A0A3Q0KBQ1_SCHMA Loading...

Uncharacterized protein AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KBQ1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 298 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
1M37.3Very low34.6Very low238 Ų238160 Ų160100%1.17284%0.843SS**  0128.80-73.4161.2160.300107.6S3M1-S3 PolarHBondContact O-N 3.06Å
2N35.4Very low34.4Very low174 Ų174156.5 Ų156.593%0.9384%0.836SS**  trans-82.294.7179.2-96.72.7000110.4G4N2-G4 VanDerWaalsContact C-N 3.3Å; N2-G4 PolarHBondContact O-N 3.38Å
3S39Very low34.1Very low111 Ų111156.1 Ų156.178%0.77683%0.834SS**  trans-73.184.1167.453.60000109.5M1 M5M1-S3 PolarHBondContact O-N 3.06Å; S3-M5 PolarHBondContact O-N 3.02Å; S3-M5 VanDerWaalsContact O-N 3.11Å
4G36.1Very low33.9Very low66 Ų66155.5 Ų155.568%0.6883%0.829SS**  trans-61.9112.4178.900000111.3N2 R6N2-G4 VanDerWaalsContact C-N 3.3Å; N2-G4 PolarHBondContact O-N 3.38Å; G4-R6 PolarHBondContact O-N 3.37Å
5M36.6Very low33.9Very low188 Ų188154.9 Ų154.993%0.92682%0.824SS**  trans-61.8105.5169.5-72.4-175-78.500108.6S3 Y7S3-M5 PolarHBondContact O-N 3.02Å; S3-M5 VanDerWaalsContact O-N 3.11Å; M5-Y7 PolarHBondContact O-N 2.95Å
6R36.1Very low34.1Very low234 Ų234152.6 Ų152.688%0.88381%0.81SS**  trans-65.3126.5167.2-76.4-173175-177.2-1.1107.8G4 V8G4-R6 PolarHBondContact O-N 3.37Å; R6-V8 PolarHBondContact O-N 2.68Å
7Y32.6Very low34.9Very low215 Ų215147.8 Ų147.884%0.84378%0.784SS**  trans-54.1130.3167.8-124.7-109.8000108.4M5M5-Y7 PolarHBondContact O-N 2.95Å
8V35.1Very low35.3Very low130 Ų130148.1 Ų148.179%0.78878%0.781SS**  trans-87.4111.5167.4177.50000105.6R6R6-V8 PolarHBondContact O-N 2.68Å
9D30.4Very low35.9Very low135 Ų135144.9 Ų144.972%0.72276%0.761SS**PPolyproline II helixtrans-57.8131.5175.9-67-50.8000109.2L11D9-L11 PolarHBondContact O-N 3.04Å
10P33.9Very low36.5Very low111 Ų111139.5 Ų139.572%0.72173%0.733SS**PPolyproline II helixtrans-62.6141.1-177.625.7-33.6000110.2
11L28.1Very low36.9Very low158 Ų158138.3 Ų138.383%0.82772%0.724SS**PPolyproline II helixtrans-47.2132.3178-71.4161.9000110.3D9 N13D9-L11 PolarHBondContact O-N 3.04Å; L11-N13 PolarHBondContact O-N 3.43Å
12P32.4Very low37.5Very low118 Ų118131.6 Ų131.677%0.76670%0.696SS**PPolyproline II helixtrans-58.6126.818024.5-33.4000109.2I14P12-I14 PolarHBondContact O-N 3.06Å
13N30.7Very low38.3Very low151 Ų151124 Ų12481%0.80766%0.656SS**PPolyproline II helixtrans-53.4138.1-175-93.7-21.9000111.1L11 I15L11-N13 PolarHBondContact O-N 3.43Å; N13-I15 PolarHBondContact O-N 3.06Å
14I30.7Very low39.2Very low148 Ų148120 Ų12076%0.75963%0.626SS**  trans-73.676.6179.5-57.2171.8000108.4P12 I16P12-I14 PolarHBondContact O-N 3.06Å; I14-I16 HydrophobicContact CG2-CD1 3.9Å; I14-I16 HydrophobicContact CG2-CG1 3.83Å; I14-I16 PolarHBondContact O-N 3.23Å
15I33.8Very low39.9Very low147 Ų147122.1 Ų122.175%0.75462%0.621SS**  trans-77.680.5163.2-53.2179.5000106.2N13 D17N13-I15 PolarHBondContact O-N 3.06Å; I15-D17 PolarHBondContact O-N 3.37Å
16I37.7Very low41Very low118 Ų118115.6 Ų115.661%0.60559%0.594SS**  trans-59126.4151.4-70.5157.8000105.1I14 E18I14-I16 HydrophobicContact CG2-CD1 3.9Å; I14-I16 HydrophobicContact CG2-CG1 3.83Å; I14-I16 PolarHBondContact O-N 3.23Å; I16-E18 VanDerWaalsContact C-N 3.28Å; I16-E18 PolarHBondContact O-N 2.96Å
