Å; K67-Y70 PolarHBondContact O-N 3.01Å; K68-Y70 PolarHBondContact O-N 2.9Å; Y70-M73 PolarHBondContact O-N 2.9Å; Y70-L74 HydrophobicContact CD1-CD1 3.84Å; Y70-L74 HydrophobicContact CD1-CG 4.39Å; Y70-L74 HydrophobicContact CE1-CD1 3.38Å; Y70-L74 HydrophobicContact CE1-CG 4.11Å; Y70-L74 PolarHBondContact O-N 2.97Å; Y70-I107 HydrophobicContact CE2-CG2 4.2Å; Y70-W111 HydrophobicContact CD2-CB 4.31Å; Y70-W111 AromaticContact CD2-CD2 3.45Å; Y70-W111 HydrophobicContact CD2-CD2 3.45Å; Y70-W111 VanDerWaalsContact CD2-CD2 3.45Å; Y70-W111 AromaticContact CD2-CE2 3.65Å; Y70-W111 AromaticContact CD2-CE3 3.75Å; Y70-W111 HydrophobicContact CD2-CE3 3.75Å; Y70-W111 AromaticContact CD2-CG 3.72Å; Y70-W111 HydrophobicContact CD2-CG 3.72Å; Y70-W111 HydrophobicContact CD2-CH2 4.34Å; Y70-W111 HydrophobicContact CD2-CZ2 4.11Å; Y70-W111 HydrophobicContact CD2-CZ3 4.18Å; Y70-W111 HydrophobicContact CE2-CB 4.11Å; Y70-W111 HydrophobicContact CE2-CD2 4.11Å; Y70-W111 HydrophobicContact CE2-CE3 4.35Å; Y70-W111 HydrophobicContact CE2-CG 4.02Å; Y70-W111 HydrophobicContact CG-CD2 4.45Å; Y70-W111 HydrophobicContact CG-CZ2 4.42Å; Y70-P199 HydrophobicContact CE2-CG 4.39Å; Y70-A201 HydrophobicContact CE1-CB 4.4Å; Y70-A201 WeakPolarHBondContact OH-CB 3.24Å
71L94.5Very high95Very high36 Ų3657.1 Ų57.119%0.18831%0.308CS..Hα-helixtrans-65.5-38.7177.9-69.1170.5000111.9T2 I52 K67 K68 L69 M73 L74 I75T2-L71 HydrophobicContact CG2-CD1 4.26Å; I52-L71 HydrophobicContact CB-CD2 4.49Å; I52-L71 HydrophobicContact CD1-CD2 4.29Å; I52-L71 HydrophobicContact CG1-CD2 3.88Å; I52-L71 HydrophobicContact CG2-CD2 3.99Å; K67-L71 WeakPolarHBondContact O-CG 3.4Å; K67-L71 PolarHBondContact O-N 3.37Å; K67-L71 VanDerWaalsContact O-N 3.07Å; K68-L71 PolarHBondContact O-N 3.21Å; L69-L71 VanDerWaalsContact C-N 3.35Å; L69-L71 PolarHBondContact O-N 3.48Å; L71-M73 VanDerWaalsContact C-N 3.31Å; L71-M73 PolarHBondContact O-N 3.22Å; L71-L74 PolarHBondContact O-N 3.33Å; L71-I75 VanDerWaalsContact O-CG1 3.27Å; L71-I75 WeakPolarHBondContact O-CG1 3.38Å; L71-I75 PolarHBondContact O-N 3.09Å
72S95.3Very high95.2Very high55 Ų5554.5 Ų54.539%0.38529%0.286SS..Hα-helixtrans-65.9-33.6174.762.40000112.3K68 L69 I75 S76K68-S72 PolarHBondContact O-N 3.49Å; K68-S72 PolarHBondContact O-OG 3.21Å; L69-S72 WeakPolarHBondContact CA-OG 3.44Å; L69-S72 PolarHBondContact O-N 2.71Å; L69-S72 PolarHBondContact O-OG 3.09Å; S72-I75 PolarHBondContact O-N 3.28Å; S72-S76 WeakPolarHBondContact O-CB 3.4Å; S72-S76 PolarHBondContact O-N 3.12Å; S72-S76 PolarHBondContact O-OG 3.31Å
73M96.7Very high95.3Very high46 Ų4654.6 Ų54.623%0.22729%0.287CS..Hα-helixtrans-67-40.6172.6-63.6-45.4-106.500111.8L69 Y70 L71 S76 L77 A106 I107 W111L69-M73 VanDerWaalsContact O-CG 3.31Å; L69-M73 WeakPolarHBondContact O-CG 3.35Å; L69-M73 PolarHBondContact O-N 3.47Å; Y70-M73 PolarHBondContact O-N 2.9Å; L71-M73 VanDerWaalsContact C-N 3.31Å; L71-M73 PolarHBondContact O-N 3.22Å; M73-S76 WeakPolarHBondContact CA-OG 3.3Å; M73-S76 PolarHBondContact O-OG 3.27Å; M73-L77 VanDerWaalsContact O-CB 3.3Å; M73-L77 WeakPolarHBondContact O-CB 3.44Å; M73-L77 PolarHBondContact O-N 2.88Å; M73-A106 HydrophobicContact CE-CB 3.25Å; M73-I107 HydrophobicContact CB-CD1 4.17Å; M73-I107 HydrophobicContact CB-CG1 3.99Å; M73-W111 HydrophobicContact CG-CH2 4.32Å; M73-W111 HydrophobicContact CG-CZ3 4.34Å
74L95.1Very high95.3Very high3 Ų351.7 Ų51.72%0.01627%0.268CS..Hα-helixtrans-65-40.5174.4-72.1176.4000112.6L48 I52 Y70 L71 L77 Q78 I107 A201L48-L74 HydrophobicContact CD1-CB 4.28Å; I52-L74 HydrophobicContact CG1-CD1 4.5Å; Y70-L74 HydrophobicContact CD1-CD1 3.84Å; Y70-L74 HydrophobicContact CD1-CG 4.39Å; Y70-L74 HydrophobicContact CE1-CD1 3.38Å; Y70-L74 HydrophobicContact CE1-CG 4.11Å; Y70-L74 PolarHBondContact O-N 2.97Å; L71-L74 PolarHBondContact O-N 3.33Å; L74-L77 WeakPolarHBondContact O-CB 3.34Å; L74-L77 PolarHBondContact O-N 3.15Å; L74-Q78 PolarHBondContact O-N 3.41Å; L74-I107 HydrophobicContact CD2-CD1 3.71Å; L74-I107 HydrophobicContact CG-CD1 4.3Å; L74-A201 HydrophobicContact CD1-CB 4.12Å; L74-A201 HydrophobicContact CD2-CB 3.93Å
75I94.4Very high95.3Very high77 Ų7746 Ų4640%0.39524%0.238SC..Hα-helixtrans-68.4-44.5178.6-67163.9000110.8L48 L71 S72 L77 Q78 I79L48-I75 HydrophobicContact CD1-CG1 4.43Å; L71-I75 VanDerWaalsContact O-CG1 3.27Å; L71-I75 WeakPolarHBondContact O-CG1 3.38Å; L71-I75 PolarHBondContact O-N 3.09Å; S72-I75 PolarHBondContact O-N 3.28Å; I75-L77 VanDerWaalsContact C-N 3.29Å; I75-L77 PolarHBondContact O-N 3.41Å; I75-Q78 PolarHBondContact O-N 3.13Å; I75-Q78 VanDerWaalsContact O-N 3.16Å; I75-I79 HydrophobicContact CG2-CD1 3.87Å; I75-I79 HydrophobicContact CG2-CG1 4.44Å; I75-I79 WeakPolarHBondContact O-CG1 3.32Å; I75-I79 PolarHBondContact O-N 3.06Å
76S96.5Very high95.2Very high44 Ų4443.3 Ų43.331%0.30822%0.218SC..Hα-helixtrans-63.5-35.4175.456.30000112.4S72 M73 I79 S80S72-S76 WeakPolarHBondContact O-CB 3.4Å; S72-S76 PolarHBondContact O-N 3.12Å; S72-S76 PolarHBondContact O-OG 3.31Å; M73-S76 WeakPolarHBondContact CA-OG 3.3Å; M73-S76 PolarHBondContact O-OG 3.27Å; S76-I79 PolarHBondContact O-N 2.78Å; S76-S80 PolarHBondContact O-N 2.86Å; S76-S80 PolarHBondContact O-OG 3.01Å
77L96.4Very high95.2Very high4 Ų438.7 Ų38.72%0.02120%0.201CC..Hα-helixtrans-61.9-45.8171-175.653.1000111.7M73 L74 I75 S80 L81 T100 P103 T104 I107 V205M73-L77 VanDerWaalsContact O-CB 3.3Å; M73-L77 WeakPolarHBondContact O-CB 3.44Å; M73-L77 PolarHBondContact O-N 2.88Å; L74-L77 WeakPolarHBondContact O-CB 3.34Å; L74-L77 PolarHBondContact O-N 3.15Å; I75-L77 VanDerWaalsContact C-N 3.29Å; I75-L77 PolarHBondContact O-N 3.41Å; L77-S80 WeakPolarHBondContact CA-OG 3.43Å; L77-S80 PolarHBondContact O-N 3.08Å; L77-S80 PolarHBondContact O-OG 3.49Å; L77-L81 HydrophobicContact CD1-CD1 4.09Å; L77-L81 HydrophobicContact CD1-CG 4.25Å; L77-L81 HydrophobicContact CG-CD1 3.96Å; L77-L81 WeakPolarHBondContact O-CB 3.37Å; L77-L81 WeakPolarHBondContact O-CD1 3.28Å; L77-L81 WeakPolarHBondContact O-CG 3.27Å; L77-L81 PolarHBondContact O-N 3.2Å; L77-T100 HydrophobicContact CD1-CG2 4.47Å; L77-P103 HydrophobicContact CB-CB 3.83Å; L77-P103 HydrophobicContact CB-CG 4.37Å; L77-P103 HydrophobicContact CD1-CB 4.35Å; L77-T104 HydrophobicContact CD1-CG2 3.48Å; L77-T104 VanDerWaalsContact CD1-CG2 3.48Å; L77-T104 HydrophobicContact CD2-CG2 3.52Å; L77-T104 HydrophobicContact CG-CG2 4.15Å; L77-I107 HydrophobicContact CD2-CD1 4.2Å; L77-V205 HydrophobicContact CD2-CB 4.15Å; L77-V205 HydrophobicContact CD2-CG1 3.53Å; L77-V205 HydrophobicContact CD2-CG2 4.35Å; L77-V205 HydrophobicContact CG-CG1 4.14Å
78Q94.7Very high95.1Very high15 Ų1535.7 Ų35.77%0.0719%0.188CC..Hα-helixtrans-62.9-44177.1-172.8-166.42.800111.8L48 L74 I75 L81 I82L48-Q78 HydrophobicContact CD1-CB 3.98Å; L48-Q78 HydrophobicContact CD1-CG 4.47Å; L48-Q78 VanDerWaalsContact CD1-OE1 3.28Å; L74-Q78 PolarHBondContact O-N 3.41Å; I75-Q78 PolarHBondContact O-N 3.13Å; I75-Q78 VanDerWaalsContact O-N 3.16Å; Q78-L81 PolarHBondContact O-N 2.74Å; Q78-I82 HydrophobicContact CG-CD1 3.89Å; Q78-I82 HydrophobicContact CG-CG1 4.39Å; Q78-I82 WeakPolarHBondContact O-CG1 3.39Å; Q78-I82 PolarHBondContact O-N 3.42Å
79I94.5Very high95.1Very high99 Ų9933.3 Ų33.351%0.50818%0.179SC..Hα-helixtrans-60.9-49.6178.9-66.8165.1000110I75 S76 L81 I82 M83I75-I79 HydrophobicContact CG2-CD1 3.87Å; I75-I79 HydrophobicContact CG2-CG1 4.44Å; I75-I79 WeakPolarHBondContact O-CG1 3.32Å; I75-I79 PolarHBondContact O-N 3.06Å; S76-I79 PolarHBondContact O-N 2.78Å; I79-L81 VanDerWaalsContact C-N 3.29Å; I79-L81 PolarHBondContact O-N 3.45Å; I79-I82 PolarHBondContact O-N 3.3Å; I79-M83 HydrophobicContact CG2-CG 4.39Å; I79-M83 WeakPolarHBondContact O-CG 3.43Å; I79-M83 PolarHBondContact O-N 2.96Å
80S96.6Very high95Very high10 Ų1028.8 Ų28.87%0.0716%0.156CC..Hα-helixtrans-58.1-42.3176.751.30000111.7S76 L77 M83 T84 T99S76-S80 PolarHBondContact O-N 2.86Å; S76-S80 PolarHBondContact O-OG 3.01Å; L77-S80 WeakPolarHBondContact CA-OG 3.43Å; L77-S80 PolarHBondContact O-N 3.08Å; L77-S80 PolarHBondContact O-OG 3.49Å; S80-M83 PolarHBondContact O-N 3.42Å; S80-T84 WeakPolarHBondContact O-CG2 3.45Å; S80-T84 PolarHBondContact O-N 3.36Å; S80-T99 WeakPolarHBondContact CB-OG1 3.22Å
81L96.3Very high95Very high4 Ų431 Ų312%0.02117%0.167CC..Hα-helixtrans-63.3-45.6176.9-73.6169.3000113.6T44 L77 Q78 I79 M83 T84 F85 T100 V205 V209 L210 L213T44-L81 HydrophobicContact CG2-CB 4.33Å; L77-L81 HydrophobicContact CD1-CD1 4.09Å; L77-L81 HydrophobicContact CD1-CG 4.25Å; L77-L81 HydrophobicContact CG-CD1 3.96Å; L77-L81 WeakPolarHBondContact O-CB 3.37Å; L77-L81 WeakPolarHBondContact O-CD1 3.28Å; L77-L81 WeakPolarHBondContact O-CG 3.27Å; L77-L81 PolarHBondContact O-N 3.2Å; Q78-L81 PolarHBondContact O-N 2.74Å; I79-L81 VanDerWaalsContact C-N 3.29Å; I79-L81 PolarHBondContact O-N 3.45Å; L81-M83 VanDerWaalsContact C-N 3.26Å; L81-M83 PolarHBondContact O-N 3.16Å; L81-T84 WeakPolarHBondContact CA-OG1 3.39Å; L81-T84 PolarHBondContact O-N 2.97Å; L81-T84 PolarHBondContact O-OG1 3.4Å; L81-F85 HydrophobicContact CD2-CE2 4.49Å; L81-F85 WeakPolarHBondContact O-CD2 3.42Å; L81-F85 PolarHBondContact O-N 2.94Å; L81-T100 HydrophobicContact CD2-CG2 3.77Å; L81-T100 HydrophobicContact CG-CG2 4.11Å; L81-V205 HydrophobicContact CD1-CG1 3.96Å; L81-V209 HydrophobicContact CD1-CB 4.33Å; L81-V209 HydrophobicContact CD1-CG1 3.91Å; L81-V209 HydrophobicContact CD2-CG1 3.69Å; L81-V209 HydrophobicContact CG-CG1 4.3Å; L81-L210 HydrophobicContact CD2-CD2 4Å; L81-L213 HydrophobicContact CD2-CD1 3.71Å; L81-L213 HydrophobicContact CD2-CD2 4.19Å; L81-L213 HydrophobicContact CD2-CG 4.16Å
82I94.7Very high95.1Very high47 Ų4730.8 Ų30.824%0.24117%0.165CC..Hα-helixtrans-58.4-45.5176.6-68.4165000109.7L41 T45 Q78 I79 T84 F85 T86L41-I82 HydrophobicContact CD2-CB 4.31Å; L41-I82 HydrophobicContact CD2-CG1 4.46Å; L41-I82 HydrophobicContact CD2-CG2 4.01Å; T45-I82 HydrophobicContact CG2-CD1 3.86Å; T45-I82 HydrophobicContact CG2-CG1 4.14Å; Q78-I82 HydrophobicContact CG-CD1 3.89Å; Q78-I82 HydrophobicContact CG-CG1 4.39Å; Q78-I82 WeakPolarHBondContact O-CG1 3.39Å; Q78-I82 PolarHBondContact O-N 3.42Å; I79-I82 PolarHBondContact O-N 3.3Å; I82-T84 VanDerWaalsContact C-N 3.34Å; I82-T84 PolarHBondContact O-N 3.06Å; I82-F85 PolarHBondContact O-N 3.48Å; I82-T86 PolarHBondContact O-N 3.26Å; I82-T86 VanDerWaalsContact O-N 3.15Å; I82-T86 PolarHBondContact O-OG1 3.43Å; I82-T86 VanDerWaalsContact O-OG1 3.05Å
83M95.1Very high95.1Very high53 Ų5328.5 Ų28.526%0.26115%0.148SC..Hα-helixtrans-67.8-31.2179.5-59.5-66.6-83.600112.6F31 I79 S80 L81 A87 F96F31-M83 HydrophobicContact CE1-CE 3.54Å; F31-M83 HydrophobicContact CE1-SD 3.86Å; F31-M83 HydrophobicContact CE2-CE 3.86Å; F31-M83 HydrophobicContact CZ-CE 3.07Å; F31-M83 HydrophobicContact CZ-SD 3.88Å; I79-M83 HydrophobicContact CG2-CG 4.39Å; I79-M83 WeakPolarHBondContact O-CG 3.43Å; I79-M83 PolarHBondContact O-N 2.96Å; S80-M83 PolarHBondContact O-N 3.42Å; L81-M83 VanDerWaalsContact C-N 3.26Å; L81-M83 PolarHBondContact O-N 3.16Å; M83-A87 WeakPolarHBondContact O-CB 3.34Å; M83-A87 PolarHBondContact O-N 3.02Å; M83-F96 HydrophobicContact CB-CD1 3.99Å; M83-F96 HydrophobicContact CB-CD2 3.73Å; M83-F96 HydrophobicContact CB-CE1 4.04Å; M83-F96 HydrophobicContact CB-CE2 3.77Å; M83-F96 HydrophobicContact CB-CG 3.86Å; M83-F96 HydrophobicContact CB-CZ 3.94Å; M83-F96 HydrophobicContact CE-CE2 4.17Å; M83-F96 HydrophobicContact CE-CZ 3.84Å; M83-F96 HydrophobicContact CG-CE1 4.49Å; M83-F96 HydrophobicContact CG-CZ 4.39Å
84T96.1Very high95.2Very high0 Ų027.2 Ų27.20%014%0.141CC..Hα-helixtrans-63.3-46.217353.40000112.3S80 L81 I82 F93 F96 F97 T100 L213S80-T84 WeakPolarHBondContact O-CG2 3.45Å; S80-T84 PolarHBondContact O-N 3.36Å; L81-T84 WeakPolarHBondContact CA-OG1 3.39Å; L81-T84 PolarHBondContact O-N 2.97Å; L81-T84 PolarHBondContact O-OG1 3.4Å; I82-T84 VanDerWaalsContact C-N 3.34Å; I82-T84 PolarHBondContact O-N 3.06Å; T84-F93 WeakPolarHBondContact O-CD2 3.4Å; T84-F96 HydrophobicContact CG2-CB 3.4Å; T84-F96 VanDerWaalsContact CG2-CB 3.4Å; T84-F96 WeakPolarHBondContact CG2-O 3.42Å; T84-F97 HydrophobicContact CG2-CB 4.37Å; T84-F97 VanDerWaalsContact CG2-N 3.29Å; T84-T100 HydrophobicContact CG2-CG2 4.13Å; T84-L213 HydrophobicContact CG2-CD2 4.35Å; T84-L213 VanDerWaalsContact OG1-CD2 3.29Å; T84-L213 WeakPolarHBondContact OG1-CD2 3.25Å
85F94.1Very high95.3Very high0 Ų031.5 Ų31.50%016%0.163CC..Hα-helixtrans-73.9-33.1-175.5-68.7-61.9000111.8T37 L40 L41 T44 L81 I82 V209 L213 Y216T37-F85 WeakPolarHBondContact CG2-O 3.48Å; L40-F85 HydrophobicContact CB-CD1 4.01Å; L40-F85 HydrophobicContact CB-CD2 4.41Å; L40-F85 HydrophobicContact CB-CE1 3.97Å; L40-F85 HydrophobicContact CB-CE2 4.39Å; L40-F85 HydrophobicContact CB-CG 4.24Å; L40-F85 HydrophobicContact CB-CZ 4.16Å; L40-F85 HydrophobicContact CD1-CD1 3.92Å; L40-F85 HydrophobicContact CD1-CE1 3.66Å; L40-F85 HydrophobicContact CD1-CZ 4.45Å; L40-F85 HydrophobicContact CG-CE1 4.3Å; L41-F85 HydrophobicContact CD2-CB 3.79Å; L41-F85 HydrophobicContact CD2-CD2 4.46Å; L41-F85 HydrophobicContact CG-CB 3.92Å; T44-F85 HydrophobicContact CG2-CD2 3.79Å; T44-F85 HydrophobicContact CG2-CE2 3.41Å; T44-F85 VanDerWaalsContact CG2-CE2 3.41Å; T44-F85 HydrophobicContact CG2-CZ 4.5Å; L81-F85 HydrophobicContact CD2-CE2 4.49Å; L81-F85 WeakPolarHBondContact O-CD2 3.42Å; L81-F85 PolarHBondContact O-N 2.94Å; I82-F85 PolarHBondContact O-N 3.48Å; F85-V209 HydrophobicContact CE2-CG1 3.66Å; F85-V209 HydrophobicContact CZ-CG1 3.9Å; F85-L213 HydrophobicContact CD1-CD2 4.35Å; F85-L213 HydrophobicContact CE1-CD2 3.64Å; F85-L213 HydrophobicContact CE1-CG 4.49Å; F85-L213 HydrophobicContact CE2-CD2 3.95Å; F85-L213 HydrophobicContact CZ-CD2 3.41Å; F85-L213 VanDerWaalsContact CZ-CD2 3.41Å; F85-L213 HydrophobicContact CZ-CG 4.03Å; F85-Y216 AromaticContact CD1-CD1 3.78Å; F85-Y216 HydrophobicContact CD1-CD1 3.78Å; F85-Y216 HydrophobicContact CD1-CD2 4.07Å; F85-Y216 HydrophobicContact CD1-CE1 4.13Å; F85-Y216 HydrophobicContact CD1-CE2 4.44Å; F85-Y216 AromaticContact CD1-CG 3.74Å; F85-Y216 HydrophobicContact CD1-CG 3.74Å; F85-Y216 HydrophobicContact CE1-CD1 4.08Å; F85-Y216 HydrophobicContact CE1-CD2 4.47Å; F85-Y216 AromaticContact CE1-CG 3.87Å; F85-Y216 HydrophobicContact CE1-CG 3.87Å; F85-Y216 PolarHBondContact O-OH 2.74Å
86T93.1Very high95.5Very high20 Ų2030.2 Ų30.212%0.12316%0.155CC..Hα-helixtrans-84.6-7179.255.70000114.5F31 S32 L41 I82 T88F31-T86 VanDerWaalsContact CA-O 3.26Å; F31-T86 WeakPolarHBondContact CA-O 3.32Å; F31-T86 WeakPolarHBondContact CD1-OG1 3.13Å; S32-T86 PolarHBondContact N-O 3.39Å; S32-T86 WeakPolarHBondContact O-CA 3.45Å; L41-T86 HydrophobicContact CD1-CG2 3.58Å; L41-T86 HydrophobicContact CD2-CG2 3.99Å; L41-T86 HydrophobicContact CG-CG2 4.4Å; I82-T86 PolarHBondContact O-N 3.26Å; I82-T86 VanDerWaalsContact O-N 3.15Å; I82-T86 PolarHBondContact O-OG1 3.43Å; I82-T86 VanDerWaalsContact O-OG1 3.05Å; T86-T88 PolarHBondContact O-N 2.87Å
87A94.9Very high95.5Very high0 Ų028.1 Ų28.10%014%0.14CC..BIsolated β-bridgetrans-63.8122-176.100000112.6M83 M92 F93M83-A87 WeakPolarHBondContact O-CB 3.34Å; M83-A87 PolarHBondContact O-N 3.02Å; A87-M92 HydrophobicContact CB-CE 3.71Å; A87-M92 HydrophobicContact CB-CG 4.21Å; A87-F93 HydrophobicContact CB-CB 3.94Å
88T92.3Very high95.5Very high2 Ų229.1 Ų29.11%0.01215%0.145CC..  trans-80.2-37.8176.551.60000113.3P29 T30 S32 T86 I151P29-T88 PolarHBondContact O-OG1 3.48Å; T30-T88 WeakPolarHBondContact CA-OG1 3.31Å; T30-T88 WeakPolarHBondContact O-CB 3.1Å; T30-T88 WeakPolarHBondContact O-CG2 3.4Å; T30-T88 PolarHBondContact O-N 2.87Å; T30-T88 PolarHBondContact O-OG1 3.44Å; S32-T88 VanDerWaalsContact OG-CG2 3.3Å; S32-T88 WeakPolarHBondContact OG-CG2 3.38Å; T86-T88 PolarHBondContact O-N 2.87Å; T88-I151 WeakPolarHBondContact O-CB 3.26Å; T88-I151 WeakPolarHBondContact O-CD1 3.11Å; T88-I151 WeakPolarHBondContact O-CG1 3.36Å; T88-I151 PolarHBondContact O-N 3.42Å
89E93.9Very high95.6Very high87 Ų8730.5 Ų30.541%0.40715%0.154SC..BIsolated β-bridgetrans-90.8132.5177.4-66.6-167.7163.700111.3I91 M92 F93 N150E89-I91 VanDerWaalsContact C-N 3.29Å; E89-I91 PolarHBondContact O-N 2.93Å; E89-M92 HydrophobicContact CB-CB 4.27Å; E89-M92 PolarHBondContact O-N 2.97Å; E89-M92 VanDerWaalsContact O-N 3.15Å; E89-F93 PolarHBondContact O-N 3.45Å; E89-N150 HydrophobicContact CG-CB 4.43Å
90L94.6Very high95.7Very high3 Ų325.8 Ų25.82%0.01613%0.13CC..Hα-helixtrans-64.8-28.9-176.4-66.7173.4000113.7F93 Y94 L139 L149 I151 L154 L221 I224L90-F93 WeakPolarHBondContact O-CB 3.3Å; L90-F93 PolarHBondContact O-N 3.07Å; L90-Y94 PolarHBondContact O-N 2.97Å; L90-L139 HydrophobicContact CB-CD2 3.66Å; L90-L139 HydrophobicContact CD1-CD2 3.96Å; L90-L139 HydrophobicContact CG-CD2 4.44Å; L90-L149 HydrophobicContact CB-CB 4.24Å; L90-L149 PolarHBondContact N-O 3.48Å; L90-I151 HydrophobicContact CD2-CD1 4.13Å; L90-I151 HydrophobicContact CD2-CG1 3.85Å; L90-I151 HydrophobicContact CG-CG1 4.13Å; L90-L154 HydrophobicContact CD1-CD1 3.51Å; L90-L154 HydrophobicContact CG-CD1 4.23Å; L90-L221 HydrophobicContact CD1-CD2 3.68Å; L90-L221 HydrophobicContact CD2-CD2 3.96Å; L90-L221 HydrophobicContact CG-CD2 4.45Å; L90-I224 HydrophobicContact CD1-CD1 3.69Å
91I95.9Very high95.7Very high47 Ų4725.8 Ų25.824%0.24113%0.129CC..Hα-helixtrans-70.9-38.1175.6-163.265.5000111.6E89 Y94 I95 L136 L149E89-I91 VanDerWaalsContact C-N 3.29Å; E89-I91 PolarHBondContact O-N 2.93Å; I91-Y94 WeakPolarHBondContact O-CB 3.45Å; I91-Y94 PolarHBondContact O-N 3.43Å; I91-I95 WeakPolarHBondContact O-CG1 3.35Å; I91-I95 PolarHBondContact O-N 3.48Å; I91-L136 HydrophobicContact CD1-CD1 3.57Å; I91-L149 HydrophobicContact CB-CD1 3.98Å
92M95.9Very high95.7Very high31 Ų3131.2 Ų31.215%0.15316%0.157CC..Hα-helixtrans-68.5-40.1174.5177.7174.564.300110.7T30 F31 A87 E89 Y94 I95 F96T30-M92 WeakPolarHBondContact O-CE 3.37Å; F31-M92 HydrophobicContact CD1-CE 4.48Å; F31-M92 HydrophobicContact CE1-CE 4.08Å; F31-M92 HydrophobicContact CE1-SD 4.18Å; F31-M92 HydrophobicContact CZ-SD 4.3Å; A87-M92 HydrophobicContact CB-CE 3.71Å; A87-M92 HydrophobicContact CB-CG 4.21Å; E89-M92 HydrophobicContact CB-CB 4.27Å; E89-M92 PolarHBondContact O-N 2.97Å; E89-M92 VanDerWaalsContact O-N 3.15Å; M92-Y94 VanDerWaalsContact C-N 3.32Å; M92-Y94 PolarHBondContact O-N 3.41Å; M92-I95 PolarHBondContact O-N 3.35Å; M92-F96 HydrophobicContact CG-CD2 3.66Å; M92-F96 HydrophobicContact CG-CE2 3.4Å; M92-F96 VanDerWaalsContact CG-CE2 3.4Å; M92-F96 VanDerWaalsContact O-CD2 3.27Å; M92-F96 WeakPolarHBondContact O-CD2 3.41Å; M92-F96 PolarHBondContact O-N 3.43Å; M92-F96 HydrophobicContact SD-CE2 3.93Å
93F96.4Very high95.8Very high7 Ų729.5 Ų29.53%0.03115%0.149CC..Hα-helixtrans-54.2-48.6168.7165.5-98.7000111.1T84 A87 E89 L90 F96 F97 F178 Y216T84-F93 WeakPolarHBondContact O-CD2 3.4Å; A87-F93 HydrophobicContact CB-CB 3.94Å; E89-F93 PolarHBondContact O-N 3.45Å; L90-F93 WeakPolarHBondContact O-CB 3.3Å; L90-F93 PolarHBondContact O-N 3.07Å; F93-F96 PolarHBondContact O-N 3.01Å; F93-F97 HydrophobicContact CZ-CB 4.41Å; F93-F97 HydrophobicContact CZ-CD2 4.24Å; F93-F97 WeakPolarHBondContact O-CB 3.49Å; F93-F97 PolarHBondContact O-N 3.36Å; F93-F178 AromaticContact CE1-CE1 3.72Å; F93-F178 HydrophobicContact CE1-CE1 3.72Å; F93-F178 AromaticContact CE1-CZ 3.72Å; F93-F178 HydrophobicContact CE1-CZ 3.72Å; F93-F178 AromaticContact CZ-CE1 3.86Å; F93-F178 HydrophobicContact CZ-CE1 3.86Å; F93-F178 HydrophobicContact CZ-CZ 4.27Å; F93-Y216 HydrophobicContact CD2-CD1 4.29Å; F93-Y216 AromaticContact CD2-CE1 3.86Å; F93-Y216 HydrophobicContact CD2-CE1 3.86Å; F93-Y216 AromaticContact CE2-CD1 3.59Å; F93-Y216 HydrophobicContact CE2-CD1 3.59Å; F93-Y216 AromaticContact CE2-CE1 3.65Å; F93-Y216 HydrophobicContact CE2-CE1 3.65Å; F93-Y216 HydrophobicContact CZ-CD1 4.27Å
94Y97.3Very high95.9Very high19 Ų1927.2 Ų27.28%0.07514%0.138CC..Hα-helixtrans-60.2-47178174.5-90.6000112.7L90 I91 M92 F96 F97 E98 S132 L135 L136 L139L90-Y94 PolarHBondContact O-N 2.97Å; I91-Y94 WeakPolarHBondContact O-CB 3.45Å; I91-Y94 PolarHBondContact O-N 3.43Å; M92-Y94 VanDerWaalsContact C-N 3.32Å; M92-Y94 PolarHBondContact O-N 3.41Å; Y94-F96 PolarHBondContact O-N 3.3Å; Y94-F97 WeakPolarHBondContact O-CB 3.41Å; Y94-F97 PolarHBondContact O-N 2.86Å; Y94-E98 HydrophobicContact CE1-CG 4Å; Y94-E98 HydrophobicContact CE2-CG 4.01Å; Y94-E98 PolarHBondContact O-N 2.92Å; Y94-S132 VanDerWaalsContact CE2-O 3.3Å; Y94-S132 WeakPolarHBondContact CE2-O 3.47Å; Y94-L135 HydrophobicContact CD2-CD2 3.86Å; Y94-L135 HydrophobicContact CD2-CG 4.1Å; Y94-L135 HydrophobicContact CE2-CD2 4.33Å; Y94-L135 HydrophobicContact CE2-CG 4.45Å; Y94-L136 HydrophobicContact CD1-CD1 3.85Å; Y94-L136 HydrophobicContact CE1-CB 3.96Å; Y94-L136 HydrophobicContact CE1-CD1 3.73Å; Y94-L136 HydrophobicContact CE1-CD2 4.04Å; Y94-L136 HydrophobicContact CE1-CG 4.12Å; Y94-L136 HydrophobicContact CE2-CB 4Å; Y94-L139 HydrophobicContact CD2-CD1 4.42Å; Y94-L139 HydrophobicContact CG-CD1 4.33Å
95I97.9Very high96Very high93 Ų9329.2 Ų29.248%0.47715%0.149SC..Hα-helixtrans-58.3-52.1179-69165.1000109.6I91 M92 F97 E98 T99I91-I95 WeakPolarHBondContact O-CG1 3.35Å; I91-I95 PolarHBondContact O-N 3.48Å; M92-I95 PolarHBondContact O-N 3.35Å; I95-F97 VanDerWaalsContact C-N 3.3Å; I95-F97 PolarHBondContact O-N 2.87Å; I95-E98 PolarHBondContact O-N 3.22Å; I95-T99 HydrophobicContact CG2-CG2 4.15Å; I95-T99 WeakPolarHBondContact O-CG2 3.44Å; I95-T99 PolarHBondContact O-N 2.81Å
96F97.7Very high96.1Very high49 Ų4930.3 Ų30.322%0.21516%0.158CC..Hα-helixtrans-65.2-36.8179.5-70-54.9000112M83 T84 M92 F93 Y94 E98 T99 T100M83-F96 HydrophobicContact CB-CD1 3.99Å; M83-F96 HydrophobicContact CB-CD2 3.73Å; M83-F96 HydrophobicContact CB-CE1 4.04Å; M83-F96 HydrophobicContact CB-CE2 3.77Å; M83-F96 HydrophobicContact CB-CG 3.86Å; M83-F96 HydrophobicContact CB-CZ 3.94Å; M83-F96 HydrophobicContact CE-CE2 4.17Å; M83-F96 HydrophobicContact CE-CZ 3.84Å; M83-F96 HydrophobicContact CG-CE1 4.49Å; M83-F96 HydrophobicContact CG-CZ 4.39Å; T84-F96 HydrophobicContact CG2-CB 3.4Å; T84-F96 VanDerWaalsContact CG2-CB 3.4Å; T84-F96 WeakPolarHBondContact CG2-O 3.42Å; M92-F96 HydrophobicContact CG-CD2 3.66Å; M92-F96 HydrophobicContact CG-CE2 3.4Å; M92-F96 VanDerWaalsContact CG-CE2 3.4Å; M92-F96 VanDerWaalsContact O-CD2 3.27Å; M92-F96 WeakPolarHBondContact O-CD2 3.41Å; M92-F96 PolarHBondContact O-N 3.43Å; M92-F96 HydrophobicContact SD-CE2 3.93Å; F93-F96 PolarHBondContact O-N 3.01Å; Y94-F96 PolarHBondContact O-N 3.3Å; F96-E98 VanDerWaalsContact C-N 3.34Å; F96-E98 PolarHBondContact O-N 3.16Å; F96-T99 VanDerWaalsContact CA-OG1 3.3Å; F96-T99 WeakPolarHBondContact CA-OG1 3.28Å; F96-T99 PolarHBondContact O-N 2.89Å; F96-T99 VanDerWaalsContact O-N 3.12Å; F96-T99 PolarHBondContact O-OG1 3.49Å; F96-T100 WeakPolarHBondContact O-CG2 3.42Å; F96-T100 PolarHBondContact O-N 2.87Å; F96-T100 VanDerWaalsContact O-N 3.14Å
97F96.6Very high96.3Very high0 Ų029.5 Ų29.50%015%0.152CC..Hα-helixtrans-58.5-45.2177.4165.8-94.2000111.5T84 F93 Y94 I95 T100 F178 K181 L213T84-F97 HydrophobicContact CG2-CB 4.37Å; T84-F97 VanDerWaalsContact CG2-N 3.29Å; F93-F97 HydrophobicContact CZ-CB 4.41Å; F93-F97 HydrophobicContact CZ-CD2 4.24Å; F93-F97 WeakPolarHBondContact O-CB 3.49Å; F93-F97 PolarHBondContact O-N 3.36Å; Y94-F97 WeakPolarHBondContact O-CB 3.41Å; Y94-F97 PolarHBondContact O-N 2.86Å; I95-F97 VanDerWaalsContact C-N 3.3Å; I95-F97 PolarHBondContact O-N 2.87Å; F97-T100 PolarHBondContact O-OG1 3.34Å; F97-F178 HydrophobicContact CE2-CD1 4.33Å; F97-F178 HydrophobicContact CE2-CE1 4.22Å; F97-F178 HydrophobicContact CZ-CD1 4.43Å; F97-F178 HydrophobicContact CZ-CE1 4.35Å; F97-K181 HydrophobicContact CE2-CD 4.09Å; F97-K181 HydrophobicContact CE2-CG 3.71Å; F97-K181 HydrophobicContact CZ-CD 4.03Å; F97-K181 HydrophobicContact CZ-CG 3.49Å; F97-K181 VanDerWaalsContact CZ-CG 3.49Å; F97-L213 HydrophobicContact CD2-CB 4.24Å; F97-L213 HydrophobicContact CD2-CD1 4.4Å; F97-L213 HydrophobicContact CE2-CB 4.3Å
98E96.7Very high96.3Very high25 Ų2529.5 Ų29.512%0.11715%0.153CC..Hα-helixtrans-71.5-35.6173.8-73-58.8134.800112.3Y94 I95 F96 T100 L101 L129 S132Y94-E98 HydrophobicContact CE1-CG 4Å; Y94-E98 HydrophobicContact CE2-CG 4.01Å; Y94-E98 PolarHBondContact O-N 2.92Å; I95-E98 PolarHBondContact O-N 3.22Å; F96-E98 VanDerWaalsContact C-N 3.34Å; F96-E98 PolarHBondContact O-N 3.16Å; E98-T100 PolarHBondContact O-N 3.19Å; E98-T100 VanDerWaalsContact O-N 3.15Å; E98-L101 WeakPolarHBondContact O-CB 3.35Å; E98-L101 WeakPolarHBondContact O-CG 3.44Å; E98-L101 PolarHBondContact O-N 3.23Å; E98-L101 WeakPolarHBondContact OE2-CD1 3.48Å; E98-L129 WeakPolarHBondContact OE2-CD2 3.16Å; E98-S132 WeakPolarHBondContact OE1-CB 3.47Å; E98-S132 PolarHBondContact OE1-OG 3.4Å
99T97.1Very high96.6Very high45 Ų4531.1 Ų31.128%0.27616%0.162SC..Hα-helixtrans-59.9-29.2177.870.20000112.7S80 I95 F96 L101 I102 P103S80-T99 WeakPolarHBondContact CB-OG1 3.22Å; I95-T99 HydrophobicContact CG2-CG2 4.15Å; I95-T99 WeakPolarHBondContact O-CG2 3.44Å; I95-T99 PolarHBondContact O-N 2.81Å; F96-T99 VanDerWaalsContact CA-OG1 3.3Å; F96-T99 WeakPolarHBondContact CA-OG1 3.28Å; F96-T99 PolarHBondContact O-N 2.89Å; F96-T99 VanDerWaalsContact O-N 3.12Å; F96-T99 PolarHBondContact O-OG1 3.49Å; T99-L101 PolarHBondContact O-N 2.8Å; T99-I102 PolarHBondContact O-N 3.23Å; T99-I102 VanDerWaalsContact O-N 3.15Å; T99-P103 WeakPolarHBondContact O-CD 3.48Å
100T97.3Very high96.6Very high0 Ų033.3 Ų33.30%017%0.167CC..THydrogen-bonded Turntrans-61.4-23.4175.4680000113.1L77 L81 T84 F96 F97 E98 I102 T104 L213L77-T100 HydrophobicContact CD1-CG2 4.47Å; L81-T100 HydrophobicContact CD2-CG2 3.77Å; L81-T100 HydrophobicContact CG-CG2 4.11Å; T84-T100 HydrophobicContact CG2-CG2 4.13Å; F96-T100 WeakPolarHBondContact O-CG2 3.42Å; F96-T100 PolarHBondContact O-N 2.87Å; F96-T100 VanDerWaalsContact O-N 3.14Å; F97-T100 PolarHBondContact O-OG1 3.34Å; E98-T100 PolarHBondContact O-N 3.19Å; E98-T100 VanDerWaalsContact O-N 3.15Å; T100-I102 VanDerWaalsContact C-N 3.32Å; T100-I102 PolarHBondContact O-N 3.5Å; T100-T104 WeakPolarHBondContact O-CB 3.38Å; T100-T104 WeakPolarHBondContact O-CG2 3.21Å; T100-T104 PolarHBondContact O-N 3.29Å; T100-T104 PolarHBondContact O-OG1 3.47Å; T100-L213 HydrophobicContact CG2-CD1 4.28Å
101L96.4Very high96.7Very high10 Ų1034.2 Ų34.25%0.05217%0.17CC..Hα-helixtrans-65.9-33.7177.1-65.7-178.6000112.3E98 T99 T104 L105 F124 T128E98-L101 WeakPolarHBondContact O-CB 3.35Å; E98-L101 WeakPolarHBondContact O-CG 3.44Å; E98-L101 PolarHBondContact O-N 3.23Å; E98-L101 WeakPolarHBondContact OE2-CD1 3.48Å; T99-L101 PolarHBondContact O-N 2.8Å; L101-T104 VanDerWaalsContact CA-OG1 3.26Å; L101-T104 WeakPolarHBondContact CA-OG1 3.46Å; L101-T104 PolarHBondContact O-OG1 2.95Å; L101-L105 WeakPolarHBondContact O-CB 3.38Å; L101-L105 PolarHBondContact O-N 2.92Å; L101-F124 HydrophobicContact CD2-CD1 4.39Å; L101-F124 HydrophobicContact CD2-CE1 3.53Å; L101-F124 HydrophobicContact CD2-CE2 4.21Å; L101-F124 HydrophobicContact CD2-CZ 3.43Å; L101-F124 VanDerWaalsContact CD2-CZ 3.43Å; L101-T128 WeakPolarHBondContact CD1-OG1 3.49Å; L101-T128 HydrophobicContact CD2-CG2 4.03Å; L101-T128 WeakPolarHBondContact CD2-OG1 3.44Å
102I96.6Very high96.6Very high118 Ų11832.1 Ų32.161%0.60516%0.16SC*.Hα-helixtrans-68.3-53.3-173.1-58.8168.3000110.9T99 T100 T104 A106T99-I102 PolarHBondContact O-N 3.23Å; T99-I102 VanDerWaalsContact O-N 3.15Å; T100-I102 VanDerWaalsContact C-N 3.32Å; T100-I102 PolarHBondContact O-N 3.5Å; I102-T104 VanDerWaalsContact C-N 3.31Å; I102-T104 PolarHBondContact O-N 2.91Å; I102-A106 PolarHBondContact O-N 3.46Å
103P97Very high96.3Very high10 Ų1033.8 Ų33.87%0.06517%0.169CC..Hα-helixtrans-62.8-37.8176.6-23.334.8000113L77 T99 A106 I107L77-P103 HydrophobicContact CB-CB 3.83Å; L77-P103 HydrophobicContact CB-CG 4.37Å; L77-P103 HydrophobicContact CD1-CB 4.35Å; T99-P103 WeakPolarHBondContact O-CD 3.48Å; P103-A106 PolarHBondContact O-N 3.43Å; P103-I107 WeakPolarHBondContact O-CD1 3.5Å; P103-I107 WeakPolarHBondContact O-CG1 3.37Å; P103-I107 PolarHBondContact O-N 3.36Å
104T96.7Very high96.1Very high6 Ų636.9 Ų36.94%0.03718%0.184CC..Hα-helixtrans-69.7-45.1-176.750.50000111.8L77 T100 L101 I102 A106 I107 I108 F124 L210L77-T104 HydrophobicContact CD1-CG2 3.48Å; L77-T104 VanDerWaalsContact CD1-CG2 3.48Å; L77-T104 HydrophobicContact CD2-CG2 3.52Å; L77-T104 HydrophobicContact CG-CG2 4.15Å; T100-T104 WeakPolarHBondContact O-CB 3.38Å; T100-T104 WeakPolarHBondContact O-CG2 3.21Å; T100-T104 PolarHBondContact O-N 3.29Å; T100-T104 PolarHBondContact O-OG1 3.47Å; L101-T104 VanDerWaalsContact CA-OG1 3.26Å; L101-T104 WeakPolarHBondContact CA-OG1 3.46Å; L101-T104 PolarHBondContact O-OG1 2.95Å; I102-T104 VanDerWaalsContact C-N 3.31Å; I102-T104 PolarHBondContact O-N 2.91Å; T104-A106 VanDerWaalsContact C-N 3.3Å; T104-A106 PolarHBondContact O-N 3.36Å; T104-I107 PolarHBondContact O-N 3.36Å; T104-I108 VanDerWaalsContact O-CG1 3.28Å; T104-I108 WeakPolarHBondContact O-CG1 3.46Å; T104-I108 PolarHBondContact O-N 2.92Å; T104-F124 VanDerWaalsContact OG1-CE1 3.29Å; T104-F124 WeakPolarHBondContact OG1-CE1 3.43Å; T104-L210 HydrophobicContact CG2-CD1 3.39Å; T104-L210 HydrophobicContact CG2-CD2 4.36Å; T104-L210 HydrophobicContact CG2-CG 4.49Å
105L96.8Very high95.8Very high42 Ų4240.5 Ų40.522%0.2221%0.21CC..Hα-helixtrans-58.4-44.5174.2-177.971.5000111.2L101 I107 I108 T109 G121 L125L101-L105 WeakPolarHBondContact O-CB 3.38Å; L101-L105 PolarHBondContact O-N 2.92Å; L105-I107 VanDerWaalsContact C-N 3.35Å; L105-I107 PolarHBondContact O-N 3.11Å; L105-I108 PolarHBondContact O-N 3.46Å; L105-T109 HydrophobicContact CD1-CG2 3.81Å; L105-T109 HydrophobicContact CG-CG2 4.19Å; L105-T109 WeakPolarHBondContact O-CB 3.42Å; L105-T109 WeakPolarHBondContact O-CG2 3.26Å; L105-T109 PolarHBondContact O-N 3.42Å; L105-T109 PolarHBondContact O-OG1 2.96Å; L105-G121 WeakPolarHBondContact CD1-O 3.47Å; L105-L125 HydrophobicContact CD1-CB 4.4Å; L105-L125 HydrophobicContact CD2-CD1 3.63Å
106A97Very high95.7Very high23 Ų2340.8 Ų40.819%0.1921%0.209CC..Hα-helixtrans-61.7-43176.900000111.6M73 I102 P103 T104 I108 R110M73-A106 HydrophobicContact CE-CB 3.25Å; I102-A106 PolarHBondContact O-N 3.46Å; P103-A106 PolarHBondContact O-N 3.43Å; T104-A106 VanDerWaalsContact C-N 3.3Å; T104-A106 PolarHBondContact O-N 3.36Å; A106-I108 PolarHBondContact O-N 2.73Å; A106-R110 WeakPolarHBondContact O-CB 3.25Å; A106-R110 PolarHBondContact O-N 2.73Å
107I96.9Very high95.6Very high2 Ų241.9 Ų41.91%0.0121%0.212CC..Hα-helixtrans-59.9-46.4177.3-70.7162000111.2Y70 M73 L74 L77 P103 T104 L105 W111 P199Y70-I107 HydrophobicContact CE2-CG2 4.2Å; M73-I107 HydrophobicContact CB-CD1 4.17Å; M73-I107 HydrophobicContact CB-CG1 3.99Å; L74-I107 HydrophobicContact CD2-CD1 3.71Å; L74-I107 HydrophobicContact CG-CD1 4.3Å; L77-I107 HydrophobicContact CD2-CD1 4.2Å; P103-I107 WeakPolarHBondContact O-CD1 3.5Å; P103-I107 WeakPolarHBondContact O-CG1 3.37Å; P103-I107 PolarHBondContact O-N 3.36Å; T104-I107 PolarHBondContact O-N 3.36Å; L105-I107 VanDerWaalsContact C-N 3.35Å; L105-I107 PolarHBondContact O-N 3.11Å; I107-W111 PolarHBondContact O-N 2.81Å; I107-P199 HydrophobicContact CG2-CG 3.61Å
108I96.4Very high95.5Very high1 Ų147.2 Ų47.21%0.00524%0.24CC..Hα-helixtrans-67.6-55.1-178.3-62.2163.8000110.8T104 L105 A106 R110 G112 F124 A198 L206T104-I108 VanDerWaalsContact O-CG1 3.28Å; T104-I108 WeakPolarHBondContact O-CG1 3.46Å; T104-I108 PolarHBondContact O-N 2.92Å; L105-I108 PolarHBondContact O-N 3.46Å; A106-I108 PolarHBondContact O-N 2.73Å; I108-R110 PolarHBondContact O-N 2.99Å; I108-G112 WeakPolarHBondContact O-CA 3.28Å; I108-G112 PolarHBondContact O-N 3.3Å; I108-F124 HydrophobicContact CD1-CD1 4.27Å; I108-A198 HydrophobicContact CG1-CB 4.12Å; I108-L206 HydrophobicContact CD1-CD1 4.1Å; I108-L206 HydrophobicContact CG1-CD1 4.48Å