17D46.6Very low42.1Very low70 Ų70105 Ų10537%0.37455%0.554SS.*  trans-76.880.4-168.2-173.4-4000111.4I15 Q19 N20 E21I15-D17 PolarHBondContact O-N 3.37Å; D17-Q19 PolarHBondContact O-N 3.41Å; D17-Q19 WeakPolarHBondContact OD1-CB 3.45Å; D17-Q19 PolarHBondContact OD1-N 3.39Å; D17-N20 HydrophobicContact CB-CB 4.09Å; D17-N20 WeakPolarHBondContact O-CB 3.35Å; D17-N20 PolarHBondContact O-N 3.02Å; D17-N20 PolarHBondContact OD1-N 2.71Å; D17-N20 PolarHBondContact OD2-ND2 3.18Å; D17-E21 PolarHBondContact O-N 3.01Å
18E43Very low43.3Very low153 Ų15398.3 Ų98.372%0.71553%0.532SS*.Hα-helixtrans-56.4-26.8175.8-166.6173.7-147.200111.8I16 E21 V22I16-E18 VanDerWaalsContact C-N 3.28Å; I16-E18 PolarHBondContact O-N 2.96Å; E18-E21 PolarHBondContact O-N 3.18Å; E18-V22 WeakPolarHBondContact O-CG2 3.36Å; E18-V22 PolarHBondContact O-N 3.31Å; E18-V22 VanDerWaalsContact O-N 3.08Å
19Q46.5Very low44.6Very low89 Ų8995.8 Ų95.842%0.41652%0.521SS..Hα-helixtrans-72.5-36175.9-54.7-175.2-10.300111.6D17 T23 I110D17-Q19 PolarHBondContact O-N 3.41Å; D17-Q19 WeakPolarHBondContact OD1-CB 3.45Å; D17-Q19 PolarHBondContact OD1-N 3.39Å; Q19-T23 VanDerWaalsContact O-CB 3.26Å; Q19-T23 WeakPolarHBondContact O-CB 3.42Å; Q19-T23 PolarHBondContact O-N 3.23Å; Q19-T23 PolarHBondContact O-OG1 2.84Å; Q19-I110 HydrophobicContact CB-CD1 4.16Å; Q19-I110 HydrophobicContact CG-CD1 4.36Å
20N47.8Very low46Very low35 Ų3589.9 Ų89.919%0.18749%0.491CS..Hα-helixtrans-63.5-42.5169.9-113.4-60.5000111.4D17 T23 V24 P158D17-N20 HydrophobicContact CB-CB 4.09Å; D17-N20 WeakPolarHBondContact O-CB 3.35Å; D17-N20 PolarHBondContact O-N 3.02Å; D17-N20 PolarHBondContact OD1-N 2.71Å; D17-N20 PolarHBondContact OD2-ND2 3.18Å; N20-T23 PolarHBondContact O-N 3.4Å; N20-V24 WeakPolarHBondContact O-CB 3.48Å; N20-V24 WeakPolarHBondContact O-CG2 3.13Å; N20-V24 PolarHBondContact O-N 2.93Å; N20-P158 WeakPolarHBondContact OD1-CB 3.1Å
21E45.4Very low47.5Very low116 Ų11685.4 Ų85.454%0.54246%0.461SS..Hα-helixtrans-63.4-47.9178.6-66.5-160.116500112.5D17 E18 T23 V24 I25D17-E21 PolarHBondContact O-N 3.01Å; E18-E21 PolarHBondContact O-N 3.18Å; E21-T23 VanDerWaalsContact C-N 3.31Å; E21-T23 PolarHBondContact O-N 2.79Å; E21-V24 PolarHBondContact O-N 3.01Å; E21-V24 VanDerWaalsContact O-N 3.14Å; E21-I25 VanDerWaalsContact O-CG1 3.32Å; E21-I25 WeakPolarHBondContact O-CG1 3.47Å; E21-I25 PolarHBondContact O-N 3.01Å
22V48.8Very low49.1Very low97 Ų9780.2 Ų80.259%0.58844%0.44SS*.Hα-helixtrans-59.1-43.6175.51730000111.3E18 V24 I25 S26E18-V22 WeakPolarHBondContact O-CG2 3.36Å; E18-V22 PolarHBondContact O-N 3.31Å; E18-V22 VanDerWaalsContact O-N 3.08Å; V22-V24 VanDerWaalsContact C-N 3.3Å; V22-V24 PolarHBondContact O-N 3.05Å; V22-I25 PolarHBondContact O-N 2.87Å; V22-S26 PolarHBondContact O-N 3.18Å; V22-S26 VanDerWaalsContact O-N 3.16Å
23T53.8Low50.6Low15 Ų1580.5 Ų80.59%0.09243%0.427CS..Hα-helixtrans-63.9-35.2177.9-59.60000111.8Q19 N20 E21 S26 R27 P158Q19-T23 VanDerWaalsContact O-CB 3.26Å; Q19-T23 WeakPolarHBondContact O-CB 3.42Å; Q19-T23 PolarHBondContact O-N 3.23Å; Q19-T23 PolarHBondContact O-OG1 2.84Å; N20-T23 PolarHBondContact O-N 3.4Å; E21-T23 VanDerWaalsContact C-N 3.31Å; E21-T23 PolarHBondContact O-N 2.79Å; T23-S26 PolarHBondContact O-OG 3.2Å; T23-R27 VanDerWaalsContact O-CD 3.29Å; T23-R27 WeakPolarHBondContact O-CD 3.46Å; T23-R27 WeakPolarHBondContact O-CG 3.02Å; T23-R27 PolarHBondContact O-NE 2.99Å; T23-R27 VanDerWaalsContact O-NE 3.17Å; T23-P158 HydrophobicContact CG2-CG 4.15Å