109T96.7Very high95.5Very high35 Ų3549.9 Ų49.922%0.21526%0.255CS..Hα-helixtrans-72.2-28.3-170.657.20000113.2L105 R117 L118L105-T109 HydrophobicContact CD1-CG2 3.81Å; L105-T109 HydrophobicContact CG-CG2 4.19Å; L105-T109 WeakPolarHBondContact O-CB 3.42Å; L105-T109 WeakPolarHBondContact O-CG2 3.26Å; L105-T109 PolarHBondContact O-N 3.42Å; L105-T109 PolarHBondContact O-OG1 2.96Å; T109-R117 VanDerWaalsContact O-CD 3.32Å; T109-R117 WeakPolarHBondContact O-CD 3.48Å; T109-R117 VanDerWaalsContact O-CZ 3.25Å; T109-R117 PolarHBondContact O-NE 3.49Å; T109-L118 HydrophobicContact CG2-CD2 4.39Å
110R95.7Very high95.5Very high134 Ų13447.8 Ų47.851%0.50624%0.242SC..Hα-helixtrans-94-40.4-177.1-175.562.1174.4-176.8-0.6113.8A106 I108 R117A106-R110 WeakPolarHBondContact O-CB 3.25Å; A106-R110 PolarHBondContact O-N 2.73Å; I108-R110 PolarHBondContact O-N 2.99Å; R110-R117 PolarHBondContact O-NH1 3.06Å
111W95.8Very high95.4Very high22 Ų2247.9 Ų47.98%0.08324%0.243CC..Hα-helixtrans-113.27.9-175.4-65.2-89.4000113.9L69 Y70 M73 I107 P199L69-W111 HydrophobicContact CB-CH2 4.35Å; L69-W111 HydrophobicContact CB-CZ2 4.32Å; Y70-W111 HydrophobicContact CD2-CB 4.31Å; Y70-W111 AromaticContact CD2-CD2 3.45Å; Y70-W111 HydrophobicContact CD2-CD2 3.45Å; Y70-W111 VanDerWaalsContact CD2-CD2 3.45Å; Y70-W111 AromaticContact CD2-CE2 3.65Å; Y70-W111 AromaticContact CD2-CE3 3.75Å; Y70-W111 HydrophobicContact CD2-CE3 3.75Å; Y70-W111 AromaticContact CD2-CG 3.72Å; Y70-W111 HydrophobicContact CD2-CG 3.72Å; Y70-W111 HydrophobicContact CD2-CH2 4.34Å; Y70-W111 HydrophobicContact CD2-CZ2 4.11Å; Y70-W111 HydrophobicContact CD2-CZ3 4.18Å; Y70-W111 HydrophobicContact CE2-CB 4.11Å; Y70-W111 HydrophobicContact CE2-CD2 4.11Å; Y70-W111 HydrophobicContact CE2-CE3 4.35Å; Y70-W111 HydrophobicContact CE2-CG 4.02Å; Y70-W111 HydrophobicContact CG-CD2 4.45Å; Y70-W111 HydrophobicContact CG-CZ2 4.42Å; M73-W111 HydrophobicContact CG-CH2 4.32Å; M73-W111 HydrophobicContact CG-CZ3 4.34Å; I107-W111 PolarHBondContact O-N 2.81Å; W111-P199 HydrophobicContact CB-CG 4.11Å
112G93.8Very high95.4Very high2 Ų250.5 Ų50.52%0.02126%0.259CS..  trans-66.1150.216600000111.9I108 R117 E197I108-G112 WeakPolarHBondContact O-CA 3.28Å; I108-G112 PolarHBondContact O-N 3.3Å; G112-R117 WeakPolarHBondContact O-CD 3.21Å; G112-R117 PolarHBondContact O-NH1 2.95Å; G112-E197 WeakPolarHBondContact CA-O 3.4Å
113N89.8Confident95.3Very high67 Ų6748.5 Ų48.536%0.35825%0.245SC..SBendtrans-81.1-40.6-172.3-71.6-20.3000113.8H58 Y309H58-N113 PolarHBondContact CE1-OD1 3.42Å; N113-Y309 VanDerWaalsContact ND2-CE1 3.27Å; N113-Y309 WeakPolarHBondContact ND2-CE1 3.29Å; N113-Y309 PolarHBondContact ND2-OH 3.45Å; N113-Y309 VanDerWaalsContact ND2-OH 3.1Å
114Q93.1Very high95.3Very high71 Ų7148.1 Ų48.133%0.33224%0.242SC..SBendtrans-97.9158.9-172.8-53.5-67.9-11.100112.1E116 R117 E197Q114-E116 WeakPolarHBondContact CB-OE2 3.21Å; Q114-E116 PolarHBondContact O-N 3.08Å; Q114-R117 WeakPolarHBondContact O-CB 3.22Å; Q114-R117 VanDerWaalsContact O-CD 3.3Å; Q114-R117 WeakPolarHBondContact O-CD 3.15Å; Q114-R117 WeakPolarHBondContact O-CG 3.32Å; Q114-R117 PolarHBondContact O-N 3.37Å; Q114-E197 WeakPolarHBondContact CB-OE2 3.43Å; Q114-E197 VanDerWaalsContact CG-OE2 3.28Å; Q114-E197 WeakPolarHBondContact CG-OE2 3.13Å
115P90.8Very high95.2Very high95 Ų9550 Ų5062%0.61725%0.251SS*.THydrogen-bonded Turntrans-61.1-29178.324.3-35.1000113.6R117 L118P115-R117 PolarHBondContact O-N 3.22Å; P115-L118 PolarHBondContact O-N 3.47Å
116E94.6Very high95.3Very high100 Ų10053.8 Ų53.847%0.46727%0.267SS..THydrogen-bonded Turntrans-62.3-11.7179.3-64.577.2-16800113.1Q114 L118 N119 A120 E197Q114-E116 WeakPolarHBondContact CB-OE2 3.21Å; Q114-E116 PolarHBondContact O-N 3.08Å; E116-L118 PolarHBondContact O-N 3.22Å; E116-L118 VanDerWaalsContact O-N 3.17Å; E116-N119 WeakPolarHBondContact O-CA 3.45Å; E116-N119 WeakPolarHBondContact O-CB 3.38Å; E116-N119 PolarHBondContact O-N 3.1Å; E116-A120 PolarHBondContact O-N 3.32Å; E116-E197 HydrophobicContact CB-CG 4.13Å
117R95.4Very high95.2Very high71 Ų7155.6 Ų55.627%0.26827%0.269SS..Hα-helixtrans-54.2-32.5175.672.4-170.5179.7167.57.3113.8T109 R110 G112 Q114 P115 G121 E197T109-R117 VanDerWaalsContact O-CD 3.32Å; T109-R117 WeakPolarHBondContact O-CD 3.48Å; T109-R117 VanDerWaalsContact O-CZ 3.25Å; T109-R117 PolarHBondContact O-NE 3.49Å; R110-R117 PolarHBondContact O-NH1 3.06Å; G112-R117 WeakPolarHBondContact O-CD 3.21Å; G112-R117 PolarHBondContact O-NH1 2.95Å; Q114-R117 WeakPolarHBondContact O-CB 3.22Å; Q114-R117 VanDerWaalsContact O-CD 3.3Å; Q114-R117 WeakPolarHBondContact O-CD 3.15Å; Q114-R117 WeakPolarHBondContact O-CG 3.32Å; Q114-R117 PolarHBondContact O-N 3.37Å; P115-R117 PolarHBondContact O-N 3.22Å; R117-G121 PolarHBondContact O-N 3.42Å; R117-E197 HydrophobicContact CB-CB 4.14Å
118L95.3Very high95.2Very high112 Ų11255.6 Ų55.659%0.58627%0.269SS*.Hα-helixtrans-68.7-46.6176.3-67178.4000110.3T109 P115 E116 G121 T122T109-L118 HydrophobicContact CG2-CD2 4.39Å; P115-L118 PolarHBondContact O-N 3.47Å; E116-L118 PolarHBondContact O-N 3.22Å; E116-L118 VanDerWaalsContact O-N 3.17Å; L118-G121 PolarHBondContact O-N 3.1Å; L118-T122 WeakPolarHBondContact O-CG2 3.49Å; L118-T122 PolarHBondContact O-N 2.98Å
119N96.8Very high95.2Very high82 Ų8258.1 Ų58.144%0.43928%0.282SS..Hα-helixtrans-62.2-47.5176.2-16410.7000110.5E116 G121 T122 Y123E116-N119 WeakPolarHBondContact O-CA 3.45Å; E116-N119 WeakPolarHBondContact O-CB 3.38Å; E116-N119 PolarHBondContact O-N 3.1Å; N119-G121 VanDerWaalsContact C-N 3.28Å; N119-G121 PolarHBondContact O-N 3.19Å; N119-T122 WeakPolarHBondContact CA-OG1 3.45Å; N119-T122 PolarHBondContact O-N 2.98Å; N119-T122 PolarHBondContact O-OG1 3.37Å; N119-Y123 VanDerWaalsContact O-CD2 3.3Å; N119-Y123 WeakPolarHBondContact O-CD2 3.46Å; N119-Y123 PolarHBondContact O-N 3.19Å; N119-Y123 WeakPolarHBondContact OD1-CD2 3.27Å; N119-Y123 WeakPolarHBondContact OD1-CE2 3.41Å
120A95.9Very high95.2Very high1 Ų161.4 Ų61.41%0.00830%0.302CS..Hα-helixtrans-56.3-41.6175.200000112.4E116 Y123 F124 K193 E197E116-A120 PolarHBondContact O-N 3.32Å; A120-Y123 PolarHBondContact O-N 3.19Å; A120-F124 WeakPolarHBondContact O-CB 3.45Å; A120-F124 PolarHBondContact O-N 3.02Å; A120-K193 HydrophobicContact CB-CB 4.07Å; A120-E197 HydrophobicContact CB-CB 4.13Å; A120-E197 HydrophobicContact CB-CG 4.28Å
121G96.2Very high95.1Very high1 Ų155.3 Ų55.31%0.0128%0.281CS..Hα-helixtrans-61.3-42.4173.300000113.1L105 R117 L118 N119 F124 L125L105-G121 WeakPolarHBondContact CD1-O 3.47Å; R117-G121 PolarHBondContact O-N 3.42Å; L118-G121 PolarHBondContact O-N 3.1Å; N119-G121 VanDerWaalsContact C-N 3.28Å; N119-G121 PolarHBondContact O-N 3.19Å; G121-F124 PolarHBondContact O-N 2.94Å; G121-L125 WeakPolarHBondContact O-CB 3.36Å; G121-L125 PolarHBondContact O-N 3.47Å
122T95.8Very high95.1Very high66 Ų6654.2 Ų54.241%0.40528%0.277SS..Hα-helixtrans-65.4-42.5175.959.60000112.6L118 N119 L125 F126L118-T122 WeakPolarHBondContact O-CG2 3.49Å; L118-T122 PolarHBondContact O-N 2.98Å; N119-T122 WeakPolarHBondContact CA-OG1 3.45Å; N119-T122 PolarHBondContact O-N 2.98Å; N119-T122 PolarHBondContact O-OG1 3.37Å; T122-L125 PolarHBondContact O-N 3.41Å; T122-F126 WeakPolarHBondContact O-CB 3.45Å; T122-F126 VanDerWaalsContact O-CD2 3.28Å; T122-F126 WeakPolarHBondContact O-CD2 3.39Å; T122-F126 PolarHBondContact O-N 3.28Å
123Y95.7Very high95.2Very high76 Ų7658.7 Ų58.730%0.29830%0.3SS..Hα-helixtrans-59.2-48.8174-85.6-82.6000111.1N119 A120 L125 Y127 K193N119-Y123 VanDerWaalsContact O-CD2 3.3Å; N119-Y123 WeakPolarHBondContact O-CD2 3.46Å; N119-Y123 PolarHBondContact O-N 3.19Å; N119-Y123 WeakPolarHBondContact OD1-CD2 3.27Å; N119-Y123 WeakPolarHBondContact OD1-CE2 3.41Å; A120-Y123 PolarHBondContact O-N 3.19Å; Y123-L125 PolarHBondContact O-N 2.61Å; Y123-Y127 HydrophobicContact CD1-CD2 4.25Å; Y123-Y127 AromaticContact CD1-CE2 3.65Å; Y123-Y127 HydrophobicContact CD1-CE2 3.65Å; Y123-Y127 HydrophobicContact CE1-CE2 4.24Å; Y123-Y127 VanDerWaalsContact O-CB 3.31Å; Y123-Y127 WeakPolarHBondContact O-CB 3.46Å; Y123-Y127 WeakPolarHBondContact O-CD2 3.32Å; Y123-Y127 PolarHBondContact O-N 3.46Å; Y123-Y127 VanDerWaalsContact O-N 3.09Å; Y123-K193 HydrophobicContact CD2-CD 3.93Å; Y123-K193 HydrophobicContact CE2-CD 4.18Å; Y123-K193 HydrophobicContact CG-CD 4.28Å; Y123-K193 PolarHBondContact OH-NZ 3.44Å
124F95.6Very high95.6Very high1 Ų157.9 Ų57.90%0.00430%0.298CS..Hα-helixtrans-57.7-49.6178.9174.6-113.6000111.9L101 T104 I108 A120 G121 T128 W190 L206L101-F124 HydrophobicContact CD2-CD1 4.39Å; L101-F124 HydrophobicContact CD2-CE1 3.53Å; L101-F124 HydrophobicContact CD2-CE2 4.21Å; L101-F124 HydrophobicContact CD2-CZ 3.43Å; L101-F124 VanDerWaalsContact CD2-CZ 3.43Å; T104-F124 VanDerWaalsContact OG1-CE1 3.29Å; T104-F124 WeakPolarHBondContact OG1-CE1 3.43Å; I108-F124 HydrophobicContact CD1-CD1 4.27Å; A120-F124 WeakPolarHBondContact O-CB 3.45Å; A120-F124 PolarHBondContact O-N 3.02Å; G121-F124 PolarHBondContact O-N 2.94Å; F124-T128 HydrophobicContact CE2-CG2 4.4Å; F124-T128 WeakPolarHBondContact O-CG2 3.14Å; F124-T128 PolarHBondContact O-N 2.85Å; F124-T128 PolarHBondContact O-OG1 3.12Å; F124-W190 HydrophobicContact CD2-CD2 4.37Å; F124-W190 AromaticContact CD2-CE3 3.53Å; F124-W190 HydrophobicContact CD2-CE3 3.53Å; F124-W190 HydrophobicContact CD2-CH2 4.27Å; F124-W190 AromaticContact CD2-CZ3 3.47Å; F124-W190 HydrophobicContact CD2-CZ3 3.47Å; F124-W190 VanDerWaalsContact CD2-CZ3 3.47Å; F124-W190 HydrophobicContact CE2-CE3 4.25Å; F124-W190 HydrophobicContact CE2-CH2 4.19Å; F124-W190 AromaticContact CE2-CZ3 3.72Å; F124-W190 HydrophobicContact CE2-CZ3 3.72Å; F124-L206 HydrophobicContact CE2-CD2 4Å; F124-L206 HydrophobicContact CZ-CD2 4.36Å
125L96.3Very high95.8Very high45 Ų4554.5 Ų54.524%0.23628%0.282CS..Hα-helixtrans-66.1-48.2-177.8176141.3000112.8L105 G121 T122 Y123 T128 L129L105-L125 HydrophobicContact CD1-CB 4.4Å; L105-L125 HydrophobicContact CD2-CD1 3.63Å; G121-L125 WeakPolarHBondContact O-CB 3.36Å; G121-L125 PolarHBondContact O-N 3.47Å; T122-L125 PolarHBondContact O-N 3.41Å; Y123-L125 PolarHBondContact O-N 2.61Å; L125-T128 PolarHBondContact O-N 3.17Å; L125-T128 PolarHBondContact O-OG1 3.32Å; L125-L129 HydrophobicContact CD1-CD1 4.39Å; L125-L129 HydrophobicContact CD2-CD1 3.53Å; L125-L129 HydrophobicContact CG-CD1 3.71Å; L125-L129 HydrophobicContact CG-CG 4.41Å; L125-L129 WeakPolarHBondContact O-CB 3.26Å; L125-L129 WeakPolarHBondContact O-CG 3.4Å; L125-L129 PolarHBondContact O-N 3.41Å
126F97.1Very high96.1Very high123 Ų12352.2 Ų52.254%0.53927%0.265SS..Hα-helixtrans-74.3-35.7-173.8-78.5-64.5000112.8T122 T128 V130T122-F126 WeakPolarHBondContact O-CB 3.45Å; T122-F126 VanDerWaalsContact O-CD2 3.28Å; T122-F126 WeakPolarHBondContact O-CD2 3.39Å; T122-F126 PolarHBondContact O-N 3.28Å; F126-T128 VanDerWaalsContact C-N 3.3Å; F126-T128 PolarHBondContact O-N 3.48Å; F126-V130 VanDerWaalsContact O-CB 3.31Å; F126-V130 WeakPolarHBondContact O-CB 3.2Å; F126-V130 WeakPolarHBondContact O-CG2 3.44Å; F126-V130 PolarHBondContact O-N 3.42Å
127Y96.3Very high96.2Very high60 Ų6053.2 Ų53.224%0.23527%0.272CS..Hα-helixtrans-58.6-48.4173.3-88.2-117.1000109.8Y123 G131 V180 L187 W190Y123-Y127 HydrophobicContact CD1-CD2 4.25Å; Y123-Y127 AromaticContact CD1-CE2 3.65Å; Y123-Y127 HydrophobicContact CD1-CE2 3.65Å; Y123-Y127 HydrophobicContact CE1-CE2 4.24Å; Y123-Y127 VanDerWaalsContact O-CB 3.31Å; Y123-Y127 WeakPolarHBondContact O-CB 3.46Å; Y123-Y127 WeakPolarHBondContact O-CD2 3.32Å; Y123-Y127 PolarHBondContact O-N 3.46Å; Y123-Y127 VanDerWaalsContact O-N 3.09Å; Y127-G131 PolarHBondContact O-N 3.13Å; Y127-G131 VanDerWaalsContact O-N 3.17Å; Y127-V180 HydrophobicContact CD1-CG1 4.43Å; Y127-V180 WeakPolarHBondContact O-CG1 3.47Å; Y127-L187 WeakPolarHBondContact CE1-O 3.34Å; Y127-W190 HydrophobicContact CD1-CB 4.4Å; Y127-W190 AromaticContact CD1-CD1 3.58Å; Y127-W190 HydrophobicContact CD1-CG 4.33Å; Y127-W190 HydrophobicContact CD2-CB 4.48Å; Y127-W190 HydrophobicContact CG-CB 4.2Å; Y127-W190 AromaticContact CG-CD1 3.96Å; Y127-W190 HydrophobicContact CG-CG 4.36Å
128T95.8Very high96.2Very high2 Ų250 Ų501%0.01226%0.26CS..Hα-helixtrans-67.3-45.4-177.154.70000112.4L101 F124 L125 F126 G131 S132 V180 K181L101-T128 WeakPolarHBondContact CD1-OG1 3.49Å; L101-T128 HydrophobicContact CD2-CG2 4.03Å; L101-T128 WeakPolarHBondContact CD2-OG1 3.44Å; F124-T128 HydrophobicContact CE2-CG2 4.4Å; F124-T128 WeakPolarHBondContact O-CG2 3.14Å; F124-T128 PolarHBondContact O-N 2.85Å; F124-T128 PolarHBondContact O-OG1 3.12Å; L125-T128 PolarHBondContact O-N 3.17Å; L125-T128 PolarHBondContact O-OG1 3.32Å; F126-T128 VanDerWaalsContact C-N 3.3Å; F126-T128 PolarHBondContact O-N 3.48Å; T128-G131 PolarHBondContact O-N 3.45Å; T128-S132 VanDerWaalsContact O-CB 3.25Å; T128-S132 WeakPolarHBondContact O-CB 3.2Å; T128-S132 PolarHBondContact O-N 3.31Å; T128-S132 PolarHBondContact O-OG 2.92Å; T128-V180 HydrophobicContact CG2-CG1 4.43Å; T128-K181 HydrophobicContact CG2-CD 3.88Å
129L96.3Very high96.2Very high54 Ų5444.7 Ų44.728%0.28323%0.232SC..Hα-helixtrans-65.9-41.2-179-74.3174.7000112.8E98 L125 G131 S132 L133E98-L129 WeakPolarHBondContact OE2-CD2 3.16Å; L125-L129 HydrophobicContact CD1-CD1 4.39Å; L125-L129 HydrophobicContact CD2-CD1 3.53Å; L125-L129 HydrophobicContact CG-CD1 3.71Å; L125-L129 HydrophobicContact CG-CG 4.41Å; L125-L129 WeakPolarHBondContact O-CB 3.26Å; L125-L129 WeakPolarHBondContact O-CG 3.4Å; L125-L129 PolarHBondContact O-N 3.41Å; L129-G131 VanDerWaalsContact C-N 3.28Å; L129-G131 PolarHBondContact O-N 2.83Å; L129-S132 WeakPolarHBondContact CA-OG 3.39Å; L129-S132 PolarHBondContact O-N 2.88Å; L129-S132 PolarHBondContact O-OG 3.48Å; L129-L133 WeakPolarHBondContact O-CG 3.49Å; L129-L133 PolarHBondContact O-N 2.76Å
130V96.6Very high96.2Very high104 Ų10444.7 Ų44.763%0.6323%0.231SC*.Hα-helixtrans-65-37178172.30000110.7F126 P134F126-V130 VanDerWaalsContact O-CB 3.31Å; F126-V130 WeakPolarHBondContact O-CB 3.2Å; F126-V130 WeakPolarHBondContact O-CG2 3.44Å; F126-V130 PolarHBondContact O-N 3.42Å; V130-P134 WeakPolarHBondContact O-CD 3.16Å
131G94.8Very high96.2Very high6 Ų650.6 Ų50.66%0.06225%0.254CS..Hα-helixtrans-71.3-36.1174.800000113.5Y127 T128 L129 A177Y127-G131 PolarHBondContact O-N 3.13Å; Y127-G131 VanDerWaalsContact O-N 3.17Å; T128-G131 PolarHBondContact O-N 3.45Å; L129-G131 VanDerWaalsContact C-N 3.28Å; L129-G131 PolarHBondContact O-N 2.83Å; G131-A177 WeakPolarHBondContact O-CA 3.13Å; G131-A177 WeakPolarHBondContact O-CB 3.28Å; G131-A177 PolarHBondContact O-N 3.49Å
132S96Very high96Very high0 Ų051.1 Ų51.10%026%0.257CS..Hα-helixtrans-90.5-27.1-169.769.10000115.3Y94 E98 T128 L129 L135 L136Y94-S132 VanDerWaalsContact CE2-O 3.3Å; Y94-S132 WeakPolarHBondContact CE2-O 3.47Å; E98-S132 WeakPolarHBondContact OE1-CB 3.47Å; E98-S132 PolarHBondContact OE1-OG 3.4Å; T128-S132 VanDerWaalsContact O-CB 3.25Å; T128-S132 WeakPolarHBondContact O-CB 3.2Å; T128-S132 PolarHBondContact O-N 3.31Å; T128-S132 PolarHBondContact O-OG 2.92Å; L129-S132 WeakPolarHBondContact CA-OG 3.39Å; L129-S132 PolarHBondContact O-N 2.88Å; L129-S132 PolarHBondContact O-OG 3.48Å; S132-L135 WeakPolarHBondContact O-CA 3.29Å; S132-L135 VanDerWaalsContact O-CB 3.28Å; S132-L135 WeakPolarHBondContact O-CB 3.42Å; S132-L135 PolarHBondContact O-N 2.71Å; S132-L136 PolarHBondContact O-N 3.37Å
133L96.1Very high95.9Very high96 Ų9652 Ų5250%0.50326%0.257SS..Hα-helixtrans-59.6-41.6175.2-72.7170.3000113.4L129 L135 L136 I137L129-L133 WeakPolarHBondContact O-CG 3.49Å; L129-L133 PolarHBondContact O-N 2.76Å; L133-L135 VanDerWaalsContact C-N 3.29Å; L133-L135 PolarHBondContact O-N 2.84Å; L133-L136 WeakPolarHBondContact O-CB 3.42Å; L133-L136 PolarHBondContact O-N 3.49Å; L133-I137 PolarHBondContact O-N 2.92Å
134P97.2Very high95.9Very high49 Ų4954.3 Ų54.332%0.31827%0.274SS..Hα-helixtrans-58.4-39170.4-26.435.4000113.3V130 L136 I137 A138 A173V130-P134 WeakPolarHBondContact O-CD 3.16Å; P134-L136 VanDerWaalsContact C-N 3.32Å; P134-L136 PolarHBondContact O-N 2.85Å; P134-I137 PolarHBondContact O-N 2.91Å; P134-A138 WeakPolarHBondContact O-CB 3.03Å; P134-A138 PolarHBondContact O-N 2.98Å; P134-A173 HydrophobicContact CB-CB 3.95Å
135L96.6Very high95.6Very high1 Ų157.7 Ų57.71%0.00530%0.295CS..Hα-helixtrans-60.9-40.8176.3169.867.4000111.2Y94 S132 L133 A138 L139 A173 Y174 A177 F178 L221Y94-L135 HydrophobicContact CD2-CD2 3.86Å; Y94-L135 HydrophobicContact CD2-CG 4.1Å; Y94-L135 HydrophobicContact CE2-CD2 4.33Å; Y94-L135 HydrophobicContact CE2-CG 4.45Å; S132-L135 WeakPolarHBondContact O-CA 3.29Å; S132-L135 VanDerWaalsContact O-CB 3.28Å; S132-L135 WeakPolarHBondContact O-CB 3.42Å; S132-L135 PolarHBondContact O-N 2.71Å; L133-L135 VanDerWaalsContact C-N 3.29Å; L133-L135 PolarHBondContact O-N 2.84Å; L135-A138 PolarHBondContact O-N 2.91Å; L135-L139 HydrophobicContact CD1-CD1 4.09Å; L135-L139 HydrophobicContact CD1-CG 4.07Å; L135-L139 HydrophobicContact CG-CD1 4.07Å; L135-L139 HydrophobicContact CG-CG 4.46Å; L135-L139 WeakPolarHBondContact O-CB 3.47Å; L135-L139 VanDerWaalsContact O-CG 3.3Å; L135-L139 WeakPolarHBondContact O-CG 3.33Å; L135-L139 PolarHBondContact O-N 3.39Å; L135-A173 WeakPolarHBondContact CA-O 3.31Å; L135-A173 PolarHBondContact N-O 3.39Å; L135-Y174 HydrophobicContact CD1-CD1 3.68Å; L135-Y174 HydrophobicContact CD1-CE1 4.33Å; L135-A177 HydrophobicContact CB-CB 3.89Å; L135-A177 HydrophobicContact CD2-CB 3.67Å; L135-A177 HydrophobicContact CG-CB 4.38Å; L135-F178 HydrophobicContact CD1-CE2 4.26Å; L135-F178 HydrophobicContact CD1-CZ 4.41Å; L135-F178 HydrophobicContact CD2-CE1 4.17Å; L135-F178 HydrophobicContact CD2-CE2 4.07Å; L135-F178 HydrophobicContact CD2-CZ 3.61Å; L135-L221 HydrophobicContact CD1-CD1 3.98Å
136L97.4Very high95.3Very high47 Ų4757.5 Ų57.525%0.24629%0.294CS..Hα-helixtrans-60.4-46.5175.7178.760.1000112.1I91 Y94 S132 L133 P134 A138 L139 I140I91-L136 HydrophobicContact CD1-CD1 3.57Å; Y94-L136 HydrophobicContact CD1-CD1 3.85Å; Y94-L136 HydrophobicContact CE1-CB 3.96Å; Y94-L136 HydrophobicContact CE1-CD1 3.73Å; Y94-L136 HydrophobicContact CE1-CD2 4.04Å; Y94-L136 HydrophobicContact CE1-CG 4.12Å; Y94-L136 HydrophobicContact CE2-CB 4Å; S132-L136 PolarHBondContact O-N 3.37Å; L133-L136 WeakPolarHBondContact O-CB 3.42Å; L133-L136 PolarHBondContact O-N 3.49Å; P134-L136 VanDerWaalsContact C-N 3.32Å; P134-L136 PolarHBondContact O-N 2.85Å; L136-A138 VanDerWaalsContact C-N 3.31Å; L136-A138 PolarHBondContact O-N 3.14Å; L136-L139 PolarHBondContact O-N 3.47Å; L136-I140 HydrophobicContact CD1-CD1 3.9Å; L136-I140 HydrophobicContact CD1-CG1 4.24Å; L136-I140 HydrophobicContact CG-CD1 3.92Å; L136-I140 WeakPolarHBondContact O-CG1 3.19Å; L136-I140 PolarHBondContact O-N 2.84Å
137I97.1Very high95Very high121 Ų12154.2 Ų54.262%0.62130%0.295SS*.Hα-helixtrans-61.3-44.5179.3-63.1167.7000110L133 P134 I140 Y141L133-I137 PolarHBondContact O-N 2.92Å; P134-I137 PolarHBondContact O-N 2.91Å; I137-I140 PolarHBondContact O-N 3.07Å; I137-Y141 WeakPolarHBondContact O-CB 3.25Å; I137-Y141 PolarHBondContact O-N 3.48Å
138A95.8Very high94.7Very high2 Ų252.5 Ų52.52%0.01729%0.292CS..Hα-helixtrans-59.8-47.9177.100000111.8P134 L135 L136 I140 Y141 T142 M170 A173 Y174P134-A138 WeakPolarHBondContact O-CB 3.03Å; P134-A138 PolarHBondContact O-N 2.98Å; L135-A138 PolarHBondContact O-N 2.91Å; L136-A138 VanDerWaalsContact C-N 3.31Å; L136-A138 PolarHBondContact O-N 3.14Å; A138-I140 PolarHBondContact O-N 3.32Å; A138-Y141 WeakPolarHBondContact O-CB 3.22Å; A138-Y141 PolarHBondContact O-N 3.29Å; A138-T142 PolarHBondContact O-N 3.39Å; A138-T142 PolarHBondContact O-OG1 3.12Å; A138-M170 HydrophobicContact CB-SD 3.45Å; A138-M170 WeakPolarHBondContact CB-SD 3.33Å; A138-A173 HydrophobicContact CB-CB 3.91Å; A138-Y174 VanDerWaalsContact C-OH 3.26Å; A138-Y174 HydrophobicContact CB-CD1 3.9Å; A138-Y174 HydrophobicContact CB-CD2 4.4Å; A138-Y174 HydrophobicContact CB-CE1 3.53Å; A138-Y174 HydrophobicContact CB-CE2 4.12Å; A138-Y174 HydrophobicContact CB-CG 4.29Å; A138-Y174 PolarHBondContact O-OH 3.13Å
139L96Very high94.6Very high2 Ų252.7 Ų52.71%0.0129%0.293CS..Hα-helixtrans-60.7-46178.5-72.7173000112.3L90 Y94 L135 L136 Y141 T142 H143 L149 Y174L90-L139 HydrophobicContact CB-CD2 3.66Å; L90-L139 HydrophobicContact CD1-CD2 3.96Å; L90-L139 HydrophobicContact CG-CD2 4.44Å; Y94-L139 HydrophobicContact CD2-CD1 4.42Å; Y94-L139 HydrophobicContact CG-CD1 4.33Å; L135-L139 HydrophobicContact CD1-CD1 4.09Å; L135-L139 HydrophobicContact CD1-CG 4.07Å; L135-L139 HydrophobicContact CG-CD1 4.07Å; L135-L139 HydrophobicContact CG-CG 4.46Å; L135-L139 WeakPolarHBondContact O-CB 3.47Å; L135-L139 VanDerWaalsContact O-CG 3.3Å; L135-L139 WeakPolarHBondContact O-CG 3.33Å; L135-L139 PolarHBondContact O-N 3.39Å; L136-L139 PolarHBondContact O-N 3.47Å; L139-Y141 VanDerWaalsContact C-N 3.3Å; L139-Y141 PolarHBondContact O-N 3.4Å; L139-T142 WeakPolarHBondContact CA-OG1 3.4Å; L139-T142 PolarHBondContact O-N 3.13Å; L139-T142 PolarHBondContact O-OG1 3.03Å; L139-H143 PolarHBondContact O-N 3.45Å; L139-L149 HydrophobicContact CB-CD1 4.24Å; L139-Y174 HydrophobicContact CD2-CE1 3.92Å; L139-Y174 HydrophobicContact CG-CE1 4.2Å
140I96.6Very high94.4Very high81 Ų8151.9 Ų51.942%0.41529%0.289SS..Hα-helixtrans-61.3-41.5176.5-66.4167000110.5L136 I137 A138 H143 N144L136-I140 HydrophobicContact CD1-CD1 3.9Å; L136-I140 HydrophobicContact CD1-CG1 4.24Å; L136-I140 HydrophobicContact CG-CD1 3.92Å; L136-I140 WeakPolarHBondContact O-CG1 3.19Å; L136-I140 PolarHBondContact O-N 2.84Å; I137-I140 PolarHBondContact O-N 3.07Å; A138-I140 PolarHBondContact O-N 3.32Å; I140-H143 WeakPolarHBondContact O-CB 3.49Å; I140-H143 PolarHBondContact O-N 2.95Å; I140-N144 PolarHBondContact O-N 2.95Å
141Y94.9Very high94.1Very high126 Ų12647.4 Ų47.449%0.49426%0.261SS..Hα-helixtrans-58.8-49.3175175-91.9000111.4I137 A138 L139 H143 N144 T145 M170I137-Y141 WeakPolarHBondContact O-CB 3.25Å; I137-Y141 PolarHBondContact O-N 3.48Å; A138-Y141 WeakPolarHBondContact O-CB 3.22Å; A138-Y141 PolarHBondContact O-N 3.29Å; L139-Y141 VanDerWaalsContact C-N 3.3Å; L139-Y141 PolarHBondContact O-N 3.4Å; Y141-H143 VanDerWaalsContact C-N 3.29Å; Y141-H143 PolarHBondContact O-N 2.9Å; Y141-N144 PolarHBondContact O-N 2.85Å; Y141-N144 VanDerWaalsContact O-N 3.15Å; Y141-T145 HydrophobicContact CD1-CG2 4.27Å; Y141-T145 HydrophobicContact CE1-CG2 3.8Å; Y141-T145 HydrophobicContact CE2-CG2 4.17Å; Y141-T145 PolarHBondContact O-N 2.8Å; Y141-T145 VanDerWaalsContact O-N 3.07Å; Y141-T145 PolarHBondContact O-OG1 3.07Å; Y141-M170 HydrophobicContact CD1-CE 3.15Å; Y141-M170 HydrophobicContact CD1-SD 4.31Å; Y141-M170 HydrophobicContact CD2-CE 4.43Å; Y141-M170 HydrophobicContact CE1-CE 3.6Å; Y141-M170 HydrophobicContact CG-CE 3.63Å
142T92.2Very high93.7Very high11 Ų1150 Ų507%0.06727%0.273CS..Hα-helixtrans-64.4-32.9177.539.30000113.9A138 L139 N144 T145 L146 L149 Y174A138-T142 PolarHBondContact O-N 3.39Å; A138-T142 PolarHBondContact O-OG1 3.12Å; L139-T142 WeakPolarHBondContact CA-OG1 3.4Å; L139-T142 PolarHBondContact O-N 3.13Å; L139-T142 PolarHBondContact O-OG1 3.03Å; T142-N144 VanDerWaalsContact C-N 3.3Å; T142-N144 PolarHBondContact O-N 3.05Å; T142-T145 WeakPolarHBondContact CA-OG1 2.92Å; T142-T145 PolarHBondContact O-N 3.45Å; T142-T145 PolarHBondContact O-OG1 3.43Å; T142-T145 VanDerWaalsContact O-OG1 3.1Å; T142-L146 WeakPolarHBondContact O-CB 3.47Å; T142-L146 PolarHBondContact O-N 3.1Å; T142-L149 WeakPolarHBondContact OG1-CD2 3.36Å; T142-Y174 WeakPolarHBondContact CB-OH 3.33Å; T142-Y174 WeakPolarHBondContact CG2-OH 3.46Å; T142-Y174 PolarHBondContact OG1-OH 3.36Å
143H93.7Very high93.3Very high86 Ų8653.4 Ų53.440%0.39829%0.291SS..Hα-helixtrans-61.4-43.7174.4-174.358000110.8L139 I140 Y141 T145 G147 L149L139-H143 PolarHBondContact O-N 3.45Å; I140-H143 WeakPolarHBondContact O-CB 3.49Å; I140-H143 PolarHBondContact O-N 2.95Å; Y141-H143 VanDerWaalsContact C-N 3.29Å; Y141-H143 PolarHBondContact O-N 2.9Å; H143-T145 VanDerWaalsContact C-N 3.34Å; H143-T145 PolarHBondContact O-N 2.84Å; H143-G147 PolarHBondContact CE1-O 3.31Å; H143-G147 VanDerWaalsContact CE1-O 3.28Å; H143-G147 CarbonylContact O-C 3.57Å; H143-G147 WeakPolarHBondContact O-CA 3.48Å; H143-G147 PolarHBondContact O-N 3.49Å; H143-L149 HydrophobicContact CB-CD1 3.84Å; H143-L149 HydrophobicContact CB-CD2 4.31Å; H143-L149 HydrophobicContact CB-CG 3.81Å
144N94.8Very high92.9Very high123 Ų12349 Ų4966%0.65827%0.268SS*.Hα-helixtrans-68.5-31.2178.9-66.2-16.5000112.7I140 Y141 T142I140-N144 PolarHBondContact O-N 2.95Å; Y141-N144 PolarHBondContact O-N 2.85Å; Y141-N144 VanDerWaalsContact O-N 3.15Å; T142-N144 VanDerWaalsContact C-N 3.3Å; T142-N144 PolarHBondContact O-N 3.05Å
145T91.1Very high92.3Very high73 Ų7350.3 Ų50.345%0.44828%0.275SS..Hα-helixtrans-83.5-42-179.8580000113.6Y141 T142 H143Y141-T145 HydrophobicContact CD1-CG2 4.27Å; Y141-T145 HydrophobicContact CE1-CG2 3.8Å; Y141-T145 HydrophobicContact CE2-CG2 4.17Å; Y141-T145 PolarHBondContact O-N 2.8Å; Y141-T145 VanDerWaalsContact O-N 3.07Å; Y141-T145 PolarHBondContact O-OG1 3.07Å; T142-T145 WeakPolarHBondContact CA-OG1 2.92Å; T142-T145 PolarHBondContact O-N 3.45Å; T142-T145 PolarHBondContact O-OG1 3.43Å; T142-T145 VanDerWaalsContact O-OG1 3.1Å; H143-T145 VanDerWaalsContact C-N 3.34Å; H143-T145 PolarHBondContact O-N 2.84Å
146L89.8Confident91.8Very high40 Ų4057.4 Ų57.421%0.20931%0.313CS..Hα-helixtrans-97.8-12.2-175.3-63173.2000112.9T142 S148 L154 Q159T142-L146 WeakPolarHBondContact O-CB 3.47Å; T142-L146 PolarHBondContact O-N 3.1Å; L146-S148 PolarHBondContact O-N 3.36Å; L146-L154 HydrophobicContact CD1-CD2 3.6Å; L146-Q159 HydrophobicContact CD2-CG 4.24Å
147G90.1Very high91.2Very high55 Ų5558 Ų5857%0.56732%0.318SS*.SBendtrans78.8-19.4-178.200000114.8H143H143-G147 PolarHBondContact CE1-O 3.31Å; H143-G147 VanDerWaalsContact CE1-O 3.28Å; H143-G147 CarbonylContact O-C 3.57Å; H143-G147 WeakPolarHBondContact O-CA 3.48Å; H143-G147 PolarHBondContact O-N 3.49Å
148S91.2Very high90.4Very high24 Ų2454.1 Ų54.117%0.16830%0.304CS..  trans-145.3156.3176.8900000112.7L146 L153L146-S148 PolarHBondContact O-N 3.36Å; S148-L153 WeakPolarHBondContact OG-CD2 3.48Å
149L92.6Very high89.8Confident5 Ų560.8 Ų60.83%0.02634%0.335CS..  trans-118.916.6175.5-69.7178.9000112.7L90 I91 L139 T142 H143 I151L90-L149 HydrophobicContact CB-CB 4.24Å; L90-L149 PolarHBondContact N-O 3.48Å; I91-L149 HydrophobicContact CB-CD1 3.98Å; L139-L149 HydrophobicContact CB-CD1 4.24Å; T142-L149 WeakPolarHBondContact OG1-CD2 3.36Å; H143-L149 HydrophobicContact CB-CD1 3.84Å; H143-L149 HydrophobicContact CB-CD2 4.31Å; H143-L149 HydrophobicContact CB-CG 3.81Å; L149-I151 PolarHBondContact O-N 3.13Å
150N92.4Very high89.3Confident37 Ų3768.7 Ų68.720%0.19837%0.372CS..BIsolated β-bridgetrans-69.8123.9176.4-175.8-10.2000108.8E89 L152 L153 L154E89-N150 HydrophobicContact CG-CB 4.43Å; N150-L152 PolarHBondContact O-N 3.38Å; N150-L152 VanDerWaalsContact O-N 3.15Å; N150-L152 PolarHBondContact OD1-N 3.09Å; N150-L152 VanDerWaalsContact OD1-N 3.13Å; N150-L153 HydrophobicContact CB-CB 4.21Å; N150-L153 PolarHBondContact O-N 3.01Å; N150-L154 WeakPolarHBondContact O-CG 3.39Å; N150-L154 PolarHBondContact O-N 2.81Å
151I88.9Confident88.8Confident10 Ų1066.3 Ų66.35%0.05136%0.36CS..Hα-helixtrans-52.3-39-179.7-67.6159.7000111T88 L90 L149 L153 L154 T155 R220T88-I151 WeakPolarHBondContact O-CB 3.26Å; T88-I151 WeakPolarHBondContact O-CD1 3.11Å; T88-I151 WeakPolarHBondContact O-CG1 3.36Å; T88-I151 PolarHBondContact O-N 3.42Å; L90-I151 HydrophobicContact CD2-CD1 4.13Å; L90-I151 HydrophobicContact CD2-CG1 3.85Å; L90-I151 HydrophobicContact CG-CG1 4.13Å; L149-I151 PolarHBondContact O-N 3.13Å; I151-L153 VanDerWaalsContact C-N 3.35Å; I151-L153 PolarHBondContact O-N 2.68Å; I151-L154 PolarHBondContact O-N 3.11Å; I151-T155 WeakPolarHBondContact O-CG2 3.4Å; I151-T155 PolarHBondContact O-N 2.87Å; I151-R220 HydrophobicContact CD1-CG 4.4Å
152L86.5Confident88.5Confident61 Ų6164 Ų6432%0.31936%0.362SS..Hα-helixtrans-67.5-31.6178.8-70.8170000113.7L24 N150 T155L24-L152 HydrophobicContact CB-CD2 4.13Å; L24-L152 HydrophobicContact CD1-CD2 3.39Å; L24-L152 HydrophobicContact CD2-CD2 4.2Å; L24-L152 HydrophobicContact CG-CD2 4.08Å; N150-L152 PolarHBondContact O-N 3.38Å; N150-L152 VanDerWaalsContact O-N 3.15Å; N150-L152 PolarHBondContact OD1-N 3.09Å; N150-L152 VanDerWaalsContact OD1-N 3.13Å; L152-T155 PolarHBondContact O-OG1 3.13Å
153L88.4Confident88.4Confident71 Ų7169.2 Ų69.237%0.37239%0.39SS..Hα-helixtrans-84.7-32.9179.1-165.7142.6000110.6S148 N150 I151 T155 L156 T157S148-L153 WeakPolarHBondContact OG-CD2 3.48Å; N150-L153 HydrophobicContact CB-CB 4.21Å; N150-L153 PolarHBondContact O-N 3.01Å; I151-L153 VanDerWaalsContact C-N 3.35Å; I151-L153 PolarHBondContact O-N 2.68Å; L153-T155 VanDerWaalsContact C-N 3.31Å; L153-T155 PolarHBondContact O-N 3Å; L153-L156 PolarHBondContact O-N 2.87Å; L153-L156 VanDerWaalsContact O-N 3.13Å; L153-T157 HydrophobicContact CD2-CG2 3.67Å; L153-T157 WeakPolarHBondContact CD2-OG1 3.29Å; L153-T157 HydrophobicContact CG-CG2 4.36Å; L153-T157 PolarHBondContact O-N 3.48Å; L153-T157 PolarHBondContact O-OG1 3.16Å
154L88.3Confident88.5Confident4 Ų467.1 Ų67.12%0.02139%0.385CS..Hα-helixtrans-62.8-34.4175.4-73.8164.6000112.3L90 L146 N150 I151 L156 T157 A158 I224L90-L154 HydrophobicContact CD1-CD1 3.51Å; L90-L154 HydrophobicContact CG-CD1 4.23Å; L146-L154 HydrophobicContact CD1-CD2 3.6Å; N150-L154 WeakPolarHBondContact O-CG 3.39Å; N150-L154 PolarHBondContact O-N 2.81Å; I151-L154 PolarHBondContact O-N 3.11Å; L154-L156 PolarHBondContact O-N 2.88Å; L154-T157 PolarHBondContact O-N 2.82Å; L154-A158 WeakPolarHBondContact O-CA 3.4Å; L154-A158 WeakPolarHBondContact O-CB 3.46Å; L154-A158 PolarHBondContact O-N 3.25Å; L154-I224 HydrophobicContact CD1-CD1 4Å; L154-I224 HydrophobicContact CD2-CD1 4.27Å; L154-I224 HydrophobicContact CD2-CG1 4.3Å
155T84.7Confident88.4Confident76 Ų7671.5 Ų71.547%0.46639%0.392SS..Hα-helixtrans-60.5-27.2174.654.50000113I151 L152 L153 L223I151-T155 WeakPolarHBondContact O-CG2 3.4Å; I151-T155 PolarHBondContact O-N 2.87Å; L152-T155 PolarHBondContact O-OG1 3.13Å; L153-T155 VanDerWaalsContact C-N 3.31Å; L153-T155 PolarHBondContact O-N 3Å; T155-L223 HydrophobicContact CG2-CD1 3.61Å
156L84.9Confident88.6Confident151 Ų15171.3 Ų71.379%0.79140%0.398SS*.Hα-helixtrans-96.6-29.7-178.8-61175.8000113.3L153 L154L153-L156 PolarHBondContact O-N 2.87Å; L153-L156 VanDerWaalsContact O-N 3.13Å; L154-L156 PolarHBondContact O-N 2.88Å
157T85.1Confident88.7Confident58 Ų5870.8 Ų70.836%0.35640%0.395SS..Hα-helixtrans-112.6-1.8-17158.10000114.3L153 L154 Q159L153-T157 HydrophobicContact CD2-CG2 3.67Å; L153-T157 WeakPolarHBondContact CD2-OG1 3.29Å; L153-T157 HydrophobicContact CG-CG2 4.36Å; L153-T157 PolarHBondContact O-N 3.48Å; L153-T157 PolarHBondContact O-OG1 3.16Å; L154-T157 PolarHBondContact O-N 2.82Å; T157-Q159 PolarHBondContact O-N 2.83Å
158A81.1Confident89Confident41 Ų4169.3 Ų69.334%0.33937%0.374SS..PPolyproline II helixtrans-56.3123.2177.500000110.5L154L154-A158 WeakPolarHBondContact O-CA 3.4Å; L154-A158 WeakPolarHBondContact O-CB 3.46Å; L154-A158 PolarHBondContact O-N 3.25Å
159Q82.4Confident89.2Confident142 Ų14273.6 Ų73.666%0.66440%0.395SS*.PPolyproline II helixtrans-89.1140.5172.2-66.1178.7-7.800109.2L146 T157 L161L146-Q159 HydrophobicContact CD2-CG 4.24Å; T157-Q159 PolarHBondContact O-N 2.83Å; Q159-L161 PolarHBondContact O-N 3.49Å
160E85.6Confident89.2Confident168 Ų16874.8 Ų74.879%0.78540%0.401SS*.PPolyproline II helixtrans-65.7128.9175.9-66.5-171.8171.400111S162E160-S162 PolarHBondContact O-N 2.62Å
161L85.8Confident89.4Confident30 Ų3073.1 Ų73.116%0.15739%0.392CS..  trans-76.7115.9175.6-69.4176.9000110.8Q159 I224 L225 N226 L228Q159-L161 PolarHBondContact O-N 3.49Å; L161-I224 VanDerWaalsContact CD1-O 3.26Å; L161-I224 WeakPolarHBondContact CD1-O 3.47Å; L161-I224 WeakPolarHBondContact CG-O 3.19Å; L161-L225 HydrophobicContact CD1-CD2 4.42Å; L161-N226 PolarHBondContact N-O 2.92Å; L161-L228 HydrophobicContact CB-CB 4.12Å