24V56.3Low52.3Low25 Ų2573.5 Ų73.515%0.15239%0.389CS..Hα-helixtrans-71.4-46.3175158.50000112.7N20 E21 V22 S26 R27 L28 Q265N20-V24 WeakPolarHBondContact O-CB 3.48Å; N20-V24 WeakPolarHBondContact O-CG2 3.13Å; N20-V24 PolarHBondContact O-N 2.93Å; E21-V24 PolarHBondContact O-N 3.01Å; E21-V24 VanDerWaalsContact O-N 3.14Å; V22-V24 VanDerWaalsContact C-N 3.3Å; V22-V24 PolarHBondContact O-N 3.05Å; V24-S26 VanDerWaalsContact C-N 3.3Å; V24-S26 PolarHBondContact O-N 2.83Å; V24-R27 WeakPolarHBondContact O-CB 3.24Å; V24-R27 PolarHBondContact O-N 3.23Å; V24-R27 VanDerWaalsContact O-N 3.14Å; V24-L28 HydrophobicContact CG1-CD1 4.23Å; V24-L28 PolarHBondContact O-N 2.88Å; V24-Q265 HydrophobicContact CG2-CG 4.47Å
25I52.1Low53.9Low111 Ų11166.6 Ų66.657%0.56935%0.354SS*.Hα-helixtrans-60.1-42-178.8-69.6164.2000110.8E21 V22 R27 L28 S29E21-I25 VanDerWaalsContact O-CG1 3.32Å; E21-I25 WeakPolarHBondContact O-CG1 3.47Å; E21-I25 PolarHBondContact O-N 3.01Å; V22-I25 PolarHBondContact O-N 2.87Å; I25-R27 PolarHBondContact O-N 2.99Å; I25-L28 PolarHBondContact O-N 3.08Å; I25-S29 PolarHBondContact O-N 3.1Å
26S58.2Low55.5Low52 Ų5264.4 Ų64.436%0.36434%0.341SS..Hα-helixtrans-55-41177.472.90000112.4V22 T23 V24 S29V22-S26 PolarHBondContact O-N 3.18Å; V22-S26 VanDerWaalsContact O-N 3.16Å; T23-S26 PolarHBondContact O-OG 3.2Å; V24-S26 VanDerWaalsContact C-N 3.3Å; V24-S26 PolarHBondContact O-N 2.83Å; S26-S29 PolarHBondContact O-N 2.9Å; S26-S29 PolarHBondContact O-OG 3.37Å
27R59Low56.8Low12 Ų1260 Ų605%0.04532%0.318CS..Hα-helixtrans-69-46.8-178.5-63.8161.4-169.5-133.7-10.5111.3T23 V24 I25 S29 G30 F31 E113 T154 P158 L261T23-R27 VanDerWaalsContact O-CD 3.29Å; T23-R27 WeakPolarHBondContact O-CD 3.46Å; T23-R27 WeakPolarHBondContact O-CG 3.02Å; T23-R27 PolarHBondContact O-NE 2.99Å; T23-R27 VanDerWaalsContact O-NE 3.17Å; V24-R27 WeakPolarHBondContact O-CB 3.24Å; V24-R27 PolarHBondContact O-N 3.23Å; V24-R27 VanDerWaalsContact O-N 3.14Å; I25-R27 PolarHBondContact O-N 2.99Å; R27-S29 PolarHBondContact O-N 3.43Å; R27-S29 VanDerWaalsContact O-N 3.14Å; R27-G30 PolarHBondContact O-N 2.73Å; R27-F31 HydrophobicContact CB-CD2 4.5Å; R27-F31 HydrophobicContact CB-CE2 4.16Å; R27-F31 WeakPolarHBondContact O-CD2 3.43Å; R27-F31 PolarHBondContact O-N 3.17Å; R27-E113 IonicContact CZ-OE2 3.84Å; R27-E113 IonicContact NH2-OE2 2.67Å; R27-E113 PolarHBondContact NH2-OE2 3.45Å; R27-T154 PolarHBondContact NH1-O 3.28Å; R27-T154 PolarHBondContact NH2-O 3.14Å; R27-P158 VanDerWaalsContact NH1-CD 3.31Å; R27-P158 VanDerWaalsContact NH1-CG 3.33Å; R27-L261 HydrophobicContact CB-CD2 4.28Å
28L58Low57.6Low74 Ų7457.1 Ų57.139%0.38730%0.303SS..Hα-helixtrans-55.2-32.8178.4-66.8175000112.2V24 I25 F31 A32V24-L28 HydrophobicContact CG1-CD1 4.23Å; V24-L28 PolarHBondContact O-N 2.88Å; I25-L28 PolarHBondContact O-N 3.08Å; L28-F31 PolarHBondContact O-N 3.32Å; L28-A32 PolarHBondContact O-N 2.97Å