162S89.7Confident89.7Confident79 Ų7975.1 Ų75.155%0.55240%0.402SS*.  trans-73.2157.4174.264.50000112.5E160 S164 N167 L228E160-S162 PolarHBondContact O-N 2.62Å; S162-S164 PolarHBondContact O-N 2.99Å; S162-N167 PolarHBondContact N-ND2 2.89Å; S162-N167 VanDerWaalsContact O-CB 3.25Å; S162-N167 WeakPolarHBondContact O-CB 3.05Å; S162-N167 PolarHBondContact O-ND2 3.48Å; S162-N167 PolarHBondContact OG-ND2 2.72Å; S162-N167 VanDerWaalsContact OG-ND2 3.15Å; S162-L228 WeakPolarHBondContact O-CD1 3.22Å
163N90.4Very high90.2Very high120 Ų12073 Ų7364%0.64239%0.394SS*.SBendtrans-75.593.9178.2-170.720.8000111.2L228N163-L228 HydrophobicContact CB-CD1 4.44Å
164S94.1Very high90.5Very high42 Ų4269.7 Ų69.729%0.29438%0.376SS..  trans-137.7155.6174.571.50000110.2S162 A166 N167 N168S162-S164 PolarHBondContact O-N 2.99Å; S164-A166 PolarHBondContact O-N 3.36Å; S164-N167 PolarHBondContact O-N 3.5Å; S164-N167 VanDerWaalsContact O-N 3.09Å; S164-N167 WeakPolarHBondContact OG-CB 3.36Å; S164-N167 VanDerWaalsContact OG-CG 3.25Å; S164-N167 PolarHBondContact OG-N 2.96Å; S164-N167 PolarHBondContact OG-ND2 3.04Å; S164-N168 VanDerWaalsContact O-CG 3.27Å; S164-N168 PolarHBondContact O-N 2.99Å
165W93.7Very high90.8Very high215 Ų21569.6 Ų69.681%0.81438%0.376SS*.Hα-helixtrans-57.6-36.7177.4-76.4106.4000112.9N168 L169W165-N168 PolarHBondContact O-N 3.38Å; W165-L169 WeakPolarHBondContact O-CG 3.16Å; W165-L169 PolarHBondContact O-N 3.22Å
166A94.3Very high91.3Very high68 Ų6868.6 Ų68.656%0.56237%0.367SS*.Hα-helixtrans-62.9-45.8175.200000111.5S164 N168 L169 M170S164-A166 PolarHBondContact O-N 3.36Å; A166-N168 PolarHBondContact O-N 3.02Å; A166-L169 PolarHBondContact O-N 3.03Å; A166-M170 WeakPolarHBondContact O-CB 3.21Å; A166-M170 PolarHBondContact O-N 2.97Å
167N93.5Very high91.8Very high29 Ų2961.5 Ų61.516%0.15533%0.329CS..Hα-helixtrans-69.4-32.7178.2-67.7-15.8000112.3S162 S164 M170 W171 L228S162-N167 PolarHBondContact N-ND2 2.89Å; S162-N167 VanDerWaalsContact O-CB 3.25Å; S162-N167 WeakPolarHBondContact O-CB 3.05Å; S162-N167 PolarHBondContact O-ND2 3.48Å; S162-N167 PolarHBondContact OG-ND2 2.72Å; S162-N167 VanDerWaalsContact OG-ND2 3.15Å; S164-N167 PolarHBondContact O-N 3.5Å; S164-N167 VanDerWaalsContact O-N 3.09Å; S164-N167 WeakPolarHBondContact OG-CB 3.36Å; S164-N167 VanDerWaalsContact OG-CG 3.25Å; S164-N167 PolarHBondContact OG-N 2.96Å; S164-N167 PolarHBondContact OG-ND2 3.04Å; N167-M170 PolarHBondContact O-N 3.28Å; N167-W171 WeakPolarHBondContact O-CB 3.2Å; N167-W171 PolarHBondContact O-N 3.3Å; N167-L228 HydrophobicContact CB-CD1 4.34Å; N167-L228 HydrophobicContact CB-CD2 4.47Å; N167-L228 WeakPolarHBondContact O-CD2 3.37Å
168N94.8Very high92.4Very high24 Ų2458.8 Ų58.813%0.12831%0.313CS..Hα-helixtrans-64.4-43.2172.9-68-15.8000111.6S164 W165 A166 W171 L172 L228 M232S164-N168 VanDerWaalsContact O-CG 3.27Å; S164-N168 PolarHBondContact O-N 2.99Å; W165-N168 PolarHBondContact O-N 3.38Å; A166-N168 PolarHBondContact O-N 3.02Å; N168-W171 PolarHBondContact O-N 3.26Å; N168-L172 WeakPolarHBondContact O-CG 3.41Å; N168-L172 PolarHBondContact O-N 3.45Å; N168-L172 VanDerWaalsContact O-N 3.08Å; N168-L228 WeakPolarHBondContact OD1-CD1 3.48Å; N168-M232 HydrophobicContact CB-CE 3.95Å; N168-M232 HydrophobicContact CB-SD 4.06Å
169L95.1Very high93.1Very high114 Ų11456.9 Ų56.960%0.59730%0.297SS*.Hα-helixtrans-66.8-39.2173.8-73.6171.5000112W165 A166 L172 A173W165-L169 WeakPolarHBondContact O-CG 3.16Å; W165-L169 PolarHBondContact O-N 3.22Å; A166-L169 PolarHBondContact O-N 3.03Å; L169-L172 PolarHBondContact O-N 3.32Å; L169-A173 WeakPolarHBondContact O-CB 3.23Å; L169-A173 PolarHBondContact O-N 3.1Å
170M94.1Very high93.7Very high31 Ų3150.4 Ų50.415%0.15327%0.267CS..Hα-helixtrans-61.6-44175.1-173.364.570.500111.4A138 Y141 A166 N167 L172 A173 Y174A138-M170 HydrophobicContact CB-SD 3.45Å; A138-M170 WeakPolarHBondContact CB-SD 3.33Å; Y141-M170 HydrophobicContact CD1-CE 3.15Å; Y141-M170 HydrophobicContact CD1-SD 4.31Å; Y141-M170 HydrophobicContact CD2-CE 4.43Å; Y141-M170 HydrophobicContact CE1-CE 3.6Å; Y141-M170 HydrophobicContact CG-CE 3.63Å; A166-M170 WeakPolarHBondContact O-CB 3.21Å; A166-M170 PolarHBondContact O-N 2.97Å; N167-M170 PolarHBondContact O-N 3.28Å; M170-L172 VanDerWaalsContact C-N 3.33Å; M170-L172 PolarHBondContact O-N 3.25Å; M170-A173 WeakPolarHBondContact O-CB 3.28Å; M170-A173 PolarHBondContact O-N 2.89Å; M170-Y174 HydrophobicContact CG-CD2 3.86Å; M170-Y174 HydrophobicContact CG-CE2 3.45Å; M170-Y174 VanDerWaalsContact CG-CE2 3.45Å; M170-Y174 WeakPolarHBondContact O-CD2 3.42Å; M170-Y174 PolarHBondContact O-N 3.05Å; M170-Y174 HydrophobicContact SD-CD2 4.28Å; M170-Y174 HydrophobicContact SD-CE2 3.63Å
171W95.6Very high94.2Very high1 Ų142.5 Ų42.50%0.00423%0.23CC..Hα-helixtrans-61.2-41.7175.7-175.499.9000112N167 N168 Y174 T175 L225 L228 M232 F236 L277N167-W171 WeakPolarHBondContact O-CB 3.2Å; N167-W171 PolarHBondContact O-N 3.3Å; N168-W171 PolarHBondContact O-N 3.26Å; W171-Y174 PolarHBondContact O-N 2.84Å; W171-T175 HydrophobicContact CD2-CG2 4.05Å; W171-T175 HydrophobicContact CE3-CG2 4.24Å; W171-T175 HydrophobicContact CH2-CG2 4.06Å; W171-T175 HydrophobicContact CZ2-CG2 3.88Å; W171-T175 HydrophobicContact CZ3-CG2 4.22Å; W171-T175 WeakPolarHBondContact CZ3-OG1 3.31Å; W171-T175 WeakPolarHBondContact O-CB 3.38Å; W171-T175 WeakPolarHBondContact O-CG2 3.48Å; W171-T175 PolarHBondContact O-N 3.42Å; W171-T175 PolarHBondContact O-OG1 3.34Å; W171-L225 HydrophobicContact CB-CD2 4.31Å; W171-L225 HydrophobicContact CG-CD2 4.09Å; W171-L228 HydrophobicContact CB-CD2 3.46Å; W171-L228 VanDerWaalsContact CB-CD2 3.46Å; W171-L228 HydrophobicContact CG-CD2 3.81Å; W171-M232 HydrophobicContact CD2-CB 3.6Å; W171-M232 HydrophobicContact CD2-CG 4.16Å; W171-M232 HydrophobicContact CE3-CB 3.72Å; W171-M232 HydrophobicContact CE3-CE 4.03Å; W171-M232 HydrophobicContact CE3-CG 4.33Å; W171-M232 HydrophobicContact CG-CB 4.19Å; W171-M232 HydrophobicContact CG-CG 4.31Å; W171-M232 HydrophobicContact CH2-CB 4.04Å; W171-M232 HydrophobicContact CZ2-CB 3.9Å; W171-M232 HydrophobicContact CZ3-CB 3.96Å; W171-F236 AromaticContact CH2-CD2 3.67Å; W171-F236 HydrophobicContact CH2-CD2 3.67Å; W171-F236 AromaticContact CH2-CE2 3.79Å; W171-F236 HydrophobicContact CH2-CE2 3.79Å; W171-F236 AromaticContact CZ3-CD2 3.83Å; W171-F236 HydrophobicContact CZ3-CD2 3.83Å; W171-F236 AromaticContact CZ3-CE2 3.42Å; W171-F236 HydrophobicContact CZ3-CE2 3.42Å; W171-F236 VanDerWaalsContact CZ3-CE2 3.42Å; W171-F236 HydrophobicContact CZ3-CZ 4.15Å; W171-L277 HydrophobicContact CZ2-CD2 4.32Å
172L95.8Very high94.4Very high53 Ų5341.1 Ų41.128%0.27722%0.223SC..Hα-helixtrans-63.2-44.9173.2-74.3167.3000111.2N168 L169 M170 Y174 T175 M176 M232 F236N168-L172 WeakPolarHBondContact O-CG 3.41Å; N168-L172 PolarHBondContact O-N 3.45Å; N168-L172 VanDerWaalsContact O-N 3.08Å; L169-L172 PolarHBondContact O-N 3.32Å; M170-L172 VanDerWaalsContact C-N 3.33Å; M170-L172 PolarHBondContact O-N 3.25Å; L172-Y174 VanDerWaalsContact C-N 3.27Å; L172-Y174 PolarHBondContact O-N 3.34Å; L172-T175 PolarHBondContact O-N 3.48Å; L172-T175 PolarHBondContact O-OG1 3.02Å; L172-M176 HydrophobicContact CB-CG 4.49Å; L172-M176 HydrophobicContact CD2-CG 4.49Å; L172-M176 VanDerWaalsContact O-CB 3.28Å; L172-M176 WeakPolarHBondContact O-CB 3.13Å; L172-M176 WeakPolarHBondContact O-CG 3.02Å; L172-M176 PolarHBondContact O-N 2.87Å; L172-M232 HydrophobicContact CD1-CE 4.3Å; L172-M232 HydrophobicContact CG-CE 4.1Å; L172-F236 HydrophobicContact CD2-CE2 4.01Å; L172-F236 HydrophobicContact CD2-CZ 3.69Å
173A96.3Very high94.2Very high17 Ų1737.5 Ų37.514%0.1420%0.197CC..Hα-helixtrans-59-39.2178.300000112.2P134 L135 A138 L169 M170P134-A173 HydrophobicContact CB-CB 3.95Å; L135-A173 WeakPolarHBondContact CA-O 3.31Å; L135-A173 PolarHBondContact N-O 3.39Å; A138-A173 HydrophobicContact CB-CB 3.91Å; L169-A173 WeakPolarHBondContact O-CB 3.23Å; L169-A173 PolarHBondContact O-N 3.1Å; M170-A173 WeakPolarHBondContact O-CB 3.28Å; M170-A173 PolarHBondContact O-N 2.89Å
174Y94.9Very high94.3Very high1 Ų132.1 Ų32.10%0.00417%0.168CC..Hα-helixtrans-68.8-40.7175.2-79.6-53000114.3L135 A138 L139 T142 M170 W171 L172 F178 L221 I224 L225L135-Y174 HydrophobicContact CD1-CD1 3.68Å; L135-Y174 HydrophobicContact CD1-CE1 4.33Å; A138-Y174 VanDerWaalsContact C-OH 3.26Å; A138-Y174 HydrophobicContact CB-CD1 3.9Å; A138-Y174 HydrophobicContact CB-CD2 4.4Å; A138-Y174 HydrophobicContact CB-CE1 3.53Å; A138-Y174 HydrophobicContact CB-CE2 4.12Å; A138-Y174 HydrophobicContact CB-CG 4.29Å; A138-Y174 PolarHBondContact O-OH 3.13Å; L139-Y174 HydrophobicContact CD2-CE1 3.92Å; L139-Y174 HydrophobicContact CG-CE1 4.2Å; T142-Y174 WeakPolarHBondContact CB-OH 3.33Å; T142-Y174 WeakPolarHBondContact CG2-OH 3.46Å; T142-Y174 PolarHBondContact OG1-OH 3.36Å; M170-Y174 HydrophobicContact CG-CD2 3.86Å; M170-Y174 HydrophobicContact CG-CE2 3.45Å; M170-Y174 VanDerWaalsContact CG-CE2 3.45Å; M170-Y174 WeakPolarHBondContact O-CD2 3.42Å; M170-Y174 PolarHBondContact O-N 3.05Å; M170-Y174 HydrophobicContact SD-CD2 4.28Å; M170-Y174 HydrophobicContact SD-CE2 3.63Å; W171-Y174 PolarHBondContact O-N 2.84Å; L172-Y174 VanDerWaalsContact C-N 3.27Å; L172-Y174 PolarHBondContact O-N 3.34Å; Y174-F178 VanDerWaalsContact O-CD2 3.24Å; Y174-F178 WeakPolarHBondContact O-CD2 3.35Å; Y174-F178 VanDerWaalsContact O-CE2 3.27Å; Y174-F178 WeakPolarHBondContact O-CE2 3.31Å; Y174-L221 HydrophobicContact CD1-CD1 3.44Å; Y174-L221 VanDerWaalsContact CD1-CD1 3.44Å; Y174-L221 HydrophobicContact CE1-CD1 4.38Å; Y174-L221 HydrophobicContact CG-CD1 3.88Å; Y174-I224 HydrophobicContact CE2-CG2 4.27Å; Y174-L225 HydrophobicContact CD2-CD2 3.54Å; Y174-L225 HydrophobicContact CG-CD2 3.94Å
175T95.3Very high94.3Very high2 Ų233 Ų331%0.01217%0.166CC..Hα-helixtrans-89.6-32.7-169.553.20000113.3W171 L172 A177 F178 M179 L225W171-T175 HydrophobicContact CD2-CG2 4.05Å; W171-T175 HydrophobicContact CE3-CG2 4.24Å; W171-T175 HydrophobicContact CH2-CG2 4.06Å; W171-T175 HydrophobicContact CZ2-CG2 3.88Å; W171-T175 HydrophobicContact CZ3-CG2 4.22Å; W171-T175 WeakPolarHBondContact CZ3-OG1 3.31Å; W171-T175 WeakPolarHBondContact O-CB 3.38Å; W171-T175 WeakPolarHBondContact O-CG2 3.48Å; W171-T175 PolarHBondContact O-N 3.42Å; W171-T175 PolarHBondContact O-OG1 3.34Å; L172-T175 PolarHBondContact O-N 3.48Å; L172-T175 PolarHBondContact O-OG1 3.02Å; T175-A177 VanDerWaalsContact C-N 3.34Å; T175-A177 PolarHBondContact O-N 3.08Å; T175-F178 PolarHBondContact O-N 2.96Å; T175-M179 WeakPolarHBondContact O-CG 3.21Å; T175-M179 PolarHBondContact O-N 2.74Å; T175-L225 HydrophobicContact CG2-CD1 3.7Å
176M95.3Very high94.4Very high55 Ų5525 Ų2527%0.27115%0.15SC..Hα-helixtrans-60.9-38.1-171.6-76.4-60.7-6300113.6L172 F178 M179 V180 L187 F236L172-M176 HydrophobicContact CB-CG 4.49Å; L172-M176 HydrophobicContact CD2-CG 4.49Å; L172-M176 VanDerWaalsContact O-CB 3.28Å; L172-M176 WeakPolarHBondContact O-CB 3.13Å; L172-M176 WeakPolarHBondContact O-CG 3.02Å; L172-M176 PolarHBondContact O-N 2.87Å; M176-F178 VanDerWaalsContact C-N 3.28Å; M176-F178 PolarHBondContact O-N 2.86Å; M176-M179 PolarHBondContact O-N 3.43Å; M176-V180 WeakPolarHBondContact O-CG2 3.41Å; M176-V180 PolarHBondContact O-N 3.07Å; M176-L187 HydrophobicContact CE-CD1 3.76Å; M176-F236 HydrophobicContact SD-CE1 4.08Å; M176-F236 HydrophobicContact SD-CZ 4.24Å
177A95.7Very high94.4Very high1 Ų123.9 Ų23.91%0.00813%0.134CC..Hα-helixtrans-56.3-44.1175.200000112G131 L135 T175 V180 K181G131-A177 WeakPolarHBondContact O-CA 3.13Å; G131-A177 WeakPolarHBondContact O-CB 3.28Å; G131-A177 PolarHBondContact O-N 3.49Å; L135-A177 HydrophobicContact CB-CB 3.89Å; L135-A177 HydrophobicContact CD2-CB 3.67Å; L135-A177 HydrophobicContact CG-CB 4.38Å; T175-A177 VanDerWaalsContact C-N 3.34Å; T175-A177 PolarHBondContact O-N 3.08Å; A177-V180 PolarHBondContact O-N 2.96Å; A177-K181 PolarHBondContact O-N 3.48Å
178F96.5Very high94.6Very high2 Ų223.1 Ų23.11%0.00913%0.13CC..Hα-helixtrans-77.5-32.1-179.7-54.8-54.6000112.4F93 F97 L135 Y174 T175 M176 V180 K181 M182 G214 M218 L221F93-F178 AromaticContact CE1-CE1 3.72Å; F93-F178 HydrophobicContact CE1-CE1 3.72Å; F93-F178 AromaticContact CE1-CZ 3.72Å; F93-F178 HydrophobicContact CE1-CZ 3.72Å; F93-F178 AromaticContact CZ-CE1 3.86Å; F93-F178 HydrophobicContact CZ-CE1 3.86Å; F93-F178 HydrophobicContact CZ-CZ 4.27Å; F97-F178 HydrophobicContact CE2-CD1 4.33Å; F97-F178 HydrophobicContact CE2-CE1 4.22Å; F97-F178 HydrophobicContact CZ-CD1 4.43Å; F97-F178 HydrophobicContact CZ-CE1 4.35Å; L135-F178 HydrophobicContact CD1-CE2 4.26Å; L135-F178 HydrophobicContact CD1-CZ 4.41Å; L135-F178 HydrophobicContact CD2-CE1 4.17Å; L135-F178 HydrophobicContact CD2-CE2 4.07Å; L135-F178 HydrophobicContact CD2-CZ 3.61Å; Y174-F178 VanDerWaalsContact O-CD2 3.24Å; Y174-F178 WeakPolarHBondContact O-CD2 3.35Å; Y174-F178 VanDerWaalsContact O-CE2 3.27Å; Y174-F178 WeakPolarHBondContact O-CE2 3.31Å; T175-F178 PolarHBondContact O-N 2.96Å; M176-F178 VanDerWaalsContact C-N 3.28Å; M176-F178 PolarHBondContact O-N 2.86Å; F178-V180 VanDerWaalsContact C-N 3.26Å; F178-V180 PolarHBondContact O-N 3.4Å; F178-K181 PolarHBondContact O-N 3.49Å; F178-M182 WeakPolarHBondContact O-CB 3.12Å; F178-M182 PolarHBondContact O-N 3Å; F178-G214 WeakPolarHBondContact CB-O 3.46Å; F178-M218 HydrophobicContact CB-CB 4.21Å; F178-M218 HydrophobicContact CD2-CB 4.43Å; F178-M218 HydrophobicContact CG-CB 4.45Å; F178-L221 HydrophobicContact CD2-CD1 4.37Å; F178-L221 HydrophobicContact CE2-CD1 3.48Å; F178-L221 VanDerWaalsContact CE2-CD1 3.48Å; F178-L221 HydrophobicContact CE2-CG 4.02Å; F178-L221 HydrophobicContact CZ-CD1 4.29Å
179M95.6Very high94.6Very high0 Ų025.9 Ų25.90%014%0.144CC..Hα-helixtrans-70.2-20.1172.8-65.8-63.8-172.700113.5T175 M176 M182 L184 M218 F236 V273 L277T175-M179 WeakPolarHBondContact O-CG 3.21Å; T175-M179 PolarHBondContact O-N 2.74Å; M176-M179 PolarHBondContact O-N 3.43Å; M179-M182 CarbonylContact C-O 3.28Å; M179-M182 VanDerWaalsContact C-O 3.23Å; M179-M182 CarbonylContact O-C 3.59Å; M179-L184 HydrophobicContact CB-CB 4.34Å; M179-L184 WeakPolarHBondContact O-CB 3.25Å; M179-L184 PolarHBondContact O-N 3.44Å; M179-L184 HydrophobicContact SD-CD1 4.2Å; M179-M218 HydrophobicContact CE-CE 3.45Å; M179-M218 VanDerWaalsContact CE-CE 3.45Å; M179-M218 HydrophobicContact CE-SD 3.67Å; M179-M218 HydrophobicContact SD-CE 4.44Å; M179-M218 HydrophobicContact SD-SD 4.15Å; M179-F236 HydrophobicContact CE-CB 4.15Å; M179-F236 HydrophobicContact CE-CD1 4.18Å; M179-F236 HydrophobicContact CE-CG 4.22Å; M179-F236 HydrophobicContact CG-CD1 4.42Å; M179-F236 HydrophobicContact SD-CD1 4.47Å; M179-V273 HydrophobicContact CE-CG1 4.09Å; M179-V273 HydrophobicContact SD-CG1 3.86Å; M179-L277 HydrophobicContact CE-CD1 4.07Å; M179-L277 HydrophobicContact CE-CD2 3.96Å; M179-L277 HydrophobicContact CE-CG 4.28Å
180V96.8Very high94.7Very high6 Ų620.5 Ų20.54%0.03612%0.116CC..Hα-helixtrans-79.3-42.9168.5172.30000110.5Y127 T128 M176 A177 F178 L187 W190Y127-V180 HydrophobicContact CD1-CG1 4.43Å; Y127-V180 WeakPolarHBondContact O-CG1 3.47Å; T128-V180 HydrophobicContact CG2-CG1 4.43Å; M176-V180 WeakPolarHBondContact O-CG2 3.41Å; M176-V180 PolarHBondContact O-N 3.07Å; A177-V180 PolarHBondContact O-N 2.96Å; F178-V180 VanDerWaalsContact C-N 3.26Å; F178-V180 PolarHBondContact O-N 3.4Å; V180-L187 HydrophobicContact CG2-CD1 3.95Å; V180-W190 WeakPolarHBondContact O-CZ2 3.28Å; V180-W190 PolarHBondContact O-NE1 2.73Å
181K94.3Very high94.7Very high2 Ų219 Ų191%0.00911%0.109CC..Hα-helixtrans-71.4-44.7-179.5-73.7-76.7-169.1167.30113.6F97 T128 A177 F178 P183 L211F97-K181 HydrophobicContact CE2-CD 4.09Å; F97-K181 HydrophobicContact CE2-CG 3.71Å; F97-K181 HydrophobicContact CZ-CD 4.03Å; F97-K181 HydrophobicContact CZ-CG 3.49Å; F97-K181 VanDerWaalsContact CZ-CG 3.49Å; T128-K181 HydrophobicContact CG2-CD 3.88Å; A177-K181 PolarHBondContact O-N 3.48Å; F178-K181 PolarHBondContact O-N 3.49Å; K181-P183 WeakPolarHBondContact O-CD 3.38Å; K181-L211 WeakPolarHBondContact O-CD2 3.49Å
182M90.5Very high94.6Very high1 Ų119.6 Ų19.61%0.00511%0.112CC..THydrogen-bonded Turntrans-82.995159.7-76.1-169-65.500105.9F178 M179 L184 L211 G215 M218 V272 V273 I276F178-M182 WeakPolarHBondContact O-CB 3.12Å; F178-M182 PolarHBondContact O-N 3Å; M179-M182 CarbonylContact C-O 3.28Å; M179-M182 VanDerWaalsContact C-O 3.23Å; M179-M182 CarbonylContact O-C 3.59Å; M182-L184 PolarHBondContact O-N 2.99Å; M182-L211 WeakPolarHBondContact CG-O 3.45Å; M182-G215 WeakPolarHBondContact SD-CA 3.11Å; M182-G215 PolarHBondContact SD-N 3.38Å; M182-M218 HydrophobicContact CE-CB 4.01Å; M182-M218 HydrophobicContact CE-CG 4.44Å; M182-M218 HydrophobicContact CE-SD 3.56Å; M182-M218 VanDerWaalsContact CE-SD 3.56Å; M182-V272 HydrophobicContact SD-CG1 3.98Å; M182-V273 HydrophobicContact CB-CG2 3.86Å; M182-V273 HydrophobicContact CE-CG2 3.92Å; M182-V273 HydrophobicContact CG-CG2 4.47Å; M182-V273 HydrophobicContact SD-CG2 3.82Å; M182-I276 HydrophobicContact CE-CD1 4.06Å; M182-I276 HydrophobicContact SD-CD1 4.15Å
183P85.8Confident94.5Very high3 Ų320.9 Ų20.92%0.01912%0.116CC..THydrogen-bonded Turntrans-58.593.6-166.231.2-43.9000110.9K181 H188 L191 I266K181-P183 WeakPolarHBondContact O-CD 3.38Å; P183-H188 HydrophobicContact CB-CB 3.65Å; P183-L191 HydrophobicContact CB-CD1 4.1Å; P183-L191 HydrophobicContact CG-CD1 3.52Å; P183-I266 HydrophobicContact CB-CG1 4.26Å; P183-I266 HydrophobicContact CG-CB 4.38Å; P183-I266 HydrophobicContact CG-CG1 3.83Å; P183-I266 HydrophobicContact CG-CG2 4.27Å
184L93.1Very high94.4Very high7 Ų720 Ų204%0.03711%0.109CC..  trans-61.6146.9173.9-172.678000108.2M179 M182 G186 L187 H188 F236 L239 V273M179-L184 HydrophobicContact CB-CB 4.34Å; M179-L184 WeakPolarHBondContact O-CB 3.25Å; M179-L184 PolarHBondContact O-N 3.44Å; M179-L184 HydrophobicContact SD-CD1 4.2Å; M182-L184 PolarHBondContact O-N 2.99Å; L184-G186 PolarHBondContact O-N 3.33Å; L184-L187 HydrophobicContact CB-CD1 4.49Å; L184-L187 CarbonylContact O-C 3.58Å; L184-L187 WeakPolarHBondContact O-CA 3.47Å; L184-L187 PolarHBondContact O-N 3.33Å; L184-H188 PolarHBondContact O-N 2.91Å; L184-F236 HydrophobicContact CD2-CD1 3.55Å; L184-F236 HydrophobicContact CD2-CE1 4.02Å; L184-L239 HydrophobicContact CD1-CB 4.3Å; L184-L239 HydrophobicContact CD2-CB 4.36Å; L184-L239 HydrophobicContact CD2-CD1 3.92Å; L184-L239 HydrophobicContact CG-CB 4.36Å; L184-V273 HydrophobicContact CD1-CG1 4.15Å
185Y94.3Very high94.4Very high61 Ų6120 Ų2024%0.23911%0.109CC..THydrogen-bonded Turntrans-53.7135.4169.1-169.2-103.5000110.5L187 H188 L239 M246 T247Y185-L187 PolarHBondContact O-N 3.28Å; Y185-H188 AromaticContact CD2-CE1 3.61Å; Y185-H188 AromaticContact CD2-ND1 3.95Å; Y185-H188 AromaticContact CE2-CE1 3.77Å; Y185-L239 WeakPolarHBondContact CB-O 3.3Å; Y185-L239 HydrophobicContact CD1-CD2 4.43Å; Y185-M246 HydrophobicContact CE2-CB 3.78Å; Y185-T247 HydrophobicContact CD2-CG2 4.04Å; Y185-T247 HydrophobicContact CE2-CG2 4.3Å
186G94.4Very high94.3Very high47 Ų4720.5 Ų20.549%0.48511%0.112SC..THydrogen-bonded Turntrans90.4-41.1-164.800000115.2L184 H188L184-G186 PolarHBondContact O-N 3.33Å; G186-H188 PolarHBondContact N-ND1 3.5Å; G186-H188 VanDerWaalsContact N-ND1 3.13Å
187L95.8Very high94.3Very high45 Ų4518.6 Ų18.624%0.23610%0.102CC..THydrogen-bonded Turntrans-98.31.1179.9-60175000113.7Y127 M176 V180 L184 Y185 L189Y127-L187 WeakPolarHBondContact CE1-O 3.34Å; M176-L187 HydrophobicContact CE-CD1 3.76Å; V180-L187 HydrophobicContact CG2-CD1 3.95Å; L184-L187 HydrophobicContact CB-CD1 4.49Å; L184-L187 CarbonylContact O-C 3.58Å; L184-L187 WeakPolarHBondContact O-CA 3.47Å; L184-L187 PolarHBondContact O-N 3.33Å; Y185-L187 PolarHBondContact O-N 3.28Å; L187-L189 PolarHBondContact O-N 3.49Å
188H96.4Very high94.2Very high13 Ų1318.6 Ų18.66%0.0610%0.103CC..THydrogen-bonded Turntrans-80.5-7.6-171.865.2-82.3000116P183 L184 Y185 G186 W190 L191 P192 I266P183-H188 HydrophobicContact CB-CB 3.65Å; L184-H188 PolarHBondContact O-N 2.91Å; Y185-H188 AromaticContact CD2-CE1 3.61Å; Y185-H188 AromaticContact CD2-ND1 3.95Å; Y185-H188 AromaticContact CE2-CE1 3.77Å; G186-H188 PolarHBondContact N-ND1 3.5Å; G186-H188 VanDerWaalsContact N-ND1 3.13Å; H188-W190 PolarHBondContact O-N 3.4Å; H188-W190 VanDerWaalsContact O-N 3.09Å; H188-L191 WeakPolarHBondContact O-CB 3.21Å; H188-L191 PolarHBondContact O-N 2.93Å; H188-P192 WeakPolarHBondContact O-CD 3.42Å; H188-I266 HydrophobicContact CB-CD1 3.78Å; H188-I266 HydrophobicContact CB-CG1 4.19Å; H188-I266 HydrophobicContact CB-CG2 3.98Å
189L95.5Very high94.2Very high81 Ų8118.7 Ų18.742%0.42410%0.103SC..THydrogen-bonded Turntrans-61.3-24.9-169.4-68.4176.8000114.5L187 L191L187-L189 PolarHBondContact O-N 3.49Å; L189-L191 VanDerWaalsContact C-N 3.29Å; L189-L191 PolarHBondContact O-N 3.32Å
190W96.3Very high94.2Very high2 Ų218.9 Ų18.91%0.00810%0.104CC..Hα-helixtrans-67.8-31176.269.5-95.5000112F124 Y127 V180 H188 K193 A194 L206 L211F124-W190 HydrophobicContact CD2-CD2 4.37Å; F124-W190 AromaticContact CD2-CE3 3.53Å; F124-W190 HydrophobicContact CD2-CE3 3.53Å; F124-W190 HydrophobicContact CD2-CH2 4.27Å; F124-W190 AromaticContact CD2-CZ3 3.47Å; F124-W190 HydrophobicContact CD2-CZ3 3.47Å; F124-W190 VanDerWaalsContact CD2-CZ3 3.47Å; F124-W190 HydrophobicContact CE2-CE3 4.25Å; F124-W190 HydrophobicContact CE2-CH2 4.19Å; F124-W190 AromaticContact CE2-CZ3 3.72Å; F124-W190 HydrophobicContact CE2-CZ3 3.72Å; Y127-W190 HydrophobicContact CD1-CB 4.4Å; Y127-W190 AromaticContact CD1-CD1 3.58Å; Y127-W190 HydrophobicContact CD1-CG 4.33Å; Y127-W190 HydrophobicContact CD2-CB 4.48Å; Y127-W190 HydrophobicContact CG-CB 4.2Å; Y127-W190 AromaticContact CG-CD1 3.96Å; Y127-W190 HydrophobicContact CG-CG 4.36Å; V180-W190 WeakPolarHBondContact O-CZ2 3.28Å; V180-W190 PolarHBondContact O-NE1 2.73Å; H188-W190 PolarHBondContact O-N 3.4Å; H188-W190 VanDerWaalsContact O-N 3.09Å; W190-K193 PolarHBondContact O-N 3.5Å; W190-A194 HydrophobicContact CE3-CB 3.97Å; W190-A194 HydrophobicContact CZ3-CB 4.26Å; W190-A194 VanDerWaalsContact O-CB 3.25Å; W190-A194 WeakPolarHBondContact O-CB 3.47Å; W190-A194 PolarHBondContact O-N 2.97Å; W190-L206 HydrophobicContact CZ3-CD2 4.14Å; W190-L211 HydrophobicContact CH2-CD2 3.9Å; W190-L211 HydrophobicContact CZ2-CD2 4.26Å
191L93.9Very high94.1Very high0 Ų018.6 Ų18.60%010%0.102CC..Hα-helixtrans-70-52.2-169-172.7163.3000112.4P183 H188 L189 K193 A194 H195 L211 A262 I266P183-L191 HydrophobicContact CB-CD1 4.1Å; P183-L191 HydrophobicContact CG-CD1 3.52Å; H188-L191 WeakPolarHBondContact O-CB 3.21Å; H188-L191 PolarHBondContact O-N 2.93Å; L189-L191 VanDerWaalsContact C-N 3.29Å; L189-L191 PolarHBondContact O-N 3.32Å; L191-K193 PolarHBondContact O-N 3.26Å; L191-A194 PolarHBondContact O-N 3.13Å; L191-H195 WeakPolarHBondContact CD2-CD2 3.27Å; L191-H195 VanDerWaalsContact CG-CD2 3.47Å; L191-H195 WeakPolarHBondContact CG-CD2 3.18Å; L191-H195 PolarHBondContact O-CD2 3.11Å; L191-H195 PolarHBondContact O-N 2.97Å; L191-L211 HydrophobicContact CD1-CD1 3.92Å; L191-L211 HydrophobicContact CD1-CD2 3.52Å; L191-L211 HydrophobicContact CD1-CG 4.36Å; L191-A262 HydrophobicContact CD2-CB 3.63Å; L191-A262 WeakPolarHBondContact CD2-O 3.38Å; L191-I266 HydrophobicContact CB-CD1 4.42Å; L191-I266 HydrophobicContact CD1-CG1 3.95Å; L191-I266 HydrophobicContact CD2-CD1 4.22Å; L191-I266 HydrophobicContact CD2-CG1 4.15Å; L191-I266 HydrophobicContact CG-CG1 4.47Å
192P94.7Very high94.1Very high12 Ų1218.8 Ų18.88%0.07811%0.105CC..Hα-helixtrans-57-40.6177.9-25.735.4000111.9H188 V196 Y263 I266H188-P192 WeakPolarHBondContact O-CD 3.42Å; P192-V196 WeakPolarHBondContact O-CB 3.4Å; P192-V196 WeakPolarHBondContact O-CG2 3.31Å; P192-V196 PolarHBondContact O-N 3.09Å; P192-Y263 HydrophobicContact CB-CE2 3.96Å; P192-Y263 HydrophobicContact CG-CD1 4.27Å; P192-Y263 HydrophobicContact CG-CD2 4.35Å; P192-Y263 HydrophobicContact CG-CE1 3.75Å; P192-Y263 HydrophobicContact CG-CE2 3.83Å; P192-I266 HydrophobicContact CG-CD1 4.07Å
193K93Very high94.3Very high80 Ų8018.7 Ų18.735%0.34811%0.105SC..Hα-helixtrans-64.7-48176.6-64.1-179.9-177.51760111.9A120 Y123 W190 L191 E197A120-K193 HydrophobicContact CB-CB 4.07Å; Y123-K193 HydrophobicContact CD2-CD 3.93Å; Y123-K193 HydrophobicContact CE2-CD 4.18Å; Y123-K193 HydrophobicContact CG-CD 4.28Å; Y123-K193 PolarHBondContact OH-NZ 3.44Å; W190-K193 PolarHBondContact O-N 3.5Å; L191-K193 PolarHBondContact O-N 3.26Å; K193-E197 PolarHBondContact O-N 3.04Å; K193-E197 VanDerWaalsContact O-N 3.13Å
194A94.3Very high94.8Very high0 Ų018.6 Ų18.60%010%0.104CC..Hα-helixtrans-62.4-45.1-17900000112.1W190 L191 A198W190-A194 HydrophobicContact CE3-CB 3.97Å; W190-A194 HydrophobicContact CZ3-CB 4.26Å; W190-A194 VanDerWaalsContact O-CB 3.25Å; W190-A194 WeakPolarHBondContact O-CB 3.47Å; W190-A194 PolarHBondContact O-N 2.97Å; L191-A194 PolarHBondContact O-N 3.13Å; A194-A198 WeakPolarHBondContact O-CB 3.37Å; A194-A198 PolarHBondContact O-N 3.03Å
195H94.9Very high95Very high0 Ų018.8 Ų18.80%011%0.105CC..Hα-helixtrans-69.8-40.7179.5-83.4-85.5000113.6L191 E197 S203 L206 A207 A262 F302L191-H195 WeakPolarHBondContact CD2-CD2 3.27Å; L191-H195 VanDerWaalsContact CG-CD2 3.47Å; L191-H195 WeakPolarHBondContact CG-CD2 3.18Å; L191-H195 PolarHBondContact O-CD2 3.11Å; L191-H195 PolarHBondContact O-N 2.97Å; H195-E197 VanDerWaalsContact C-N 3.31Å; H195-S203 PolarHBondContact CE1-O 2.85Å; H195-S203 PolarHBondContact ND1-O 3Å; H195-L206 WeakPolarHBondContact CE1-CB 3.38Å; H195-A207 PolarHBondContact CE1-N 3.41Å; H195-A262 HydrophobicContact CB-CB 3.95Å; H195-F302 HydrophobicContact CB-CE1 4.09Å; H195-F302 HydrophobicContact CB-CZ 3.92Å; H195-F302 AromaticContact CE1-CE2 3.88Å; H195-F302 AromaticContact CG-CZ 3.7Å; H195-F302 AromaticContact ND1-CE1 3.89Å; H195-F302 AromaticContact ND1-CE2 3.44Å; H195-F302 WeakPolarHBondContact ND1-CE2 3.16Å; H195-F302 AromaticContact ND1-CZ 3.2Å; H195-F302 WeakPolarHBondContact ND1-CZ 3.46Å
196V93.7Very high95Very high13 Ų1316 Ų168%0.0799%0.094CC..Hα-helixtrans-66.6-38.7-177169.20000110.4P192 K258 R315P192-V196 WeakPolarHBondContact O-CB 3.4Å; P192-V196 WeakPolarHBondContact O-CG2 3.31Å; P192-V196 PolarHBondContact O-N 3.09Å; V196-K258 HydrophobicContact CG2-CB 4.12Å; V196-R315 PolarHBondContact O-NH1 2.72Å
197E94.2Very high94.9Very high14 Ų1413.8 Ų13.87%0.0657%0.071CC..Hα-helixtrans-92.8-14.4-178.4-58.1-48.815000115.9G112 Q114 E116 R117 A120 K193 H195 R315G112-E197 WeakPolarHBondContact CA-O 3.4Å; Q114-E197 WeakPolarHBondContact CB-OE2 3.43Å; Q114-E197 VanDerWaalsContact CG-OE2 3.28Å; Q114-E197 WeakPolarHBondContact CG-OE2 3.13Å; E116-E197 HydrophobicContact CB-CG 4.13Å; R117-E197 HydrophobicContact CB-CB 4.14Å; A120-E197 HydrophobicContact CB-CB 4.13Å; A120-E197 HydrophobicContact CB-CG 4.28Å; K193-E197 PolarHBondContact O-N 3.04Å; K193-E197 VanDerWaalsContact O-N 3.13Å; H195-E197 VanDerWaalsContact C-N 3.31Å; E197-R315 VanDerWaalsContact CD-NH1 3.35Å; E197-R315 IonicContact OE1-CZ 3.54Å; E197-R315 IonicContact OE1-NH1 3.28Å; E197-R315 PolarHBondContact OE1-NH1 3.31Å; E197-R315 IonicContact OE1-NH2 3.36Å; E197-R315 PolarHBondContact OE1-NH2 3.43Å; E197-R315 IonicContact OE2-NH1 2.97Å; E197-R315 PolarHBondContact OE2-NH1 3.16Å; E197-R315 VanDerWaalsContact OE2-NH1 3.11Å
198A94.8Very high94.8Very high2 Ų211.6 Ų11.62%0.0176%0.06CC..SBendtrans-66.5146.9172.300000112.4I108 A194 L206 K258I108-A198 HydrophobicContact CG1-CB 4.12Å; A194-A198 WeakPolarHBondContact O-CB 3.37Å; A194-A198 PolarHBondContact O-N 3.03Å; A198-L206 HydrophobicContact CB-CD1 4.15Å; A198-K258 PolarHBondContact O-NZ 2.85Å
199P95.3Very high94.8Very high3 Ų311.1 Ų11.12%0.0196%0.058CC..  trans-63.4164.8162.530.1-34.9000110.3Y70 I107 W111 A201 G202 S203Y70-P199 HydrophobicContact CE2-CG 4.39Å; I107-P199 HydrophobicContact CG2-CG 3.61Å; W111-P199 HydrophobicContact CB-CG 4.11Å; P199-A201 PolarHBondContact O-N 2.87Å; P199-G202 WeakPolarHBondContact O-CA 3.2Å; P199-G202 PolarHBondContact O-N 2.98Å; P199-S203 PolarHBondContact O-N 3.29Å; P199-S203 PolarHBondContact O-OG 3.17Å
200I95.9Very high94.8Very high4 Ų47.4 Ų7.42%0.0214%0.039CC..Hα-helixtrans-53.2-47.5-173.3-175.451000113.4A54 G202 S203 M204 F302 N306A54-I200 HydrophobicContact CB-CG1 3.89Å; A54-I200 HydrophobicContact CB-CG2 3.89Å; I200-G202 VanDerWaalsContact C-N 3.3Å; I200-G202 PolarHBondContact O-N 2.95Å; I200-S203 WeakPolarHBondContact CA-OG 3.33Å; I200-S203 PolarHBondContact O-N 3.32Å; I200-S203 PolarHBondContact O-OG 2.93Å; I200-M204 HydrophobicContact CD1-CG 4.02Å; I200-M204 HydrophobicContact CD1-SD 4.25Å; I200-M204 HydrophobicContact CG1-CG 4.34Å; I200-M204 HydrophobicContact CG1-SD 3.96Å; I200-M204 VanDerWaalsContact O-CG 3.25Å; I200-M204 WeakPolarHBondContact O-CG 3.46Å; I200-M204 PolarHBondContact O-N 3.01Å; I200-F302 HydrophobicContact CD1-CB 4.08Å; I200-F302 WeakPolarHBondContact CD1-O 3.48Å; I200-N306 HydrophobicContact CB-CB 4.24Å; I200-N306 HydrophobicContact CD1-CB 3.7Å; I200-N306 HydrophobicContact CG1-CB 3.83Å
201A94.1Very high94.6Very high0 Ų07.3 Ų7.30%04%0.038CC..Hα-helixtrans-60.4-40.1177.600000112.5T51 Y70 L74 P199 M204 V205T51-A201 HydrophobicContact CG2-CB 4.31Å; Y70-A201 HydrophobicContact CE1-CB 4.4Å; Y70-A201 WeakPolarHBondContact OH-CB 3.24Å; L74-A201 HydrophobicContact CD1-CB 4.12Å; L74-A201 HydrophobicContact CD2-CB 3.93Å; P199-A201 PolarHBondContact O-N 2.87Å; A201-M204 PolarHBondContact O-N 3.41Å; A201-V205 WeakPolarHBondContact O-CG2 3.48Å; A201-V205 PolarHBondContact O-N 2.99Å
202G94.3Very high94.8Very high6 Ų67.3 Ų7.36%0.0624%0.038CC..Hα-helixtrans-61.1-50.3176.100000110.8P199 I200 M204 V205 L206P199-G202 WeakPolarHBondContact O-CA 3.2Å; P199-G202 PolarHBondContact O-N 2.98Å; I200-G202 VanDerWaalsContact C-N 3.3Å; I200-G202 PolarHBondContact O-N 2.95Å; G202-M204 VanDerWaalsContact C-N 3.3Å; G202-M204 PolarHBondContact O-N 3.45Å; G202-V205 PolarHBondContact O-N 3.49Å; G202-L206 VanDerWaalsContact O-CB 3.26Å; G202-L206 WeakPolarHBondContact O-CB 2.83Å; G202-L206 WeakPolarHBondContact O-CD1 3.37Å; G202-L206 WeakPolarHBondContact O-CG 3.2Å; G202-L206 PolarHBondContact O-N 2.72Å
203S95.5Very high94.8Very high0 Ų06.8 Ų6.80%04%0.035CC..Hα-helixtrans-60.7-36.6177.8570000113.2H195 P199 I200 A207H195-S203 PolarHBondContact CE1-O 2.85Å; H195-S203 PolarHBondContact ND1-O 3Å; P199-S203 PolarHBondContact O-N 3.29Å; P199-S203 PolarHBondContact O-OG 3.17Å; I200-S203 WeakPolarHBondContact CA-OG 3.33Å; I200-S203 PolarHBondContact O-N 3.32Å; I200-S203 PolarHBondContact O-OG 2.93Å; S203-A207 VanDerWaalsContact O-CB 3.27Å; S203-A207 WeakPolarHBondContact O-CB 3.46Å; S203-A207 PolarHBondContact O-N 3.29Å
204M96.9Very high94.9Very high0 Ų03 Ų30%02%0.018CC..Hα-helixtrans-65.9-50.9176-68.4166.976.900111.5L47 L50 T51 A54 I200 A201 G202 A207 A208 C303 H415L47-M204 HydrophobicContact CD1-CE 4.35Å; L50-M204 HydrophobicContact CB-CE 3.87Å; T51-M204 HydrophobicContact CG2-CB 3.91Å; T51-M204 HydrophobicContact CG2-CE 3.95Å; T51-M204 HydrophobicContact CG2-SD 3.96Å; A54-M204 HydrophobicContact CB-CE 4.41Å; A54-M204 HydrophobicContact CB-SD 3.6Å; A54-M204 VanDerWaalsContact CB-SD 3.6Å; I200-M204 HydrophobicContact CD1-CG 4.02Å; I200-M204 HydrophobicContact CD1-SD 4.25Å; I200-M204 HydrophobicContact CG1-CG 4.34Å; I200-M204 HydrophobicContact CG1-SD 3.96Å; I200-M204 VanDerWaalsContact O-CG 3.25Å; I200-M204 WeakPolarHBondContact O-CG 3.46Å; I200-M204 PolarHBondContact O-N 3.01Å; A201-M204 PolarHBondContact O-N 3.41Å; G202-M204 VanDerWaalsContact C-N 3.3Å; G202-M204 PolarHBondContact O-N 3.45Å; M204-A207 PolarHBondContact O-N 2.98Å; M204-A208 WeakPolarHBondContact O-CB 3.2Å; M204-A208 PolarHBondContact O-N 3.12Å; M204-C303 VanDerWaalsContact CE-SG 3.53Å; M204-C303 PolarHBondContact SD-SG 2.73Å; M204-H415 WeakPolarHBondContact CE-NE2 2.97Å