29S62.9Low58.6Low77 Ų7751.5 Ų51.554%0.53828%0.277SS..Hα-helixtrans-63.6-40.5175.681.90000113.5I25 S26 R27 F31 A32 Y33I25-S29 PolarHBondContact O-N 3.1Å; S26-S29 PolarHBondContact O-N 2.9Å; S26-S29 PolarHBondContact O-OG 3.37Å; R27-S29 PolarHBondContact O-N 3.43Å; R27-S29 VanDerWaalsContact O-N 3.14Å; S29-F31 VanDerWaalsContact C-N 3.3Å; S29-F31 PolarHBondContact O-N 2.99Å; S29-A32 PolarHBondContact O-N 2.85Å; S29-Y33 PolarHBondContact O-N 3.07Å
30G59.1Low59.4Low10 Ų1052.2 Ų52.210%0.10328%0.284CS..Hα-helixtrans-64-34.7175.800000112.5R27 Y33 F34R27-G30 PolarHBondContact O-N 2.73Å; G30-Y33 PolarHBondContact O-N 3.01Å; G30-F34 WeakPolarHBondContact O-CB 3.4Å; G30-F34 PolarHBondContact O-N 3.11Å
31F66.2Low60Low18 Ų1851.6 Ų51.68%0.07928%0.282CS..Hα-helixtrans-76-31.7176.4-63.7-70.8000113.1R27 L28 S29 F34 S35 V155 T254 M258 L261R27-F31 HydrophobicContact CB-CD2 4.5Å; R27-F31 HydrophobicContact CB-CE2 4.16Å; R27-F31 WeakPolarHBondContact O-CD2 3.43Å; R27-F31 PolarHBondContact O-N 3.17Å; L28-F31 PolarHBondContact O-N 3.32Å; S29-F31 VanDerWaalsContact C-N 3.3Å; S29-F31 PolarHBondContact O-N 2.99Å; F31-F34 PolarHBondContact O-N 3.01Å; F31-S35 PolarHBondContact O-N 3.45Å; F31-S35 VanDerWaalsContact O-N 3.08Å; F31-V155 HydrophobicContact CZ-CG2 4.27Å; F31-T254 HydrophobicContact CD1-CG2 3.95Å; F31-T254 HydrophobicContact CE1-CG2 3.87Å; F31-M258 HydrophobicContact CB-CE 3.6Å; F31-M258 HydrophobicContact CB-CG 3.99Å; F31-M258 HydrophobicContact CB-SD 3.63Å; F31-M258 HydrophobicContact CD1-CB 4.27Å; F31-M258 HydrophobicContact CD1-CE 2.33Å; F31-M258 HydrophobicContact CD1-CG 2.75Å; F31-M258 HydrophobicContact CD1-SD 2.48Å; F31-M258 WeakPolarHBondContact CD1-SD 3.46Å; F31-M258 HydrophobicContact CD2-CE 2.34Å; F31-M258 HydrophobicContact CD2-CG 3.99Å; F31-M258 HydrophobicContact CD2-SD 2.46Å; F31-M258 WeakPolarHBondContact CD2-SD 3.4Å; F31-M258 HydrophobicContact CE1-CB 4.46Å; F31-M258 HydrophobicContact CE1-CE 2.34Å; F31-M258 HydrophobicContact CE1-CG 3.07Å; F31-M258 HydrophobicContact CE1-SD 2.47Å; F31-M258 WeakPolarHBondContact CE1-SD 3.36Å; F31-M258 HydrophobicContact CE2-CE 2.34Å; F31-M258 HydrophobicContact CE2-CG 4.23Å; F31-M258 HydrophobicContact CE2-SD 2.46Å; F31-M258 WeakPolarHBondContact CE2-SD 3.48Å; F31-M258 HydrophobicContact CG-CE 2.34Å; F31-M258 HydrophobicContact CG-CG 3.28Å; F31-M258 HydrophobicContact CG-SD 2.46Å; F31-M258 WeakPolarHBondContact CG-SD 3.08Å; F31-M258 HydrophobicContact CZ-CE 2.35Å; F31-M258 HydrophobicContact CZ-CG 3.83Å; F31-M258 HydrophobicContact CZ-SD 2.47Å; F31-M258 WeakPolarHBondContact CZ-SD 3.47Å; F31-L261 HydrophobicContact CD2-CD2 4.35Å; F31-L261 HydrophobicContact CE2-CD2 3.58Å
32A62.8Low60.7Low49 Ų4946.8 Ų46.841%0.40526%0.259SS..Hα-helixtrans-63.6-42.3167.600000111.4L28 S29 S35 Q36L28-A32 PolarHBondContact O-N 2.97Å; S29-A32 PolarHBondContact O-N 2.85Å; A32-S35 WeakPolarHBondContact O-CB 3.16Å; A32-S35 PolarHBondContact O-N 2.78Å; A32-Q36 PolarHBondContact O-N 2.78Å; A32-Q36 VanDerWaalsContact O-N 3.13Å
33Y63.6Low61.1Low123 Ų12346.7 Ų46.748%0.48226%0.255SS..Hα-helixtrans-63.9-42.2174.8-170.9-98.4000112.5S29 G30 S35 Q36 L37 V125S29-Y33 PolarHBondContact O-N 3.07Å; G30-Y33 PolarHBondContact O-N 3.01Å; Y33-S35 VanDerWaalsContact C-N 3.3Å; Y33-S35 PolarHBondContact O-N 2.86Å; Y33-Q36 PolarHBondContact O-N 3.33Å; Y33-L37 HydrophobicContact CE1-CD1 4.11Å; Y33-L37 PolarHBondContact O-N 3.14Å; Y33-V125 HydrophobicContact CD1-CG2 4.36Å; Y33-V125 HydrophobicContact CE1-CG2 3.88Å