205V96.6Very high95Very high12 Ų123 Ų37%0.0732%0.018CC..Hα-helixtrans-67.4-39.4-178.6-178.40000111.3L47 T51 L77 L81 A201 G202 V209 L210L47-V205 HydrophobicContact CD2-CB 4.29Å; L47-V205 HydrophobicContact CD2-CG2 3.93Å; T51-V205 HydrophobicContact CG2-CG2 3.77Å; L77-V205 HydrophobicContact CD2-CB 4.15Å; L77-V205 HydrophobicContact CD2-CG1 3.53Å; L77-V205 HydrophobicContact CD2-CG2 4.35Å; L77-V205 HydrophobicContact CG-CG1 4.14Å; L81-V205 HydrophobicContact CD1-CG1 3.96Å; A201-V205 WeakPolarHBondContact O-CG2 3.48Å; A201-V205 PolarHBondContact O-N 2.99Å; G202-V205 PolarHBondContact O-N 3.49Å; V205-V209 PolarHBondContact O-N 3.34Å; V205-L210 HydrophobicContact CG1-CD1 4.47Å; V205-L210 HydrophobicContact CG1-CG 4.36Å; V205-L210 PolarHBondContact O-N 3.48Å; V205-L210 VanDerWaalsContact O-N 3.11Å
206L93.9Very high95.1Very high2 Ų23 Ų31%0.012%0.018CC..Iπ-helixtrans-54.5-53.4171.5-81.8155000110.9I108 F124 W190 H195 A198 G202 L210 L211I108-L206 HydrophobicContact CD1-CD1 4.1Å; I108-L206 HydrophobicContact CG1-CD1 4.48Å; F124-L206 HydrophobicContact CE2-CD2 4Å; F124-L206 HydrophobicContact CZ-CD2 4.36Å; W190-L206 HydrophobicContact CZ3-CD2 4.14Å; H195-L206 WeakPolarHBondContact CE1-CB 3.38Å; A198-L206 HydrophobicContact CB-CD1 4.15Å; G202-L206 VanDerWaalsContact O-CB 3.26Å; G202-L206 WeakPolarHBondContact O-CB 2.83Å; G202-L206 WeakPolarHBondContact O-CD1 3.37Å; G202-L206 WeakPolarHBondContact O-CG 3.2Å; G202-L206 PolarHBondContact O-N 2.72Å; L206-L210 HydrophobicContact CB-CD1 4.42Å; L206-L210 HydrophobicContact CD2-CD1 3.67Å; L206-L210 HydrophobicContact CG-CD1 3.85Å; L206-L210 PolarHBondContact O-N 3.44Å; L206-L211 WeakPolarHBondContact O-CG 3.39Å; L206-L211 PolarHBondContact O-N 3.43Å
207A92.1Very high95.1Very high0 Ų02.4 Ų2.40%02%0.015CC..Iπ-helixtrans-70.1-48-173.900000111.3H195 S203 M204 K212 F302H195-A207 PolarHBondContact CE1-N 3.41Å; S203-A207 VanDerWaalsContact O-CB 3.27Å; S203-A207 WeakPolarHBondContact O-CB 3.46Å; S203-A207 PolarHBondContact O-N 3.29Å; M204-A207 PolarHBondContact O-N 2.98Å; A207-K212 PolarHBondContact O-NZ 3.37Å; A207-F302 HydrophobicContact CB-CD2 3.84Å; A207-F302 HydrophobicContact CB-CE2 3.68Å
208A94.3Very high95.2Very high0 Ų02 Ų20%01%0.013CC..Iπ-helixtrans-75.3-39.3-170.400000113L43 L47 M204 K212 G295L43-A208 VanDerWaalsContact CD2-O 3.3Å; L43-A208 WeakPolarHBondContact CD2-O 3.25Å; L47-A208 HydrophobicContact CD1-CB 3.95Å; L47-A208 HydrophobicContact CD2-CB 3.59Å; L47-A208 HydrophobicContact CG-CB 4.41Å; M204-A208 WeakPolarHBondContact O-CB 3.2Å; M204-A208 PolarHBondContact O-N 3.12Å; A208-K212 WeakPolarHBondContact O-CD 3.1Å; A208-K212 WeakPolarHBondContact O-CE 3.15Å; A208-G295 WeakPolarHBondContact CB-O 3.35Å
209V96.1Very high95.1Very high3 Ų32.4 Ų2.42%0.0182%0.015CC..Iπ-helixtrans-123.1-46.6-168.4-173.60000113.4T44 L47 L81 F85 V205 L211 K212 L213T44-V209 HydrophobicContact CG2-CB 4.36Å; T44-V209 HydrophobicContact CG2-CG1 3.44Å; T44-V209 VanDerWaalsContact CG2-CG1 3.44Å; T44-V209 HydrophobicContact CG2-CG2 3.92Å; L47-V209 HydrophobicContact CD2-CG2 4.12Å; L81-V209 HydrophobicContact CD1-CB 4.33Å; L81-V209 HydrophobicContact CD1-CG1 3.91Å; L81-V209 HydrophobicContact CD2-CG1 3.69Å; L81-V209 HydrophobicContact CG-CG1 4.3Å; F85-V209 HydrophobicContact CE2-CG1 3.66Å; F85-V209 HydrophobicContact CZ-CG1 3.9Å; V205-V209 PolarHBondContact O-N 3.34Å; V209-L211 VanDerWaalsContact C-N 3.3Å; V209-L211 PolarHBondContact O-N 2.91Å; V209-K212 WeakPolarHBondContact O-CA 3.21Å; V209-K212 WeakPolarHBondContact O-CB 3.41Å; V209-K212 PolarHBondContact O-N 2.94Å; V209-L213 PolarHBondContact O-N 2.65Å
210L95.3Very high95Very high3 Ų33.4 Ų3.42%0.0162%0.018CC..Iπ-helixtrans-64.9-33.7-171.1-66.5171.2000113.2L81 T104 V205 L206 K212 L213L81-L210 HydrophobicContact CD2-CD2 4Å; T104-L210 HydrophobicContact CG2-CD1 3.39Å; T104-L210 HydrophobicContact CG2-CD2 4.36Å; T104-L210 HydrophobicContact CG2-CG 4.49Å; V205-L210 HydrophobicContact CG1-CD1 4.47Å; V205-L210 HydrophobicContact CG1-CG 4.36Å; V205-L210 PolarHBondContact O-N 3.48Å; V205-L210 VanDerWaalsContact O-N 3.11Å; L206-L210 HydrophobicContact CB-CD1 4.42Å; L206-L210 HydrophobicContact CD2-CD1 3.67Å; L206-L210 HydrophobicContact CG-CD1 3.85Å; L206-L210 PolarHBondContact O-N 3.44Å; L210-K212 VanDerWaalsContact C-N 3.26Å; L210-K212 PolarHBondContact O-N 3.22Å; L210-L213 HydrophobicContact CD2-CD1 3.78Å; L210-L213 WeakPolarHBondContact O-CB 3.4Å; L210-L213 PolarHBondContact O-N 3.05Å
211L93.5Very high94.7Very high0 Ų03.4 Ų3.40%02%0.018CC..Hα-helixtrans-65.8-31.8172.9-57.3178000112K181 M182 W190 L191 L206 V209 L213 G214 M269K181-L211 WeakPolarHBondContact O-CD2 3.49Å; M182-L211 WeakPolarHBondContact CG-O 3.45Å; W190-L211 HydrophobicContact CH2-CD2 3.9Å; W190-L211 HydrophobicContact CZ2-CD2 4.26Å; L191-L211 HydrophobicContact CD1-CD1 3.92Å; L191-L211 HydrophobicContact CD1-CD2 3.52Å; L191-L211 HydrophobicContact CD1-CG 4.36Å; L206-L211 WeakPolarHBondContact O-CG 3.39Å; L206-L211 PolarHBondContact O-N 3.43Å; V209-L211 VanDerWaalsContact C-N 3.3Å; V209-L211 PolarHBondContact O-N 2.91Å; L211-L213 VanDerWaalsContact C-N 3.34Å; L211-G214 PolarHBondContact O-N 3.18Å; L211-M269 HydrophobicContact CB-CG 4.29Å; L211-M269 HydrophobicContact CB-SD 4.22Å; L211-M269 HydrophobicContact CD1-CG 4.15Å
212K97.1Very high94.4Very high0 Ų04 Ų40%02%0.022CC..Hα-helixtrans-77-23.7-176.5-74.358.1168.4176.80111.8L40 A207 A208 V209 L210 G214 G215 Y216 M269 M291 H294L40-K212 HydrophobicContact CD2-CB 3.9Å; L40-K212 HydrophobicContact CD2-CG 4.16Å; A207-K212 PolarHBondContact O-NZ 3.37Å; A208-K212 WeakPolarHBondContact O-CD 3.1Å; A208-K212 WeakPolarHBondContact O-CE 3.15Å; V209-K212 WeakPolarHBondContact O-CA 3.21Å; V209-K212 WeakPolarHBondContact O-CB 3.41Å; V209-K212 PolarHBondContact O-N 2.94Å; L210-K212 VanDerWaalsContact C-N 3.26Å; L210-K212 PolarHBondContact O-N 3.22Å; K212-G214 PolarHBondContact O-N 3.31Å; K212-G215 PolarHBondContact O-N 3.49Å; K212-G215 VanDerWaalsContact O-N 3.14Å; K212-Y216 WeakPolarHBondContact O-CB 3.08Å; K212-Y216 PolarHBondContact O-N 3.34Å; K212-M269 HydrophobicContact CD-SD 4.23Å; K212-M291 HydrophobicContact CB-SD 4.19Å; K212-M291 WeakPolarHBondContact CE-O 3.31Å; K212-M291 HydrophobicContact CG-CB 3.76Å; K212-M291 HydrophobicContact CG-CG 3.91Å; K212-M291 HydrophobicContact CG-SD 4.07Å; K212-H294 PolarHBondContact NZ-CD2 3.3Å; K212-H294 VanDerWaalsContact NZ-CD2 3.34Å
213L95.4Very high94Very high0 Ų07.3 Ų7.30%04%0.038CC..Hα-helixtrans-56.5-36.3169.9-71.6172.9000112L81 T84 F85 F97 T100 V209 L210 L211 G217L81-L213 HydrophobicContact CD2-CD1 3.71Å; L81-L213 HydrophobicContact CD2-CD2 4.19Å; L81-L213 HydrophobicContact CD2-CG 4.16Å; T84-L213 HydrophobicContact CG2-CD2 4.35Å; T84-L213 VanDerWaalsContact OG1-CD2 3.29Å; T84-L213 WeakPolarHBondContact OG1-CD2 3.25Å; F85-L213 HydrophobicContact CD1-CD2 4.35Å; F85-L213 HydrophobicContact CE1-CD2 3.64Å; F85-L213 HydrophobicContact CE1-CG 4.49Å; F85-L213 HydrophobicContact CE2-CD2 3.95Å; F85-L213 HydrophobicContact CZ-CD2 3.41Å; F85-L213 VanDerWaalsContact CZ-CD2 3.41Å; F85-L213 HydrophobicContact CZ-CG 4.03Å; F97-L213 HydrophobicContact CD2-CB 4.24Å; F97-L213 HydrophobicContact CD2-CD1 4.4Å; F97-L213 HydrophobicContact CE2-CB 4.3Å; T100-L213 HydrophobicContact CG2-CD1 4.28Å; V209-L213 PolarHBondContact O-N 2.65Å; L210-L213 HydrophobicContact CD2-CD1 3.78Å; L210-L213 WeakPolarHBondContact O-CB 3.4Å; L210-L213 PolarHBondContact O-N 3.05Å; L211-L213 VanDerWaalsContact C-N 3.34Å; L213-G217 PolarHBondContact O-N 3.48Å
214G95.5Very high93.6Very high0 Ų07.9 Ų7.90%04%0.04CC..Hα-helixtrans-64.3-47.4175.300000111.6F178 L211 K212 G217 M218F178-G214 WeakPolarHBondContact CB-O 3.46Å; L211-G214 PolarHBondContact O-N 3.18Å; K212-G214 PolarHBondContact O-N 3.31Å; G214-G217 PolarHBondContact O-N 3Å; G214-M218 WeakPolarHBondContact O-CB 3.34Å; G214-M218 PolarHBondContact O-N 2.95Å
215G95.8Very high93.3Very high0 Ų08 Ų80%04%0.041CC..Hα-helixtrans-63.3-44.7178.100000112.5M182 K212 M218 M219M182-G215 WeakPolarHBondContact SD-CA 3.11Å; M182-G215 PolarHBondContact SD-N 3.38Å; K212-G215 PolarHBondContact O-N 3.49Å; K212-G215 VanDerWaalsContact O-N 3.14Å; G215-M218 PolarHBondContact O-N 3.23Å; G215-M219 WeakPolarHBondContact O-CG 3.4Å; G215-M219 PolarHBondContact O-N 3.17Å
216Y95.8Very high92.9Very high1 Ų110.2 Ų10.20%0.0045%0.052CC..Hα-helixtrans-57.4-51.9174.9176-106.1000112.3L36 T37 L40 F85 F93 K212 M218 M219 R220L36-Y216 HydrophobicContact CD2-CD2 3.73Å; L36-Y216 HydrophobicContact CD2-CE2 3.79Å; L36-Y216 HydrophobicContact CG-CD2 3.91Å; L36-Y216 HydrophobicContact CG-CE2 4.09Å; T37-Y216 HydrophobicContact CG2-CD2 4.38Å; T37-Y216 HydrophobicContact CG2-CE2 3.35Å; T37-Y216 WeakPolarHBondContact CG2-OH 3.49Å; L40-Y216 HydrophobicContact CD1-CD2 3.92Å; L40-Y216 HydrophobicContact CD1-CG 4.25Å; F85-Y216 AromaticContact CD1-CD1 3.78Å; F85-Y216 HydrophobicContact CD1-CD1 3.78Å; F85-Y216 HydrophobicContact CD1-CD2 4.07Å; F85-Y216 HydrophobicContact CD1-CE1 4.13Å; F85-Y216 HydrophobicContact CD1-CE2 4.44Å; F85-Y216 AromaticContact CD1-CG 3.74Å; F85-Y216 HydrophobicContact CD1-CG 3.74Å; F85-Y216 HydrophobicContact CE1-CD1 4.08Å; F85-Y216 HydrophobicContact CE1-CD2 4.47Å; F85-Y216 AromaticContact CE1-CG 3.87Å; F85-Y216 HydrophobicContact CE1-CG 3.87Å; F85-Y216 PolarHBondContact O-OH 2.74Å; F93-Y216 HydrophobicContact CD2-CD1 4.29Å; F93-Y216 AromaticContact CD2-CE1 3.86Å; F93-Y216 HydrophobicContact CD2-CE1 3.86Å; F93-Y216 AromaticContact CE2-CD1 3.59Å; F93-Y216 HydrophobicContact CE2-CD1 3.59Å; F93-Y216 AromaticContact CE2-CE1 3.65Å; F93-Y216 HydrophobicContact CE2-CE1 3.65Å; F93-Y216 HydrophobicContact CZ-CD1 4.27Å; K212-Y216 WeakPolarHBondContact O-CB 3.08Å; K212-Y216 PolarHBondContact O-N 3.34Å; Y216-M218 VanDerWaalsContact C-N 3.32Å; Y216-M218 PolarHBondContact O-N 2.97Å; Y216-M219 PolarHBondContact O-N 2.93Å; Y216-R220 HydrophobicContact CE1-CG 4.16Å; Y216-R220 HydrophobicContact CE2-CG 3.98Å; Y216-R220 WeakPolarHBondContact O-CG 3.37Å; Y216-R220 PolarHBondContact O-N 3.31Å; Y216-R220 PolarHBondContact OH-NE 2.91Å; Y216-R220 PolarHBondContact OH-NH2 3.42Å
217G95.7Very high92.8Very high0 Ų012.3 Ų12.30%07%0.066CC..Hα-helixtrans-61.7-40.6179.200000112.4L213 G214 R220 L221L213-G217 PolarHBondContact O-N 3.48Å; G214-G217 PolarHBondContact O-N 3Å; G217-R220 PolarHBondContact O-N 2.9Å; G217-L221 WeakPolarHBondContact O-CG 3.46Å; G217-L221 PolarHBondContact O-N 3.31Å
218M94.9Very high92.8Very high6 Ų612.5 Ų12.53%0.037%0.067CC..Hα-helixtrans-66.6-41.4178.5-161.215913500112.1F178 M179 M182 G214 G215 Y216 L221 T222 I276 L277F178-M218 HydrophobicContact CB-CB 4.21Å; F178-M218 HydrophobicContact CD2-CB 4.43Å; F178-M218 HydrophobicContact CG-CB 4.45Å; M179-M218 HydrophobicContact CE-CE 3.45Å; M179-M218 VanDerWaalsContact CE-CE 3.45Å; M179-M218 HydrophobicContact CE-SD 3.67Å; M179-M218 HydrophobicContact SD-CE 4.44Å; M179-M218 HydrophobicContact SD-SD 4.15Å; M182-M218 HydrophobicContact CE-CB 4.01Å; M182-M218 HydrophobicContact CE-CG 4.44Å; M182-M218 HydrophobicContact CE-SD 3.56Å; M182-M218 VanDerWaalsContact CE-SD 3.56Å; G214-M218 WeakPolarHBondContact O-CB 3.34Å; G214-M218 PolarHBondContact O-N 2.95Å; G215-M218 PolarHBondContact O-N 3.23Å; Y216-M218 VanDerWaalsContact C-N 3.32Å; Y216-M218 PolarHBondContact O-N 2.97Å; M218-L221 PolarHBondContact O-N 2.94Å; M218-T222 WeakPolarHBondContact O-CG2 3.33Å; M218-T222 PolarHBondContact O-N 3.21Å; M218-T222 VanDerWaalsContact O-N 3.16Å; M218-I276 HydrophobicContact CB-CG2 4.06Å; M218-I276 HydrophobicContact CE-CB 4.06Å; M218-I276 HydrophobicContact CE-CG2 3.69Å; M218-I276 HydrophobicContact CG-CG2 3.71Å; M218-I276 HydrophobicContact SD-CG2 4.35Å; M218-L277 HydrophobicContact CE-CD1 4.48Å; M218-L277 HydrophobicContact CE-CD2 3.43Å; M218-L277 VanDerWaalsContact CE-CD2 3.43Å; M218-L277 HydrophobicContact CE-CG 3.54Å
219M93.9Very high92.7Very high11 Ų1112.7 Ų12.75%0.0547%0.068CC..Hα-helixtrans-59.9-45172.9-74.2-179.5179.800111.8L36 G215 Y216 L221 T222 I276 F284 A287 V288 M291L36-M219 HydrophobicContact CD1-SD 3.43Å; L36-M219 WeakPolarHBondContact CD1-SD 3.43Å; L36-M219 HydrophobicContact CD2-CB 4.03Å; L36-M219 HydrophobicContact CD2-SD 4.2Å; L36-M219 HydrophobicContact CG-SD 4.48Å; G215-M219 WeakPolarHBondContact O-CG 3.4Å; G215-M219 PolarHBondContact O-N 3.17Å; Y216-M219 PolarHBondContact O-N 2.93Å; M219-L221 VanDerWaalsContact C-N 3.34Å; M219-L221 PolarHBondContact O-N 2.98Å; M219-T222 PolarHBondContact O-N 3.41Å; M219-T222 PolarHBondContact O-OG1 3.05Å; M219-I276 HydrophobicContact CE-CD1 3.92Å; M219-I276 HydrophobicContact CE-CG1 3.64Å; M219-I276 HydrophobicContact CG-CD1 4.1Å; M219-I276 HydrophobicContact CG-CG1 4.02Å; M219-I276 HydrophobicContact CG-CG2 4.24Å; M219-F284 HydrophobicContact CE-CD1 4.13Å; M219-F284 HydrophobicContact CG-CD1 4.18Å; M219-F284 HydrophobicContact CG-CE1 4.29Å; M219-A287 HydrophobicContact CE-CB 3.37Å; M219-V288 HydrophobicContact CE-CG2 3.84Å; M219-V288 HydrophobicContact SD-CG2 3.96Å; M219-M291 HydrophobicContact CE-CE 3.72Å; M219-M291 HydrophobicContact SD-CE 4.13Å
220R91.9Very high92.4Very high23 Ų2319.5 Ų19.59%0.08710%0.098CC..Hα-helixtrans-62.3-38177.8-71.3-60.5-166.7-158.8-5.8113.3D34 I151 Y216 G217D34-R220 IonicContact OD1-CZ 2.83Å; D34-R220 IonicContact OD1-NH2 3.01Å; D34-R220 PolarHBondContact OD1-NH2 3.37Å; D34-R220 IonicContact OD2-CZ 3.88Å; D34-R220 IonicContact OD2-NH1 3.91Å; D34-R220 PolarHBondContact OD2-NH1 2.98Å; D34-R220 IonicContact OD2-NH2 3Å; D34-R220 PolarHBondContact OD2-NH2 3.29Å; I151-R220 HydrophobicContact CD1-CG 4.4Å; Y216-R220 HydrophobicContact CE1-CG 4.16Å; Y216-R220 HydrophobicContact CE2-CG 3.98Å; Y216-R220 WeakPolarHBondContact O-CG 3.37Å; Y216-R220 PolarHBondContact O-N 3.31Å; Y216-R220 PolarHBondContact OH-NE 2.91Å; Y216-R220 PolarHBondContact OH-NH2 3.42Å; G217-R220 PolarHBondContact O-N 2.9Å
221L91.1Very high92.2Very high4 Ų425.4 Ų25.42%0.02113%0.125CC..Hα-helixtrans-80.4-14.5-179.7-69.1-161.4000114.4L90 L135 Y174 F178 G217 M218 M219 L223 I224 L225L90-L221 HydrophobicContact CD1-CD2 3.68Å; L90-L221 HydrophobicContact CD2-CD2 3.96Å; L90-L221 HydrophobicContact CG-CD2 4.45Å; L135-L221 HydrophobicContact CD1-CD1 3.98Å; Y174-L221 HydrophobicContact CD1-CD1 3.44Å; Y174-L221 VanDerWaalsContact CD1-CD1 3.44Å; Y174-L221 HydrophobicContact CE1-CD1 4.38Å; Y174-L221 HydrophobicContact CG-CD1 3.88Å; F178-L221 HydrophobicContact CD2-CD1 4.37Å; F178-L221 HydrophobicContact CE2-CD1 3.48Å; F178-L221 VanDerWaalsContact CE2-CD1 3.48Å; F178-L221 HydrophobicContact CE2-CG 4.02Å; F178-L221 HydrophobicContact CZ-CD1 4.29Å; G217-L221 WeakPolarHBondContact O-CG 3.46Å; G217-L221 PolarHBondContact O-N 3.31Å; M218-L221 PolarHBondContact O-N 2.94Å; M219-L221 VanDerWaalsContact C-N 3.34Å; M219-L221 PolarHBondContact O-N 2.98Å; L221-L223 PolarHBondContact O-N 3.27Å; L221-I224 HydrophobicContact CD2-CD1 4.05Å; L221-I224 PolarHBondContact O-N 2.9Å; L221-L225 HydrophobicContact CB-CD1 4.07Å; L221-L225 HydrophobicContact CB-CG 4.49Å; L221-L225 WeakPolarHBondContact O-CG 3.24Å; L221-L225 PolarHBondContact O-N 3.4Å
222T87.2Confident92.3Very high14 Ų1427.1 Ų27.19%0.08613%0.133CC..Hα-helixtrans-54.1-32.6-179.858.60000113.2M218 M219 I224 L225 N226 I276 Q279 F284M218-T222 WeakPolarHBondContact O-CG2 3.33Å; M218-T222 PolarHBondContact O-N 3.21Å; M218-T222 VanDerWaalsContact O-N 3.16Å; M219-T222 PolarHBondContact O-N 3.41Å; M219-T222 PolarHBondContact O-OG1 3.05Å; T222-I224 VanDerWaalsContact C-N 3.33Å; T222-I224 PolarHBondContact O-N 2.98Å; T222-L225 PolarHBondContact O-N 2.68Å; T222-N226 PolarHBondContact O-N 2.85Å; T222-N226 PolarHBondContact O-ND2 3.32Å; T222-N226 PolarHBondContact O-OD1 3.03Å; T222-I276 HydrophobicContact CG2-CG2 4.35Å; T222-Q279 HydrophobicContact CG2-CG 4.34Å; T222-F284 HydrophobicContact CG2-CE1 4.3Å; T222-F284 HydrophobicContact CG2-CZ 3.99Å
223L84.8Confident92.2Very high75 Ų7527.3 Ų27.339%0.39314%0.135SC..Hα-helixtrans-59.4-39.9176.9-65.8168.7000113T155 L221T155-L223 HydrophobicContact CG2-CD1 3.61Å; L221-L223 PolarHBondContact O-N 3.27Å
224I88.2Confident92.2Very high11 Ų1133.2 Ų33.26%0.05616%0.158CC..Hα-helixtrans-80-31.1-179.9-63.4161.9000110.8L90 L154 L161 Y174 L221 T222 N226L90-I224 HydrophobicContact CD1-CD1 3.69Å; L154-I224 HydrophobicContact CD1-CD1 4Å; L154-I224 HydrophobicContact CD2-CD1 4.27Å; L154-I224 HydrophobicContact CD2-CG1 4.3Å; L161-I224 VanDerWaalsContact CD1-O 3.26Å; L161-I224 WeakPolarHBondContact CD1-O 3.47Å; L161-I224 WeakPolarHBondContact CG-O 3.19Å; Y174-I224 HydrophobicContact CE2-CG2 4.27Å; L221-I224 HydrophobicContact CD2-CD1 4.05Å; L221-I224 PolarHBondContact O-N 2.9Å; T222-I224 VanDerWaalsContact C-N 3.33Å; T222-I224 PolarHBondContact O-N 2.98Å; I224-N226 PolarHBondContact O-N 3.36Å
225L90.1Very high92.2Very high4 Ų436.8 Ų36.82%0.02118%0.181CC..Hα-helixtrans-83.4-11.3-168.7-63.5172.8000114.2L161 W171 Y174 T175 L221 T222 L228 T229L161-L225 HydrophobicContact CD1-CD2 4.42Å; W171-L225 HydrophobicContact CB-CD2 4.31Å; W171-L225 HydrophobicContact CG-CD2 4.09Å; Y174-L225 HydrophobicContact CD2-CD2 3.54Å; Y174-L225 HydrophobicContact CG-CD2 3.94Å; T175-L225 HydrophobicContact CG2-CD1 3.7Å; L221-L225 HydrophobicContact CB-CD1 4.07Å; L221-L225 HydrophobicContact CB-CG 4.49Å; L221-L225 WeakPolarHBondContact O-CG 3.24Å; L221-L225 PolarHBondContact O-N 3.4Å; T222-L225 PolarHBondContact O-N 2.68Å; L225-L228 WeakPolarHBondContact O-CB 3.23Å; L225-L228 PolarHBondContact O-N 3.45Å; L225-T229 HydrophobicContact CB-CG2 3.45Å; L225-T229 VanDerWaalsContact CB-CG2 3.45Å; L225-T229 WeakPolarHBondContact O-CG2 3.33Å; L225-T229 PolarHBondContact O-N 3.09Å
226N88.6Confident92.3Very high57 Ų5737.8 Ų37.831%0.30519%0.186SC..THydrogen-bonded Turntrans-78.4147-178.7-70-12.9000111.6L161 T222 I224 T229 Q279L161-N226 PolarHBondContact N-O 2.92Å; T222-N226 PolarHBondContact O-N 2.85Å; T222-N226 PolarHBondContact O-ND2 3.32Å; T222-N226 PolarHBondContact O-OD1 3.03Å; I224-N226 PolarHBondContact O-N 3.36Å; N226-T229 PolarHBondContact OD1-OG1 2.95Å; N226-Q279 PolarHBondContact OD1-NE2 3.33Å; N226-Q279 VanDerWaalsContact OD1-NE2 3.17Å; N226-Q279 PolarHBondContact OD1-OE1 3.02Å
227P90.9Very high92.3Very high46 Ų4638 Ų3830%0.29919%0.187SC..THydrogen-bonded Turncis-87.51.4-3.135-36.6000114.8T229 K230P227-T229 PolarHBondContact O-N 3.24Å; P227-T229 VanDerWaalsContact O-N 3.13Å; P227-K230 WeakPolarHBondContact O-CB 3.11Å; P227-K230 PolarHBondContact O-N 3.48Å; P227-K230 VanDerWaalsContact O-N 3.07Å
228L92.4Very high92.3Very high4 Ų442.7 Ų42.72%0.02122%0.215CC..THydrogen-bonded Turntrans-57.2-30.8-173.5-160.893.7000113.7L161 S162 N163 N167 N168 W171 L225 K230 H231 M232L161-L228 HydrophobicContact CB-CB 4.12Å; S162-L228 WeakPolarHBondContact O-CD1 3.22Å; N163-L228 HydrophobicContact CB-CD1 4.44Å; N167-L228 HydrophobicContact CB-CD1 4.34Å; N167-L228 HydrophobicContact CB-CD2 4.47Å; N167-L228 WeakPolarHBondContact O-CD2 3.37Å; N168-L228 WeakPolarHBondContact OD1-CD1 3.48Å; W171-L228 HydrophobicContact CB-CD2 3.46Å; W171-L228 VanDerWaalsContact CB-CD2 3.46Å; W171-L228 HydrophobicContact CG-CD2 3.81Å; L225-L228 WeakPolarHBondContact O-CB 3.23Å; L225-L228 PolarHBondContact O-N 3.45Å; L228-K230 PolarHBondContact O-N 3.34Å; L228-K230 VanDerWaalsContact O-N 3.15Å; L228-H231 PolarHBondContact O-N 3.14Å; L228-M232 HydrophobicContact CD2-CG 3.78Å; L228-M232 HydrophobicContact CG-CG 3.98Å; L228-M232 PolarHBondContact O-N 3.4Å
229T92.6Very high92.4Very high4 Ų445.6 Ų45.63%0.02523%0.231CC..Hα-helixtrans-47.3-39.1173.448.80000113L225 N226 P227 H231 M232 A233 Q279L225-T229 HydrophobicContact CB-CG2 3.45Å; L225-T229 VanDerWaalsContact CB-CG2 3.45Å; L225-T229 WeakPolarHBondContact O-CG2 3.33Å; L225-T229 PolarHBondContact O-N 3.09Å; N226-T229 PolarHBondContact OD1-OG1 2.95Å; P227-T229 PolarHBondContact O-N 3.24Å; P227-T229 VanDerWaalsContact O-N 3.13Å; T229-H231 PolarHBondContact O-N 3.23Å; T229-H231 VanDerWaalsContact O-N 3.14Å; T229-M232 PolarHBondContact O-N 2.84Å; T229-A233 WeakPolarHBondContact O-CB 3.07Å; T229-A233 PolarHBondContact O-N 2.97Å; T229-Q279 PolarHBondContact OG1-OE1 3.15Å
230K89.6Confident92.6Very high146 Ų14645.1 Ų45.164%0.63523%0.228SC*.Hα-helixtrans-59.2-28.2-179-66.6179.6179.1175.70113.1P227 L228 Y234P227-K230 WeakPolarHBondContact O-CB 3.11Å; P227-K230 PolarHBondContact O-N 3.48Å; P227-K230 VanDerWaalsContact O-N 3.07Å; L228-K230 PolarHBondContact O-N 3.34Å; L228-K230 VanDerWaalsContact O-N 3.15Å; K230-Y234 WeakPolarHBondContact O-CE2 3.36Å
231H91.3Very high92.8Very high127 Ų12744.6 Ų44.659%0.58823%0.227SC*.Hα-helixtrans-100.1-38.4178-60.7-60.5000112.3L228 T229 Y234L228-H231 PolarHBondContact O-N 3.14Å; T229-H231 PolarHBondContact O-N 3.23Å; T229-H231 VanDerWaalsContact O-N 3.14Å; H231-Y234 WeakPolarHBondContact O-CD2 3.4Å
232M95Very high93.1Very high36 Ų3650.9 Ų50.918%0.17725%0.251CS..Hα-helixtrans-79-19.4-175.8-68.2-63.2-70.900113.8N168 W171 L172 L228 T229 Y234 P235N168-M232 HydrophobicContact CB-CE 3.95Å; N168-M232 HydrophobicContact CB-SD 4.06Å; W171-M232 HydrophobicContact CD2-CB 3.6Å; W171-M232 HydrophobicContact CD2-CG 4.16Å; W171-M232 HydrophobicContact CE3-CB 3.72Å; W171-M232 HydrophobicContact CE3-CE 4.03Å; W171-M232 HydrophobicContact CE3-CG 4.33Å; W171-M232 HydrophobicContact CG-CB 4.19Å; W171-M232 HydrophobicContact CG-CG 4.31Å; W171-M232 HydrophobicContact CH2-CB 4.04Å; W171-M232 HydrophobicContact CZ2-CB 3.9Å; W171-M232 HydrophobicContact CZ3-CB 3.96Å; L172-M232 HydrophobicContact CD1-CE 4.3Å; L172-M232 HydrophobicContact CG-CE 4.1Å; L228-M232 HydrophobicContact CD2-CG 3.78Å; L228-M232 HydrophobicContact CG-CG 3.98Å; L228-M232 PolarHBondContact O-N 3.4Å; T229-M232 PolarHBondContact O-N 2.84Å; M232-Y234 PolarHBondContact O-N 3Å; M232-P235 WeakPolarHBondContact O-CD 3.46Å
233A95.2Very high93.6Very high4 Ų450.2 Ų50.23%0.03325%0.247CC..THydrogen-bonded Turntrans-69.3-26.5-17700000114.4T229 F236 L237 L277T229-A233 WeakPolarHBondContact O-CB 3.07Å; T229-A233 PolarHBondContact O-N 2.97Å; A233-F236 PolarHBondContact O-N 3.26Å; A233-F236 VanDerWaalsContact O-N 3.1Å; A233-L237 HydrophobicContact CB-CD1 4.02Å; A233-L237 HydrophobicContact CB-CG 4.39Å; A233-L237 PolarHBondContact O-N 3.5Å; A233-L277 HydrophobicContact CB-CB 4.19Å; A233-L277 HydrophobicContact CB-CD2 3.98Å; A233-L277 HydrophobicContact CB-CG 4.48Å
234Y95.4Very high94.2Very high124 Ų12446.7 Ų46.749%0.48623%0.228SC..Hα-helixtrans-54.3-48.6-169.4-73.8-79.5000114.9K230 H231 M232 F236 L237 V238 W363K230-Y234 WeakPolarHBondContact O-CE2 3.36Å; H231-Y234 WeakPolarHBondContact O-CD2 3.4Å; M232-Y234 PolarHBondContact O-N 3Å; Y234-F236 VanDerWaalsContact C-N 3.28Å; Y234-F236 PolarHBondContact O-N 3.06Å; Y234-L237 PolarHBondContact O-N 3.01Å; Y234-V238 WeakPolarHBondContact O-CG2 3.49Å; Y234-V238 PolarHBondContact O-N 3.27Å; Y234-W363 HydrophobicContact CD1-CH2 4.11Å; Y234-W363 AromaticContact CD1-CZ2 3.96Å; Y234-W363 HydrophobicContact CD1-CZ2 3.96Å; Y234-W363 AromaticContact CE1-CH2 3.91Å; Y234-W363 HydrophobicContact CE1-CH2 3.91Å; Y234-W363 AromaticContact CE1-CZ2 3.49Å; Y234-W363 HydrophobicContact CE1-CZ2 3.49Å; Y234-W363 VanDerWaalsContact CE1-CZ2 3.49Å
235P96.3Very high94.6Very high75 Ų7547 Ų4749%0.48723%0.23SC..Hα-helixtrans-60.8-39.3179.3-22.534.6000112.3M232 V238 L239M232-P235 WeakPolarHBondContact O-CD 3.46Å; P235-V238 PolarHBondContact O-N 2.92Å; P235-L239 WeakPolarHBondContact O-CB 3.18Å; P235-L239 VanDerWaalsContact O-CG 3.31Å; P235-L239 WeakPolarHBondContact O-CG 3.42Å; P235-L239 PolarHBondContact O-N 3.17Å
236F96.7Very high95Very high22 Ų2249.4 Ų49.410%0.09624%0.242CC..Hα-helixtrans-73.7-33.7-179.5-61.1-82.9000112.3W171 L172 M176 M179 L184 A233 Y234 L239 S240 L277W171-F236 AromaticContact CH2-CD2 3.67Å; W171-F236 HydrophobicContact CH2-CD2 3.67Å; W171-F236 AromaticContact CH2-CE2 3.79Å; W171-F236 HydrophobicContact CH2-CE2 3.79Å; W171-F236 AromaticContact CZ3-CD2 3.83Å; W171-F236 HydrophobicContact CZ3-CD2 3.83Å; W171-F236 AromaticContact CZ3-CE2 3.42Å; W171-F236 HydrophobicContact CZ3-CE2 3.42Å; W171-F236 VanDerWaalsContact CZ3-CE2 3.42Å; W171-F236 HydrophobicContact CZ3-CZ 4.15Å; L172-F236 HydrophobicContact CD2-CE2 4.01Å; L172-F236 HydrophobicContact CD2-CZ 3.69Å; M176-F236 HydrophobicContact SD-CE1 4.08Å; M176-F236 HydrophobicContact SD-CZ 4.24Å; M179-F236 HydrophobicContact CE-CB 4.15Å; M179-F236 HydrophobicContact CE-CD1 4.18Å; M179-F236 HydrophobicContact CE-CG 4.22Å; M179-F236 HydrophobicContact CG-CD1 4.42Å; M179-F236 HydrophobicContact SD-CD1 4.47Å; L184-F236 HydrophobicContact CD2-CD1 3.55Å; L184-F236 HydrophobicContact CD2-CE1 4.02Å; A233-F236 PolarHBondContact O-N 3.26Å; A233-F236 VanDerWaalsContact O-N 3.1Å; Y234-F236 VanDerWaalsContact C-N 3.28Å; Y234-F236 PolarHBondContact O-N 3.06Å; F236-L239 PolarHBondContact O-N 2.88Å; F236-S240 WeakPolarHBondContact O-CB 3.46Å; F236-S240 PolarHBondContact O-N 3.47Å; F236-S240 PolarHBondContact O-OG 2.96Å; F236-L277 HydrophobicContact CB-CD1 3.62Å
237L96.5Very high95.4Very high5 Ų546.7 Ų46.73%0.02623%0.227CC..Hα-helixtrans-62.5-46.7170.7-77.6169000111.1A233 Y234 L239 S240 L241 T274 L277 I278 W363A233-L237 HydrophobicContact CB-CD1 4.02Å; A233-L237 HydrophobicContact CB-CG 4.39Å; A233-L237 PolarHBondContact O-N 3.5Å; Y234-L237 PolarHBondContact O-N 3.01Å; L237-L239 PolarHBondContact O-N 3.12Å; L237-S240 WeakPolarHBondContact CA-OG 3.49Å; L237-S240 PolarHBondContact O-N 2.85Å; L237-S240 PolarHBondContact O-OG 3.45Å; L237-L241 WeakPolarHBondContact O-CB 3.25Å; L237-L241 VanDerWaalsContact O-CG 3.31Å; L237-L241 WeakPolarHBondContact O-CG 3.34Å; L237-L241 PolarHBondContact O-N 3.44Å; L237-T274 HydrophobicContact CD2-CG2 4.38Å; L237-L277 HydrophobicContact CD2-CB 3.75Å; L237-L277 HydrophobicContact CD2-CD1 4.1Å; L237-L277 HydrophobicContact CG-CB 4.05Å; L237-L277 HydrophobicContact CG-CD1 3.99Å; L237-I278 HydrophobicContact CD2-CG1 4.14Å; L237-W363 HydrophobicContact CD1-CH2 4.1Å; L237-W363 HydrophobicContact CD1-CZ2 3.7Å
238V96.5Very high95.7Very high98 Ų9844.5 Ų44.559%0.59421%0.213SC*.Hα-helixtrans-63-45.2177.2175.20000110.8Y234 P235 S240 W242Y234-V238 WeakPolarHBondContact O-CG2 3.49Å; Y234-V238 PolarHBondContact O-N 3.27Å; P235-V238 PolarHBondContact O-N 2.92Å; V238-S240 VanDerWaalsContact C-N 3.32Å; V238-S240 PolarHBondContact O-N 3.42Å; V238-W242 VanDerWaalsContact O-CB 3.28Å; V238-W242 WeakPolarHBondContact O-CB 3.37Å; V238-W242 PolarHBondContact O-N 3.24Å
239L97.3Very high96Very high67 Ų6746.2 Ų46.235%0.35123%0.225SC..Hα-helixtrans-61.5-38.2177.7-76.7167.8000112.7L184 Y185 P235 F236 L237 G243L184-L239 HydrophobicContact CD1-CB 4.3Å; L184-L239 HydrophobicContact CD2-CB 4.36Å; L184-L239 HydrophobicContact CD2-CD1 3.92Å; L184-L239 HydrophobicContact CG-CB 4.36Å; Y185-L239 WeakPolarHBondContact CB-O 3.3Å; Y185-L239 HydrophobicContact CD1-CD2 4.43Å; P235-L239 WeakPolarHBondContact O-CB 3.18Å; P235-L239 VanDerWaalsContact O-CG 3.31Å; P235-L239 WeakPolarHBondContact O-CG 3.42Å; P235-L239 PolarHBondContact O-N 3.17Å; F236-L239 PolarHBondContact O-N 2.88Å; L237-L239 PolarHBondContact O-N 3.12Å; L239-G243 WeakPolarHBondContact O-CA 3.49Å; L239-G243 PolarHBondContact O-N 2.9Å
240S96.9Very high96.2Very high1 Ų148 Ų481%0.00724%0.235CC..Hα-helixtrans-76-43.3179.349.40000112.6F236 L237 V238 G243 M244 T274F236-S240 WeakPolarHBondContact O-CB 3.46Å; F236-S240 PolarHBondContact O-N 3.47Å; F236-S240 PolarHBondContact O-OG 2.96Å; L237-S240 WeakPolarHBondContact CA-OG 3.49Å; L237-S240 PolarHBondContact O-N 2.85Å; L237-S240 PolarHBondContact O-OG 3.45Å; V238-S240 VanDerWaalsContact C-N 3.32Å; V238-S240 PolarHBondContact O-N 3.42Å; S240-G243 PolarHBondContact O-N 3.26Å; S240-M244 PolarHBondContact O-N 3.32Å; S240-T274 WeakPolarHBondContact OG-CG2 3.38Å
241L96.9Very high96.6Very high13 Ų1341.1 Ų41.17%0.06820%0.204CC..Hα-helixtrans-64.1-42175.5-72.3167.2000113.2L237 M244 T274 T367 L370 T371L237-L241 WeakPolarHBondContact O-CB 3.25Å; L237-L241 VanDerWaalsContact O-CG 3.31Å; L237-L241 WeakPolarHBondContact O-CG 3.34Å; L237-L241 PolarHBondContact O-N 3.44Å; L241-M244 HydrophobicContact CD2-CE 3.9Å; L241-M244 HydrophobicContact CD2-SD 4.41Å; L241-M244 WeakPolarHBondContact O-CG 3.08Å; L241-T274 HydrophobicContact CD2-CG2 3.92Å; L241-T274 HydrophobicContact CG-CG2 3.84Å; L241-T367 HydrophobicContact CD1-CG2 3.72Å; L241-T367 HydrophobicContact CD2-CG2 4.33Å; L241-L370 HydrophobicContact CB-CD1 4.07Å; L241-L370 HydrophobicContact CD1-CD1 4.46Å; L241-T371 HydrophobicContact CD2-CG2 4.26Å
242W97.8Very high96.8Very high135 Ų13538 Ų3851%0.51119%0.192SC..Hα-helixtrans-72.3-40.7172.6-175.3-112000111.3V238 M244 I245 M246V238-W242 VanDerWaalsContact O-CB 3.28Å; V238-W242 WeakPolarHBondContact O-CB 3.37Å; V238-W242 PolarHBondContact O-N 3.24Å; W242-M244 PolarHBondContact O-N 3.42Å; W242-I245 PolarHBondContact O-N 3.42Å; W242-M246 HydrophobicContact CD2-CG 4.2Å; W242-M246 HydrophobicContact CG-CG 4.25Å; W242-M246 HydrophobicContact CH2-SD 4.35Å; W242-M246 HydrophobicContact CZ2-CG 4.13Å; W242-M246 HydrophobicContact CZ2-SD 3.57Å; W242-M246 VanDerWaalsContact CZ2-SD 3.57Å; W242-M246 VanDerWaalsContact NE1-CG 3.31Å; W242-M246 WeakPolarHBondContact O-CG 3.22Å; W242-M246 PolarHBondContact O-N 3.06Å
243G97.1Very high96.9Very high1 Ų146.4 Ų46.41%0.0122%0.222CC..Hα-helixtrans-57.1-44.5-179.500000113.8L239 S240 I245 M246 T247L239-G243 WeakPolarHBondContact O-CA 3.49Å; L239-G243 PolarHBondContact O-N 2.9Å; S240-G243 PolarHBondContact O-N 3.26Å; G243-I245 VanDerWaalsContact C-N 3.29Å; G243-I245 PolarHBondContact O-N 3.1Å; G243-M246 PolarHBondContact O-N 3.45Å; G243-T247 WeakPolarHBondContact O-CG2 3.42Å; G243-T247 PolarHBondContact O-N 3.5Å; G243-T247 PolarHBondContact O-OG1 3.28Å
244M96.6Very high97Very high0 Ų048.1 Ų48.10%023%0.229CC..Hα-helixtrans-60.4-38.117963179.368.100112.3S240 L241 W242 T247 S248 A270 L271 T274 T371 N374S240-M244 PolarHBondContact O-N 3.32Å; L241-M244 HydrophobicContact CD2-CE 3.9Å; L241-M244 HydrophobicContact CD2-SD 4.41Å; L241-M244 WeakPolarHBondContact O-CG 3.08Å; W242-M244 PolarHBondContact O-N 3.42Å; M244-T247 PolarHBondContact O-OG1 3.38Å; M244-S248 VanDerWaalsContact O-CB 3.22Å; M244-S248 WeakPolarHBondContact O-CB 3.13Å; M244-S248 PolarHBondContact O-N 2.82Å; M244-S248 VanDerWaalsContact O-N 3.09Å; M244-S248 PolarHBondContact O-OG 2.99Å; M244-A270 HydrophobicContact CB-CB 3.94Å; M244-L271 HydrophobicContact CE-CD2 3.58Å; M244-L271 HydrophobicContact CE-CG 3.95Å; M244-L271 HydrophobicContact SD-CD2 3.76Å; M244-L271 HydrophobicContact SD-CG 4.26Å; M244-T274 HydrophobicContact CE-CG2 3.83Å; M244-T371 HydrophobicContact SD-CG2 4.45Å; M244-N374 HydrophobicContact CG-CB 4.18Å; M244-N374 PolarHBondContact O-OD1 3.05Å; M244-N374 HydrophobicContact SD-CB 4.01Å
245I97.8Very high97Very high17 Ų1745.9 Ų45.99%0.08723%0.228CC..Hα-helixtrans-70.8-44.8176.6-62.8170.4000110.2W242 G243 S248 S249 L370 L373 N374W242-I245 PolarHBondContact O-N 3.42Å; G243-I245 VanDerWaalsContact C-N 3.29Å; G243-I245 PolarHBondContact O-N 3.1Å; I245-S248 WeakPolarHBondContact CA-OG 3.48Å; I245-S248 PolarHBondContact O-OG 3.5Å; I245-S249 WeakPolarHBondContact O-CB 3.22Å; I245-S249 PolarHBondContact O-N 2.85Å; I245-S249 PolarHBondContact O-OG 3.03Å; I245-L370 HydrophobicContact CD1-CB 4.05Å; I245-L370 HydrophobicContact CD1-CD2 3.52Å; I245-L370 HydrophobicContact CD1-CG 4.39Å; I245-L373 HydrophobicContact CB-CD2 4.35Å; I245-L373 HydrophobicContact CD1-CD2 4.18Å; I245-L373 HydrophobicContact CG1-CD2 3.99Å; I245-L373 HydrophobicContact CG2-CD2 3.55Å; I245-N374 HydrophobicContact CG1-CB 4.47Å
246M97.9Very high97Very high55 Ų5544.5 Ų44.527%0.27122%0.217SC..Hα-helixtrans-66-44.5-178.4-68-55.2-65.700111.7Y185 W242 G243 S249 I250Y185-M246 HydrophobicContact CE2-CB 3.78Å; W242-M246 HydrophobicContact CD2-CG 4.2Å; W242-M246 HydrophobicContact CG-CG 4.25Å; W242-M246 HydrophobicContact CH2-SD 4.35Å; W242-M246 HydrophobicContact CZ2-CG 4.13Å; W242-M246 HydrophobicContact CZ2-SD 3.57Å; W242-M246 VanDerWaalsContact CZ2-SD 3.57Å; W242-M246 VanDerWaalsContact NE1-CG 3.31Å; W242-M246 WeakPolarHBondContact O-CG 3.22Å; W242-M246 PolarHBondContact O-N 3.06Å; G243-M246 PolarHBondContact O-N 3.45Å; M246-S249 PolarHBondContact O-N 3.24Å; M246-S249 PolarHBondContact O-OG 3.17Å; M246-I250 VanDerWaalsContact O-CG1 3.26Å; M246-I250 WeakPolarHBondContact O-CG1 3.38Å; M246-I250 PolarHBondContact O-N 3.29Å
247T97.4Very high97Very high0 Ų043.9 Ų43.90%021%0.214CC..Hα-helixtrans-70.2-36.7179.156.40000112.6Y185 G243 M244 S249 I250 C251 Y263 I266 S267Y185-T247 HydrophobicContact CD2-CG2 4.04Å; Y185-T247 HydrophobicContact CE2-CG2 4.3Å; G243-T247 WeakPolarHBondContact O-CG2 3.42Å; G243-T247 PolarHBondContact O-N 3.5Å; G243-T247 PolarHBondContact O-OG1 3.28Å; M244-T247 PolarHBondContact O-OG1 3.38Å; T247-S249 VanDerWaalsContact C-N 3.35Å; T247-I250 WeakPolarHBondContact O-CB 3.32Å; T247-I250 PolarHBondContact O-N 3.39Å; T247-C251 PolarHBondContact O-N 2.73Å; T247-C251 VanDerWaalsContact O-N 3.09Å; T247-C251 PolarHBondContact O-SG 2.88Å; T247-Y263 HydrophobicContact CG2-CD1 4.38Å; T247-I266 HydrophobicContact CG2-CB 4.23Å; T247-I266 HydrophobicContact CG2-CG2 3.75Å; T247-S267 WeakPolarHBondContact OG1-CA 3.45Å; T247-S267 WeakPolarHBondContact OG1-CB 3.3Å; T247-S267 PolarHBondContact OG1-N 3.13Å
248S97Very high97Very high0 Ų044 Ų440%022%0.215CC..Hα-helixtrans-65-37.6172.360.10000112M244 I245 I250 C251 N374 V377M244-S248 VanDerWaalsContact O-CB 3.22Å; M244-S248 WeakPolarHBondContact O-CB 3.13Å; M244-S248 PolarHBondContact O-N 2.82Å; M244-S248 VanDerWaalsContact O-N 3.09Å; M244-S248 PolarHBondContact O-OG 2.99Å; I245-S248 WeakPolarHBondContact CA-OG 3.48Å; I245-S248 PolarHBondContact O-OG 3.5Å; S248-I250 VanDerWaalsContact C-N 3.33Å; S248-I250 PolarHBondContact O-N 2.93Å; S248-C251 VanDerWaalsContact O-CB 3.3Å; S248-C251 WeakPolarHBondContact O-CB 3.09Å; S248-C251 PolarHBondContact O-N 3.01Å; S248-N374 PolarHBondContact OG-OD1 3.05Å; S248-V377 WeakPolarHBondContact OG-CG1 3.44Å
249S97.4Very high97Very high40 Ų4039.8 Ų39.828%0.2819%0.189SC..Hα-helixtrans-66.3-34.2173.179.90000112.8I245 M246 T247 C251 L252I245-S249 WeakPolarHBondContact O-CB 3.22Å; I245-S249 PolarHBondContact O-N 2.85Å; I245-S249 PolarHBondContact O-OG 3.03Å; M246-S249 PolarHBondContact O-N 3.24Å; M246-S249 PolarHBondContact O-OG 3.17Å; T247-S249 VanDerWaalsContact C-N 3.35Å; S249-C251 VanDerWaalsContact C-N 3.31Å; S249-C251 PolarHBondContact O-N 2.74Å; S249-L252 PolarHBondContact O-N 2.97Å
250I98Very high97Very high43 Ų4336.6 Ų36.622%0.22117%0.173CC..Hα-helixtrans-62.1-42173.6-72.6165.4000109.6M246 T247 S248 L252 R253 Q254 Y263M246-I250 VanDerWaalsContact O-CG1 3.26Å; M246-I250 WeakPolarHBondContact O-CG1 3.38Å; M246-I250 PolarHBondContact O-N 3.29Å; T247-I250 WeakPolarHBondContact O-CB 3.32Å; T247-I250 PolarHBondContact O-N 3.39Å; S248-I250 VanDerWaalsContact C-N 3.33Å; S248-I250 PolarHBondContact O-N 2.93Å; I250-L252 PolarHBondContact O-N 2.72Å; I250-R253 PolarHBondContact O-N 2.86Å; I250-Q254 HydrophobicContact CG2-CG 4.14Å; I250-Q254 WeakPolarHBondContact O-CG 3.41Å; I250-Q254 PolarHBondContact O-N 3.3Å; I250-Y263 HydrophobicContact CD1-CE1 4.3Å; I250-Y263 HydrophobicContact CG2-CD1 3.95Å; I250-Y263 HydrophobicContact CG2-CD2 3.83Å; I250-Y263 HydrophobicContact CG2-CE1 4.03Å; I250-Y263 HydrophobicContact CG2-CE2 3.93Å; I250-Y263 HydrophobicContact CG2-CG 3.85Å
251C97.6Very high97.1Very high0 Ų036.5 Ų36.50%017%0.172CC..Hα-helixtrans-54.6-36.1178-64.60000113.4T247 S248 S249 R253 Q254 L260 Y263 S264 Y381T247-C251 PolarHBondContact O-N 2.73Å; T247-C251 VanDerWaalsContact O-N 3.09Å; T247-C251 PolarHBondContact O-SG 2.88Å; S248-C251 VanDerWaalsContact O-CB 3.3Å; S248-C251 WeakPolarHBondContact O-CB 3.09Å; S248-C251 PolarHBondContact O-N 3.01Å; S249-C251 VanDerWaalsContact C-N 3.31Å; S249-C251 PolarHBondContact O-N 2.74Å; C251-R253 PolarHBondContact O-N 2.98Å; C251-Q254 PolarHBondContact O-N 3.3Å; C251-L260 HydrophobicContact CB-CD2 4.47Å; C251-L260 HydrophobicContact CB-CG 4.15Å; C251-L260 WeakPolarHBondContact O-CD1 3.08Å; C251-Y263 WeakPolarHBondContact SG-CB 3.33Å; C251-S264 PolarHBondContact SG-N 2.96Å; C251-S264 VanDerWaalsContact SG-N 3.42Å; C251-Y381 HydrophobicContact CB-CD1 3.68Å; C251-Y381 HydrophobicContact CB-CD2 4.12Å; C251-Y381 HydrophobicContact CB-CE1 4.35Å; C251-Y381 HydrophobicContact CB-CG 3.58Å
252L96.6Very high97.1Very high61 Ų6135.9 Ų35.932%0.31917%0.169SC..Hα-helixtrans-63.3-25.1178.6-68.3173000113.5S249 I250 V377 L380S249-L252 PolarHBondContact O-N 2.97Å; I250-L252 PolarHBondContact O-N 2.72Å; L252-V377 HydrophobicContact CD1-CG1 4.03Å; L252-V377 HydrophobicContact CG-CG1 4.41Å; L252-L380 HydrophobicContact CD2-CB 3.87Å
253R96.7Very high97.1Very high214 Ų21431.2 Ų31.281%0.80815%0.152SC*.THydrogen-bonded Turntrans-108.65.9-177.9-61.9-162.2-67.9-169.6-2113.4I250 C251 T255I250-R253 PolarHBondContact O-N 2.86Å; C251-R253 PolarHBondContact O-N 2.98Å; R253-T255 PolarHBondContact O-N 3.4Å
254Q96.8Very high97.1Very high39 Ų3931.2 Ų31.218%0.18215%0.151CC..  trans-75.3127.4178.7-73.8-55.6-18.700111.5I250 C251 S259 L260 Y263I250-Q254 HydrophobicContact CG2-CG 4.14Å; I250-Q254 WeakPolarHBondContact O-CG 3.41Å; I250-Q254 PolarHBondContact O-N 3.3Å; C251-Q254 PolarHBondContact O-N 3.3Å; Q254-S259 PolarHBondContact OE1-OG 3.14Å; Q254-S259 VanDerWaalsContact OE1-OG 3.12Å; Q254-L260 HydrophobicContact CB-CB 3.81Å; Q254-L260 HydrophobicContact CB-CD1 4.29Å; Q254-L260 HydrophobicContact CB-CG 4.21Å; Q254-L260 HydrophobicContact CG-CB 4.38Å; Q254-Y263 HydrophobicContact CG-CD2 4.05Å
255T96Very high97.1Very high78 Ų7831.2 Ų31.248%0.47915%0.151SC..  trans-83.9-31.9172.355.20000111.9R253 M317R253-T255 PolarHBondContact O-N 3.4Å; T255-M317 WeakPolarHBondContact O-CB 3.34Å; T255-M317 PolarHBondContact O-N 3.3Å
256D96.1Very high97.1Very high45 Ų4530.4 Ų30.424%0.24115%0.147CC..BIsolated β-bridgetrans-90.2117.9-176.7-82.5-9.1000110.9K258 S259 L260D256-K258 PolarHBondContact O-N 3.27Å; D256-S259 WeakPolarHBondContact CB-OG 3.35Å; D256-S259 WeakPolarHBondContact O-CB 3.26Å; D256-S259 PolarHBondContact O-N 3.37Å; D256-S259 PolarHBondContact O-OG 2.91Å; D256-L260 PolarHBondContact O-N 3.41Å
257L95.9Very high97.1Very high9 Ų927.8 Ų27.85%0.04713%0.134CC..Hα-helixtrans-63.9-41.6-172.9-173.1152.2000112.6S259 L260 I261 A305 R315 M317 W334 T389L257-S259 VanDerWaalsContact C-N 3.29Å; L257-S259 PolarHBondContact O-N 3.2Å; L257-L260 PolarHBondContact O-N 3.32Å; L257-I261 HydrophobicContact CD2-CD1 3.68Å; L257-I261 WeakPolarHBondContact O-CG1 3.43Å; L257-I261 PolarHBondContact O-N 3.35Å; L257-I261 VanDerWaalsContact O-N 3.16Å; L257-A305 HydrophobicContact CD2-CB 3.09Å; L257-R315 PolarHBondContact N-O 2.88Å; L257-M317 HydrophobicContact CB-CB 4.33Å; L257-M317 HydrophobicContact CD1-CG 4.25Å; L257-W334 HydrophobicContact CD1-CH2 3.85Å; L257-W334 HydrophobicContact CD1-CZ2 4.33Å; L257-W334 HydrophobicContact CD2-CH2 4.1Å; L257-W334 HydrophobicContact CG-CH2 4.41Å; L257-T389 HydrophobicContact CD1-CG2 3.51Å
258K96.4Very high97.1Very high9 Ų927.8 Ų27.84%0.03913%0.134CC..Hα-helixtrans-63.8-35.4174.3-80.5-166.7178.2-174.50112.5V196 A198 D256 A262 F302 A305V196-K258 HydrophobicContact CG2-CB 4.12Å; A198-K258 PolarHBondContact O-NZ 2.85Å; D256-K258 PolarHBondContact O-N 3.27Å; K258-A262 WeakPolarHBondContact O-CB 3.43Å; K258-A262 PolarHBondContact O-N 3.22Å; K258-F302 HydrophobicContact CB-CE1 4.39Å; K258-F302 HydrophobicContact CG-CD1 4.38Å; K258-F302 HydrophobicContact CG-CE1 4.46Å; K258-A305 HydrophobicContact CG-CB 4.21Å
259S96.4Very high97.1Very high8 Ų827.9 Ų27.96%0.05614%0.135CC..Hα-helixtrans-71.1-38.5178.982.50000111.1Q254 D256 L257 I261 A262 Y263Q254-S259 PolarHBondContact OE1-OG 3.14Å; Q254-S259 VanDerWaalsContact OE1-OG 3.12Å; D256-S259 WeakPolarHBondContact CB-OG 3.35Å; D256-S259 WeakPolarHBondContact O-CB 3.26Å; D256-S259 PolarHBondContact O-N 3.37Å; D256-S259 PolarHBondContact O-OG 2.91Å; L257-S259 VanDerWaalsContact C-N 3.29Å; L257-S259 PolarHBondContact O-N 3.2Å; S259-I261 VanDerWaalsContact C-N 3.33Å; S259-I261 PolarHBondContact O-N 2.98Å; S259-A262 CarbonylContact O-C 3.6Å; S259-A262 WeakPolarHBondContact O-CB 3.37Å; S259-A262 PolarHBondContact O-N 2.81Å; S259-A262 VanDerWaalsContact O-N 3.13Å; S259-Y263 VanDerWaalsContact O-CD2 3.22Å; S259-Y263 WeakPolarHBondContact O-CD2 3.37Å; S259-Y263 PolarHBondContact O-N 3.29Å
260L97.8Very high97.1Very high0 Ų026.3 Ų26.30%012%0.124CC..Hα-helixtrans-58.3-46.9174.5-170160.1000110.3C251 Q254 D256 L257 A262 Y263 S264 M317 Y381 M385C251-L260 HydrophobicContact CB-CD2 4.47Å; C251-L260 HydrophobicContact CB-CG 4.15Å; C251-L260 WeakPolarHBondContact O-CD1 3.08Å; Q254-L260 HydrophobicContact CB-CB 3.81Å; Q254-L260 HydrophobicContact CB-CD1 4.29Å; Q254-L260 HydrophobicContact CB-CG 4.21Å; Q254-L260 HydrophobicContact CG-CB 4.38Å; D256-L260 PolarHBondContact O-N 3.41Å; L257-L260 PolarHBondContact O-N 3.32Å; L260-A262 VanDerWaalsContact C-N 3.32Å; L260-A262 PolarHBondContact O-N 3.18Å; L260-Y263 PolarHBondContact O-N 3.11Å; L260-S264 PolarHBondContact O-N 3.04Å; L260-M317 HydrophobicContact CD1-CE 4.16Å; L260-M317 HydrophobicContact CD1-SD 4.1Å; L260-Y381 HydrophobicContact CD2-CD2 4.34Å; L260-M385 HydrophobicContact CD2-CB 4.29Å; L260-M385 HydrophobicContact CD2-CE 3.3Å; L260-M385 HydrophobicContact CD2-CG 4.18Å; L260-M385 HydrophobicContact CD2-SD 4.3Å
261I97.9Very high97.1Very high0 Ų024.6 Ų24.60%012%0.115CC..Hα-helixtrans-62.8-40.4176.4-58.8161.6000110.9L257 S259 S264 S265 L301 F302 A305 M385L257-I261 HydrophobicContact CD2-CD1 3.68Å; L257-I261 WeakPolarHBondContact O-CG1 3.43Å; L257-I261 PolarHBondContact O-N 3.35Å; L257-I261 VanDerWaalsContact O-N 3.16Å; S259-I261 VanDerWaalsContact C-N 3.33Å; S259-I261 PolarHBondContact O-N 2.98Å; I261-S264 WeakPolarHBondContact CA-OG 3.36Å; I261-S264 PolarHBondContact O-N 3.29Å; I261-S264 PolarHBondContact O-OG 2.92Å; I261-S265 PolarHBondContact O-N 3.49Å; I261-L301 HydrophobicContact CD1-CB 3.91Å; I261-L301 WeakPolarHBondContact CD1-O 3.47Å; I261-L301 HydrophobicContact CG1-CB 4.11Å; I261-L301 HydrophobicContact CG2-CB 3.95Å; I261-L301 HydrophobicContact CG2-CD1 4.5Å; I261-F302 HydrophobicContact CB-CE1 4.06Å; I261-F302 HydrophobicContact CB-CE2 4.38Å; I261-F302 HydrophobicContact CB-CZ 3.97Å; I261-F302 HydrophobicContact CD1-CD1 4.43Å; I261-F302 HydrophobicContact CG2-CD1 4.28Å; I261-F302 HydrophobicContact CG2-CD2 3.82Å; I261-F302 HydrophobicContact CG2-CE1 4Å; I261-F302 HydrophobicContact CG2-CE2 3.49Å; I261-F302 VanDerWaalsContact CG2-CE2 3.49Å; I261-F302 HydrophobicContact CG2-CG 4.19Å; I261-F302 HydrophobicContact CG2-CZ 3.59Å; I261-A305 HydrophobicContact CD1-CB 3.84Å; I261-M385 HydrophobicContact CG1-CE 4.46Å; I261-M385 HydrophobicContact CG1-SD 4.45Å
262A97.1Very high97.1Very high0 Ų024.6 Ų24.60%012%0.115CC..Hα-helixtrans-64.3-38.8176.200000113.7L191 H195 K258 S259 L260 S265 I266 F302L191-A262 HydrophobicContact CD2-CB 3.63Å; L191-A262 WeakPolarHBondContact CD2-O 3.38Å; H195-A262 HydrophobicContact CB-CB 3.95Å; K258-A262 WeakPolarHBondContact O-CB 3.43Å; K258-A262 PolarHBondContact O-N 3.22Å; S259-A262 CarbonylContact O-C 3.6Å; S259-A262 WeakPolarHBondContact O-CB 3.37Å; S259-A262 PolarHBondContact O-N 2.81Å; S259-A262 VanDerWaalsContact O-N 3.13Å; L260-A262 VanDerWaalsContact C-N 3.32Å; L260-A262 PolarHBondContact O-N 3.18Å; A262-S265 PolarHBondContact O-N 3.06Å; A262-S265 PolarHBondContact O-OG 3.26Å; A262-I266 WeakPolarHBondContact O-CG1 3.19Å; A262-I266 PolarHBondContact O-N 3.23Å; A262-F302 HydrophobicContact CB-CZ 4.41Å
263Y98Very high97.1Very high37 Ų3721.8 Ų21.815%0.14510%0.101CC..Hα-helixtrans-70.8-34.7173.6-78.7-72.5000112.2P192 T247 I250 C251 Q254 S259 L260 S265 I266 S267P192-Y263 HydrophobicContact CB-CE2 3.96Å; P192-Y263 HydrophobicContact CG-CD1 4.27Å; P192-Y263 HydrophobicContact CG-CD2 4.35Å; P192-Y263 HydrophobicContact CG-CE1 3.75Å; P192-Y263 HydrophobicContact CG-CE2 3.83Å; T247-Y263 HydrophobicContact CG2-CD1 4.38Å; I250-Y263 HydrophobicContact CD1-CE1 4.3Å; I250-Y263 HydrophobicContact CG2-CD1 3.95Å; I250-Y263 HydrophobicContact CG2-CD2 3.83Å; I250-Y263 HydrophobicContact CG2-CE1 4.03Å; I250-Y263 HydrophobicContact CG2-CE2 3.93Å; I250-Y263 HydrophobicContact CG2-CG 3.85Å; C251-Y263 WeakPolarHBondContact SG-CB 3.33Å; Q254-Y263 HydrophobicContact CG-CD2 4.05Å; S259-Y263 VanDerWaalsContact O-CD2 3.22Å; S259-Y263 WeakPolarHBondContact O-CD2 3.37Å; S259-Y263 PolarHBondContact O-N 3.29Å; L260-Y263 PolarHBondContact O-N 3.11Å; Y263-S265 VanDerWaalsContact C-N 3.27Å; Y263-S265 PolarHBondContact O-N 2.8Å; Y263-I266 HydrophobicContact CD1-CD1 3.9Å; Y263-I266 HydrophobicContact CE1-CD1 4.31Å; Y263-I266 PolarHBondContact O-N 3.49Å; Y263-I266 VanDerWaalsContact O-N 3.14Å; Y263-S267 PolarHBondContact O-N 3.29Å; Y263-S267 VanDerWaalsContact O-N 3.07Å
264S97.5Very high97.2Very high0 Ų011.6 Ų11.60%06%0.062CC..Hα-helixtrans-64.7-30.5173.2780000112.7C251 L260 I261 S267 H268C251-S264 PolarHBondContact SG-N 2.96Å; C251-S264 VanDerWaalsContact SG-N 3.42Å; L260-S264 PolarHBondContact O-N 3.04Å; I261-S264 WeakPolarHBondContact CA-OG 3.36Å; I261-S264 PolarHBondContact O-N 3.29Å; I261-S264 PolarHBondContact O-OG 2.92Å; S264-S267 WeakPolarHBondContact CA-OG 3.09Å; S264-S267 PolarHBondContact O-N 3.5Å; S264-S267 PolarHBondContact O-OG 3.32Å; S264-H268 PolarHBondContact O-CD2 3.02Å; S264-H268 PolarHBondContact O-N 3.24Å; S264-H268 VanDerWaalsContact O-N 3.13Å
265S96.9Very high97.1Very high0 Ų09.8 Ų9.80%05%0.054CC..Hα-helixtrans-71.6-32.3173.264.50000112.6I261 A262 Y263 M269 H294I261-S265 PolarHBondContact O-N 3.49Å; A262-S265 PolarHBondContact O-N 3.06Å; A262-S265 PolarHBondContact O-OG 3.26Å; Y263-S265 VanDerWaalsContact C-N 3.27Å; Y263-S265 PolarHBondContact O-N 2.8Å; S265-M269 WeakPolarHBondContact O-CB 3.46Å; S265-M269 WeakPolarHBondContact O-CG 3.4Å; S265-M269 PolarHBondContact O-N 3.26Å; S265-H294 VanDerWaalsContact CA-CE1 3.49Å; S265-H294 WeakPolarHBondContact CA-CE1 3.42Å; S265-H294 VanDerWaalsContact CA-NE2 3.32Å; S265-H294 WeakPolarHBondContact CA-NE2 3.47Å; S265-H294 WeakPolarHBondContact CB-NE2 3.36Å
266I97.9Very high97.2Very high1 Ų16 Ų61%0.0053%0.031CC..Hα-helixtrans-66.1-42.9172.9-59159.7000110.8P183 H188 L191 P192 T247 A262 Y263 M269 A270P183-I266 HydrophobicContact CB-CG1 4.26Å; P183-I266 HydrophobicContact CG-CB 4.38Å; P183-I266 HydrophobicContact CG-CG1 3.83Å; P183-I266 HydrophobicContact CG-CG2 4.27Å; H188-I266 HydrophobicContact CB-CD1 3.78Å; H188-I266 HydrophobicContact CB-CG1 4.19Å; H188-I266 HydrophobicContact CB-CG2 3.98Å; L191-I266 HydrophobicContact CB-CD1 4.42Å; L191-I266 HydrophobicContact CD1-CG1 3.95Å; L191-I266 HydrophobicContact CD2-CD1 4.22Å; L191-I266 HydrophobicContact CD2-CG1 4.15Å; L191-I266 HydrophobicContact CG-CG1 4.47Å; P192-I266 HydrophobicContact CG-CD1 4.07Å; T247-I266 HydrophobicContact CG2-CB 4.23Å; T247-I266 HydrophobicContact CG2-CG2 3.75Å; A262-I266 WeakPolarHBondContact O-CG1 3.19Å; A262-I266 PolarHBondContact O-N 3.23Å; Y263-I266 HydrophobicContact CD1-CD1 3.9Å; Y263-I266 HydrophobicContact CE1-CD1 4.31Å; Y263-I266 PolarHBondContact O-N 3.49Å; Y263-I266 VanDerWaalsContact O-N 3.14Å; I266-M269 PolarHBondContact O-N 3.29Å; I266-A270 WeakPolarHBondContact O-CB 2.77Å; I266-A270 PolarHBondContact O-N 2.96Å
267S97.4Very high97.1Very high0 Ų04.5 Ų4.50%02%0.023CC..Hα-helixtrans-63-43.3177.759.10000112.4T247 Y263 S264 A270 L271T247-S267 WeakPolarHBondContact OG1-CA 3.45Å; T247-S267 WeakPolarHBondContact OG1-CB 3.3Å; T247-S267 PolarHBondContact OG1-N 3.13Å; Y263-S267 PolarHBondContact O-N 3.29Å; Y263-S267 VanDerWaalsContact O-N 3.07Å; S264-S267 WeakPolarHBondContact CA-OG 3.09Å; S264-S267 PolarHBondContact O-N 3.5Å; S264-S267 PolarHBondContact O-OG 3.32Å; S267-A270 WeakPolarHBondContact O-CB 3.35Å; S267-A270 PolarHBondContact O-N 3.1Å; S267-L271 PolarHBondContact O-N 3.48Å
268H97.7Very high97.1Very high0 Ų05.1 Ų5.10%03%0.026CC..Hα-helixtrans-67.9-41.4177.8-76.2-54.7000113S264 A270 L271 V272 H294 N341 E353S264-H268 PolarHBondContact O-CD2 3.02Å; S264-H268 PolarHBondContact O-N 3.24Å; S264-H268 VanDerWaalsContact O-N 3.13Å; H268-A270 VanDerWaalsContact C-N 3.29Å; H268-A270 PolarHBondContact O-N 3.43Å; H268-L271 WeakPolarHBondContact O-CB 3.47Å; H268-L271 PolarHBondContact O-N 3.41Å; H268-V272 PolarHBondContact O-N 3.48Å; H268-H294 AromaticContact CD2-CE1 3.58Å; H268-H294 AromaticContact CD2-ND1 3.38Å; H268-H294 PolarHBondContact CD2-ND1 3.25Å; H268-H294 AromaticContact CG-CE1 3.99Å; H268-H294 AromaticContact CG-ND1 3.62Å; H268-N341 PolarHBondContact NE2-O 3.08Å; H268-N341 PolarHBondContact NE2-OD1 3.45Å; H268-E353 IonicContact CE1-OE1 3.07Å; H268-E353 PolarHBondContact CE1-OE1 2.77Å; H268-E353 IonicContact ND1-OE1 2.73Å; H268-E353 PolarHBondContact ND1-OE1 3.4Å
269M97.4Very high97Very high2 Ų26.6 Ų6.61%0.013%0.033CC..Hα-helixtrans-71.5-23.9176.2-62.2-61.685.700112.6L211 K212 S265 I266 L271 V272 V273 H294L211-M269 HydrophobicContact CB-CG 4.29Å; L211-M269 HydrophobicContact CB-SD 4.22Å; L211-M269 HydrophobicContact CD1-CG 4.15Å; K212-M269 HydrophobicContact CD-SD 4.23Å; S265-M269 WeakPolarHBondContact O-CB 3.46Å; S265-M269 WeakPolarHBondContact O-CG 3.4Å; S265-M269 PolarHBondContact O-N 3.26Å; I266-M269 PolarHBondContact O-N 3.29Å; M269-L271 VanDerWaalsContact C-N 3.32Å; M269-L271 PolarHBondContact O-N 2.98Å; M269-V272 HydrophobicContact CE-CG2 3.79Å; M269-V272 WeakPolarHBondContact O-CB 3.07Å; M269-V272 PolarHBondContact O-N 3.42Å; M269-V272 HydrophobicContact SD-CG2 4.46Å; M269-V273 WeakPolarHBondContact O-CG2 3.2Å; M269-V273 PolarHBondContact O-N 2.87Å; M269-H294 HydrophobicContact CE-CB 3.82Å; M269-H294 WeakPolarHBondContact CE-CD2 2.91Å
270A97.8Very high96.8Very high7 Ų78.2 Ų8.26%0.0584%0.042CC..Hα-helixtrans-63.9-37171.900000112.1M244 I266 S267 H268 V272 V273 T274M244-A270 HydrophobicContact CB-CB 3.94Å; I266-A270 WeakPolarHBondContact O-CB 2.77Å; I266-A270 PolarHBondContact O-N 2.96Å; S267-A270 WeakPolarHBondContact O-CB 3.35Å; S267-A270 PolarHBondContact O-N 3.1Å; H268-A270 VanDerWaalsContact C-N 3.29Å; H268-A270 PolarHBondContact O-N 3.43Å; A270-V272 VanDerWaalsContact C-N 3.35Å; A270-V273 PolarHBondContact O-N 2.93Å; A270-T274 WeakPolarHBondContact O-CG2 3.32Å; A270-T274 PolarHBondContact O-N 3.47Å
271L97.3Very high96.5Very high6 Ų612.4 Ų12.43%0.0317%0.069CC..Hα-helixtrans-60.6-43.7170.2-73.1165.7000111.3M244 S267 H268 M269 V273 T274 A275 L290 E353 V356 T371M244-L271 HydrophobicContact CE-CD2 3.58Å; M244-L271 HydrophobicContact CE-CG 3.95Å; M244-L271 HydrophobicContact SD-CD2 3.76Å; M244-L271 HydrophobicContact SD-CG 4.26Å; S267-L271 PolarHBondContact O-N 3.48Å; H268-L271 WeakPolarHBondContact O-CB 3.47Å; H268-L271 PolarHBondContact O-N 3.41Å; M269-L271 VanDerWaalsContact C-N 3.32Å; M269-L271 PolarHBondContact O-N 2.98Å; L271-V273 VanDerWaalsContact C-N 3.34Å; L271-V273 PolarHBondContact O-N 2.89Å; L271-T274 WeakPolarHBondContact CA-OG1 3.46Å; L271-T274 PolarHBondContact O-N 3.04Å; L271-T274 PolarHBondContact O-OG1 2.73Å; L271-A275 WeakPolarHBondContact O-CB 3.21Å; L271-A275 PolarHBondContact O-N 2.92Å; L271-L290 HydrophobicContact CB-CD2 3.78Å; L271-L290 HydrophobicContact CD1-CD2 4.31Å; L271-E353 HydrophobicContact CD1-CG 4.22Å; L271-V356 HydrophobicContact CB-CG1 4.29Å; L271-V356 HydrophobicContact CD2-CG1 4.05Å; L271-T371 HydrophobicContact CD2-CG2 4.38Å
272V97.8Very high96.3Very high0 Ų020 Ų200%010%0.098CC..Hα-helixtrans-59.5-44.2175.3176.50000111.3M182 H268 M269 A270 T274 A275 I276 A287 L290 M291M182-V272 HydrophobicContact SD-CG1 3.98Å; H268-V272 PolarHBondContact O-N 3.48Å; M269-V272 HydrophobicContact CE-CG2 3.79Å; M269-V272 WeakPolarHBondContact O-CB 3.07Å; M269-V272 PolarHBondContact O-N 3.42Å; M269-V272 HydrophobicContact SD-CG2 4.46Å; A270-V272 VanDerWaalsContact C-N 3.35Å; V272-T274 PolarHBondContact O-N 3.26Å; V272-A275 PolarHBondContact O-N 3.43Å; V272-I276 HydrophobicContact CG1-CD1 3.66Å; V272-I276 HydrophobicContact CG1-CG1 4.35Å; V272-I276 VanDerWaalsContact O-CG1 3.28Å; V272-I276 WeakPolarHBondContact O-CG1 3.36Å; V272-I276 PolarHBondContact O-N 3.18Å; V272-A287 HydrophobicContact CG1-CB 4.19Å; V272-L290 HydrophobicContact CG2-CB 4.2Å; V272-L290 HydrophobicContact CG2-CD2 3.78Å; V272-L290 HydrophobicContact CG2-CG 4.03Å; V272-M291 HydrophobicContact CG1-CG 3.81Å; V272-M291 HydrophobicContact CG1-SD 4.05Å; V272-M291 HydrophobicContact CG2-CG 4.01Å
273V97.3Very high96.2Very high2 Ų220 Ų201%0.01210%0.098CC..Hα-helixtrans-60-45.8175.8173.30000111.1M179 M182 L184 M269 A270 L271 A275 I276 L277M179-V273 HydrophobicContact CE-CG1 4.09Å; M179-V273 HydrophobicContact SD-CG1 3.86Å; M182-V273 HydrophobicContact CB-CG2 3.86Å; M182-V273 HydrophobicContact CE-CG2 3.92Å; M182-V273 HydrophobicContact CG-CG2 4.47Å; M182-V273 HydrophobicContact SD-CG2 3.82Å; L184-V273 HydrophobicContact CD1-CG1 4.15Å; M269-V273 WeakPolarHBondContact O-CG2 3.2Å; M269-V273 PolarHBondContact O-N 2.87Å; A270-V273 PolarHBondContact O-N 2.93Å; L271-V273 VanDerWaalsContact C-N 3.34Å; L271-V273 PolarHBondContact O-N 2.89Å; V273-A275 VanDerWaalsContact C-N 3.32Å; V273-A275 PolarHBondContact O-N 3.31Å; V273-I276 PolarHBondContact O-N 3.37Å; V273-L277 HydrophobicContact CG1-CD1 3.88Å; V273-L277 HydrophobicContact CG1-CG 4.42Å; V273-L277 WeakPolarHBondContact O-CB 3.47Å; V273-L277 WeakPolarHBondContact O-CG 3.3Å; V273-L277 PolarHBondContact O-N 2.97Å
274T96.9Very high96Very high1 Ų119.8 Ų19.81%0.00610%0.098CC..Hα-helixtrans-59.2-44.4177.458.40000112L237 S240 L241 M244 A270 L271 V272 L277 I278L237-T274 HydrophobicContact CD2-CG2 4.38Å; S240-T274 WeakPolarHBondContact OG-CG2 3.38Å; L241-T274 HydrophobicContact CD2-CG2 3.92Å; L241-T274 HydrophobicContact CG-CG2 3.84Å; M244-T274 HydrophobicContact CE-CG2 3.83Å; A270-T274 WeakPolarHBondContact O-CG2 3.32Å; A270-T274 PolarHBondContact O-N 3.47Å; L271-T274 WeakPolarHBondContact CA-OG1 3.46Å; L271-T274 PolarHBondContact O-N 3.04Å; L271-T274 PolarHBondContact O-OG1 2.73Å; V272-T274 PolarHBondContact O-N 3.26Å; T274-L277 PolarHBondContact O-N 3.12Å; T274-I278 WeakPolarHBondContact O-CG1 3.29Å; T274-I278 PolarHBondContact O-N 3.04Å; T274-I278 VanDerWaalsContact O-N 3.12Å
275A96.6Very high95.9Very high0 Ų020.2 Ų20.20%010%0.101CC..Hα-helixtrans-66.6-40.2-177.500000112.5L271 V272 V273 Q279 S283 A287 V356L271-A275 WeakPolarHBondContact O-CB 3.21Å; L271-A275 PolarHBondContact O-N 2.92Å; V272-A275 PolarHBondContact O-N 3.43Å; V273-A275 VanDerWaalsContact C-N 3.32Å; V273-A275 PolarHBondContact O-N 3.31Å; A275-Q279 PolarHBondContact O-N 3.39Å; A275-S283 WeakPolarHBondContact CB-O 3.46Å; A275-S283 WeakPolarHBondContact O-CB 3Å; A275-S283 PolarHBondContact O-OG 3.04Å; A275-A287 HydrophobicContact CB-CB 3.97Å; A275-V356 HydrophobicContact CB-CB 4.43Å; A275-V356 HydrophobicContact CB-CG1 4.02Å; A275-V356 HydrophobicContact CB-CG2 3.66Å
276I96.3Very high95.8Very high0 Ų020.2 Ų20.20%010%0.101CC..Hα-helixtrans-69.2-37.2177.2-63.7167.9000111M182 M218 M219 T222 V272 V273 Q279 F284 A287M182-I276 HydrophobicContact CE-CD1 4.06Å; M182-I276 HydrophobicContact SD-CD1 4.15Å; M218-I276 HydrophobicContact CB-CG2 4.06Å; M218-I276 HydrophobicContact CE-CB 4.06Å; M218-I276 HydrophobicContact CE-CG2 3.69Å; M218-I276 HydrophobicContact CG-CG2 3.71Å; M218-I276 HydrophobicContact SD-CG2 4.35Å; M219-I276 HydrophobicContact CE-CD1 3.92Å; M219-I276 HydrophobicContact CE-CG1 3.64Å; M219-I276 HydrophobicContact CG-CD1 4.1Å; M219-I276 HydrophobicContact CG-CG1 4.02Å; M219-I276 HydrophobicContact CG-CG2 4.24Å; T222-I276 HydrophobicContact CG2-CG2 4.35Å; V272-I276 HydrophobicContact CG1-CD1 3.66Å; V272-I276 HydrophobicContact CG1-CG1 4.35Å; V272-I276 VanDerWaalsContact O-CG1 3.28Å; V272-I276 WeakPolarHBondContact O-CG1 3.36Å; V272-I276 PolarHBondContact O-N 3.18Å; V273-I276 PolarHBondContact O-N 3.37Å; I276-Q279 WeakPolarHBondContact O-CG 3.4Å; I276-Q279 PolarHBondContact O-N 3.07Å; I276-F284 HydrophobicContact CB-CE1 4.46Å; I276-F284 HydrophobicContact CG2-CE1 4.13Å; I276-A287 HydrophobicContact CG1-CB 4.12Å
277L95.8Very high95.7Very high12 Ų1220.2 Ų20.26%0.06310%0.101CC..Hα-helixtrans-70.5-29178.8-74.7174.7000113.7W171 M179 M218 A233 F236 L237 V273 T274W171-L277 HydrophobicContact CZ2-CD2 4.32Å; M179-L277 HydrophobicContact CE-CD1 4.07Å; M179-L277 HydrophobicContact CE-CD2 3.96Å; M179-L277 HydrophobicContact CE-CG 4.28Å; M218-L277 HydrophobicContact CE-CD1 4.48Å; M218-L277 HydrophobicContact CE-CD2 3.43Å; M218-L277 VanDerWaalsContact CE-CD2 3.43Å; M218-L277 HydrophobicContact CE-CG 3.54Å; A233-L277 HydrophobicContact CB-CB 4.19Å; A233-L277 HydrophobicContact CB-CD2 3.98Å; A233-L277 HydrophobicContact CB-CG 4.48Å; F236-L277 HydrophobicContact CB-CD1 3.62Å; L237-L277 HydrophobicContact CD2-CB 3.75Å; L237-L277 HydrophobicContact CD2-CD1 4.1Å; L237-L277 HydrophobicContact CG-CB 4.05Å; L237-L277 HydrophobicContact CG-CD1 3.99Å; V273-L277 HydrophobicContact CG1-CD1 3.88Å; V273-L277 HydrophobicContact CG1-CG 4.42Å; V273-L277 WeakPolarHBondContact O-CB 3.47Å; V273-L277 WeakPolarHBondContact O-CG 3.3Å; V273-L277 PolarHBondContact O-N 2.97Å; T274-L277 PolarHBondContact O-N 3.12Å
278I95.2Very high95.6Very high22 Ų2220.2 Ų20.211%0.11310%0.101CC..Hα-helixtrans-74-26.9176.1-70.1167.1000112L237 T274 T280 T360 W363L237-I278 HydrophobicContact CD2-CG1 4.14Å; T274-I278 WeakPolarHBondContact O-CG1 3.29Å; T274-I278 PolarHBondContact O-N 3.04Å; T274-I278 VanDerWaalsContact O-N 3.12Å; I278-T280 VanDerWaalsContact C-N 3.34Å; I278-T280 HydrophobicContact CG2-CG2 3.82Å; I278-T280 PolarHBondContact O-N 3.2Å; I278-T360 HydrophobicContact CD1-CG2 3.58Å; I278-W363 HydrophobicContact CD1-CB 4.02Å; I278-W363 HydrophobicContact CD1-CG 4.12Å; I278-W363 HydrophobicContact CG1-CB 4.33Å; I278-W363 HydrophobicContact CG1-CD2 4.46Å; I278-W363 HydrophobicContact CG1-CG 4.02Å; I278-W363 HydrophobicContact CG2-CB 4.22Å; I278-W363 HydrophobicContact CG2-CG 4.37Å
279Q93.1Very high95.5Very high41 Ų4120.4 Ų20.419%0.19210%0.102CC..THydrogen-bonded Turntrans56.935.5172.3-56.5179.1-32.800115.6T222 N226 T229 A275 I276 F284T222-Q279 HydrophobicContact CG2-CG 4.34Å; N226-Q279 PolarHBondContact OD1-NE2 3.33Å; N226-Q279 VanDerWaalsContact OD1-NE2 3.17Å; N226-Q279 PolarHBondContact OD1-OE1 3.02Å; T229-Q279 PolarHBondContact OG1-OE1 3.15Å; A275-Q279 PolarHBondContact O-N 3.39Å; I276-Q279 WeakPolarHBondContact O-CG 3.4Å; I276-Q279 PolarHBondContact O-N 3.07Å; Q279-F284 HydrophobicContact CB-CE2 4.48Å; Q279-F284 HydrophobicContact CB-CZ 3.96Å; Q279-F284 HydrophobicContact CG-CE1 4.5Å; Q279-F284 HydrophobicContact CG-CZ 4.03Å
280T93.1Very high95.5Very high41 Ų4120.3 Ų20.325%0.25210%0.101SC..  trans-92.7152.8169.562.80000110.5I278 W282 S283 F284I278-T280 VanDerWaalsContact C-N 3.34Å; I278-T280 HydrophobicContact CG2-CG2 3.82Å; I278-T280 PolarHBondContact O-N 3.2Å; T280-W282 VanDerWaalsContact C-N 3.3Å; T280-W282 PolarHBondContact O-N 3.22Å; T280-S283 PolarHBondContact N-OG 3.12Å; T280-S283 PolarHBondContact O-N 3.44Å; T280-S283 PolarHBondContact O-OG 3.28Å; T280-S283 WeakPolarHBondContact OG1-CB 3.38Å; T280-S283 PolarHBondContact OG1-N 3.34Å; T280-S283 VanDerWaalsContact OG1-N 3.17Å; T280-S283 PolarHBondContact OG1-OG 3.16Å; T280-F284 PolarHBondContact O-N 3.03Å
281P92.1Very high95.5Very high88 Ų8820 Ų2057%0.57110%0.098SC*.Hα-helixtrans-54.6-45.5177.4-27.334.9000112.8S283 F284 T285P281-S283 VanDerWaalsContact C-N 3.28Å; P281-S283 PolarHBondContact O-N 3.14Å; P281-F284 PolarHBondContact O-N 3.4Å; P281-T285 WeakPolarHBondContact O-CG2 3.42Å; P281-T285 PolarHBondContact O-N 3.38Å
282W93.4Very high95.5Very high159 Ų15919.7 Ų19.760%0.60210%0.097SC*.Hα-helixtrans-65.3-28.9176.5-81.566.4000113.2T280 T285 G286 T359T280-W282 VanDerWaalsContact C-N 3.3Å; T280-W282 PolarHBondContact O-N 3.22Å; W282-T285 WeakPolarHBondContact CA-OG1 3.48Å; W282-T285 PolarHBondContact O-OG1 3.31Å; W282-G286 PolarHBondContact O-N 2.64Å; W282-T359 HydrophobicContact CB-CG2 3.35Å
283S95.2Very high95.4Very high0 Ų019.7 Ų19.70%010%0.097CC..Hα-helixtrans-77.8-35.6178.370.50000110.7A275 T280 P281 A287 T359A275-S283 WeakPolarHBondContact CB-O 3.46Å; A275-S283 WeakPolarHBondContact O-CB 3Å; A275-S283 PolarHBondContact O-OG 3.04Å; T280-S283 PolarHBondContact N-OG 3.12Å; T280-S283 PolarHBondContact O-N 3.44Å; T280-S283 PolarHBondContact O-OG 3.28Å; T280-S283 WeakPolarHBondContact OG1-CB 3.38Å; T280-S283 PolarHBondContact OG1-N 3.34Å; T280-S283 VanDerWaalsContact OG1-N 3.17Å; T280-S283 PolarHBondContact OG1-OG 3.16Å; P281-S283 VanDerWaalsContact C-N 3.28Å; P281-S283 PolarHBondContact O-N 3.14Å; S283-A287 WeakPolarHBondContact O-CB 3.22Å; S283-A287 PolarHBondContact O-N 2.93Å; S283-T359 WeakPolarHBondContact CB-OG1 2.9Å
284F94.3Very high95.4Very high34 Ų3419.6 Ų19.615%0.14910%0.096CC..Hα-helixtrans-65.3-43.2170.8-70.2-35.4000112.3M219 T222 I276 Q279 T280 P281 G286 A287 V288M219-F284 HydrophobicContact CE-CD1 4.13Å; M219-F284 HydrophobicContact CG-CD1 4.18Å; M219-F284 HydrophobicContact CG-CE1 4.29Å; T222-F284 HydrophobicContact CG2-CE1 4.3Å; T222-F284 HydrophobicContact CG2-CZ 3.99Å; I276-F284 HydrophobicContact CB-CE1 4.46Å; I276-F284 HydrophobicContact CG2-CE1 4.13Å; Q279-F284 HydrophobicContact CB-CE2 4.48Å; Q279-F284 HydrophobicContact CB-CZ 3.96Å; Q279-F284 HydrophobicContact CG-CE1 4.5Å; Q279-F284 HydrophobicContact CG-CZ 4.03Å; T280-F284 PolarHBondContact O-N 3.03Å; P281-F284 PolarHBondContact O-N 3.4Å; F284-G286 PolarHBondContact O-N 2.92Å; F284-A287 PolarHBondContact O-N 3.41Å; F284-V288 WeakPolarHBondContact O-CG2 3.49Å; F284-V288 PolarHBondContact O-N 2.84Å
285T93.6Very high95.4Very high9 Ų919.5 Ų19.56%0.05510%0.096CC..Hα-helixtrans-63.3-46179.1660000110.4P281 W282 A287 V288 I289 T430 S433P281-T285 WeakPolarHBondContact O-CG2 3.42Å; P281-T285 PolarHBondContact O-N 3.38Å; W282-T285 WeakPolarHBondContact CA-OG1 3.48Å; W282-T285 PolarHBondContact O-OG1 3.31Å; T285-A287 PolarHBondContact O-N 3.21Å; T285-V288 PolarHBondContact O-N 3.22Å; T285-I289 WeakPolarHBondContact O-CD1 3.39Å; T285-I289 VanDerWaalsContact O-CG1 3.26Å; T285-I289 WeakPolarHBondContact O-CG1 3.45Å; T285-I289 PolarHBondContact O-N 2.98Å; T285-T430 VanDerWaalsContact CB-O 3.25Å; T285-T430 WeakPolarHBondContact CB-O 3.4Å; T285-T430 WeakPolarHBondContact CG2-O 3.43Å; T285-S433 VanDerWaalsContact CG2-CB 3.42Å; T285-S433 WeakPolarHBondContact CG2-OG 3.46Å
286G95.6Very high95.4Very high0 Ų019.7 Ų19.70%010%0.097CC..Hα-helixtrans-59.8-41.717400000114.1W282 F284 L290 S355W282-G286 PolarHBondContact O-N 2.64Å; F284-G286 PolarHBondContact O-N 2.92Å; G286-L290 WeakPolarHBondContact O-CB 3.33Å; G286-L290 PolarHBondContact O-N 3.43Å; G286-S355 WeakPolarHBondContact CA-OG 3.27Å
287A96.4Very high95.5Very high0 Ų019.7 Ų19.70%010%0.097CC..Hα-helixtrans-62.7-42.917600000112.4M219 V272 A275 I276 S283 F284 T285 M291M219-A287 HydrophobicContact CE-CB 3.37Å; V272-A287 HydrophobicContact CG1-CB 4.19Å; A275-A287 HydrophobicContact CB-CB 3.97Å; I276-A287 HydrophobicContact CG1-CB 4.12Å; S283-A287 WeakPolarHBondContact O-CB 3.22Å; S283-A287 PolarHBondContact O-N 2.93Å; F284-A287 PolarHBondContact O-N 3.41Å; T285-A287 PolarHBondContact O-N 3.21Å; A287-M291 WeakPolarHBondContact O-CB 3.42Å; A287-M291 VanDerWaalsContact O-CG 3.24Å; A287-M291 WeakPolarHBondContact O-CG 3.19Å; A287-M291 PolarHBondContact O-N 3.09Å
288V95.4Very high95.5Very high0 Ų019.1 Ų19.10%09%0.094CC..Hα-helixtrans-65-49.1177.6175.80000111L36 M219 F284 T285 L290 M291 I292 I429L36-V288 HydrophobicContact CD1-CG2 3.4Å; L36-V288 VanDerWaalsContact CD1-CG2 3.4Å; M219-V288 HydrophobicContact CE-CG2 3.84Å; M219-V288 HydrophobicContact SD-CG2 3.96Å; F284-V288 WeakPolarHBondContact O-CG2 3.49Å; F284-V288 PolarHBondContact O-N 2.84Å; T285-V288 PolarHBondContact O-N 3.22Å; V288-L290 VanDerWaalsContact C-N 3.33Å; V288-L290 PolarHBondContact O-N 2.67Å; V288-M291 HydrophobicContact CG2-CE 4.15Å; V288-M291 WeakPolarHBondContact O-CB 3.38Å; V288-M291 PolarHBondContact O-N 3.48Å; V288-I292 HydrophobicContact CG1-CD1 3.82Å; V288-I292 WeakPolarHBondContact O-CD1 3.49Å; V288-I292 WeakPolarHBondContact O-CG1 3.28Å; V288-I292 PolarHBondContact O-N 3.43Å; V288-I292 VanDerWaalsContact O-N 3.12Å; V288-I429 WeakPolarHBondContact CG1-O 3.38Å