34F66.5Low61.4Low4 Ų453.7 Ų53.72%0.01828%0.284CS..Hα-helixtrans-56.5-41.6172.7170.9-99000112.4G30 F31 L37 M38 L124 L128 L251 T254 V255G30-F34 WeakPolarHBondContact O-CB 3.4Å; G30-F34 PolarHBondContact O-N 3.11Å; F31-F34 PolarHBondContact O-N 3.01Å; F34-L37 PolarHBondContact O-N 3.13Å; F34-M38 HydrophobicContact CE1-CG 4.31Å; F34-M38 HydrophobicContact CZ-CG 4.23Å; F34-M38 PolarHBondContact O-N 2.93Å; F34-L124 HydrophobicContact CB-CD2 4.45Å; F34-L124 HydrophobicContact CD2-CD1 4.15Å; F34-L124 HydrophobicContact CD2-CD2 3.95Å; F34-L124 HydrophobicContact CD2-CG 4.34Å; F34-L124 HydrophobicContact CE2-CD1 4.23Å; F34-L128 HydrophobicContact CD2-CD1 3.85Å; F34-L128 HydrophobicContact CE2-CD1 4.05Å; F34-L251 HydrophobicContact CE2-CD2 3.58Å; F34-L251 HydrophobicContact CZ-CD2 3.54Å; F34-T254 HydrophobicContact CD1-CG2 3.93Å; F34-T254 HydrophobicContact CD2-CG2 3.87Å; F34-T254 HydrophobicContact CE1-CG2 3.8Å; F34-T254 HydrophobicContact CE2-CG2 3.71Å; F34-T254 HydrophobicContact CG-CG2 3.96Å; F34-T254 HydrophobicContact CZ-CG2 3.67Å; F34-V255 HydrophobicContact CE1-CG2 3.88Å; F34-V255 HydrophobicContact CZ-CG2 4.49Å
35S64.2Low61.2Low4 Ų454.2 Ų54.23%0.02829%0.286CS..Hα-helixtrans-61.9-45.8175-170.80000112.1F31 A32 Y33 L37 M38 L39F31-S35 PolarHBondContact O-N 3.45Å; F31-S35 VanDerWaalsContact O-N 3.08Å; A32-S35 WeakPolarHBondContact O-CB 3.16Å; A32-S35 PolarHBondContact O-N 2.78Å; Y33-S35 VanDerWaalsContact C-N 3.3Å; Y33-S35 PolarHBondContact O-N 2.86Å; S35-L37 VanDerWaalsContact C-N 3.32Å; S35-L37 PolarHBondContact O-N 2.78Å; S35-M38 WeakPolarHBondContact O-CB 3.21Å; S35-M38 PolarHBondContact O-N 3.47Å; S35-L39 WeakPolarHBondContact O-CG 3.29Å; S35-L39 PolarHBondContact O-N 3.49Å
36Q66.3Low61.4Low100 Ų10050.3 Ų50.347%0.46727%0.269SS..Hα-helixtrans-61.9-38.9174.2-65.9-176.7600112.4A32 Y33 M38 L39 N40A32-Q36 PolarHBondContact O-N 2.78Å; A32-Q36 VanDerWaalsContact O-N 3.13Å; Y33-Q36 PolarHBondContact O-N 3.33Å; Q36-M38 VanDerWaalsContact C-N 3.31Å; Q36-M38 PolarHBondContact O-N 3.33Å; Q36-L39 PolarHBondContact O-N 3.39Å; Q36-N40 PolarHBondContact O-N 3.4Å; Q36-N40 VanDerWaalsContact O-N 3.16Å; Q36-N40 PolarHBondContact O-ND2 2.9Å
37L64.8Low61.1Low25 Ų2557.9 Ų57.913%0.13129%0.289CS..Hα-helixtrans-67.9-31.5178-147.779.9000112.2Y33 F34 S35 N40 T41 L128Y33-L37 HydrophobicContact CE1-CD1 4.11Å; Y33-L37 PolarHBondContact O-N 3.14Å; F34-L37 PolarHBondContact O-N 3.13Å; S35-L37 VanDerWaalsContact C-N 3.32Å; S35-L37 PolarHBondContact O-N 2.78Å; L37-N40 PolarHBondContact O-N 2.95Å; L37-T41 VanDerWaalsContact O-CB 3.28Å; L37-T41 WeakPolarHBondContact O-CB 3.31Å; L37-T41 PolarHBondContact O-N 3.25Å; L37-T41 PolarHBondContact O-OG1 2.89Å; L37-L128 HydrophobicContact CD2-CB 3.58Å; L37-L128 HydrophobicContact CD2-CD1 3.61Å; L37-L128 HydrophobicContact CD2-CG 4.2Å