289I95.8Very high95.7Very high4 Ų418 Ų182%0.0219%0.088CC..Hα-helixtrans-57.5-49.4177.7-64.9164.6000109.8T285 M291 I292 A293 I348 L351 I429 T430T285-I289 WeakPolarHBondContact O-CD1 3.39Å; T285-I289 VanDerWaalsContact O-CG1 3.26Å; T285-I289 WeakPolarHBondContact O-CG1 3.45Å; T285-I289 PolarHBondContact O-N 2.98Å; I289-M291 VanDerWaalsContact C-N 3.35Å; I289-M291 PolarHBondContact O-N 2.97Å; I289-I292 PolarHBondContact O-N 3.2Å; I289-A293 WeakPolarHBondContact O-CB 3.4Å; I289-A293 PolarHBondContact O-N 3.28Å; I289-I348 HydrophobicContact CG2-CB 4.39Å; I289-I348 VanDerWaalsContact CG2-O 3.28Å; I289-I348 WeakPolarHBondContact CG2-O 3.19Å; I289-L351 HydrophobicContact CD1-CD2 3.85Å; I289-L351 HydrophobicContact CD1-CG 4.05Å; I289-L351 HydrophobicContact CG2-CB 4.21Å; I289-L351 HydrophobicContact CG2-CD2 4.32Å; I289-L351 HydrophobicContact CG2-CG 4.39Å; I289-I429 HydrophobicContact CG1-CD1 4.29Å; I289-I429 HydrophobicContact CG1-CG1 4.19Å; I289-I429 WeakPolarHBondContact CG1-O 3.28Å; I289-I429 HydrophobicContact CG2-CD1 4.07Å; I289-T430 HydrophobicContact CD1-CG2 4.09Å
290L96.8Very high95.9Very high0 Ų016.1 Ų16.10%08%0.079CC..Hα-helixtrans-63.5-38179.9-172.160.4000112.3L271 V272 G286 V288 I292 H294 E353L271-L290 HydrophobicContact CB-CD2 3.78Å; L271-L290 HydrophobicContact CD1-CD2 4.31Å; V272-L290 HydrophobicContact CG2-CB 4.2Å; V272-L290 HydrophobicContact CG2-CD2 3.78Å; V272-L290 HydrophobicContact CG2-CG 4.03Å; G286-L290 WeakPolarHBondContact O-CB 3.33Å; G286-L290 PolarHBondContact O-N 3.43Å; V288-L290 VanDerWaalsContact C-N 3.33Å; V288-L290 PolarHBondContact O-N 2.67Å; L290-I292 PolarHBondContact O-N 3.42Å; L290-H294 WeakPolarHBondContact O-CA 3.3Å; L290-H294 WeakPolarHBondContact O-CB 3.48Å; L290-H294 PolarHBondContact O-N 2.97Å; L290-E353 HydrophobicContact CD1-CG 3.68Å; L290-E353 HydrophobicContact CD2-CG 4.4Å
291M97.3Very high96.1Very high0 Ų014.1 Ų14.10%07%0.067CC..Hα-helixtrans-59.1-46.1175-84.3-169.4-64.500111.8K212 M219 V272 A287 V288 I289 G295K212-M291 HydrophobicContact CB-SD 4.19Å; K212-M291 WeakPolarHBondContact CE-O 3.31Å; K212-M291 HydrophobicContact CG-CB 3.76Å; K212-M291 HydrophobicContact CG-CG 3.91Å; K212-M291 HydrophobicContact CG-SD 4.07Å; M219-M291 HydrophobicContact CE-CE 3.72Å; M219-M291 HydrophobicContact SD-CE 4.13Å; V272-M291 HydrophobicContact CG1-CG 3.81Å; V272-M291 HydrophobicContact CG1-SD 4.05Å; V272-M291 HydrophobicContact CG2-CG 4.01Å; A287-M291 WeakPolarHBondContact O-CB 3.42Å; A287-M291 VanDerWaalsContact O-CG 3.24Å; A287-M291 WeakPolarHBondContact O-CG 3.19Å; A287-M291 PolarHBondContact O-N 3.09Å; V288-M291 HydrophobicContact CG2-CE 4.15Å; V288-M291 WeakPolarHBondContact O-CB 3.38Å; V288-M291 PolarHBondContact O-N 3.48Å; I289-M291 VanDerWaalsContact C-N 3.35Å; I289-M291 PolarHBondContact O-N 2.97Å; M291-G295 PolarHBondContact O-N 2.92Å
292I96.9Very high96.4Very high0 Ų010 Ų100%04%0.04CC..Hα-helixtrans-70.3-49.5-179.3-60.9152.2000110.4P39 V288 I289 L290 H294 G295 L296 L422 I429P39-I292 HydrophobicContact CB-CD1 3.27Å; P39-I292 HydrophobicContact CB-CG1 3.95Å; P39-I292 HydrophobicContact CG-CD1 4.08Å; V288-I292 HydrophobicContact CG1-CD1 3.82Å; V288-I292 WeakPolarHBondContact O-CD1 3.49Å; V288-I292 WeakPolarHBondContact O-CG1 3.28Å; V288-I292 PolarHBondContact O-N 3.43Å; V288-I292 VanDerWaalsContact O-N 3.12Å; I289-I292 PolarHBondContact O-N 3.2Å; L290-I292 PolarHBondContact O-N 3.42Å; I292-H294 PolarHBondContact O-N 2.95Å; I292-G295 WeakPolarHBondContact O-CA 3.36Å; I292-G295 PolarHBondContact O-N 3.07Å; I292-L296 HydrophobicContact CG2-CD1 4.44Å; I292-L296 PolarHBondContact O-N 3.36Å; I292-L422 HydrophobicContact CG2-CD1 4.18Å; I292-I429 HydrophobicContact CD1-CB 3.61Å; I292-I429 HydrophobicContact CD1-CG2 3.67Å
293A96.6Very high96.6Very high0 Ų02.6 Ų2.60%01%0.013CC..Hα-helixtrans-58.9-49-178.900000111.3I289 G295 L296 T297 I348 N349I289-A293 WeakPolarHBondContact O-CB 3.4Å; I289-A293 PolarHBondContact O-N 3.28Å; A293-G295 VanDerWaalsContact C-N 3.31Å; A293-G295 PolarHBondContact O-N 3.13Å; A293-L296 PolarHBondContact O-N 3.42Å; A293-T297 WeakPolarHBondContact O-CG2 3.47Å; A293-T297 PolarHBondContact O-N 3.05Å; A293-T297 PolarHBondContact O-OG1 3.15Å; A293-I348 HydrophobicContact CB-CB 4.13Å; A293-I348 HydrophobicContact CB-CD1 3.64Å; A293-I348 HydrophobicContact CB-CG1 3.63Å; A293-N349 HydrophobicContact CB-CB 4.45Å; A293-N349 WeakPolarHBondContact CB-OD1 3.47Å; A293-N349 PolarHBondContact O-OD1 3.42Å
294H97.2Very high96.7Very high0 Ų02.6 Ų2.60%01%0.013CC..Hα-helixtrans-63.3-36.6173.6-175.664.4000112.1K212 S265 H268 M269 L290 I292 L296 T297 S298K212-H294 PolarHBondContact NZ-CD2 3.3Å; K212-H294 VanDerWaalsContact NZ-CD2 3.34Å; S265-H294 VanDerWaalsContact CA-CE1 3.49Å; S265-H294 WeakPolarHBondContact CA-CE1 3.42Å; S265-H294 VanDerWaalsContact CA-NE2 3.32Å; S265-H294 WeakPolarHBondContact CA-NE2 3.47Å; S265-H294 WeakPolarHBondContact CB-NE2 3.36Å; H268-H294 AromaticContact CD2-CE1 3.58Å; H268-H294 AromaticContact CD2-ND1 3.38Å; H268-H294 PolarHBondContact CD2-ND1 3.25Å; H268-H294 AromaticContact CG-CE1 3.99Å; H268-H294 AromaticContact CG-ND1 3.62Å; M269-H294 HydrophobicContact CE-CB 3.82Å; M269-H294 WeakPolarHBondContact CE-CD2 2.91Å; L290-H294 WeakPolarHBondContact O-CA 3.3Å; L290-H294 WeakPolarHBondContact O-CB 3.48Å; L290-H294 PolarHBondContact O-N 2.97Å; I292-H294 PolarHBondContact O-N 2.95Å; H294-L296 PolarHBondContact O-N 3.04Å; H294-T297 VanDerWaalsContact CA-OG1 3.25Å; H294-T297 WeakPolarHBondContact CA-OG1 3.32Å; H294-T297 PolarHBondContact O-OG1 3.28Å; H294-S298 VanDerWaalsContact O-CB 3.22Å; H294-S298 WeakPolarHBondContact O-CB 3.34Å; H294-S298 PolarHBondContact O-N 2.97Å; H294-S298 PolarHBondContact O-OG 2.97Å
295G96.9Very high96.8Very high0 Ų01.2 Ų1.20%01%0.008CC..Hα-helixtrans-61.6-42.5178.400000113.4A208 M291 I292 A293 S298 S299A208-G295 WeakPolarHBondContact CB-O 3.35Å; M291-G295 PolarHBondContact O-N 2.92Å; I292-G295 WeakPolarHBondContact O-CA 3.36Å; I292-G295 PolarHBondContact O-N 3.07Å; A293-G295 VanDerWaalsContact C-N 3.31Å; A293-G295 PolarHBondContact O-N 3.13Å; G295-S298 PolarHBondContact O-OG 3.28Å; G295-S299 WeakPolarHBondContact O-CB 3.29Å; G295-S299 PolarHBondContact O-N 2.93Å; G295-S299 PolarHBondContact O-OG 3.05Å
296L97.1Very high96.9Very high3 Ų31.5 Ų1.52%0.0161%0.009CC..Hα-helixtrans-72.4-43.6176.4-67.5168.8000112.2L43 I292 A293 H294 S299 L300 P418 I419 L422L43-L296 HydrophobicContact CD1-CD2 3.59Å; L43-L296 HydrophobicContact CD1-CG 3.8Å; I292-L296 HydrophobicContact CG2-CD1 4.44Å; I292-L296 PolarHBondContact O-N 3.36Å; A293-L296 PolarHBondContact O-N 3.42Å; H294-L296 PolarHBondContact O-N 3.04Å; L296-S299 PolarHBondContact O-OG 3.44Å; L296-L300 WeakPolarHBondContact O-CB 3.28Å; L296-L300 PolarHBondContact O-N 3.26Å; L296-L300 VanDerWaalsContact O-N 3.1Å; L296-P418 HydrophobicContact CD1-CB 4.04Å; L296-I419 HydrophobicContact CB-CD1 3.78Å; L296-I419 HydrophobicContact CB-CG1 3.62Å; L296-I419 HydrophobicContact CD1-CG1 3.76Å; L296-I419 HydrophobicContact CG-CG1 4.31Å; L296-L422 HydrophobicContact CD1-CD1 4.26Å
297T97.6Very high96.9Very high0 Ų01.6 Ų1.60%01%0.01CC..Hα-helixtrans-69.7-44.6-178.349.30000113.1A293 H294 L300 L301 A340 N349 I419A293-T297 WeakPolarHBondContact O-CG2 3.47Å; A293-T297 PolarHBondContact O-N 3.05Å; A293-T297 PolarHBondContact O-OG1 3.15Å; H294-T297 VanDerWaalsContact CA-OG1 3.25Å; H294-T297 WeakPolarHBondContact CA-OG1 3.32Å; H294-T297 PolarHBondContact O-OG1 3.28Å; T297-L300 WeakPolarHBondContact O-CB 3.37Å; T297-L300 PolarHBondContact O-N 3.14Å; T297-L301 WeakPolarHBondContact O-CG 3.48Å; T297-L301 PolarHBondContact O-N 3.02Å; T297-A340 HydrophobicContact CG2-CB 3.52Å; T297-N349 WeakPolarHBondContact CG2-OD1 3.39Å; T297-N349 PolarHBondContact OG1-ND2 3.44Å; T297-I419 HydrophobicContact CG2-CD1 3.84Å
298S97Very high96.8Very high0 Ų01.9 Ų1.90%01%0.011CC..Hα-helixtrans-65.4-40.5177.859.30000112.5H294 G295 L301 F302H294-S298 VanDerWaalsContact O-CB 3.22Å; H294-S298 WeakPolarHBondContact O-CB 3.34Å; H294-S298 PolarHBondContact O-N 2.97Å; H294-S298 PolarHBondContact O-OG 2.97Å; G295-S298 PolarHBondContact O-OG 3.28Å; S298-L301 PolarHBondContact O-N 3.42Å; S298-F302 WeakPolarHBondContact O-CD2 3.26Å; S298-F302 PolarHBondContact O-N 2.79Å
299S97.5Very high96.8Very high0 Ų03.4 Ų3.40%02%0.017CC..Hα-helixtrans-64.4-41.317654.60000112.1G295 L296 F302 C303 H415G295-S299 WeakPolarHBondContact O-CB 3.29Å; G295-S299 PolarHBondContact O-N 2.93Å; G295-S299 PolarHBondContact O-OG 3.05Å; L296-S299 PolarHBondContact O-OG 3.44Å; S299-F302 PolarHBondContact O-N 2.91Å; S299-C303 PolarHBondContact O-N 3.42Å; S299-C303 PolarHBondContact O-SG 3.36Å; S299-H415 PolarHBondContact OG-CE1 2.97Å; S299-H415 PolarHBondContact OG-ND1 3.48Å
300L97.9Very high96.6Very high0 Ų05 Ų50%03%0.025CC..Hα-helixtrans-57.5-47.7171.5176.564.4000112L296 T297 F302 C303 L304 A337 M412 H415 L416L296-L300 WeakPolarHBondContact O-CB 3.28Å; L296-L300 PolarHBondContact O-N 3.26Å; L296-L300 VanDerWaalsContact O-N 3.1Å; T297-L300 WeakPolarHBondContact O-CB 3.37Å; T297-L300 PolarHBondContact O-N 3.14Å; L300-F302 PolarHBondContact O-N 3.25Å; L300-C303 WeakPolarHBondContact O-CB 3.4Å; L300-C303 PolarHBondContact O-N 3.34Å; L300-C303 VanDerWaalsContact O-N 3.11Å; L300-L304 HydrophobicContact CD1-CD1 4.48Å; L300-L304 HydrophobicContact CG-CD1 4.23Å; L300-L304 WeakPolarHBondContact O-CG 3.21Å; L300-L304 PolarHBondContact O-N 3.48Å; L300-A337 HydrophobicContact CD2-CB 3.5Å; L300-A337 VanDerWaalsContact CD2-CB 3.5Å; L300-A337 HydrophobicContact CG-CB 3.9Å; L300-M412 HydrophobicContact CD1-CB 4.12Å; L300-M412 HydrophobicContact CD1-CG 4.33Å; L300-M412 HydrophobicContact CD1-SD 3.42Å; L300-M412 WeakPolarHBondContact CD1-SD 3.37Å; L300-H415 HydrophobicContact CB-CB 3.97Å; L300-H415 HydrophobicContact CD1-CB 3.75Å; L300-H415 HydrophobicContact CG-CB 4.31Å; L300-L416 HydrophobicContact CD2-CD1 4.13Å; L300-L416 HydrophobicContact CD2-CD2 3.84Å; L300-L416 HydrophobicContact CD2-CG 3.72Å
301L97.8Very high96.4Very high0 Ų06.8 Ų6.80%03%0.031CC..Hα-helixtrans-61.9-41.2178.1-73172.4000112.2I261 T297 S298 C303 L304 A305 W334 A337 N341 M385I261-L301 HydrophobicContact CD1-CB 3.91Å; I261-L301 WeakPolarHBondContact CD1-O 3.47Å; I261-L301 HydrophobicContact CG1-CB 4.11Å; I261-L301 HydrophobicContact CG2-CB 3.95Å; I261-L301 HydrophobicContact CG2-CD1 4.5Å; T297-L301 WeakPolarHBondContact O-CG 3.48Å; T297-L301 PolarHBondContact O-N 3.02Å; S298-L301 PolarHBondContact O-N 3.42Å; L301-C303 VanDerWaalsContact C-N 3.28Å; L301-C303 PolarHBondContact O-N 3.22Å; L301-L304 HydrophobicContact CD2-CD1 4.42Å; L301-L304 PolarHBondContact O-N 2.99Å; L301-A305 WeakPolarHBondContact O-CB 3.33Å; L301-A305 PolarHBondContact O-N 3.34Å; L301-W334 HydrophobicContact CD2-CZ3 4.33Å; L301-A337 HydrophobicContact CD2-CB 3.77Å; L301-A337 HydrophobicContact CG-CB 4.37Å; L301-N341 HydrophobicContact CD1-CB 4.07Å; L301-M385 HydrophobicContact CD1-CE 4.39Å; L301-M385 HydrophobicContact CD2-SD 4.02Å
302F98.1Very high96.1Very high0 Ų08.2 Ų8.20%04%0.04CC..Hα-helixtrans-63.4-34.4174-81.6-65.1000112.2H195 I200 A207 K258 I261 A262 S298 S299 L300 A305 N306H195-F302 HydrophobicContact CB-CE1 4.09Å; H195-F302 HydrophobicContact CB-CZ 3.92Å; H195-F302 AromaticContact CE1-CE2 3.88Å; H195-F302 AromaticContact CG-CZ 3.7Å; H195-F302 AromaticContact ND1-CE1 3.89Å; H195-F302 AromaticContact ND1-CE2 3.44Å; H195-F302 WeakPolarHBondContact ND1-CE2 3.16Å; H195-F302 AromaticContact ND1-CZ 3.2Å; H195-F302 WeakPolarHBondContact ND1-CZ 3.46Å; I200-F302 HydrophobicContact CD1-CB 4.08Å; I200-F302 WeakPolarHBondContact CD1-O 3.48Å; A207-F302 HydrophobicContact CB-CD2 3.84Å; A207-F302 HydrophobicContact CB-CE2 3.68Å; K258-F302 HydrophobicContact CB-CE1 4.39Å; K258-F302 HydrophobicContact CG-CD1 4.38Å; K258-F302 HydrophobicContact CG-CE1 4.46Å; I261-F302 HydrophobicContact CB-CE1 4.06Å; I261-F302 HydrophobicContact CB-CE2 4.38Å; I261-F302 HydrophobicContact CB-CZ 3.97Å; I261-F302 HydrophobicContact CD1-CD1 4.43Å; I261-F302 HydrophobicContact CG2-CD1 4.28Å; I261-F302 HydrophobicContact CG2-CD2 3.82Å; I261-F302 HydrophobicContact CG2-CE1 4Å; I261-F302 HydrophobicContact CG2-CE2 3.49Å; I261-F302 VanDerWaalsContact CG2-CE2 3.49Å; I261-F302 HydrophobicContact CG2-CG 4.19Å; I261-F302 HydrophobicContact CG2-CZ 3.59Å; A262-F302 HydrophobicContact CB-CZ 4.41Å; S298-F302 WeakPolarHBondContact O-CD2 3.26Å; S298-F302 PolarHBondContact O-N 2.79Å; S299-F302 PolarHBondContact O-N 2.91Å; L300-F302 PolarHBondContact O-N 3.25Å; F302-A305 WeakPolarHBondContact O-CB 3.12Å; F302-A305 PolarHBondContact O-N 2.9Å; F302-N306 WeakPolarHBondContact O-CB 3.03Å; F302-N306 PolarHBondContact O-N 3.25Å
303C97.2Very high95.8Very high4 Ų415 Ų153%0.0277%0.071CC..Hα-helixtrans-69.4-40.3174.9-68.60000112.8M204 S299 L300 L301 A305 N306 S307 L411 M412M204-C303 VanDerWaalsContact CE-SG 3.53Å; M204-C303 PolarHBondContact SD-SG 2.73Å; S299-C303 PolarHBondContact O-N 3.42Å; S299-C303 PolarHBondContact O-SG 3.36Å; L300-C303 WeakPolarHBondContact O-CB 3.4Å; L300-C303 PolarHBondContact O-N 3.34Å; L300-C303 VanDerWaalsContact O-N 3.11Å; L301-C303 VanDerWaalsContact C-N 3.28Å; L301-C303 PolarHBondContact O-N 3.22Å; C303-A305 VanDerWaalsContact C-N 3.35Å; C303-N306 WeakPolarHBondContact O-CB 3.17Å; C303-N306 PolarHBondContact O-N 3.17Å; C303-N306 VanDerWaalsContact O-N 3.16Å; C303-S307 PolarHBondContact O-N 3.41Å; C303-L411 HydrophobicContact CB-CD2 3.37Å; C303-L411 VanDerWaalsContact SG-CD2 3.55Å; C303-M412 HydrophobicContact CB-CE 3.9Å; C303-M412 HydrophobicContact CB-SD 4.21Å
304L97.6Very high95.5Very high0 Ų016.3 Ų16.30%08%0.081CC..Hα-helixtrans-64.4-39.8173-71.5170.4000111.7L300 L301 N306 S307 N308 M330 W333 W334 A337 M412L300-L304 HydrophobicContact CD1-CD1 4.48Å; L300-L304 HydrophobicContact CG-CD1 4.23Å; L300-L304 WeakPolarHBondContact O-CG 3.21Å; L300-L304 PolarHBondContact O-N 3.48Å; L301-L304 HydrophobicContact CD2-CD1 4.42Å; L301-L304 PolarHBondContact O-N 2.99Å; L304-N306 PolarHBondContact O-N 3.03Å; L304-S307 PolarHBondContact O-N 3.06Å; L304-S307 PolarHBondContact O-OG 3.02Å; L304-N308 PolarHBondContact O-N 2.97Å; L304-M330 HydrophobicContact CD2-CG 4.46Å; L304-M330 HydrophobicContact CD2-SD 3.53Å; L304-M330 VanDerWaalsContact CD2-SD 3.53Å; L304-W333 HydrophobicContact CD2-CB 4Å; L304-W334 HydrophobicContact CB-CD2 4.11Å; L304-W334 HydrophobicContact CB-CH2 4.02Å; L304-W334 HydrophobicContact CB-CZ2 3.58Å; L304-W334 HydrophobicContact CB-CZ3 4.48Å; L304-W334 HydrophobicContact CD1-CD2 3.99Å; L304-W334 HydrophobicContact CD1-CE3 4.2Å; L304-W334 HydrophobicContact CD1-CG 4.18Å; L304-W334 HydrophobicContact CD2-CD2 4.46Å; L304-W334 HydrophobicContact CD2-CG 4.21Å; L304-W334 HydrophobicContact CG-CD2 4.43Å; L304-A337 HydrophobicContact CD1-CB 3.49Å; L304-A337 VanDerWaalsContact CD1-CB 3.49Å; L304-M412 HydrophobicContact CD2-CE 3.74Å; L304-M412 HydrophobicContact CD2-CG 4.17Å; L304-M412 HydrophobicContact CD2-SD 3.62Å; L304-M412 HydrophobicContact CG-CE 4.08Å; L304-M412 HydrophobicContact CG-SD 3.79Å
305A97Very high95.3Very high6 Ų618.6 Ų18.65%0.059%0.09CC..Hα-helixtrans-57.2-41.8170.200000111.8L257 K258 I261 L301 F302 C303 N308 Y309L257-A305 HydrophobicContact CD2-CB 3.09Å; K258-A305 HydrophobicContact CG-CB 4.21Å; I261-A305 HydrophobicContact CD1-CB 3.84Å; L301-A305 WeakPolarHBondContact O-CB 3.33Å; L301-A305 PolarHBondContact O-N 3.34Å; F302-A305 WeakPolarHBondContact O-CB 3.12Å; F302-A305 PolarHBondContact O-N 2.9Å; C303-A305 VanDerWaalsContact C-N 3.35Å; A305-N308 PolarHBondContact O-N 3.43Å; A305-Y309 WeakPolarHBondContact O-CB 3.42Å; A305-Y309 PolarHBondContact O-N 2.91Å
306N96Very high95.1Very high15 Ų1522.2 Ų22.28%0.0811%0.108CC..Hα-helixtrans-71.5-34.7-179-174.967.5000113I200 F302 C303 L304 N308 Y309 E310I200-N306 HydrophobicContact CB-CB 4.24Å; I200-N306 HydrophobicContact CD1-CB 3.7Å; I200-N306 HydrophobicContact CG1-CB 3.83Å; F302-N306 WeakPolarHBondContact O-CB 3.03Å; F302-N306 PolarHBondContact O-N 3.25Å; C303-N306 WeakPolarHBondContact O-CB 3.17Å; C303-N306 PolarHBondContact O-N 3.17Å; C303-N306 VanDerWaalsContact O-N 3.16Å; L304-N306 PolarHBondContact O-N 3.03Å; N306-N308 VanDerWaalsContact C-N 3.29Å; N306-N308 PolarHBondContact O-N 3.29Å; N306-Y309 PolarHBondContact O-N 3.48Å; N306-E310 PolarHBondContact ND2-OE1 2.96Å; N306-E310 WeakPolarHBondContact O-CB 3.49Å; N306-E310 WeakPolarHBondContact O-CG 3.44Å; N306-E310 PolarHBondContact O-N 2.89Å
307S95.3Very high94.9Very high2 Ų222.1 Ų22.11%0.01411%0.108CC..Hα-helixtrans-64.2-36.2175.766.90000111.7C303 L304 R311C303-S307 PolarHBondContact O-N 3.41Å; L304-S307 PolarHBondContact O-N 3.06Å; L304-S307 PolarHBondContact O-OG 3.02Å; S307-R311 PolarHBondContact O-NH1 3.35Å
308N94.6Very high94.6Very high6 Ų626.2 Ų26.23%0.03213%0.129CC..Hα-helixtrans-68.2-43171.2-69.3-2.8000111.5L304 A305 N306 R311 T312 L323L304-N308 PolarHBondContact O-N 2.97Å; A305-N308 PolarHBondContact O-N 3.43Å; N306-N308 VanDerWaalsContact C-N 3.29Å; N306-N308 PolarHBondContact O-N 3.29Å; N308-R311 PolarHBondContact O-N 2.73Å; N308-T312 PolarHBondContact O-N 3.48Å; N308-T312 PolarHBondContact O-OG1 3.2Å; N308-L323 WeakPolarHBondContact OD1-CD1 3.15Å
309Y94.1Very high94.3Very high32 Ų3229.9 Ų29.913%0.12515%0.148CC..Hα-helixtrans-65.5-38.6-180-177.1-96.6000113N113 A305 N306 R311 H313 R315N113-Y309 VanDerWaalsContact ND2-CE1 3.27Å; N113-Y309 WeakPolarHBondContact ND2-CE1 3.29Å; N113-Y309 PolarHBondContact ND2-OH 3.45Å; N113-Y309 VanDerWaalsContact ND2-OH 3.1Å; A305-Y309 WeakPolarHBondContact O-CB 3.42Å; A305-Y309 PolarHBondContact O-N 2.91Å; N306-Y309 PolarHBondContact O-N 3.48Å; Y309-R311 PolarHBondContact O-N 3.41Å; Y309-R311 VanDerWaalsContact O-N 3.16Å; Y309-H313 VanDerWaalsContact O-CA 3.27Å; Y309-H313 WeakPolarHBondContact O-CA 3.47Å; Y309-H313 PolarHBondContact O-N 2.96Å; Y309-R315 HydrophobicContact CD2-CG 3.79Å; Y309-R315 HydrophobicContact CE2-CG 3.84Å
310E92.6Very high93.8Very high38 Ų3830.2 Ų30.218%0.17815%0.15CC..Hα-helixtrans-63.5-18.2176.6-78-177-165.700113.1R57 N306 R407R57-E310 WeakPolarHBondContact CG-OE2 3.19Å; N306-E310 PolarHBondContact ND2-OE1 2.96Å; N306-E310 WeakPolarHBondContact O-CB 3.49Å; N306-E310 WeakPolarHBondContact O-CG 3.44Å; N306-E310 PolarHBondContact O-N 2.89Å; E310-R407 IonicContact OE1-NH2 3.51Å; E310-R407 PolarHBondContact OE1-NH2 3Å; E310-R407 IonicContact OE2-NH2 3.42Å; E310-R407 PolarHBondContact OE2-NH2 3.35Å
311R91.8Very high93.5Very high36 Ų3633 Ų3314%0.13616%0.163CC..Hα-helixtrans-101.9-44.4178.5-63.7175173.670.32.4113.1S307 N308 Y309 M401 K402 P403 E408S307-R311 PolarHBondContact O-NH1 3.35Å; N308-R311 PolarHBondContact O-N 2.73Å; Y309-R311 PolarHBondContact O-N 3.41Å; Y309-R311 VanDerWaalsContact O-N 3.16Å; R311-M401 HydrophobicContact CB-CE 4.32Å; R311-M401 HydrophobicContact CB-SD 3.45Å; R311-M401 WeakPolarHBondContact CB-SD 3.46Å; R311-M401 VanDerWaalsContact CD-SD 3.55Å; R311-M401 HydrophobicContact CG-SD 4.05Å; R311-K402 PolarHBondContact NE-O 2.98Å; R311-K402 PolarHBondContact NH2-O 3.02Å; R311-P403 PolarHBondContact NH2-O 3.4Å; R311-E408 IonicContact CZ-OE1 2.86Å; R311-E408 IonicContact CZ-OE2 3.52Å; R311-E408 IonicContact NH1-OE1 3.15Å; R311-E408 PolarHBondContact NH1-OE1 3.13Å; R311-E408 IonicContact NH1-OE2 2.81Å; R311-E408 PolarHBondContact NH1-OE2 3.18Å; R311-E408 IonicContact NH2-OE1 2.68Å; R311-E408 PolarHBondContact NH2-OE1 2.83Å; R311-E408 IonicContact NH2-OE2 3.36Å; R311-E408 PolarHBondContact NH2-OE2 3.45Å
312T90.8Very high93.2Very high31 Ų3133 Ų3319%0.1916%0.164CC..Hα-helixtrans-93.3-17.7-174.461.70000113.7N308 S314 I398 M401N308-T312 PolarHBondContact O-N 3.48Å; N308-T312 PolarHBondContact O-OG1 3.2Å; T312-S314 PolarHBondContact O-N 3.43Å; T312-S314 PolarHBondContact OG1-N 3.01Å; T312-S314 PolarHBondContact OG1-O 3.35Å; T312-S314 PolarHBondContact OG1-OG 3.41Å; T312-I398 HydrophobicContact CG2-CD1 4.13Å; T312-M401 HydrophobicContact CG2-CE 3.36Å
313H91.1Very high93Very high141 Ų14133.2 Ų33.265%0.65317%0.165SC*.SBendtrans54.217-171.4-63.5-65.4000114.9Y309Y309-H313 VanDerWaalsContact O-CA 3.27Å; Y309-H313 WeakPolarHBondContact O-CA 3.47Å; Y309-H313 PolarHBondContact O-N 2.96Å
314S90.9Very high92.9Very high29 Ų2937.3 Ų37.320%0.20318%0.183CC..  trans-128.1147.9179.875.60000110.3T312 L319T312-S314 PolarHBondContact O-N 3.43Å; T312-S314 PolarHBondContact OG1-N 3.01Å; T312-S314 PolarHBondContact OG1-O 3.35Å; T312-S314 PolarHBondContact OG1-OG 3.41Å; S314-L319 WeakPolarHBondContact OG-CD1 3.47Å
315R92.1Very high92.7Very high48 Ų4842.4 Ų42.418%0.18122%0.215CC..  trans-95.6-6.8178.1-60.6-174.9-67.5-153.11.6112.8V196 E197 L257 Y309 M317V196-R315 PolarHBondContact O-NH1 2.72Å; E197-R315 VanDerWaalsContact CD-NH1 3.35Å; E197-R315 IonicContact OE1-CZ 3.54Å; E197-R315 IonicContact OE1-NH1 3.28Å; E197-R315 PolarHBondContact OE1-NH1 3.31Å; E197-R315 IonicContact OE1-NH2 3.36Å; E197-R315 PolarHBondContact OE1-NH2 3.43Å; E197-R315 IonicContact OE2-NH1 2.97Å; E197-R315 PolarHBondContact OE2-NH1 3.16Å; E197-R315 VanDerWaalsContact OE2-NH1 3.11Å; L257-R315 PolarHBondContact N-O 2.88Å; Y309-R315 HydrophobicContact CD2-CG 3.79Å; Y309-R315 HydrophobicContact CE2-CG 3.84Å; R315-M317 PolarHBondContact O-N 3.32Å
316I93.8Very high92.5Very high76 Ų7645.9 Ų45.939%0.3923%0.232SC..BIsolated β-bridgetrans-74.2119.1-174.2-60.3168000108.8I318 L319I316-I318 VanDerWaalsContact C-N 3.33Å; I316-I318 HydrophobicContact CG2-CB 4.41Å; I316-I318 PolarHBondContact O-N 3.03Å; I316-L319 HydrophobicContact CB-CD1 3.94Å; I316-L319 HydrophobicContact CB-CG 4.09Å; I316-L319 HydrophobicContact CD1-CD1 4.07Å; I316-L319 HydrophobicContact CG2-CD1 4.39Å; I316-L319 HydrophobicContact CG2-CG 4.08Å; I316-L319 PolarHBondContact O-N 2.93Å
317M93.1Very high92.4Very high1 Ų145.5 Ų45.51%0.00523%0.23CC..G310 helixtrans-62.5-37.8-173.2-173.3164.96700113.2T255 L257 L260 R315 L319 S320 Y384 M385 T388 T389T255-M317 WeakPolarHBondContact O-CB 3.34Å; T255-M317 PolarHBondContact O-N 3.3Å; L257-M317 HydrophobicContact CB-CB 4.33Å; L257-M317 HydrophobicContact CD1-CG 4.25Å; L260-M317 HydrophobicContact CD1-CE 4.16Å; L260-M317 HydrophobicContact CD1-SD 4.1Å; R315-M317 PolarHBondContact O-N 3.32Å; M317-L319 PolarHBondContact O-N 3.37Å; M317-S320 PolarHBondContact O-N 3.03Å; M317-S320 VanDerWaalsContact O-N 3.1Å; M317-S320 PolarHBondContact O-OG 2.95Å; M317-S320 VanDerWaalsContact O-OG 3.06Å; M317-Y384 HydrophobicContact CE-CD1 4.01Å; M317-Y384 HydrophobicContact CE-CE1 3.32Å; M317-M385 HydrophobicContact SD-CG 4.45Å; M317-T388 HydrophobicContact CE-CG2 4.18Å; M317-T388 WeakPolarHBondContact CG-OG1 3.45Å; M317-T388 PolarHBondContact SD-OG1 2.98Å; M317-T389 HydrophobicContact CG-CG2 3.73Å; M317-T389 HydrophobicContact SD-CG2 4.38Å
318I90.8Very high92.4Very high86 Ų8649.7 Ų49.744%0.44126%0.257SS..G310 helixtrans-66.5-24-178.4-63.9170.2000111.8I316 S320 Q321I316-I318 VanDerWaalsContact C-N 3.33Å; I316-I318 HydrophobicContact CG2-CB 4.41Å; I316-I318 PolarHBondContact O-N 3.03Å; I318-S320 VanDerWaalsContact C-N 3.29Å; I318-S320 PolarHBondContact O-N 3.32Å; I318-Q321 WeakPolarHBondContact O-CG 3.3Å
319L89.9Confident92.5Very high77 Ų7753.2 Ų53.240%0.40328%0.275SS..G310 helixtrans-73.9-21.1175.9-67.4177.8000112.7S314 I316 M317 I398S314-L319 WeakPolarHBondContact OG-CD1 3.47Å; I316-L319 HydrophobicContact CB-CD1 3.94Å; I316-L319 HydrophobicContact CB-CG 4.09Å; I316-L319 HydrophobicContact CD1-CD1 4.07Å; I316-L319 HydrophobicContact CG2-CD1 4.39Å; I316-L319 HydrophobicContact CG2-CG 4.08Å; I316-L319 PolarHBondContact O-N 2.93Å; M317-L319 PolarHBondContact O-N 3.37Å; L319-I398 WeakPolarHBondContact O-CD1 3.28Å
320S87Confident92.6Very high6 Ų651.8 Ų51.84%0.04227%0.27CS..SBendtrans-107.454.7-177.562.20000111.8M317 I318 T389M317-S320 PolarHBondContact O-N 3.03Å; M317-S320 VanDerWaalsContact O-N 3.1Å; M317-S320 PolarHBondContact O-OG 2.95Å; M317-S320 VanDerWaalsContact O-OG 3.06Å; I318-S320 VanDerWaalsContact C-N 3.29Å; I318-S320 PolarHBondContact O-N 3.32Å; S320-T389 CarbonylContact O-C 3.39Å; S320-T389 WeakPolarHBondContact O-CA 3.37Å
321Q92.1Very high92.8Very high59 Ų5950.1 Ų50.128%0.27626%0.263SS..  trans-88.7154.4179.4-75.6174.6-4.100113I318 L323 T388 T395I318-Q321 WeakPolarHBondContact O-CG 3.3Å; Q321-L323 VanDerWaalsContact C-N 3.27Å; Q321-L323 PolarHBondContact O-N 3.49Å; Q321-T388 WeakPolarHBondContact CG-O 3.45Å; Q321-T395 HydrophobicContact CB-CG2 4.23Å
322G91.9Very high93.1Very high1 Ų153.2 Ų53.21%0.0128%0.277CS..  trans67.32017100000115.3Q324 T325 T389 Q390 W391 G392 L394G322-Q324 PolarHBondContact O-N 3.03Å; G322-Q324 VanDerWaalsContact O-N 3.1Å; G322-T325 PolarHBondContact O-N 3.27Å; G322-T325 PolarHBondContact O-OG1 3.24Å; G322-T325 VanDerWaalsContact O-OG1 3.06Å; G322-T389 PolarHBondContact N-O 3.41Å; G322-Q390 CarbonylContact C-O 3.29Å; G322-Q390 VanDerWaalsContact C-O 3.29Å; G322-Q390 WeakPolarHBondContact CA-O 3.45Å; G322-W391 WeakPolarHBondContact CA-O 3.47Å; G322-W391 PolarHBondContact N-O 2.91Å; G322-G392 WeakPolarHBondContact CA-O 3.46Å; G322-L394 WeakPolarHBondContact O-CD1 3.03Å
323L93.9Very high93.4Very high4 Ų453 Ų532%0.02127%0.273CS..G310 helixtrans-64.1-17.3-173.2-69.3176.7000114.4N308 Q321 T325 L326 L327 T389 Q390 M401N308-L323 WeakPolarHBondContact OD1-CD1 3.15Å; Q321-L323 VanDerWaalsContact C-N 3.27Å; Q321-L323 PolarHBondContact O-N 3.49Å; L323-T325 VanDerWaalsContact C-N 3.26Å; L323-T325 PolarHBondContact O-N 3.29Å; L323-L326 PolarHBondContact O-N 3.37Å; L323-L327 PolarHBondContact O-N 2.89Å; L323-T389 WeakPolarHBondContact CB-O 3.38Å; L323-T389 PolarHBondContact N-O 3.05Å; L323-Q390 PolarHBondContact N-O 3.42Å; L323-M401 HydrophobicContact CD2-CE 3.68Å
324Q95.6Very high93.7Very high90 Ų9046.3 Ų46.342%0.42124%0.242SC..G310 helixtrans-61.1-33.4177.9-178.2175.8-5.800113G322 L326 A331 Q390G322-Q324 PolarHBondContact O-N 3.03Å; G322-Q324 VanDerWaalsContact O-N 3.1Å; Q324-L326 VanDerWaalsContact C-N 3.29Å; Q324-L326 PolarHBondContact O-N 3.06Å; Q324-A331 HydrophobicContact CB-CB 3.81Å; Q324-A331 HydrophobicContact CG-CB 3.79Å; Q324-Q390 HydrophobicContact CB-CB 4.35Å; Q324-Q390 WeakPolarHBondContact CB-O 3.16Å; Q324-Q390 PolarHBondContact N-O 2.93Å; Q324-Q390 VanDerWaalsContact N-O 3.08Å
325T92.2Very high94.1Very high107 Ų10748 Ų4866%0.65625%0.248SC*.G310 helixtrans-69.3-29.5-179.662.70000112.1G322 L323G322-T325 PolarHBondContact O-N 3.27Å; G322-T325 PolarHBondContact O-OG1 3.24Å; G322-T325 VanDerWaalsContact O-OG1 3.06Å; L323-T325 VanDerWaalsContact C-N 3.26Å; L323-T325 PolarHBondContact O-N 3.29Å
326L92.6Very high94.3Very high79 Ų7947.9 Ų47.941%0.41425%0.251SS..THydrogen-bonded Turntrans-93.2-39.1180-63.5-179.2000113.3L323 Q324 P328 L394 M401L323-L326 PolarHBondContact O-N 3.37Å; Q324-L326 VanDerWaalsContact C-N 3.29Å; Q324-L326 PolarHBondContact O-N 3.06Å; L326-P328 WeakPolarHBondContact O-CD 3.16Å; L326-L394 HydrophobicContact CD1-CD1 3.4Å; L326-L394 HydrophobicContact CD1-CD2 3.91Å; L326-L394 HydrophobicContact CD1-CG 4.25Å; L326-L394 HydrophobicContact CD2-CD1 4.48Å; L326-L394 HydrophobicContact CG-CD1 3.6Å; L326-M401 HydrophobicContact CD1-CB 3.88Å; L326-M401 HydrophobicContact CD1-CG 3.94Å
327L95.3Very high94.5Very high7 Ų744.3 Ų44.34%0.03723%0.233CC..  trans-128.765.8-169.2-60.7170.1000110.7L323 L329 M330 A331L323-L327 PolarHBondContact O-N 2.89Å; L327-L329 VanDerWaalsContact C-N 3.34Å; L327-L329 PolarHBondContact O-N 3.39Å; L327-M330 HydrophobicContact CB-CB 3.8Å; L327-M330 WeakPolarHBondContact O-CB 3.38Å; L327-M330 PolarHBondContact O-N 3.01Å; L327-A331 PolarHBondContact O-N 2.86Å
328P94.8Very high94.7Very high89 Ų8944.3 Ų44.358%0.57823%0.233SC*.Hα-helixtrans-61.5-38.1-171.223.5-34.5000113.3L326 A331 F332L326-P328 WeakPolarHBondContact O-CD 3.16Å; P328-A331 WeakPolarHBondContact O-CB 3.39Å; P328-A331 PolarHBondContact O-N 3.27Å; P328-F332 PolarHBondContact O-N 2.97Å
329L96.6Very high95Very high80 Ų8042.3 Ų42.342%0.41922%0.223SC..Hα-helixtrans-68.6-35.6176.1-175.661.9000112L327 A331 F332 W333L327-L329 VanDerWaalsContact C-N 3.34Å; L327-L329 PolarHBondContact O-N 3.39Å; L329-A331 VanDerWaalsContact C-N 3.35Å; L329-F332 WeakPolarHBondContact O-CB 3.31Å; L329-F332 PolarHBondContact O-N 3.16Å; L329-W333 PolarHBondContact O-N 2.93Å; L329-W333 VanDerWaalsContact O-N 3.17Å
330M96.7Very high95.3Very high2 Ų238.8 Ų38.81%0.0121%0.205CC..Hα-helixtrans-68.3-38.1174.2-166.359.46400111L304 L327 F332 W333 W334 E408 M412L304-M330 HydrophobicContact CD2-CG 4.46Å; L304-M330 HydrophobicContact CD2-SD 3.53Å; L304-M330 VanDerWaalsContact CD2-SD 3.53Å; L327-M330 HydrophobicContact CB-CB 3.8Å; L327-M330 WeakPolarHBondContact O-CB 3.38Å; L327-M330 PolarHBondContact O-N 3.01Å; M330-F332 VanDerWaalsContact C-N 3.29Å; M330-F332 PolarHBondContact O-N 3.17Å; M330-W333 WeakPolarHBondContact O-CB 3.27Å; M330-W333 PolarHBondContact O-N 2.83Å; M330-W333 VanDerWaalsContact O-N 3.14Å; M330-W334 VanDerWaalsContact O-CD1 3.31Å; M330-W334 PolarHBondContact O-N 3.48Å; M330-E408 HydrophobicContact CE-CB 3.91Å; M330-M412 HydrophobicContact SD-CE 4.26Å; M330-M412 HydrophobicContact SD-CG 4.36Å
331A96.9Very high95.7Very high4 Ų438.5 Ų38.53%0.03320%0.203CC..Hα-helixtrans-62.5-36.1173.700000112.1Q324 L327 P328 L329 W334 L335 Q390Q324-A331 HydrophobicContact CB-CB 3.81Å; Q324-A331 HydrophobicContact CG-CB 3.79Å; L327-A331 PolarHBondContact O-N 2.86Å; P328-A331 WeakPolarHBondContact O-CB 3.39Å; P328-A331 PolarHBondContact O-N 3.27Å; L329-A331 VanDerWaalsContact C-N 3.35Å; A331-W334 WeakPolarHBondContact O-CB 3.48Å; A331-W334 PolarHBondContact O-N 2.68Å; A331-L335 WeakPolarHBondContact O-CB 3.3Å; A331-L335 PolarHBondContact O-N 2.73Å; A331-Q390 HydrophobicContact CB-CG 4.38Å
332F96.9Very high95.9Very high100 Ų10037 Ų3744%0.43920%0.197SC..Hα-helixtrans-61.7-43.3171.1177.7-103.6000112.2P328 L329 M330 W334 L335 L336P328-F332 PolarHBondContact O-N 2.97Å; L329-F332 WeakPolarHBondContact O-CB 3.31Å; L329-F332 PolarHBondContact O-N 3.16Å; M330-F332 VanDerWaalsContact C-N 3.29Å; M330-F332 PolarHBondContact O-N 3.17Å; F332-W334 PolarHBondContact O-N 3.07Å; F332-L335 WeakPolarHBondContact O-CB 3.32Å; F332-L335 PolarHBondContact O-N 3.3Å; F332-L336 HydrophobicContact CD1-CD1 4.06Å; F332-L336 HydrophobicContact CE1-CD1 3.36Å; F332-L336 HydrophobicContact CE1-CG 4.14Å; F332-L336 HydrophobicContact CE2-CD1 4.28Å; F332-L336 HydrophobicContact CE2-CG 4.27Å; F332-L336 HydrophobicContact CZ-CD1 3.51Å; F332-L336 HydrophobicContact CZ-CD2 4.32Å; F332-L336 HydrophobicContact CZ-CG 3.98Å; F332-L336 PolarHBondContact O-N 2.66Å
333W97.8Very high96.1Very high26 Ų2637.1 Ų37.110%0.09820%0.198CC..Hα-helixtrans-63-40.8173.8-59.5130.9000112.6L304 L329 M330 L335 L336 A337 N409 M412 F413 L416L304-W333 HydrophobicContact CD2-CB 4Å; L329-W333 PolarHBondContact O-N 2.93Å; L329-W333 VanDerWaalsContact O-N 3.17Å; M330-W333 WeakPolarHBondContact O-CB 3.27Å; M330-W333 PolarHBondContact O-N 2.83Å; M330-W333 VanDerWaalsContact O-N 3.14Å; W333-L335 VanDerWaalsContact C-N 3.34Å; W333-L335 PolarHBondContact O-N 2.97Å; W333-L336 HydrophobicContact CE3-CD1 4.19Å; W333-L336 HydrophobicContact CZ3-CD1 4.28Å; W333-L336 PolarHBondContact O-N 2.97Å; W333-A337 VanDerWaalsContact O-CB 3.3Å; W333-A337 WeakPolarHBondContact O-CB 3.46Å; W333-A337 PolarHBondContact O-N 2.81Å; W333-N409 PolarHBondContact NE1-OD1 2.92Å; W333-M412 HydrophobicContact CB-CB 4.1Å; W333-M412 HydrophobicContact CB-CG 4.06Å; W333-M412 HydrophobicContact CD2-CB 3.63Å; W333-M412 HydrophobicContact CD2-CG 4.39Å; W333-M412 HydrophobicContact CE3-CB 4.17Å; W333-M412 HydrophobicContact CG-CB 3.6Å; W333-M412 HydrophobicContact CG-CG 3.84Å; W333-F413 HydrophobicContact CH2-CB 3.96Å; W333-F413 HydrophobicContact CH2-CD2 4.12Å; W333-F413 HydrophobicContact CZ2-CB 4.27Å; W333-L416 HydrophobicContact CD2-CD1 4.32Å; W333-L416 HydrophobicContact CE3-CD1 3.18Å; W333-L416 HydrophobicContact CZ3-CD1 3.43Å; W333-L416 VanDerWaalsContact CZ3-CD1 3.43Å