38M64.4Low60.8Low10 Ų1064 Ų645%0.04932%0.316CS..Hα-helixtrans-62.4-46.5171.9-89.9-67.1-7200112.4F34 S35 Q36 N40 T41 E42 V228 I240 L251F34-M38 HydrophobicContact CE1-CG 4.31Å; F34-M38 HydrophobicContact CZ-CG 4.23Å; F34-M38 PolarHBondContact O-N 2.93Å; S35-M38 WeakPolarHBondContact O-CB 3.21Å; S35-M38 PolarHBondContact O-N 3.47Å; Q36-M38 VanDerWaalsContact C-N 3.31Å; Q36-M38 PolarHBondContact O-N 3.33Å; M38-N40 PolarHBondContact O-N 2.86Å; M38-T41 WeakPolarHBondContact O-CB 3.48Å; M38-T41 PolarHBondContact O-N 2.92Å; M38-T41 VanDerWaalsContact O-N 3.17Å; M38-E42 PolarHBondContact O-N 3.17Å; M38-V228 HydrophobicContact CE-CG2 4.18Å; M38-I240 HydrophobicContact CE-CD1 4Å; M38-L251 HydrophobicContact CE-CD1 3.98Å; M38-L251 HydrophobicContact CG-CD2 4.14Å; M38-L251 HydrophobicContact SD-CD1 3.54Å; M38-L251 VanDerWaalsContact SD-CD1 3.54Å; M38-L251 HydrophobicContact SD-CD2 3.37Å; M38-L251 WeakPolarHBondContact SD-CD2 3.19Å; M38-L251 HydrophobicContact SD-CG 4.04Å
39L64.2Low60.4Low35 Ų3561.8 Ų61.818%0.18331%0.305CS..Hα-helixtrans-59-45.9175.7-56.9170000111.8S35 Q36 T41 E42 N43 L193 L200S35-L39 WeakPolarHBondContact O-CG 3.29Å; S35-L39 PolarHBondContact O-N 3.49Å; Q36-L39 PolarHBondContact O-N 3.39Å; L39-T41 VanDerWaalsContact C-N 3.29Å; L39-T41 PolarHBondContact O-N 2.71Å; L39-E42 PolarHBondContact O-N 3.44Å; L39-N43 PolarHBondContact O-N 3Å; L39-N43 PolarHBondContact O-ND2 3.31Å; L39-L193 HydrophobicContact CD2-CD1 3.96Å; L39-L193 HydrophobicContact CD2-CD2 3.76Å; L39-L193 HydrophobicContact CD2-CG 3.95Å; L39-L200 HydrophobicContact CD1-CD1 3.76Å; L39-L200 HydrophobicContact CD1-CD2 4.27Å; L39-L200 HydrophobicContact CD2-CD1 3.77Å; L39-L200 HydrophobicContact CG-CD1 4.24Å
40N63.2Low59.9Low104 Ų10465.1 Ų65.156%0.55632%0.316SS*.Hα-helixtrans-66.7-31.7177.9-76.5-33.7000112.4Q36 L37 M38 K44Q36-N40 PolarHBondContact O-N 3.4Å; Q36-N40 VanDerWaalsContact O-N 3.16Å; Q36-N40 PolarHBondContact O-ND2 2.9Å; L37-N40 PolarHBondContact O-N 2.95Å; M38-N40 PolarHBondContact O-N 2.86Å; N40-K44 PolarHBondContact O-N 3.34Å
41T61.1Low59.6Low22 Ų2272.4 Ų72.414%0.13535%0.347CS..Hα-helixtrans-70.1-42.5174.4-60.90000111L37 M38 L39 K44 I45 I240L37-T41 VanDerWaalsContact O-CB 3.28Å; L37-T41 WeakPolarHBondContact O-CB 3.31Å; L37-T41 PolarHBondContact O-N 3.25Å; L37-T41 PolarHBondContact O-OG1 2.89Å; M38-T41 WeakPolarHBondContact O-CB 3.48Å; M38-T41 PolarHBondContact O-N 2.92Å; M38-T41 VanDerWaalsContact O-N 3.17Å; L39-T41 VanDerWaalsContact C-N 3.29Å; L39-T41 PolarHBondContact O-N 2.71Å; T41-K44 PolarHBondContact O-N 3.05Å; T41-I45 HydrophobicContact CG2-CD1 3.63Å; T41-I45 HydrophobicContact CG2-CG1 4.4Å; T41-I45 WeakPolarHBondContact O-CB 3.35Å; T41-I45 WeakPolarHBondContact O-CG1 3.44Å; T41-I45 PolarHBondContact O-N 3.33Å; T41-I240 HydrophobicContact CG2-CG2 4.24Å
42E58.7Low58.7Low16 Ų1674.8 Ų74.88%0.07536%0.357CS..Hα-helixtrans-60.9-51173.8-170.8171.7146.700111.7M38 L39 K44 I45 S46 L193 I240M38-E42 PolarHBondContact O-N 3.17Å; L39-E42 PolarHBondContact O-N 3.44Å; E42-K44 PolarHBondContact O-N 2.91Å; E42-I45 PolarHBondContact O-N 3.41Å; E42-S46 VanDerWaalsContact CG-OG 3.23Å; E42-S46 WeakPolarHBondContact CG-OG 3.4Å; E42-S46 WeakPolarHBondContact O-CB 3.49Å; E42-S46 PolarHBondContact O-N 3.14Å; E42-S46 PolarHBondContact O-OG 3Å; E42-L193 WeakPolarHBondContact OE2-CD1 3.22Å; E42-L193 WeakPolarHBondContact OE2-CD2 3.46Å; E42-I240 HydrophobicContact CB-CD1 4.02Å; E42-I240 HydrophobicContact CB-CG1 4.31Å; E42-I240 HydrophobicContact CB-CG2 4.23Å; E42-I240 HydrophobicContact CG-CD1 4.12Å; E42-I240 HydrophobicContact CG-CG1 4.05Å; E42-I240 WeakPolarHBondContact OE2-CD1 2.94Å
43N58.6Low58.1Low94 Ų9479.2 Ų79.250%0.50337%0.37SS..Hα-helixtrans-55.7-27.9-179.7-80.3-43.5000113.3L39L39-N43 PolarHBondContact O-N 3Å; L39-N43 PolarHBondContact O-ND2 3.31Å
44K58.2Low57.4Low162 Ų16280.9 Ų80.970%0.70439%0.385SS*.Hα-helixtrans-88.4-24.4177.3-162.2170.4-173.3173.30113.7N40 T41 E42N40-K44 PolarHBondContact O-N 3.34Å; T41-K44 PolarHBondContact O-N 3.05Å; E42-K44 PolarHBondContact O-N 2.91Å
45I54Low56.6Low37 Ų3786.9 Ų86.919%0.1941%0.412CS..Hα-helixtrans-97.7-37.5-178.3-66.7178.5000112.4T41 E42 R47 K48 L49 I240T41-I45 HydrophobicContact CG2-CD1 3.63Å; T41-I45 HydrophobicContact CG2-CG1 4.4Å; T41-I45 WeakPolarHBondContact O-CB 3.35Å; T41-I45 WeakPolarHBondContact O-CG1 3.44Å; T41-I45 PolarHBondContact O-N 3.33Å; E42-I45 PolarHBondContact O-N 3.41Å; I45-R47 PolarHBondContact O-N 3.28Å; I45-K48 CarbonylContact O-C 3.44Å; I45-K48 WeakPolarHBondContact O-CA 3.43Å; I45-K48 WeakPolarHBondContact O-CB 3.41Å; I45-K48 PolarHBondContact O-N 3.12Å; I45-L49 HydrophobicContact CG2-CD1 3.94Å; I45-L49 HydrophobicContact CG2-CG 3.91Å; I45-L49 PolarHBondContact O-N 3.48Å; I45-I240 HydrophobicContact CD1-CG2 4.27Å; I45-I240 VanDerWaalsContact CD1-O 3.29Å; I45-I240 WeakPolarHBondContact CD1-O 3.46Å
46S55.3Low56Low29 Ų2992.4 Ų92.420%0.20345%0.448CS..Hα-helixtrans-59.2-30.9175.6-68.40000112.3E42 K48 L50E42-S46 VanDerWaalsContact CG-OG 3.23Å; E42-S46 WeakPolarHBondContact CG-OG 3.4Å; E42-S46 WeakPolarHBondContact O-CB 3.49Å; E42-S46 PolarHBondContact O-N 3.14Å; E42-S46 PolarHBondContact O-OG 3Å; S46-K48 VanDerWaalsContact C-N 3.28Å; S46-K48 PolarHBondContact O-N 2.96Å; S46-L50 PolarHBondContact O-N 3.37Å
47R52.9Low55.7Low210 Ų21093.4 Ų93.479%0.79245%0.451SS*.Hα-helixtrans-64.3-25.9169.3-69.7-175.8-176.5-165.51.2114.2I45I45-R47 PolarHBondContact O-N 3.28Å
48K51.7Low55.9Low141 Ų14195.9 Ų95.961%0.61346%0.464SS*.Hα-helixtrans-94.7-27.8177.1-66.1-164.6170.2-1520113.6I45 S46 L50 E51 K52I45-K48 CarbonylContact O-C 3.44Å; I45-K48 WeakPolarHBondContact O-CA 3.43Å; I45-K48 WeakPolarHBondContact O-CB 3.41Å; I45-K48 PolarHBondContact O-N 3.12Å; S46-K48 VanDerWaalsContact C-N 3.28Å; S46-K48 PolarHBondContact O-N 2.96Å; K48-L50 VanDerWaalsContact C-N 3.32Å; K48-E51 WeakPolarHBondContact O-CB 3.17Å; K48-E51 PolarHBondContact O-N 2.91Å; K48-K52 PolarHBondContact O-N 2.97Å
49L50.5Low56.4Low27 Ų2798.9 Ų98.914%0.14148%0.484CS..Hα-helixtrans-68.7-35175.5-69.4173.9000111.3I45 E51 K52I45-L49 HydrophobicContact CG2-CD1 3.94Å; I45-L49 HydrophobicContact CG2-CG 3.91Å; I45-L49 PolarHBondContact O-N 3.48Å; L49-E51 PolarHBondContact O-N 3.3Å; L49-K52 CarbonylContact O-C 3.52Å; L49-K52 PolarHBondContact O-N 2.97Å
50L51.4Low57.4Low148 Ų148105.6 Ų105.678%0.77551%0.507SS*.THydrogen-bonded Turntrans-65.6-12.7173.5-155137.6000113.2S46 K48S46-L50 PolarHBondContact O-N 3.37Å; K48-L50 VanDerWaalsContact C-N 3.32Å
51E52.1Low58.5Low163 Ų163101.2 Ų101.276%0.76248%0.483SS*.THydrogen-bonded Turntrans-101.1-8.4176.3-167.5177.1-135.700112.2K48 L49K48-E51 WeakPolarHBondContact O-CB 3.17Å; K48-E51 PolarHBondContact O-N 2.91Å; L49-E51 PolarHBondContact O-N 3.3Å