334W97.9Very high96.1Very high1 Ų140.3 Ų40.30%0.00421%0.214CC..Hα-helixtrans-59.1-43.4172.6-90103.6000112.4L257 L301 L304 M330 A331 F332 A337 S338 M385 F386 Q390L257-W334 HydrophobicContact CD1-CH2 3.85Å; L257-W334 HydrophobicContact CD1-CZ2 4.33Å; L257-W334 HydrophobicContact CD2-CH2 4.1Å; L257-W334 HydrophobicContact CG-CH2 4.41Å; L301-W334 HydrophobicContact CD2-CZ3 4.33Å; L304-W334 HydrophobicContact CB-CD2 4.11Å; L304-W334 HydrophobicContact CB-CH2 4.02Å; L304-W334 HydrophobicContact CB-CZ2 3.58Å; L304-W334 HydrophobicContact CB-CZ3 4.48Å; L304-W334 HydrophobicContact CD1-CD2 3.99Å; L304-W334 HydrophobicContact CD1-CE3 4.2Å; L304-W334 HydrophobicContact CD1-CG 4.18Å; L304-W334 HydrophobicContact CD2-CD2 4.46Å; L304-W334 HydrophobicContact CD2-CG 4.21Å; L304-W334 HydrophobicContact CG-CD2 4.43Å; M330-W334 VanDerWaalsContact O-CD1 3.31Å; M330-W334 PolarHBondContact O-N 3.48Å; A331-W334 WeakPolarHBondContact O-CB 3.48Å; A331-W334 PolarHBondContact O-N 2.68Å; F332-W334 PolarHBondContact O-N 3.07Å; W334-A337 PolarHBondContact O-N 3Å; W334-S338 WeakPolarHBondContact O-CB 3.35Å; W334-S338 PolarHBondContact O-N 2.95Å; W334-S338 PolarHBondContact O-OG 3.03Å; W334-M385 HydrophobicContact CH2-SD 4.45Å; W334-M385 HydrophobicContact CZ3-CG 4.09Å; W334-M385 HydrophobicContact CZ3-SD 3.67Å; W334-F386 HydrophobicContact CB-CD2 3.99Å; W334-F386 HydrophobicContact CB-CE2 4.02Å; W334-Q390 HydrophobicContact CB-CG 3.8Å; W334-Q390 HydrophobicContact CG-CG 4.01Å
335L97.6Very high95.8Very high64 Ų6440 Ų4034%0.33522%0.221SC..Hα-helixtrans-61.2-54.4177.5-178.667.9000110A331 F332 W333 A337 S338 L339 F386A331-L335 WeakPolarHBondContact O-CB 3.3Å; A331-L335 PolarHBondContact O-N 2.73Å; F332-L335 WeakPolarHBondContact O-CB 3.32Å; F332-L335 PolarHBondContact O-N 3.3Å; W333-L335 VanDerWaalsContact C-N 3.34Å; W333-L335 PolarHBondContact O-N 2.97Å; L335-A337 VanDerWaalsContact C-N 3.32Å; L335-A337 PolarHBondContact O-N 2.99Å; L335-S338 PolarHBondContact O-N 2.83Å; L335-S338 VanDerWaalsContact O-N 3.13Å; L335-S338 PolarHBondContact O-OG 3.47Å; L335-L339 HydrophobicContact CD1-CD1 4.24Å; L335-L339 HydrophobicContact CD1-CG 4.31Å; L335-L339 HydrophobicContact CG-CD1 3.92Å; L335-L339 HydrophobicContact CG-CG 4.37Å; L335-L339 VanDerWaalsContact O-CG 3.3Å; L335-L339 WeakPolarHBondContact O-CG 3.35Å; L335-L339 PolarHBondContact O-N 3.18Å; L335-F386 HydrophobicContact CB-CD2 4.43Å; L335-F386 HydrophobicContact CB-CE2 3.67Å; L335-F386 HydrophobicContact CB-CZ 3.98Å; L335-F386 HydrophobicContact CD1-CE1 4.03Å; L335-F386 HydrophobicContact CD1-CE2 4.1Å; L335-F386 HydrophobicContact CD1-CZ 3.8Å; L335-F386 HydrophobicContact CG-CZ 4.45Å
336L97.1Very high95.6Very high46 Ų4640.2 Ų40.224%0.24122%0.223CC..Hα-helixtrans-58.6-42179.2-71-179.1000112.7F332 W333 L339 A340 L416F332-L336 HydrophobicContact CD1-CD1 4.06Å; F332-L336 HydrophobicContact CE1-CD1 3.36Å; F332-L336 HydrophobicContact CE1-CG 4.14Å; F332-L336 HydrophobicContact CE2-CD1 4.28Å; F332-L336 HydrophobicContact CE2-CG 4.27Å; F332-L336 HydrophobicContact CZ-CD1 3.51Å; F332-L336 HydrophobicContact CZ-CD2 4.32Å; F332-L336 HydrophobicContact CZ-CG 3.98Å; F332-L336 PolarHBondContact O-N 2.66Å; W333-L336 HydrophobicContact CE3-CD1 4.19Å; W333-L336 HydrophobicContact CZ3-CD1 4.28Å; W333-L336 PolarHBondContact O-N 2.97Å; L336-L339 PolarHBondContact O-N 3.01Å; L336-A340 WeakPolarHBondContact O-CB 3.42Å; L336-A340 PolarHBondContact O-N 3.41Å; L336-L416 HydrophobicContact CB-CD1 4.04Å; L336-L416 HydrophobicContact CB-CD2 4.03Å; L336-L416 HydrophobicContact CD1-CD1 3.85Å
337A97.2Very high95.7Very high1 Ų137.5 Ų37.51%0.00821%0.21CC..Hα-helixtrans-64-41.6176.700000112.1L300 L301 L304 W333 W334 L335 A340 N341L300-A337 HydrophobicContact CD2-CB 3.5Å; L300-A337 VanDerWaalsContact CD2-CB 3.5Å; L300-A337 HydrophobicContact CG-CB 3.9Å; L301-A337 HydrophobicContact CD2-CB 3.77Å; L301-A337 HydrophobicContact CG-CB 4.37Å; L304-A337 HydrophobicContact CD1-CB 3.49Å; L304-A337 VanDerWaalsContact CD1-CB 3.49Å; W333-A337 VanDerWaalsContact O-CB 3.3Å; W333-A337 WeakPolarHBondContact O-CB 3.46Å; W333-A337 PolarHBondContact O-N 2.81Å; W334-A337 PolarHBondContact O-N 3Å; L335-A337 VanDerWaalsContact C-N 3.32Å; L335-A337 PolarHBondContact O-N 2.99Å; A337-A340 PolarHBondContact O-N 2.87Å; A337-N341 WeakPolarHBondContact O-CB 3.4Å; A337-N341 PolarHBondContact O-N 3.5Å
338S97.6Very high95.6Very high1 Ų137.3 Ų37.31%0.00721%0.209CC..Hα-helixtrans-66.9-41177.269.70000112.3W334 L335 N341 L342W334-S338 WeakPolarHBondContact O-CB 3.35Å; W334-S338 PolarHBondContact O-N 2.95Å; W334-S338 PolarHBondContact O-OG 3.03Å; L335-S338 PolarHBondContact O-N 2.83Å; L335-S338 VanDerWaalsContact O-N 3.13Å; L335-S338 PolarHBondContact O-OG 3.47Å; S338-N341 PolarHBondContact O-N 3.16Å; S338-L342 WeakPolarHBondContact O-CG 3.32Å; S338-L342 PolarHBondContact O-N 3.17Å
339L96.8Very high95.7Very high44 Ų4433 Ų3323%0.2318%0.182CC..Hα-helixtrans-64.4-40.3175.6-68.9174.2000111.9L335 L336 L342 A343 L344L335-L339 HydrophobicContact CD1-CD1 4.24Å; L335-L339 HydrophobicContact CD1-CG 4.31Å; L335-L339 HydrophobicContact CG-CD1 3.92Å; L335-L339 HydrophobicContact CG-CG 4.37Å; L335-L339 VanDerWaalsContact O-CG 3.3Å; L335-L339 WeakPolarHBondContact O-CG 3.35Å; L335-L339 PolarHBondContact O-N 3.18Å; L336-L339 PolarHBondContact O-N 3.01Å; L339-L342 HydrophobicContact CD2-CD2 4.35Å; L339-L342 WeakPolarHBondContact O-CG 3.47Å; L339-A343 PolarHBondContact O-N 3.3Å; L339-L344 HydrophobicContact CB-CB 4.25Å; L339-L344 HydrophobicContact CB-CD2 4.38Å; L339-L344 HydrophobicContact CD1-CD2 4.38Å; L339-L344 HydrophobicContact CD2-CD1 4.2Å; L339-L344 HydrophobicContact CD2-CD2 4.32Å; L339-L344 WeakPolarHBondContact O-CB 3.34Å; L339-L344 PolarHBondContact O-N 3.45Å
340A95.9Very high95.6Very high3 Ų331.3 Ų31.33%0.02517%0.172CC..Hα-helixtrans-66.6-39.9173.800000111.3T297 L336 A337 L342 A343 N349T297-A340 HydrophobicContact CG2-CB 3.52Å; L336-A340 WeakPolarHBondContact O-CB 3.42Å; L336-A340 PolarHBondContact O-N 3.41Å; A337-A340 PolarHBondContact O-N 2.87Å; A340-L342 PolarHBondContact O-N 3.44Å; A340-A343 PolarHBondContact O-N 3.01Å; A340-A343 VanDerWaalsContact O-N 3.08Å; A340-N349 VanDerWaalsContact O-CB 3.31Å; A340-N349 WeakPolarHBondContact O-CB 3.31Å; A340-N349 PolarHBondContact O-ND2 3.05Å
341N97Very high95.5Very high0 Ų034.6 Ų34.60%019%0.19CC..Hα-helixtrans-68-29.8179.9-168.529.9000114.2H268 L301 A337 S338 A343H268-N341 PolarHBondContact NE2-O 3.08Å; H268-N341 PolarHBondContact NE2-OD1 3.45Å; L301-N341 HydrophobicContact CD1-CB 4.07Å; A337-N341 WeakPolarHBondContact O-CB 3.4Å; A337-N341 PolarHBondContact O-N 3.5Å; S338-N341 PolarHBondContact O-N 3.16Å; N341-A343 VanDerWaalsContact C-N 3.26Å
342L95.8Very high95.4Very high28 Ų2834.4 Ų34.415%0.14719%0.188CC..THydrogen-bonded Turntrans-86.57.2171.766.483.3000113.9S338 L339 A340 L344 S382 L383S338-L342 WeakPolarHBondContact O-CG 3.32Å; S338-L342 PolarHBondContact O-N 3.17Å; L339-L342 HydrophobicContact CD2-CD2 4.35Å; L339-L342 WeakPolarHBondContact O-CG 3.47Å; A340-L342 PolarHBondContact O-N 3.44Å; L342-L344 HydrophobicContact CD1-CB 3.97Å; L342-L344 HydrophobicContact CD1-CD1 4.21Å; L342-S382 WeakPolarHBondContact CB-OG 3.34Å; L342-L383 HydrophobicContact CD2-CD2 4.14Å; L342-L383 HydrophobicContact CD2-CG 4.13Å
343A95.4Very high95.4Very high4 Ų429.9 Ų29.93%0.03317%0.168CC..THydrogen-bonded Turntrans5953.7-179.900000113.8L339 A340 N341 N349 L350 E353 M375L339-A343 PolarHBondContact O-N 3.3Å; A340-A343 PolarHBondContact O-N 3.01Å; A340-A343 VanDerWaalsContact O-N 3.08Å; N341-A343 VanDerWaalsContact C-N 3.26Å; A343-N349 HydrophobicContact CB-CB 4.02Å; A343-L350 HydrophobicContact CB-CB 4.06Å; A343-L350 HydrophobicContact CB-CD1 4.28Å; A343-L350 WeakPolarHBondContact O-CB 3.46Å; A343-L350 WeakPolarHBondContact O-CD1 3.37Å; A343-E353 WeakPolarHBondContact CB-OE2 3.48Å; A343-M375 HydrophobicContact CB-CE 4.33Å
344L93.8Very high95.3Very high70 Ų7033 Ų3337%0.36619%0.186SC..  trans-66.6136.3174-168.689.6000110.8L339 L342 T347L339-L344 HydrophobicContact CB-CB 4.25Å; L339-L344 HydrophobicContact CB-CD2 4.38Å; L339-L344 HydrophobicContact CD1-CD2 4.38Å; L339-L344 HydrophobicContact CD2-CD1 4.2Å; L339-L344 HydrophobicContact CD2-CD2 4.32Å; L339-L344 WeakPolarHBondContact O-CB 3.34Å; L339-L344 PolarHBondContact O-N 3.45Å; L342-L344 HydrophobicContact CD1-CB 3.97Å; L342-L344 HydrophobicContact CD1-CD1 4.21Å; L344-T347 VanDerWaalsContact O-CB 3.29Å; L344-T347 WeakPolarHBondContact O-CB 3.13Å; L344-T347 VanDerWaalsContact O-CG2 3.32Å; L344-T347 WeakPolarHBondContact O-CG2 3.28Å; L344-T347 PolarHBondContact O-N 2.96Å; L344-T347 PolarHBondContact O-OG1 2.94Å
345P89.6Confident95.2Very high85 Ų8533.3 Ų33.355%0.55219%0.189SC*.THydrogen-bonded Turntrans-62.6138.9167.624.1-32.1000110.9L350P345-L350 HydrophobicContact CB-CD2 3.57Å; P345-L350 HydrophobicContact CG-CD2 4.23Å
346P88.6Confident95.1Very high110 Ų11030.2 Ų30.271%0.71417%0.173SC*.THydrogen-bonded Turncis-99.431.65.339.3-36.2000114.5S423P346-S423 WeakPolarHBondContact O-CB 3.15Å
347T93.6Very high95.1Very high23 Ų2330.2 Ų30.214%0.14117%0.172CC..SBendtrans-66.8151.3-175.464.90000113.4L344 N349 L350 L351L344-T347 VanDerWaalsContact O-CB 3.29Å; L344-T347 WeakPolarHBondContact O-CB 3.13Å; L344-T347 VanDerWaalsContact O-CG2 3.32Å; L344-T347 WeakPolarHBondContact O-CG2 3.28Å; L344-T347 PolarHBondContact O-N 2.96Å; L344-T347 PolarHBondContact O-OG1 2.94Å; T347-N349 PolarHBondContact O-N 3.19Å; T347-L350 WeakPolarHBondContact O-CB 3.43Å; T347-L350 PolarHBondContact O-N 2.91Å; T347-L350 VanDerWaalsContact O-N 3.08Å; T347-L351 PolarHBondContact O-N 2.96Å
348I94.8Very high95Very high2 Ų233.2 Ų33.21%0.0119%0.191CC..Hα-helixtrans-61.6-24.3175.651.2165.9000113.5I289 A293 L350 L351 G352 I419 L422 I429I289-I348 HydrophobicContact CG2-CB 4.39Å; I289-I348 VanDerWaalsContact CG2-O 3.28Å; I289-I348 WeakPolarHBondContact CG2-O 3.19Å; A293-I348 HydrophobicContact CB-CB 4.13Å; A293-I348 HydrophobicContact CB-CD1 3.64Å; A293-I348 HydrophobicContact CB-CG1 3.63Å; I348-L350 VanDerWaalsContact C-N 3.32Å; I348-L350 PolarHBondContact O-N 3.22Å; I348-L351 PolarHBondContact O-N 3.33Å; I348-G352 PolarHBondContact O-N 3.42Å; I348-G352 VanDerWaalsContact O-N 3.1Å; I348-I419 HydrophobicContact CG1-CG2 4.2Å; I348-L422 HydrophobicContact CD1-CB 4.17Å; I348-L422 HydrophobicContact CD1-CD1 4.11Å; I348-L422 HydrophobicContact CG2-CB 4.01Å; I348-I429 HydrophobicContact CB-CD1 4.27Å; I348-I429 HydrophobicContact CD1-CD1 4.35Å; I348-I429 HydrophobicContact CG2-CD1 3.93Å
349N95.7Very high95Very high0 Ų033.4 Ų33.40%019%0.192CC..Hα-helixtrans-58.7-45.6172.5-79.447.9000110.4A293 T297 A340 A343 T347 G352 E353A293-N349 HydrophobicContact CB-CB 4.45Å; A293-N349 WeakPolarHBondContact CB-OD1 3.47Å; A293-N349 PolarHBondContact O-OD1 3.42Å; T297-N349 WeakPolarHBondContact CG2-OD1 3.39Å; T297-N349 PolarHBondContact OG1-ND2 3.44Å; A340-N349 VanDerWaalsContact O-CB 3.31Å; A340-N349 WeakPolarHBondContact O-CB 3.31Å; A340-N349 PolarHBondContact O-ND2 3.05Å; A343-N349 HydrophobicContact CB-CB 4.02Å; T347-N349 PolarHBondContact O-N 3.19Å; N349-G352 PolarHBondContact O-N 2.84Å; N349-E353 WeakPolarHBondContact O-CG 3.36Å; N349-E353 PolarHBondContact O-N 2.89Å
350L95.5Very high95Very high43 Ų4331.3 Ų31.323%0.22518%0.181CC..Hα-helixtrans-64-42.3177.2-176.170.9000112A343 P345 T347 I348 G352 E353 L354A343-L350 HydrophobicContact CB-CB 4.06Å; A343-L350 HydrophobicContact CB-CD1 4.28Å; A343-L350 WeakPolarHBondContact O-CB 3.46Å; A343-L350 WeakPolarHBondContact O-CD1 3.37Å; P345-L350 HydrophobicContact CB-CD2 3.57Å; P345-L350 HydrophobicContact CG-CD2 4.23Å; T347-L350 WeakPolarHBondContact O-CB 3.43Å; T347-L350 PolarHBondContact O-N 2.91Å; T347-L350 VanDerWaalsContact O-N 3.08Å; I348-L350 VanDerWaalsContact C-N 3.32Å; I348-L350 PolarHBondContact O-N 3.22Å; L350-G352 VanDerWaalsContact C-N 3.27Å; L350-G352 PolarHBondContact O-N 3.32Å; L350-E353 PolarHBondContact O-N 3Å; L350-L354 WeakPolarHBondContact O-CB 3.36Å; L350-L354 PolarHBondContact O-N 3.49Å
351L94.4Very high95Very high72 Ų7235.3 Ų35.338%0.37720%0.198SC..Hα-helixtrans-58.7-42.5179.5-17467.7000111.3I289 T347 I348 S355 P426I289-L351 HydrophobicContact CD1-CD2 3.85Å; I289-L351 HydrophobicContact CD1-CG 4.05Å; I289-L351 HydrophobicContact CG2-CB 4.21Å; I289-L351 HydrophobicContact CG2-CD2 4.32Å; I289-L351 HydrophobicContact CG2-CG 4.39Å; T347-L351 PolarHBondContact O-N 2.96Å; I348-L351 PolarHBondContact O-N 3.33Å; L351-S355 WeakPolarHBondContact O-CB 3.4Å; L351-S355 PolarHBondContact O-N 3.2Å; L351-S355 PolarHBondContact O-OG 3.18Å; L351-P426 HydrophobicContact CD2-CB 3.47Å; L351-P426 VanDerWaalsContact CD2-CB 3.47Å; L351-P426 HydrophobicContact CD2-CG 4.13Å
352G95.1Very high95Very high0 Ų039.3 Ų39.30%023%0.226CC..Hα-helixtrans-66.9-49.117400000113.1I348 N349 L350 L354 S355 V356I348-G352 PolarHBondContact O-N 3.42Å; I348-G352 VanDerWaalsContact O-N 3.1Å; N349-G352 PolarHBondContact O-N 2.84Å; L350-G352 VanDerWaalsContact C-N 3.27Å; L350-G352 PolarHBondContact O-N 3.32Å; G352-L354 PolarHBondContact O-N 3.39Å; G352-S355 PolarHBondContact O-N 3.27Å; G352-S355 PolarHBondContact O-OG 3.33Å; G352-V356 WeakPolarHBondContact O-CG2 3.24Å; G352-V356 PolarHBondContact O-N 2.99Å; G352-V356 VanDerWaalsContact O-N 3.13Å
353E96.1Very high95Very high4 Ų442.6 Ų42.62%0.01924%0.236CC..Hα-helixtrans-65.5-39.4-178.5-72.1175.7-15900112.5H268 L271 L290 A343 N349 L350 V356 L357 M375H268-E353 IonicContact CE1-OE1 3.07Å; H268-E353 PolarHBondContact CE1-OE1 2.77Å; H268-E353 IonicContact ND1-OE1 2.73Å; H268-E353 PolarHBondContact ND1-OE1 3.4Å; L271-E353 HydrophobicContact CD1-CG 4.22Å; L290-E353 HydrophobicContact CD1-CG 3.68Å; L290-E353 HydrophobicContact CD2-CG 4.4Å; A343-E353 WeakPolarHBondContact CB-OE2 3.48Å; N349-E353 WeakPolarHBondContact O-CG 3.36Å; N349-E353 PolarHBondContact O-N 2.89Å; L350-E353 PolarHBondContact O-N 3Å; E353-V356 PolarHBondContact O-N 3.23Å; E353-L357 WeakPolarHBondContact O-CB 3.34Å; E353-L357 PolarHBondContact O-N 3.35Å; E353-M375 HydrophobicContact CB-CE 4.43Å; E353-M375 HydrophobicContact CB-SD 4.23Å; E353-M375 WeakPolarHBondContact OE2-CE 3.48Å
354L95.6Very high95.1Very high92 Ų9244 Ų4448%0.48225%0.246SC..Hα-helixtrans-69.5-40.3180-172.7140.9000112L350 G352 L357 V358L350-L354 WeakPolarHBondContact O-CB 3.36Å; L350-L354 PolarHBondContact O-N 3.49Å; G352-L354 PolarHBondContact O-N 3.39Å; L354-L357 PolarHBondContact O-N 3.42Å; L354-V358 HydrophobicContact CD2-CG2 4.18Å; L354-V358 WeakPolarHBondContact O-CG2 3.4Å; L354-V358 PolarHBondContact O-N 2.94Å
355S95.1Very high95.2Very high7 Ų746.2 Ų46.25%0.04926%0.259CS..Hα-helixtrans-65.6-38.317547.40000112.2G286 L351 G352 T359G286-S355 WeakPolarHBondContact CA-OG 3.27Å; L351-S355 WeakPolarHBondContact O-CB 3.4Å; L351-S355 PolarHBondContact O-N 3.2Å; L351-S355 PolarHBondContact O-OG 3.18Å; G352-S355 PolarHBondContact O-N 3.27Å; G352-S355 PolarHBondContact O-OG 3.33Å; S355-T359 VanDerWaalsContact O-CG2 3.29Å; S355-T359 WeakPolarHBondContact O-CG2 3.25Å; S355-T359 PolarHBondContact O-N 3.46Å; S355-T359 VanDerWaalsContact O-N 3.11Å; S355-T359 PolarHBondContact O-OG1 3.15Å
356V96.5Very high95.4Very high0 Ų048.5 Ų48.50%027%0.265CS..Hα-helixtrans-65.4-39.6171176.50000111.4L271 A275 G352 E353 T359 T360L271-V356 HydrophobicContact CB-CG1 4.29Å; L271-V356 HydrophobicContact CD2-CG1 4.05Å; A275-V356 HydrophobicContact CB-CB 4.43Å; A275-V356 HydrophobicContact CB-CG1 4.02Å; A275-V356 HydrophobicContact CB-CG2 3.66Å; G352-V356 WeakPolarHBondContact O-CG2 3.24Å; G352-V356 PolarHBondContact O-N 2.99Å; G352-V356 VanDerWaalsContact O-N 3.13Å; E353-V356 PolarHBondContact O-N 3.23Å; V356-T359 WeakPolarHBondContact CA-OG1 3.49Å; V356-T359 PolarHBondContact O-N 3.07Å; V356-T359 PolarHBondContact O-OG1 2.96Å; V356-T359 VanDerWaalsContact O-OG1 3.07Å; V356-T360 HydrophobicContact CG1-CG2 4.15Å; V356-T360 WeakPolarHBondContact O-CB 3.21Å; V356-T360 VanDerWaalsContact O-CG2 3.26Å; V356-T360 WeakPolarHBondContact O-CG2 3.47Å; V356-T360 PolarHBondContact O-N 3.18Å; V356-T360 PolarHBondContact O-OG1 3.41Å
357L96.4Very high95.8Very high45 Ų4543.5 Ų43.524%0.23623%0.232CC..Hα-helixtrans-64.1-45177.2-172.4155.2000111.9E353 L354 T359 T360 F361 L368E353-L357 WeakPolarHBondContact O-CB 3.34Å; E353-L357 PolarHBondContact O-N 3.35Å; L354-L357 PolarHBondContact O-N 3.42Å; L357-T359 VanDerWaalsContact C-N 3.34Å; L357-T359 PolarHBondContact O-N 2.66Å; L357-T360 WeakPolarHBondContact CA-OG1 3.32Å; L357-T360 PolarHBondContact O-OG1 3.18Å; L357-F361 VanDerWaalsContact O-CB 3.28Å; L357-F361 WeakPolarHBondContact O-CB 3.01Å; L357-F361 PolarHBondContact O-N 2.81Å; L357-L368 HydrophobicContact CD1-CD1 4.47Å; L357-L368 HydrophobicContact CD2-CD1 3.59Å; L357-L368 HydrophobicContact CG-CD1 4.19Å
358V96.6Very high95.9Very high65 Ų6546.1 Ų46.139%0.39425%0.245SC..Hα-helixtrans-62.5-41.2177.9170.80000111.4L354 F361 S362L354-V358 HydrophobicContact CD2-CG2 4.18Å; L354-V358 WeakPolarHBondContact O-CG2 3.4Å; L354-V358 PolarHBondContact O-N 2.94Å; V358-F361 PolarHBondContact O-N 2.6Å; V358-S362 PolarHBondContact O-N 2.67Å
359T96.5Very high96Very high4 Ų452.1 Ų52.13%0.02528%0.276CS..Hα-helixtrans-77.3-33.3-177.7520000113.5W282 S283 S355 V356 L357 S362 W363W282-T359 HydrophobicContact CB-CG2 3.35Å; S283-T359 WeakPolarHBondContact CB-OG1 2.9Å; S355-T359 VanDerWaalsContact O-CG2 3.29Å; S355-T359 WeakPolarHBondContact O-CG2 3.25Å; S355-T359 PolarHBondContact O-N 3.46Å; S355-T359 VanDerWaalsContact O-N 3.11Å; S355-T359 PolarHBondContact O-OG1 3.15Å; V356-T359 WeakPolarHBondContact CA-OG1 3.49Å; V356-T359 PolarHBondContact O-N 3.07Å; V356-T359 PolarHBondContact O-OG1 2.96Å; V356-T359 VanDerWaalsContact O-OG1 3.07Å; L357-T359 VanDerWaalsContact C-N 3.34Å; L357-T359 PolarHBondContact O-N 2.66Å; T359-S362 WeakPolarHBondContact CA-OG 3.15Å; T359-S362 PolarHBondContact O-OG 3.15Å; T359-W363 WeakPolarHBondContact O-CB 3.26Å; T359-W363 PolarHBondContact O-N 2.96Å
360T96.7Very high96Very high1 Ų154.4 Ų54.41%0.00629%0.288CS..Hα-helixtrans-67.4-42.1169.852.70000110.6I278 V356 L357 S362 W363 S364 T367I278-T360 HydrophobicContact CD1-CG2 3.58Å; V356-T360 HydrophobicContact CG1-CG2 4.15Å; V356-T360 WeakPolarHBondContact O-CB 3.21Å; V356-T360 VanDerWaalsContact O-CG2 3.26Å; V356-T360 WeakPolarHBondContact O-CG2 3.47Å; V356-T360 PolarHBondContact O-N 3.18Å; V356-T360 PolarHBondContact O-OG1 3.41Å; L357-T360 WeakPolarHBondContact CA-OG1 3.32Å; L357-T360 PolarHBondContact O-OG1 3.18Å; T360-S362 PolarHBondContact O-N 2.87Å; T360-W363 WeakPolarHBondContact O-CB 3.44Å; T360-W363 PolarHBondContact O-N 3.41Å; T360-W363 VanDerWaalsContact O-N 3.12Å; T360-S364 PolarHBondContact O-N 3.43Å; T360-T367 PolarHBondContact O-OG1 3.3Å
361F97.1Very high96Very high86 Ų8652.5 Ų52.538%0.37728%0.278SS..Hα-helixtrans-59.7-43.2174.7177.2-113.4000112.4L357 V358 W363 S364 N365 L368L357-F361 VanDerWaalsContact O-CB 3.28Å; L357-F361 WeakPolarHBondContact O-CB 3.01Å; L357-F361 PolarHBondContact O-N 2.81Å; V358-F361 PolarHBondContact O-N 2.6Å; F361-W363 VanDerWaalsContact C-N 3.29Å; F361-W363 PolarHBondContact O-N 3.14Å; F361-S364 CarbonylContact O-C 3.23Å; F361-S364 PolarHBondContact O-N 2.96Å; F361-N365 HydrophobicContact CD2-CB 4.45Å; F361-N365 HydrophobicContact CE2-CB 4.01Å; F361-N365 PolarHBondContact O-OD1 2.9Å; F361-L368 HydrophobicContact CD2-CB 3.84Å; F361-L368 HydrophobicContact CD2-CD2 4.08Å; F361-L368 HydrophobicContact CD2-CG 4.42Å; F361-L368 HydrophobicContact CE2-CB 4.44Å; F361-L368 HydrophobicContact CE2-CD2 4.05Å
362S96.8Very high96.1Very high85 Ų8550.6 Ų50.659%0.59428%0.276SS*.Hα-helixtrans-67.5-29.3175.670.80000113V358 T359 T360V358-S362 PolarHBondContact O-N 2.67Å; T359-S362 WeakPolarHBondContact CA-OG 3.15Å; T359-S362 PolarHBondContact O-OG 3.15Å; T360-S362 PolarHBondContact O-N 2.87Å
363W96.1Very high96.1Very high96 Ų9654.2 Ų54.236%0.36430%0.295SS..Hα-helixtrans-70-44.9173.1-178.184.2000112.2Y234 L237 I278 T359 T360 F361 T367Y234-W363 HydrophobicContact CD1-CH2 4.11Å; Y234-W363 AromaticContact CD1-CZ2 3.96Å; Y234-W363 HydrophobicContact CD1-CZ2 3.96Å; Y234-W363 AromaticContact CE1-CH2 3.91Å; Y234-W363 HydrophobicContact CE1-CH2 3.91Å; Y234-W363 AromaticContact CE1-CZ2 3.49Å; Y234-W363 HydrophobicContact CE1-CZ2 3.49Å; Y234-W363 VanDerWaalsContact CE1-CZ2 3.49Å; L237-W363 HydrophobicContact CD1-CH2 4.1Å; L237-W363 HydrophobicContact CD1-CZ2 3.7Å; I278-W363 HydrophobicContact CD1-CB 4.02Å; I278-W363 HydrophobicContact CD1-CG 4.12Å; I278-W363 HydrophobicContact CG1-CB 4.33Å; I278-W363 HydrophobicContact CG1-CD2 4.46Å; I278-W363 HydrophobicContact CG1-CG 4.02Å; I278-W363 HydrophobicContact CG2-CB 4.22Å; I278-W363 HydrophobicContact CG2-CG 4.37Å; T359-W363 WeakPolarHBondContact O-CB 3.26Å; T359-W363 PolarHBondContact O-N 2.96Å; T360-W363 WeakPolarHBondContact O-CB 3.44Å; T360-W363 PolarHBondContact O-N 3.41Å; T360-W363 VanDerWaalsContact O-N 3.12Å; F361-W363 VanDerWaalsContact C-N 3.29Å; F361-W363 PolarHBondContact O-N 3.14Å; W363-T367 HydrophobicContact CE3-CG2 4.14Å; W363-T367 HydrophobicContact CZ3-CG2 4.16Å
364S96.1Very high96.2Very high35 Ų3554 Ų5425%0.24529%0.294CS..  trans-157.4133.8169.175.80000112T360 F361 I366 T367T360-S364 PolarHBondContact O-N 3.43Å; F361-S364 CarbonylContact O-C 3.23Å; F361-S364 PolarHBondContact O-N 2.96Å; S364-I366 PolarHBondContact O-N 3.46Å; S364-T367 PolarHBondContact O-N 2.94Å; S364-T367 VanDerWaalsContact O-N 3.13Å; S364-T367 PolarHBondContact O-OG1 2.98Å; S364-T367 WeakPolarHBondContact OG-CG2 3.32Å
365N95.6Very high96.2Very high116 Ų11652 Ų5262%0.6228%0.283SS*.THydrogen-bonded Turntrans-59.8-28-176.3-65.2-6.3000114F361 T367 L368F361-N365 HydrophobicContact CD2-CB 4.45Å; F361-N365 HydrophobicContact CE2-CB 4.01Å; F361-N365 PolarHBondContact O-OD1 2.9Å; N365-T367 VanDerWaalsContact C-N 3.3Å; N365-T367 PolarHBondContact O-N 2.82Å; N365-L368 WeakPolarHBondContact O-CB 3.49Å; N365-L368 PolarHBondContact O-N 3.45Å
366I95.6Very high96.3Very high133 Ų13356.8 Ų56.868%0.68231%0.307SS*.THydrogen-bonded Turntrans-67.8-29.5-177.6-62.8170.6000111.6S364 L368 L369S364-I366 PolarHBondContact O-N 3.46Å; I366-L368 PolarHBondContact O-N 2.93Å; I366-L368 VanDerWaalsContact O-N 3.15Å; I366-L369 WeakPolarHBondContact O-CB 3.22Å; I366-L369 PolarHBondContact O-N 3.45Å; I366-L369 VanDerWaalsContact O-N 3.08Å
367T96.1Very high96.3Very high5 Ų557.5 Ų57.53%0.03131%0.312CS..Hα-helixtrans-65.4-20.9-17853.50000112.7L241 T360 W363 S364 N365 L369 L370 T371L241-T367 HydrophobicContact CD1-CG2 3.72Å; L241-T367 HydrophobicContact CD2-CG2 4.33Å; T360-T367 PolarHBondContact O-OG1 3.3Å; W363-T367 HydrophobicContact CE3-CG2 4.14Å; W363-T367 HydrophobicContact CZ3-CG2 4.16Å; S364-T367 PolarHBondContact O-N 2.94Å; S364-T367 VanDerWaalsContact O-N 3.13Å; S364-T367 PolarHBondContact O-OG1 2.98Å; S364-T367 WeakPolarHBondContact OG-CG2 3.32Å; N365-T367 VanDerWaalsContact C-N 3.3Å; N365-T367 PolarHBondContact O-N 2.82Å; T367-L369 PolarHBondContact O-N 3.35Å; T367-L370 PolarHBondContact O-N 2.95Å; T367-L370 VanDerWaalsContact O-N 3.08Å; T367-T371 PolarHBondContact O-N 3.2Å; T367-T371 PolarHBondContact O-OG1 3.34Å
368L95.4Very high96.4Very high77 Ų7755.4 Ų55.440%0.40330%0.301SS..Hα-helixtrans-57.7-35.9173.7-17765.7000112.2L357 F361 N365 I366 G372L357-L368 HydrophobicContact CD1-CD1 4.47Å; L357-L368 HydrophobicContact CD2-CD1 3.59Å; L357-L368 HydrophobicContact CG-CD1 4.19Å; F361-L368 HydrophobicContact CD2-CB 3.84Å; F361-L368 HydrophobicContact CD2-CD2 4.08Å; F361-L368 HydrophobicContact CD2-CG 4.42Å; F361-L368 HydrophobicContact CE2-CB 4.44Å; F361-L368 HydrophobicContact CE2-CD2 4.05Å; N365-L368 WeakPolarHBondContact O-CB 3.49Å; N365-L368 PolarHBondContact O-N 3.45Å; I366-L368 PolarHBondContact O-N 2.93Å; I366-L368 VanDerWaalsContact O-N 3.15Å; L368-G372 WeakPolarHBondContact O-CA 3.47Å; L368-G372 PolarHBondContact O-N 3.15Å
369L96.4Very high96.4Very high129 Ų12953.8 Ų53.868%0.67529%0.294SS*.Hα-helixtrans-64.5-44.7176-177.569.6000110.8I366 T367 L373I366-L369 WeakPolarHBondContact O-CB 3.22Å; I366-L369 PolarHBondContact O-N 3.45Å; I366-L369 VanDerWaalsContact O-N 3.08Å; T367-L369 PolarHBondContact O-N 3.35Å; L369-L373 VanDerWaalsContact O-CB 3.25Å; L369-L373 WeakPolarHBondContact O-CB 3.02Å; L369-L373 PolarHBondContact O-N 2.96Å
370L96.6Very high96.5Very high47 Ų4758 Ų5825%0.24632%0.316CS..Hα-helixtrans-71-46.7-177.2-63174000111.6L241 I245 T367 L373 N374L241-L370 HydrophobicContact CB-CD1 4.07Å; L241-L370 HydrophobicContact CD1-CD1 4.46Å; I245-L370 HydrophobicContact CD1-CB 4.05Å; I245-L370 HydrophobicContact CD1-CD2 3.52Å; I245-L370 HydrophobicContact CD1-CG 4.39Å; T367-L370 PolarHBondContact O-N 2.95Å; T367-L370 VanDerWaalsContact O-N 3.08Å; L370-L373 PolarHBondContact O-N 3.18Å; L370-N374 PolarHBondContact O-N 2.86Å
371T95.4Very high96.5Very high3 Ų358 Ų582%0.01832%0.316CS..Hα-helixtrans-69.2-39.5178.156.80000111.2L241 M244 L271 T367 N374 M375L241-T371 HydrophobicContact CD2-CG2 4.26Å; M244-T371 HydrophobicContact SD-CG2 4.45Å; L271-T371 HydrophobicContact CD2-CG2 4.38Å; T367-T371 PolarHBondContact O-N 3.2Å; T367-T371 PolarHBondContact O-OG1 3.34Å; T371-N374 WeakPolarHBondContact O-CB 3.09Å; T371-N374 PolarHBondContact O-N 3.37Å; T371-M375 WeakPolarHBondContact O-CG 3.42Å; T371-M375 PolarHBondContact O-N 3.3Å
372G95.6Very high96.6Very high32 Ų3253.9 Ų53.933%0.3330%0.298SS..Hα-helixtrans-62.5-41.2173.800000113.1L368 M375 L376L368-G372 WeakPolarHBondContact O-CA 3.47Å; L368-G372 PolarHBondContact O-N 3.15Å; G372-M375 PolarHBondContact O-N 2.88Å; G372-L376 PolarHBondContact O-N 3.34Å; G372-L376 VanDerWaalsContact O-N 3.13Å
373L96.8Very high96.6Very high76 Ų7653.7 Ų53.740%0.39829%0.29SS..Hα-helixtrans-64.1-42.1173.2-169.8154.5000111.1I245 L369 L370 M375 L376 V377I245-L373 HydrophobicContact CB-CD2 4.35Å; I245-L373 HydrophobicContact CD1-CD2 4.18Å; I245-L373 HydrophobicContact CG1-CD2 3.99Å; I245-L373 HydrophobicContact CG2-CD2 3.55Å; L369-L373 VanDerWaalsContact O-CB 3.25Å; L369-L373 WeakPolarHBondContact O-CB 3.02Å; L369-L373 PolarHBondContact O-N 2.96Å; L370-L373 PolarHBondContact O-N 3.18Å; L373-M375 PolarHBondContact O-N 3.35Å; L373-L376 PolarHBondContact O-N 3.45Å; L373-V377 HydrophobicContact CD2-CG2 3.77Å; L373-V377 WeakPolarHBondContact O-CG2 3.42Å; L373-V377 PolarHBondContact O-N 3.18Å
374N97.1Very high96.6Very high1 Ų152.9 Ų52.91%0.00529%0.287CS..Hα-helixtrans-58.3-46.7175.5-177.153.3000111.7M244 I245 S248 L370 T371 L376 V377 T378M244-N374 HydrophobicContact CG-CB 4.18Å; M244-N374 PolarHBondContact O-OD1 3.05Å; M244-N374 HydrophobicContact SD-CB 4.01Å; I245-N374 HydrophobicContact CG1-CB 4.47Å; S248-N374 PolarHBondContact OG-OD1 3.05Å; L370-N374 PolarHBondContact O-N 2.86Å; T371-N374 WeakPolarHBondContact O-CB 3.09Å; T371-N374 PolarHBondContact O-N 3.37Å; N374-L376 VanDerWaalsContact C-N 3.27Å; N374-L376 PolarHBondContact O-N 3.25Å; N374-V377 PolarHBondContact O-N 2.96Å; N374-V377 VanDerWaalsContact O-N 3.16Å; N374-T378 WeakPolarHBondContact O-CG2 3.37Å; N374-T378 PolarHBondContact O-N 3.45Å; N374-T378 PolarHBondContact O-OG1 3.33Å
375M95.5Very high96.7Very high50 Ų5051.2 Ų51.225%0.24628%0.276CS..Hα-helixtrans-58-38.3176.1-65.5-62.7-68.100112.7A343 E353 T371 G372 L373 T378 A379A343-M375 HydrophobicContact CB-CE 4.33Å; E353-M375 HydrophobicContact CB-CE 4.43Å; E353-M375 HydrophobicContact CB-SD 4.23Å; E353-M375 WeakPolarHBondContact OE2-CE 3.48Å; T371-M375 WeakPolarHBondContact O-CG 3.42Å; T371-M375 PolarHBondContact O-N 3.3Å; G372-M375 PolarHBondContact O-N 2.88Å; L373-M375 PolarHBondContact O-N 3.35Å; M375-T378 WeakPolarHBondContact CA-OG1 3.37Å; M375-T378 PolarHBondContact O-OG1 2.89Å; M375-A379 PolarHBondContact O-N 2.87Å; M375-A379 VanDerWaalsContact O-N 3.13Å
376L96.9Very high96.7Very high107 Ų10746.1 Ų46.156%0.5625%0.248SC*.Hα-helixtrans-67.3-46.1176.3-178.7138000111.2G372 L373 N374 T378 A379 L380G372-L376 PolarHBondContact O-N 3.34Å; G372-L376 VanDerWaalsContact O-N 3.13Å; L373-L376 PolarHBondContact O-N 3.45Å; N374-L376 VanDerWaalsContact C-N 3.27Å; N374-L376 PolarHBondContact O-N 3.25Å; L376-T378 VanDerWaalsContact C-N 3.31Å; L376-T378 PolarHBondContact O-N 2.91Å; L376-A379 PolarHBondContact O-N 2.97Å; L376-L380 HydrophobicContact CD2-CD1 3.74Å; L376-L380 HydrophobicContact CD2-CG 4.44Å; L376-L380 WeakPolarHBondContact O-CG 3.35Å; L376-L380 PolarHBondContact O-N 3.47Å
377V97.8Very high96.8Very high15 Ų1542 Ų429%0.09123%0.229CC..Hα-helixtrans-67.9-33.2178.9-176.80000111.3S248 L252 L373 N374 L380 Y381S248-V377 WeakPolarHBondContact OG-CG1 3.44Å; L252-V377 HydrophobicContact CD1-CG1 4.03Å; L252-V377 HydrophobicContact CG-CG1 4.41Å; L373-V377 HydrophobicContact CD2-CG2 3.77Å; L373-V377 WeakPolarHBondContact O-CG2 3.42Å; L373-V377 PolarHBondContact O-N 3.18Å; N374-V377 PolarHBondContact O-N 2.96Å; N374-V377 VanDerWaalsContact O-N 3.16Å; V377-L380 PolarHBondContact O-N 2.79Å; V377-Y381 HydrophobicContact CG1-CD1 4.41Å; V377-Y381 WeakPolarHBondContact O-CD1 3.45Å; V377-Y381 PolarHBondContact O-N 3.21Å
378T97.6Very high96.7Very high1 Ų142.7 Ų42.71%0.00623%0.233CC..Hα-helixtrans-64-42.7174.565.30000112.2N374 M375 L376 L380 Y381 S382N374-T378 WeakPolarHBondContact O-CG2 3.37Å; N374-T378 PolarHBondContact O-N 3.45Å; N374-T378 PolarHBondContact O-OG1 3.33Å; M375-T378 WeakPolarHBondContact CA-OG1 3.37Å; M375-T378 PolarHBondContact O-OG1 2.89Å; L376-T378 VanDerWaalsContact C-N 3.31Å; L376-T378 PolarHBondContact O-N 2.91Å; T378-L380 VanDerWaalsContact C-N 3.35Å; T378-L380 PolarHBondContact O-N 3.12Å; T378-Y381 HydrophobicContact CG2-CE1 3.75Å; T378-Y381 WeakPolarHBondContact CG2-OH 3.38Å; T378-S382 VanDerWaalsContact O-CB 3.25Å; T378-S382 WeakPolarHBondContact O-CB 3.49Å; T378-S382 PolarHBondContact O-N 3.09Å; T378-S382 VanDerWaalsContact O-N 3.11Å; T378-S382 PolarHBondContact O-OG 3.26Å
379A97.5Very high96.7Very high30 Ų3039 Ų3925%0.24821%0.214CC..Hα-helixtrans-61-43.1171.300000111.8M375 L376 S382 L383M375-A379 PolarHBondContact O-N 2.87Å; M375-A379 VanDerWaalsContact O-N 3.13Å; L376-A379 PolarHBondContact O-N 2.97Å; A379-S382 WeakPolarHBondContact CA-OG 3.38Å; A379-S382 PolarHBondContact O-OG 2.99Å; A379-L383 WeakPolarHBondContact O-CB 3.16Å; A379-L383 WeakPolarHBondContact O-CG 3.32Å; A379-L383 PolarHBondContact O-N 2.86Å; A379-L383 VanDerWaalsContact O-N 3.09Å
380L97.9Very high96.7Very high93 Ų9333 Ų3349%0.48718%0.182SC..Hα-helixtrans-62.9-50.8179.4-69.1174.6000112.7L252 L376 V377 T378 S382 Y384L252-L380 HydrophobicContact CD2-CB 3.87Å; L376-L380 HydrophobicContact CD2-CD1 3.74Å; L376-L380 HydrophobicContact CD2-CG 4.44Å; L376-L380 WeakPolarHBondContact O-CG 3.35Å; L376-L380 PolarHBondContact O-N 3.47Å; V377-L380 PolarHBondContact O-N 2.79Å; T378-L380 VanDerWaalsContact C-N 3.35Å; T378-L380 PolarHBondContact O-N 3.12Å; L380-S382 PolarHBondContact O-N 3.5Å; L380-Y384 WeakPolarHBondContact O-CB 3.31Å; L380-Y384 PolarHBondContact O-N 3.01Å
381Y97.6Very high96.6Very high0 Ų037.4 Ų37.40%020%0.196CC..Hα-helixtrans-71.9-30.7-176.973.2-117.8000112.7C251 L260 V377 T378 Y384 M385C251-Y381 HydrophobicContact CB-CD1 3.68Å; C251-Y381 HydrophobicContact CB-CD2 4.12Å; C251-Y381 HydrophobicContact CB-CE1 4.35Å; C251-Y381 HydrophobicContact CB-CG 3.58Å; L260-Y381 HydrophobicContact CD2-CD2 4.34Å; V377-Y381 HydrophobicContact CG1-CD1 4.41Å; V377-Y381 WeakPolarHBondContact O-CD1 3.45Å; V377-Y381 PolarHBondContact O-N 3.21Å; T378-Y381 HydrophobicContact CG2-CE1 3.75Å; T378-Y381 WeakPolarHBondContact CG2-OH 3.38Å; Y381-Y384 PolarHBondContact O-N 2.87Å; Y381-M385 WeakPolarHBondContact O-CB 3.35Å; Y381-M385 PolarHBondContact O-N 3.46Å
382S97.7Very high96.3Very high0 Ų040 Ų400%022%0.223CC..Hα-helixtrans-71.4-43.2179.855.30000111.4L342 T378 A379 L380 M385 F386L342-S382 WeakPolarHBondContact CB-OG 3.34Å; T378-S382 VanDerWaalsContact O-CB 3.25Å; T378-S382 WeakPolarHBondContact O-CB 3.49Å; T378-S382 PolarHBondContact O-N 3.09Å; T378-S382 VanDerWaalsContact O-N 3.11Å; T378-S382 PolarHBondContact O-OG 3.26Å; A379-S382 WeakPolarHBondContact CA-OG 3.38Å; A379-S382 PolarHBondContact O-OG 2.99Å; L380-S382 PolarHBondContact O-N 3.5Å; S382-M385 WeakPolarHBondContact O-CB 3.3Å; S382-M385 PolarHBondContact O-N 3.02Å; S382-F386 PolarHBondContact O-N 3.15Å
383L96.8Very high96Very high81 Ų8142.7 Ų42.742%0.42424%0.237SC..Hα-helixtrans-68.8-36.6171.8-68173.3000111.4L342 A379 M385 F386 T387L342-L383 HydrophobicContact CD2-CD2 4.14Å; L342-L383 HydrophobicContact CD2-CG 4.13Å; A379-L383 WeakPolarHBondContact O-CB 3.16Å; A379-L383 WeakPolarHBondContact O-CG 3.32Å; A379-L383 PolarHBondContact O-N 2.86Å; A379-L383 VanDerWaalsContact O-N 3.09Å; L383-M385 PolarHBondContact O-N 3.3Å; L383-F386 PolarHBondContact O-N 3.01Å; L383-T387 WeakPolarHBondContact O-CB 3.26Å; L383-T387 VanDerWaalsContact O-CG2 3.25Å; L383-T387 WeakPolarHBondContact O-CG2 3.22Å; L383-T387 PolarHBondContact O-N 3.24Å; L383-T387 PolarHBondContact O-OG1 3.4Å
384Y96.8Very high95.6Very high79 Ų7941.2 Ų41.231%0.3123%0.229SC..Hα-helixtrans-59.2-45.8172175.1-113.5000111.5M317 L380 Y381 F386 T387 T388M317-Y384 HydrophobicContact CE-CD1 4.01Å; M317-Y384 HydrophobicContact CE-CE1 3.32Å; L380-Y384 WeakPolarHBondContact O-CB 3.31Å; L380-Y384 PolarHBondContact O-N 3.01Å; Y381-Y384 PolarHBondContact O-N 2.87Å; Y384-F386 VanDerWaalsContact C-N 3.33Å; Y384-F386 PolarHBondContact O-N 3.36Å; Y384-T387 WeakPolarHBondContact CA-OG1 3.42Å; Y384-T387 PolarHBondContact O-N 3.29Å; Y384-T387 PolarHBondContact O-OG1 3.36Å; Y384-T387 VanDerWaalsContact O-OG1 3.12Å; Y384-T388 HydrophobicContact CD2-CG2 3.62Å; Y384-T388 HydrophobicContact CE1-CG2 4.35Å; Y384-T388 HydrophobicContact CE2-CG2 3.29Å; Y384-T388 HydrophobicContact CG-CG2 4.26Å; Y384-T388 VanDerWaalsContact O-CB 3.32Å; Y384-T388 WeakPolarHBondContact O-CB 3.34Å; Y384-T388 WeakPolarHBondContact O-CG2 3.38Å; Y384-T388 PolarHBondContact O-N 2.86Å; Y384-T388 PolarHBondContact O-OG1 3.33Å
385M97Very high95.1Very high1 Ų142.6 Ų42.61%0.00524%0.238CC..Hα-helixtrans-60.1-41.9175.5-171.1-154.5-46.100111.9L260 I261 L301 M317 W334 Y381 S382 L383 T388 T389L260-M385 HydrophobicContact CD2-CB 4.29Å; L260-M385 HydrophobicContact CD2-CE 3.3Å; L260-M385 HydrophobicContact CD2-CG 4.18Å; L260-M385 HydrophobicContact CD2-SD 4.3Å; I261-M385 HydrophobicContact CG1-CE 4.46Å; I261-M385 HydrophobicContact CG1-SD 4.45Å; L301-M385 HydrophobicContact CD1-CE 4.39Å; L301-M385 HydrophobicContact CD2-SD 4.02Å; M317-M385 HydrophobicContact SD-CG 4.45Å; W334-M385 HydrophobicContact CH2-SD 4.45Å; W334-M385 HydrophobicContact CZ3-CG 4.09Å; W334-M385 HydrophobicContact CZ3-SD 3.67Å; Y381-M385 WeakPolarHBondContact O-CB 3.35Å; Y381-M385 PolarHBondContact O-N 3.46Å; S382-M385 WeakPolarHBondContact O-CB 3.3Å; S382-M385 PolarHBondContact O-N 3.02Å; L383-M385 PolarHBondContact O-N 3.3Å; M385-T388 PolarHBondContact O-OG1 3.27Å; M385-T389 WeakPolarHBondContact O-CB 3.45Å; M385-T389 VanDerWaalsContact O-CG2 3.29Å; M385-T389 WeakPolarHBondContact O-CG2 3.32Å; M385-T389 PolarHBondContact O-N 3.44Å; M385-T389 PolarHBondContact O-OG1 3.24Å
386F97.3Very high94.3Very high9 Ų948 Ų484%0.03926%0.262CS..Hα-helixtrans-67.8-51.2177.9178.1-101.7000112.1W334 L335 S382 L383 Y384 T388 T389 Q390 W391W334-F386 HydrophobicContact CB-CD2 3.99Å; W334-F386 HydrophobicContact CB-CE2 4.02Å; L335-F386 HydrophobicContact CB-CD2 4.43Å; L335-F386 HydrophobicContact CB-CE2 3.67Å; L335-F386 HydrophobicContact CB-CZ 3.98Å; L335-F386 HydrophobicContact CD1-CE1 4.03Å; L335-F386 HydrophobicContact CD1-CE2 4.1Å; L335-F386 HydrophobicContact CD1-CZ 3.8Å; L335-F386 HydrophobicContact CG-CZ 4.45Å; S382-F386 PolarHBondContact O-N 3.15Å; L383-F386 PolarHBondContact O-N 3.01Å; Y384-F386 VanDerWaalsContact C-N 3.33Å; Y384-F386 PolarHBondContact O-N 3.36Å; F386-T388 PolarHBondContact O-N 2.93Å; F386-T389 PolarHBondContact O-N 3.21Å; F386-T389 PolarHBondContact O-OG1 2.78Å; F386-Q390 HydrophobicContact CD2-CB 4.29Å; F386-Q390 HydrophobicContact CD2-CG 3.74Å; F386-Q390 HydrophobicContact CE2-CB 3.94Å; F386-Q390 HydrophobicContact CE2-CG 3.57Å; F386-Q390 HydrophobicContact CZ-CB 4.08Å; F386-Q390 HydrophobicContact CZ-CG 4.23Å; F386-Q390 WeakPolarHBondContact O-CB 3.25Å; F386-Q390 PolarHBondContact O-N 2.64Å; F386-W391 HydrophobicContact CE1-CD2 4.35Å; F386-W391 AromaticContact CE1-CE2 3.65Å; F386-W391 AromaticContact CE1-CZ2 3.89Å; F386-W391 HydrophobicContact CE1-CZ2 3.89Å; F386-W391 AromaticContact CE1-NE1 3.53Å; F386-W391 AromaticContact CZ-NE1 3.96Å
387T96.4Very high93.7Very high47 Ų4751.8 Ų51.829%0.28828%0.276SS..Hα-helixtrans-64.3-42.2-177.352.90000112.3L383 Y384 T389 W391L383-T387 WeakPolarHBondContact O-CB 3.26Å; L383-T387 VanDerWaalsContact O-CG2 3.25Å; L383-T387 WeakPolarHBondContact O-CG2 3.22Å; L383-T387 PolarHBondContact O-N 3.24Å; L383-T387 PolarHBondContact O-OG1 3.4Å; Y384-T387 WeakPolarHBondContact CA-OG1 3.42Å; Y384-T387 PolarHBondContact O-N 3.29Å; Y384-T387 PolarHBondContact O-OG1 3.36Å; Y384-T387 VanDerWaalsContact O-OG1 3.12Å; T387-T389 VanDerWaalsContact C-N 3.31Å; T387-T389 PolarHBondContact O-N 3.05Å; T387-W391 HydrophobicContact CG2-CD2 4.22Å; T387-W391 HydrophobicContact CG2-CE3 3.6Å; T387-W391 HydrophobicContact CG2-CZ3 3.92Å; T387-W391 CarbonylContact O-C 3.56Å; T387-W391 WeakPolarHBondContact O-CA 3.36Å; T387-W391 WeakPolarHBondContact O-CB 3.43Å; T387-W391 PolarHBondContact O-N 3.36Å
388T95.6Very high92.8Very high19 Ų1952.9 Ų52.912%0.11728%0.281CS..Hα-helixtrans-67.7-30178.7530000113.2M317 Q321 Y384 M385 F386M317-T388 HydrophobicContact CE-CG2 4.18Å; M317-T388 WeakPolarHBondContact CG-OG1 3.45Å; M317-T388 PolarHBondContact SD-OG1 2.98Å; Q321-T388 WeakPolarHBondContact CG-O 3.45Å; Y384-T388 HydrophobicContact CD2-CG2 3.62Å; Y384-T388 HydrophobicContact CE1-CG2 4.35Å; Y384-T388 HydrophobicContact CE2-CG2 3.29Å; Y384-T388 HydrophobicContact CG-CG2 4.26Å; Y384-T388 VanDerWaalsContact O-CB 3.32Å; Y384-T388 WeakPolarHBondContact O-CB 3.34Å; Y384-T388 WeakPolarHBondContact O-CG2 3.38Å; Y384-T388 PolarHBondContact O-N 2.86Å; Y384-T388 PolarHBondContact O-OG1 3.33Å; M385-T388 PolarHBondContact O-OG1 3.27Å; F386-T388 PolarHBondContact O-N 2.93Å
389T95.3Very high91.8Very high0 Ų059 Ų590%031%0.314CS..Hα-helixtrans-91.8-40.7-179.359.20000113L257 M317 S320 G322 L323 M385 F386 T387L257-T389 HydrophobicContact CD1-CG2 3.51Å; M317-T389 HydrophobicContact CG-CG2 3.73Å; M317-T389 HydrophobicContact SD-CG2 4.38Å; S320-T389 CarbonylContact O-C 3.39Å; S320-T389 WeakPolarHBondContact O-CA 3.37Å; G322-T389 PolarHBondContact N-O 3.41Å; L323-T389 WeakPolarHBondContact CB-O 3.38Å; L323-T389 PolarHBondContact N-O 3.05Å; M385-T389 WeakPolarHBondContact O-CB 3.45Å; M385-T389 VanDerWaalsContact O-CG2 3.29Å; M385-T389 WeakPolarHBondContact O-CG2 3.32Å; M385-T389 PolarHBondContact O-N 3.44Å; M385-T389 PolarHBondContact O-OG1 3.24Å; F386-T389 PolarHBondContact O-N 3.21Å; F386-T389 PolarHBondContact O-OG1 2.78Å; T387-T389 VanDerWaalsContact C-N 3.31Å; T387-T389 PolarHBondContact O-N 3.05Å
390Q96.1Very high90.6Very high2 Ų265 Ų651%0.00934%0.342CS..Hα-helixtrans-97.7-37-171.1-57-47.5-5900113.1G322 L323 Q324 A331 W334 F386G322-Q390 CarbonylContact C-O 3.29Å; G322-Q390 VanDerWaalsContact C-O 3.29Å; G322-Q390 WeakPolarHBondContact CA-O 3.45Å; L323-Q390 PolarHBondContact N-O 3.42Å; Q324-Q390 HydrophobicContact CB-CB 4.35Å; Q324-Q390 WeakPolarHBondContact CB-O 3.16Å; Q324-Q390 PolarHBondContact N-O 2.93Å; Q324-Q390 VanDerWaalsContact N-O 3.08Å; A331-Q390 HydrophobicContact CB-CG 4.38Å; W334-Q390 HydrophobicContact CB-CG 3.8Å; W334-Q390 HydrophobicContact CG-CG 4.01Å; F386-Q390 HydrophobicContact CD2-CB 4.29Å; F386-Q390 HydrophobicContact CD2-CG 3.74Å; F386-Q390 HydrophobicContact CE2-CB 3.94Å; F386-Q390 HydrophobicContact CE2-CG 3.57Å; F386-Q390 HydrophobicContact CZ-CB 4.08Å; F386-Q390 HydrophobicContact CZ-CG 4.23Å; F386-Q390 WeakPolarHBondContact O-CB 3.25Å; F386-Q390 PolarHBondContact O-N 2.64Å
391W93.4Very high90.1Very high140 Ų14062.1 Ų62.153%0.5333%0.326SS..SBendtrans-95.7170-176.1-68.2-2.1000112.2G322 F386 T387G322-W391 WeakPolarHBondContact CA-O 3.47Å; G322-W391 PolarHBondContact N-O 2.91Å; F386-W391 HydrophobicContact CE1-CD2 4.35Å; F386-W391 AromaticContact CE1-CE2 3.65Å; F386-W391 AromaticContact CE1-CZ2 3.89Å; F386-W391 HydrophobicContact CE1-CZ2 3.89Å; F386-W391 AromaticContact CE1-NE1 3.53Å; F386-W391 AromaticContact CZ-NE1 3.96Å; T387-W391 HydrophobicContact CG2-CD2 4.22Å; T387-W391 HydrophobicContact CG2-CE3 3.6Å; T387-W391 HydrophobicContact CG2-CZ3 3.92Å; T387-W391 CarbonylContact O-C 3.56Å; T387-W391 WeakPolarHBondContact O-CA 3.36Å; T387-W391 WeakPolarHBondContact O-CB 3.43Å; T387-W391 PolarHBondContact O-N 3.36Å
392G90.3Very high89.8Confident58 Ų5867.3 Ų67.360%0.59835%0.349SS*.SBendtrans92.2-177.4-178.900000113.7G322G322-G392 WeakPolarHBondContact CA-O 3.46Å
393S88.7Confident89.6Confident87 Ų8772.1 Ų72.161%0.60838%0.38SS*.PPolyproline II helixtrans-72.5142.3175.4530000110.7
394L87.4Confident89.5Confident46 Ų4669.9 Ų69.924%0.24137%0.371CS..PPolyproline II helixtrans-62.6139.1172.3-15297.7000110.5G322 L326 H396G322-L394 WeakPolarHBondContact O-CD1 3.03Å; L326-L394 HydrophobicContact CD1-CD1 3.4Å; L326-L394 HydrophobicContact CD1-CD2 3.91Å; L326-L394 HydrophobicContact CD1-CG 4.25Å; L326-L394 HydrophobicContact CD2-CD1 4.48Å; L326-L394 HydrophobicContact CG-CD1 3.6Å; L394-H396 PolarHBondContact O-N 3.47Å
395T86.6Confident89.4Confident30 Ų3070.1 Ų70.118%0.18437%0.374CS..PPolyproline II helixtrans-64.8118.4171.552.30000110.5Q321 H397 I398Q321-T395 HydrophobicContact CB-CG2 4.23Å; T395-H397 PolarHBondContact O-N 3.12Å; T395-I398 PolarHBondContact O-N 2.89Å; T395-I398 WeakPolarHBondContact OG1-CD1 3.3Å; T395-I398 WeakPolarHBondContact OG1-CG1 3.5Å
396H80Confident89.4Confident164 Ų16475.8 Ų75.876%0.75941%0.409SS*.THydrogen-bonded Turntrans-59.6-21.9-171.9-66.5-60.6000116L394 N399L394-H396 PolarHBondContact O-N 3.47Å; H396-N399 PolarHBondContact O-OD1 3.22Å; H396-N399 VanDerWaalsContact O-OD1 3.08Å
397H82.9Confident89.3Confident185 Ų18577.4 Ų77.486%0.85642%0.415SS*.THydrogen-bonded Turntrans-84.3-11.3179.7-59.9-56.2000113.5T395 N399T395-H397 PolarHBondContact O-N 3.12Å; H397-N399 PolarHBondContact O-N 3.17Å
398I80.7Confident89.2Confident38 Ų3875.4 Ų75.420%0.19540%0.402CS..  trans-93.490.7-179.1-61.5-170.4000109.1T312 L319 T395 M401T312-I398 HydrophobicContact CG2-CD1 4.13Å; L319-I398 WeakPolarHBondContact O-CD1 3.28Å; T395-I398 PolarHBondContact O-N 2.89Å; T395-I398 WeakPolarHBondContact OG1-CD1 3.3Å; T395-I398 WeakPolarHBondContact OG1-CG1 3.5Å; I398-M401 HydrophobicContact CD1-CE 4.28Å; I398-M401 HydrophobicContact CG2-CE 3.52Å; I398-M401 HydrophobicContact CG2-CG 3.47Å; I398-M401 VanDerWaalsContact CG2-CG 3.47Å; I398-M401 HydrophobicContact CG2-SD 4.07Å
399N75.4Confident89.3Confident129 Ų12975.8 Ų75.869%0.6940%0.404SS*.  trans-100.9-17.6-175.8-68.6-8.3000114.2H396 H397H396-N399 PolarHBondContact O-OD1 3.22Å; H396-N399 VanDerWaalsContact O-OD1 3.08Å; H397-N399 PolarHBondContact O-N 3.17Å
400N73.3Confident89.3Confident157 Ų15778.9 Ų78.984%0.8442%0.422SS*.  trans-11746-168.9-71.8-4.4000113.9K402N400-K402 PolarHBondContact O-N 2.89Å
401M86.6Confident89.3Confident32 Ų3279 Ų7916%0.15842%0.423CS..PPolyproline II helixtrans-75.6116.8173.8-74.8-70.5-159.800110.8R311 T312 L323 L326 I398R311-M401 HydrophobicContact CB-CE 4.32Å; R311-M401 HydrophobicContact CB-SD 3.45Å; R311-M401 WeakPolarHBondContact CB-SD 3.46Å; R311-M401 VanDerWaalsContact CD-SD 3.55Å; R311-M401 HydrophobicContact CG-SD 4.05Å; T312-M401 HydrophobicContact CG2-CE 3.36Å; L323-M401 HydrophobicContact CD2-CE 3.68Å; L326-M401 HydrophobicContact CD1-CB 3.88Å; L326-M401 HydrophobicContact CD1-CG 3.94Å; I398-M401 HydrophobicContact CD1-CE 4.28Å; I398-M401 HydrophobicContact CG2-CE 3.52Å; I398-M401 HydrophobicContact CG2-CG 3.47Å; I398-M401 VanDerWaalsContact CG2-CG 3.47Å; I398-M401 HydrophobicContact CG2-SD 4.07Å
402K90.8Very high89.5Confident110 Ų11072.4 Ų72.448%0.47840%0.398SS..PPolyproline II helixtrans-70.6145.1172.5-63.1-178.6-174.9176.40110.2R311 N400 F405R311-K402 PolarHBondContact NE-O 2.98Å; R311-K402 PolarHBondContact NH2-O 3.02Å; N400-K402 PolarHBondContact O-N 2.89Å; K402-F405 HydrophobicContact CB-CE2 4.39Å; K402-F405 HydrophobicContact CB-CZ 4.19Å; K402-F405 HydrophobicContact CD-CE2 4.47Å; K402-F405 HydrophobicContact CD-CZ 3.86Å
403P94.1Very high89.8Confident100 Ų10075.1 Ų75.165%0.64939%0.394SS*.PPolyproline II helixtrans-59165.617425.6-34.2000111.8R311 F405R311-P403 PolarHBondContact NH2-O 3.4Å; P403-F405 PolarHBondContact O-N 2.92Å
404S95.1Very high90.1Very high35 Ų3573.7 Ų73.725%0.24538%0.378CS..PPolyproline II helixtrans-62.2126.9177.659.30000110.5N409S404-N409 PolarHBondContact OG-ND2 3.25Å; S404-N409 VanDerWaalsContact OG-ND2 3.09Å
405F95.5Very high90.5Very high83 Ų8371.5 Ų71.536%0.36437%0.367SS..PPolyproline II helixtrans-77.1150.6176.9-65.6-76.1000110.9K402 P403 R407 E408 N409K402-F405 HydrophobicContact CB-CE2 4.39Å; K402-F405 HydrophobicContact CB-CZ 4.19Å; K402-F405 HydrophobicContact CD-CE2 4.47Å; K402-F405 HydrophobicContact CD-CZ 3.86Å; P403-F405 PolarHBondContact O-N 2.92Å; F405-R407 PolarHBondContact O-N 3.45Å; F405-E408 HydrophobicContact CB-CG 4.14Å; F405-E408 PolarHBondContact N-OE2 2.73Å; F405-E408 WeakPolarHBondContact O-CB 3.45Å; F405-E408 PolarHBondContact O-N 2.94Å; F405-N409 PolarHBondContact O-N 3.44Å; F405-N409 VanDerWaalsContact O-N 3.1Å
406T95.4Very high90.9Very high121 Ų12170.5 Ų70.574%0.74236%0.36SS*.Hα-helixtrans-56.6-39174.5530000112.2E408 N409 T410T406-E408 VanDerWaalsContact C-N 3.33Å; T406-E408 PolarHBondContact O-N 3.42Å; T406-N409 PolarHBondContact O-N 3.23Å; T406-T410 WeakPolarHBondContact O-CB 3.44Å; T406-T410 VanDerWaalsContact O-CG2 3.25Å; T406-T410 WeakPolarHBondContact O-CG2 3.44Å; T406-T410 PolarHBondContact O-N 3.47Å; T406-T410 PolarHBondContact O-OG1 3.49Å
407R94.8Very high91.5Very high43 Ų4363.8 Ų63.816%0.16233%0.332CS..Hα-helixtrans-56.2-42.1172-176.6-166.768.299.1-3.4113M53 A54 E310 F405 T410 L411M53-R407 WeakPolarHBondContact O-CD 3.3Å; M53-R407 PolarHBondContact O-NH1 3.43Å; A54-R407 PolarHBondContact O-NH1 3.48Å; E310-R407 IonicContact OE1-NH2 3.51Å; E310-R407 PolarHBondContact OE1-NH2 3Å; E310-R407 IonicContact OE2-NH2 3.42Å; E310-R407 PolarHBondContact OE2-NH2 3.35Å; F405-R407 PolarHBondContact O-N 3.45Å; R407-T410 VanDerWaalsContact CA-OG1 3.31Å; R407-T410 WeakPolarHBondContact CA-OG1 3.43Å; R407-T410 PolarHBondContact O-OG1 2.92Å; R407-L411 VanDerWaalsContact O-CB 3.29Å; R407-L411 WeakPolarHBondContact O-CB 3.05Å; R407-L411 PolarHBondContact O-N 3.28Å; R407-L411 VanDerWaalsContact O-N 3.08Å
408E96.3Very high92Very high5 Ų555.8 Ų55.82%0.02330%0.296CS..Hα-helixtrans-70.5-47.1-179-64.2171.7152.800110.2R311 M330 F405 T406 T410 L411 M412R311-E408 IonicContact CZ-OE1 2.86Å; R311-E408 IonicContact CZ-OE2 3.52Å; R311-E408 IonicContact NH1-OE1 3.15Å; R311-E408 PolarHBondContact NH1-OE1 3.13Å; R311-E408 IonicContact NH1-OE2 2.81Å; R311-E408 PolarHBondContact NH1-OE2 3.18Å; R311-E408 IonicContact NH2-OE1 2.68Å; R311-E408 PolarHBondContact NH2-OE1 2.83Å; R311-E408 IonicContact NH2-OE2 3.36Å; R311-E408 PolarHBondContact NH2-OE2 3.45Å; M330-E408 HydrophobicContact CE-CB 3.91Å; F405-E408 HydrophobicContact CB-CG 4.14Å; F405-E408 PolarHBondContact N-OE2 2.73Å; F405-E408 WeakPolarHBondContact O-CB 3.45Å; F405-E408 PolarHBondContact O-N 2.94Å; T406-E408 VanDerWaalsContact C-N 3.33Å; T406-E408 PolarHBondContact O-N 3.42Å; E408-T410 PolarHBondContact O-N 2.98Å; E408-L411 WeakPolarHBondContact O-CB 2.85Å; E408-L411 PolarHBondContact O-N 3.19Å; E408-M412 WeakPolarHBondContact O-CG 3.47Å; E408-M412 PolarHBondContact O-N 3.35Å
409N97Very high92.6Very high27 Ų2754.1 Ų54.114%0.14429%0.288CS..Hα-helixtrans-64.9-40.4179.6-68.3-29.1000112.3W333 S404 F405 T406 L411 M412 F413W333-N409 PolarHBondContact NE1-OD1 2.92Å; S404-N409 PolarHBondContact OG-ND2 3.25Å; S404-N409 VanDerWaalsContact OG-ND2 3.09Å; F405-N409 PolarHBondContact O-N 3.44Å; F405-N409 VanDerWaalsContact O-N 3.1Å; T406-N409 PolarHBondContact O-N 3.23Å; N409-L411 VanDerWaalsContact C-N 3.31Å; N409-L411 PolarHBondContact O-N 3.45Å; N409-M412 PolarHBondContact O-N 2.9Å; N409-F413 WeakPolarHBondContact O-CB 3.43Å; N409-F413 PolarHBondContact O-N 2.87Å
410T95.8Very high93.4Very high64 Ų6452.8 Ų52.839%0.39328%0.28SS..Hα-helixtrans-63.1-38.5173.948.20000111.8M53 T406 R407 E408 F413 M414M53-T410 WeakPolarHBondContact CE-OG1 3.44Å; T406-T410 WeakPolarHBondContact O-CB 3.44Å; T406-T410 VanDerWaalsContact O-CG2 3.25Å; T406-T410 WeakPolarHBondContact O-CG2 3.44Å; T406-T410 PolarHBondContact O-N 3.47Å; T406-T410 PolarHBondContact O-OG1 3.49Å; R407-T410 VanDerWaalsContact CA-OG1 3.31Å; R407-T410 WeakPolarHBondContact CA-OG1 3.43Å; R407-T410 PolarHBondContact O-OG1 2.92Å; E408-T410 PolarHBondContact O-N 2.98Å; T410-F413 PolarHBondContact O-N 2.95Å; T410-M414 WeakPolarHBondContact O-CB 2.98Å; T410-M414 VanDerWaalsContact O-CG 3.23Å; T410-M414 WeakPolarHBondContact O-CG 3.18Å; T410-M414 PolarHBondContact O-N 3Å
411L96.2Very high94.2Very high4 Ų450.8 Ų50.82%0.02127%0.269CS..Hα-helixtrans-63.4-46.2174.4-178152.8000111.5L50 M53 A54 C303 R407 E408 N409 F413 M414 H415L50-L411 HydrophobicContact CD2-CG 4.23Å; M53-L411 HydrophobicContact CB-CD1 4.39Å; A54-L411 HydrophobicContact CB-CD1 3.63Å; C303-L411 HydrophobicContact CB-CD2 3.37Å; C303-L411 VanDerWaalsContact SG-CD2 3.55Å; R407-L411 VanDerWaalsContact O-CB 3.29Å; R407-L411 WeakPolarHBondContact O-CB 3.05Å; R407-L411 PolarHBondContact O-N 3.28Å; R407-L411 VanDerWaalsContact O-N 3.08Å; E408-L411 WeakPolarHBondContact O-CB 2.85Å; E408-L411 PolarHBondContact O-N 3.19Å; N409-L411 VanDerWaalsContact C-N 3.31Å; N409-L411 PolarHBondContact O-N 3.45Å; L411-F413 VanDerWaalsContact C-N 3.34Å; L411-F413 PolarHBondContact O-N 2.94Å; L411-M414 PolarHBondContact O-N 3.15Å; L411-H415 PolarHBondContact O-CD2 2.96Å; L411-H415 PolarHBondContact O-N 3.13Å; L411-H415 VanDerWaalsContact O-N 3.13Å
412M97.4Very high94.5Very high3 Ų349.9 Ų49.92%0.01527%0.265CS..Hα-helixtrans-62.8-43178.1-58.4-46.4158.800111.4L300 C303 L304 M330 W333 E408 N409 M414 H415 L416L300-M412 HydrophobicContact CD1-CB 4.12Å; L300-M412 HydrophobicContact CD1-CG 4.33Å; L300-M412 HydrophobicContact CD1-SD 3.42Å; L300-M412 WeakPolarHBondContact CD1-SD 3.37Å; C303-M412 HydrophobicContact CB-CE 3.9Å; C303-M412 HydrophobicContact CB-SD 4.21Å; L304-M412 HydrophobicContact CD2-CE 3.74Å; L304-M412 HydrophobicContact CD2-CG 4.17Å; L304-M412 HydrophobicContact CD2-SD 3.62Å; L304-M412 HydrophobicContact CG-CE 4.08Å; L304-M412 HydrophobicContact CG-SD 3.79Å; M330-M412 HydrophobicContact SD-CE 4.26Å; M330-M412 HydrophobicContact SD-CG 4.36Å; W333-M412 HydrophobicContact CB-CB 4.1Å; W333-M412 HydrophobicContact CB-CG 4.06Å; W333-M412 HydrophobicContact CD2-CB 3.63Å; W333-M412 HydrophobicContact CD2-CG 4.39Å; W333-M412 HydrophobicContact CE3-CB 4.17Å; W333-M412 HydrophobicContact CG-CB 3.6Å; W333-M412 HydrophobicContact CG-CG 3.84Å; E408-M412 WeakPolarHBondContact O-CG 3.47Å; E408-M412 PolarHBondContact O-N 3.35Å; N409-M412 PolarHBondContact O-N 2.9Å; M412-M414 PolarHBondContact O-N 3.03Å; M412-H415 PolarHBondContact O-N 3.26Å; M412-L416 PolarHBondContact O-N 2.69Å
413F96.7Very high94.6Very high114 Ų11446.2 Ų46.250%0.525%0.252SS..Hα-helixtrans-60.3-45.6176.5177.4-102.1000112.2W333 N409 T410 L411 H415 L416 S417W333-F413 HydrophobicContact CH2-CB 3.96Å; W333-F413 HydrophobicContact CH2-CD2 4.12Å; W333-F413 HydrophobicContact CZ2-CB 4.27Å; N409-F413 WeakPolarHBondContact O-CB 3.43Å; N409-F413 PolarHBondContact O-N 2.87Å; T410-F413 PolarHBondContact O-N 2.95Å; L411-F413 VanDerWaalsContact C-N 3.34Å; L411-F413 PolarHBondContact O-N 2.94Å; F413-H415 PolarHBondContact O-N 3.33Å; F413-L416 PolarHBondContact O-N 3.44Å; F413-S417 WeakPolarHBondContact O-CB 3.3Å; F413-S417 PolarHBondContact O-N 3.32Å; F413-S417 PolarHBondContact O-OG 3.14Å
414M95.1Very high94.4Very high58 Ų5848.3 Ų48.329%0.28626%0.257SS..Hα-helixtrans-68-20.8178.6-70.9-67.1-163.200113.6W46 L50 T410 L411 M412 P418W46-M414 HydrophobicContact CH2-SD 3.76Å; W46-M414 HydrophobicContact CZ2-CB 4.08Å; W46-M414 VanDerWaalsContact CZ2-O 3.28Å; W46-M414 WeakPolarHBondContact CZ2-O 3.27Å; W46-M414 HydrophobicContact CZ2-SD 3.87Å; W46-M414 PolarHBondContact NE1-O 3.46Å; W46-M414 VanDerWaalsContact NE1-O 3.07Å; L50-M414 HydrophobicContact CD2-CB 3.62Å; T410-M414 WeakPolarHBondContact O-CB 2.98Å; T410-M414 VanDerWaalsContact O-CG 3.23Å; T410-M414 WeakPolarHBondContact O-CG 3.18Å; T410-M414 PolarHBondContact O-N 3Å; L411-M414 PolarHBondContact O-N 3.15Å; M412-M414 PolarHBondContact O-N 3.03Å; M414-P418 WeakPolarHBondContact O-CD 3.39Å; M414-P418 WeakPolarHBondContact O-CG 3.44Å
415H95.3Very high94.1Very high0 Ų050 Ų500%026%0.264CS..Hα-helixtrans-80.3-36.4170-89.2-71000112.9M204 S299 L300 L411 M412 F413 P418 I419M204-H415 WeakPolarHBondContact CE-NE2 2.97Å; S299-H415 PolarHBondContact OG-CE1 2.97Å; S299-H415 PolarHBondContact OG-ND1 3.48Å; L300-H415 HydrophobicContact CB-CB 3.97Å; L300-H415 HydrophobicContact CD1-CB 3.75Å; L300-H415 HydrophobicContact CG-CB 4.31Å; L411-H415 PolarHBondContact O-CD2 2.96Å; L411-H415 PolarHBondContact O-N 3.13Å; L411-H415 VanDerWaalsContact O-N 3.13Å; M412-H415 PolarHBondContact O-N 3.26Å; F413-H415 PolarHBondContact O-N 3.33Å; H415-P418 WeakPolarHBondContact O-CD 3.48Å; H415-I419 WeakPolarHBondContact O-CD1 3.38Å; H415-I419 WeakPolarHBondContact O-CG1 3.34Å
416L94.4Very high93.8Very high8 Ų847.6 Ų47.64%0.04226%0.257CS..Hα-helixtrans-83.8-32.4-176.8-81.2161.1000113.5L300 W333 L336 M412 F413 I419 L420L300-L416 HydrophobicContact CD2-CD1 4.13Å; L300-L416 HydrophobicContact CD2-CD2 3.84Å; L300-L416 HydrophobicContact CD2-CG 3.72Å; W333-L416 HydrophobicContact CD2-CD1 4.32Å; W333-L416 HydrophobicContact CE3-CD1 3.18Å; W333-L416 HydrophobicContact CZ3-CD1 3.43Å; W333-L416 VanDerWaalsContact CZ3-CD1 3.43Å; L336-L416 HydrophobicContact CB-CD1 4.04Å; L336-L416 HydrophobicContact CB-CD2 4.03Å; L336-L416 HydrophobicContact CD1-CD1 3.85Å; M412-L416 PolarHBondContact O-N 2.69Å; F413-L416 PolarHBondContact O-N 3.44Å; L416-I419 HydrophobicContact CD2-CD1 4.28Å; L416-I419 WeakPolarHBondContact O-CB 3.47Å; L416-I419 PolarHBondContact O-N 3Å; L416-I419 VanDerWaalsContact O-N 3.12Å; L416-L420 PolarHBondContact O-N 3.36Å
417S93.6Very high93.2Very high24 Ų2446.9 Ų46.917%0.16825%0.248CC..Hα-helixtrans-57.8-41.9-17966.70000113.2F413 L420 L421F413-S417 WeakPolarHBondContact O-CB 3.3Å; F413-S417 PolarHBondContact O-N 3.32Å; F413-S417 PolarHBondContact O-OG 3.14Å; S417-L420 PolarHBondContact O-N 3.27Å; S417-L421 WeakPolarHBondContact O-CB 3.33Å; S417-L421 WeakPolarHBondContact O-CG 3.37Å; S417-L421 PolarHBondContact O-N 3.1Å
418P92.5Very high92.7Very high16 Ų1647.6 Ų47.610%0.10426%0.255CS..Hα-helixtrans-69.7-34.7176.1-14.731.2000112.1W46 L296 M414 H415 L420 L421 L422W46-P418 HydrophobicContact CZ2-CG 4.01Å; L296-P418 HydrophobicContact CD1-CB 4.04Å; M414-P418 WeakPolarHBondContact O-CD 3.39Å; M414-P418 WeakPolarHBondContact O-CG 3.44Å; H415-P418 WeakPolarHBondContact O-CD 3.48Å; P418-L420 VanDerWaalsContact C-N 3.33Å; P418-L420 PolarHBondContact O-N 2.89Å; P418-L421 PolarHBondContact O-N 3.47Å; P418-L422 WeakPolarHBondContact O-CB 3.34Å; P418-L422 WeakPolarHBondContact O-CG 3.41Å; P418-L422 PolarHBondContact O-N 2.84Å
419I92.6Very high92.2Very high3 Ų347.4 Ų47.42%0.01525%0.254CS..Hα-helixtrans-60.9-45.5177.2-61171.7000110L296 T297 I348 H415 L416 S423L296-I419 HydrophobicContact CB-CD1 3.78Å; L296-I419 HydrophobicContact CB-CG1 3.62Å; L296-I419 HydrophobicContact CD1-CG1 3.76Å; L296-I419 HydrophobicContact CG-CG1 4.31Å; T297-I419 HydrophobicContact CG2-CD1 3.84Å; I348-I419 HydrophobicContact CG1-CG2 4.2Å; H415-I419 WeakPolarHBondContact O-CD1 3.38Å; H415-I419 WeakPolarHBondContact O-CG1 3.34Å; L416-I419 HydrophobicContact CD2-CD1 4.28Å; L416-I419 WeakPolarHBondContact O-CB 3.47Å; L416-I419 PolarHBondContact O-N 3Å; L416-I419 VanDerWaalsContact O-N 3.12Å; I419-S423 PolarHBondContact O-N 2.89Å
420L92Very high91.4Very high101 Ų10146.9 Ų46.953%0.52925%0.251SS..Hα-helixtrans-69.1-44.9178.4-67.8171.9000111.8L416 S417 P418 L422 S423 L424L416-L420 PolarHBondContact O-N 3.36Å; S417-L420 PolarHBondContact O-N 3.27Å; P418-L420 VanDerWaalsContact C-N 3.33Å; P418-L420 PolarHBondContact O-N 2.89Å; L420-L422 PolarHBondContact O-N 3.2Å; L420-S423 WeakPolarHBondContact O-CB 3.44Å; L420-S423 PolarHBondContact O-N 3.23Å; L420-S423 PolarHBondContact O-OG 3.07Å; L420-L424 PolarHBondContact O-N 3.15Å
421L91.9Very high90.3Very high116 Ų11643.9 Ų43.961%0.60723%0.234SC*.Hα-helixtrans-64.6-41.3179.7-70.9169.2000112.1S417 P418 S423 L424 N425S417-L421 WeakPolarHBondContact O-CB 3.33Å; S417-L421 WeakPolarHBondContact O-CG 3.37Å; S417-L421 PolarHBondContact O-N 3.1Å; P418-L421 PolarHBondContact O-N 3.47Å; L421-S423 PolarHBondContact O-N 2.93Å; L421-L424 WeakPolarHBondContact O-CB 3.35Å; L421-L424 PolarHBondContact O-N 3.43Å; L421-L424 VanDerWaalsContact O-N 3.13Å; L421-N425 PolarHBondContact O-N 3.18Å
422L92.1Very high88.6Confident13 Ų1348.5 Ų48.57%0.06825%0.254CS..Hα-helixtrans-67.8-24.6176.1-70.3171.8000112.6M42 I292 L296 I348 P418 L420 L424 N425 P426 I428 I429M42-L422 HydrophobicContact CE-CD1 4.41Å; I292-L422 HydrophobicContact CG2-CD1 4.18Å; L296-L422 HydrophobicContact CD1-CD1 4.26Å; I348-L422 HydrophobicContact CD1-CB 4.17Å; I348-L422 HydrophobicContact CD1-CD1 4.11Å; I348-L422 HydrophobicContact CG2-CB 4.01Å; P418-L422 WeakPolarHBondContact O-CB 3.34Å; P418-L422 WeakPolarHBondContact O-CG 3.41Å; P418-L422 PolarHBondContact O-N 2.84Å; L420-L422 PolarHBondContact O-N 3.2Å; L422-L424 VanDerWaalsContact C-N 3.27Å; L422-L424 PolarHBondContact O-N 3.32Å; L422-N425 CarbonylContact O-C 3.21Å; L422-N425 VanDerWaalsContact O-C 3.28Å; L422-N425 PolarHBondContact O-N 3.49Å; L422-P426 WeakPolarHBondContact O-CA 3.19Å; L422-I428 HydrophobicContact CD2-CG2 4.39Å; L422-I429 HydrophobicContact CB-CD1 4.42Å; L422-I429 HydrophobicContact CD1-CG2 4.39Å; L422-I429 HydrophobicContact CD2-CG2 3.8Å
423S92.4Very high86.4Confident32 Ų3251.3 Ų51.322%0.22427%0.273CS..Hα-helixtrans-69.5-25.9172.573.90000113.2P346 I419 L420 L421P346-S423 WeakPolarHBondContact O-CB 3.15Å; I419-S423 PolarHBondContact O-N 2.89Å; L420-S423 WeakPolarHBondContact O-CB 3.44Å; L420-S423 PolarHBondContact O-N 3.23Å; L420-S423 PolarHBondContact O-OG 3.07Å; L421-S423 PolarHBondContact O-N 2.93Å
424L91Very high83.8Confident144 Ų14450.9 Ų50.975%0.75429%0.285SS*.Hα-helixtrans-78.5-32.1176.6-63.7173000112.4L420 L421 L422L420-L424 PolarHBondContact O-N 3.15Å; L421-L424 WeakPolarHBondContact O-CB 3.35Å; L421-L424 PolarHBondContact O-N 3.43Å; L421-L424 VanDerWaalsContact O-N 3.13Å; L422-L424 VanDerWaalsContact C-N 3.27Å; L422-L424 PolarHBondContact O-N 3.32Å
425N89.1Confident83.2Confident72 Ų7250.5 Ų50.539%0.38529%0.285SS..  trans-137.278.9177.9-170.43.7000110.9L421 L422 D427 I428L421-N425 PolarHBondContact O-N 3.18Å; L422-N425 CarbonylContact O-C 3.21Å; L422-N425 VanDerWaalsContact O-C 3.28Å; L422-N425 PolarHBondContact O-N 3.49Å; N425-D427 VanDerWaalsContact C-N 3.25Å; N425-D427 PolarHBondContact O-N 3.11Å; N425-I428 HydrophobicContact CB-CD1 4.23Å
426P87.3Confident82.6Confident32 Ų3253.2 Ų53.221%0.20830%0.3CS..G310 helixtrans-72-17.5-177.929.7-35.1000113.3L351 L422 I428 I429 T430L351-P426 HydrophobicContact CD2-CB 3.47Å; L351-P426 VanDerWaalsContact CD2-CB 3.47Å; L351-P426 HydrophobicContact CD2-CG 4.13Å; L422-P426 WeakPolarHBondContact O-CA 3.19Å; P426-I428 PolarHBondContact O-N 3.47Å; P426-I429 WeakPolarHBondContact O-CG1 3.08Å; P426-I429 PolarHBondContact O-N 3.15Å; P426-T430 WeakPolarHBondContact O-CG2 3.46Å; P426-T430 PolarHBondContact O-N 3.31Å
427D84.3Confident82Confident106 Ų10655.7 Ų55.757%0.56731%0.314SS*.G310 helixtrans-58.1-24.9-176.4-60.9-17.4000112.7N425 I429 T430N425-D427 VanDerWaalsContact C-N 3.25Å; N425-D427 PolarHBondContact O-N 3.11Å; D427-I429 PolarHBondContact O-N 2.83Å; D427-T430 PolarHBondContact O-OG1 3.06Å
428I83.4Confident81.3Confident58 Ų5857.5 Ų57.530%0.29732%0.322SS..G310 helixtrans-62.8-27.8175.6-68.5172.4000112.8F17 L422 N425 P426F17-I428 HydrophobicContact CD1-CB 4.41Å; F17-I428 HydrophobicContact CD1-CG2 3.14Å; F17-I428 HydrophobicContact CE1-CG2 3.03Å; F17-I428 HydrophobicContact CG-CG2 4.37Å; F17-I428 HydrophobicContact CZ-CG2 4.21Å; L422-I428 HydrophobicContact CD2-CG2 4.39Å; N425-I428 HydrophobicContact CB-CD1 4.23Å; P426-I428 PolarHBondContact O-N 3.47Å
429I86.3Confident80.6Confident0 Ų060.1 Ų60.10%034%0.336CS..G310 helixtrans-116.84.6-172.958.9166000113.1P39 V288 I289 I292 I348 L422 P426 D427 G431P39-I429 HydrophobicContact CB-CG2 4.1Å; P39-I429 HydrophobicContact CG-CG2 4.38Å; V288-I429 WeakPolarHBondContact CG1-O 3.38Å; I289-I429 HydrophobicContact CG1-CD1 4.29Å; I289-I429 HydrophobicContact CG1-CG1 4.19Å; I289-I429 WeakPolarHBondContact CG1-O 3.28Å; I289-I429 HydrophobicContact CG2-CD1 4.07Å; I292-I429 HydrophobicContact CD1-CB 3.61Å; I292-I429 HydrophobicContact CD1-CG2 3.67Å; I348-I429 HydrophobicContact CB-CD1 4.27Å; I348-I429 HydrophobicContact CD1-CD1 4.35Å; I348-I429 HydrophobicContact CG2-CD1 3.93Å; L422-I429 HydrophobicContact CB-CD1 4.42Å; L422-I429 HydrophobicContact CD1-CG2 4.39Å; L422-I429 HydrophobicContact CD2-CG2 3.8Å; P426-I429 WeakPolarHBondContact O-CG1 3.08Å; P426-I429 PolarHBondContact O-N 3.15Å; D427-I429 PolarHBondContact O-N 2.83Å; I429-G431 VanDerWaalsContact C-N 3.26Å; I429-G431 PolarHBondContact O-N 3.18Å
430T80.8Confident79.8Confident16 Ų1663.9 Ų63.910%0.09836%0.357CS..  trans-74.3-14.5179.552.50000112.8T285 I289 P426 D427 F432T285-T430 VanDerWaalsContact CB-O 3.25Å; T285-T430 WeakPolarHBondContact CB-O 3.4Å; T285-T430 WeakPolarHBondContact CG2-O 3.43Å; I289-T430 HydrophobicContact CD1-CG2 4.09Å; P426-T430 WeakPolarHBondContact O-CG2 3.46Å; P426-T430 PolarHBondContact O-N 3.31Å; D427-T430 PolarHBondContact O-OG1 3.06Å; T430-F432 PolarHBondContact O-N 3.46Å
431G71.3Confident78.9Confident2 Ų261.3 Ų61.32%0.02135%0.345CS..  trans69.1-116.5175.300000112P35 I429 S433P35-G431 VanDerWaalsContact CB-O 3.32Å; P35-G431 WeakPolarHBondContact CB-O 3.15Å; I429-G431 VanDerWaalsContact C-N 3.26Å; I429-G431 PolarHBondContact O-N 3.18Å; G431-S433 VanDerWaalsContact C-N 3.28Å; G431-S433 PolarHBondContact O-N 3.28Å
432F61.3Low77.9Confident101 Ų10157.1 Ų57.144%0.44333%0.325SS..THydrogen-bonded Turntrans-77.41.8-168.7-67.7-76.9000115.9L36 T430L36-F432 HydrophobicContact CB-CE2 4.1Å; L36-F432 HydrophobicContact CB-CZ 4.21Å; L36-F432 HydrophobicContact CD2-CE2 4.37Å; T430-F432 PolarHBondContact O-N 3.46Å
433S51.5Low76.7Confident61 Ų6160.8 Ų60.843%0.42735%0.346SS..THydrogen-bonded Turntrans-12026-175.377.50000114.7T285 G431T285-S433 VanDerWaalsContact CG2-CB 3.42Å; T285-S433 WeakPolarHBondContact CG2-OG 3.46Å; G431-S433 VanDerWaalsContact C-N 3.28Å; G431-S433 PolarHBondContact O-N 3.28Å
434S41.8Very low75.3Confident105 Ų10563.4 Ų63.473%0.73436%0.358SS*.  trans-83.10164.661.80000111N22N22-S434 PolarHBondContact ND2-O 2.85Å

Retrieved 434 of 434 residues in 955.5 ms (Link to these results)

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