52K48.3Very low59.6Low67 Ų67104.7 Ų104.729%0.29149%0.493SS..  trans-127.846.7-174.1-160-151.3175.8-154.50112.3K48 L49 F55 H236 D243K48-K52 PolarHBondContact O-N 2.97Å; L49-K52 CarbonylContact O-C 3.52Å; L49-K52 PolarHBondContact O-N 2.97Å; K52-F55 HydrophobicContact CD-CD2 4.36Å; K52-F55 HydrophobicContact CG-CD2 3.98Å; K52-F55 HydrophobicContact CG-CE2 4.2Å; K52-H236 PolarHBondContact O-CE1 3.42Å; K52-H236 VanDerWaalsContact O-CE1 3.32Å; K52-D243 IonicContact NZ-OD2 3.64Å; K52-D243 PolarHBondContact NZ-OD2 3.34Å
53E49.7Very low61Low142 Ų142109.5 Ų109.566%0.66451%0.514SS*.  trans-64.6160.3168.3-63.3-162.2147.500111.6
54I49.4Very low62.6Low159 Ų159109.1 Ų109.182%0.81551%0.509SS*.  trans60.154.8170.9-28.4-179.4000116.2
55F48.9Very low64.2Low130 Ų130101.4 Ų101.457%0.5748%0.476SS*.  trans-114.3133.5155.4-80.9-87.9000111.5K52K52-F55 HydrophobicContact CD-CD2 4.36Å; K52-F55 HydrophobicContact CG-CD2 3.98Å; K52-F55 HydrophobicContact CG-CE2 4.2Å
56P53.2Low66Low120 Ų120103.6 Ų103.678%0.77949%0.487SS*.  trans-69.4146.2-179.628.6-34.5000111.7D58P56-D58 PolarHBondContact O-N 3.49Å
57F58.8Low67.9Low121 Ų121106.6 Ų106.653%0.53150%0.504SS..  trans-64.6113.1-179.1176.6-92.9000111.8P59 W62F57-P59 VanDerWaalsContact O-CD 3.29Å; F57-P59 WeakPolarHBondContact O-CD 3.22Å; F57-W62 AromaticContact CE1-CD1 3.48Å; F57-W62 VanDerWaalsContact CE1-CD1 3.48Å; F57-W62 AromaticContact CE1-NE1 3.89Å; F57-W62 HydrophobicContact CZ-CB 4.37Å; F57-W62 AromaticContact CZ-CD1 3.45Å; F57-W62 VanDerWaalsContact CZ-CD1 3.45Å; F57-W62 HydrophobicContact CZ-CG 4.18Å
58D69.7Low69.9Low77 Ų7797.3 Ų97.341%0.41247%0.47SS..  trans-75116172.9-173.4-10.6000110.6P56 R60 Y61P56-D58 PolarHBondContact O-N 3.49Å; D58-R60 PolarHBondContact O-N 2.79Å; D58-R60 WeakPolarHBondContact OD1-CB 3.29Å; D58-R60 WeakPolarHBondContact OD1-CD 3.45Å; D58-R60 WeakPolarHBondContact OD1-CG 3.36Å; D58-R60 PolarHBondContact OD1-N 3.45Å; D58-R60 WeakPolarHBondContact OD2-CD 3.23Å; D58-Y61 PolarHBondContact O-N 2.94Å
59P75.3Confident72Confident72 Ų7290.9 Ų90.947%0.46844%0.443SS..Hα-helixtrans-67.4-2.3176.930.5-37.1000114.2F57 W62 K63F57-P59 VanDerWaalsContact O-CD 3.29Å; F57-P59 WeakPolarHBondContact O-CD 3.22Å; P59-W62 PolarHBondContact O-NE1 3.37Å; P59-W62 VanDerWaalsContact O-NE1 3.14Å; P59-K63 WeakPolarHBondContact O-CD 3.44Å; P59-K63 WeakPolarHBondContact O-CG 3.48Å
60R83.5Confident74.1Confident177 Ų17791 Ų9167%0.66845%0.45SS*.Hα-helixtrans-76.6-35.2171.1-62165.5-179.7179.6-0.9112.2D58 K63 Q64D58-R60 PolarHBondContact O-N 2.79Å; D58-R60 WeakPolarHBondContact OD1-CB 3.29Å; D58-R60 WeakPolarHBondContact OD1-CD 3.45Å; D58-R60 WeakPolarHBondContact OD1-CG 3.36Å; D58-R60 PolarHBondContact OD1-N 3.45Å; D58-R60 WeakPolarHBondContact OD2-CD 3.23Å; R60-K63 PolarHBondContact O-N 3.35Å; R60-Q64 WeakPolarHBondContact O-CG 3.39Å; R60-Q64 PolarHBondContact O-N 3.2Å
61Y86.9Confident76.3Confident11 Ų1187.7 Ų87.74%0.04343%0.432CS..Hα-helixtrans-57.2-55.6-177.5162-91.6000111.8D58 K63 Q64 V65 T232 R239 G242 A248D58-Y61 PolarHBondContact O-N 2.94Å; Y61-K63 VanDerWaalsContact C-N 3.28Å; Y61-K63 PolarHBondContact O-N 3.25Å; Y61-Q64 PolarHBondContact O-N 3.5Å; Y61-Q64 VanDerWaalsContact O-N 3.12Å; Y61-V65 HydrophobicContact CD2-CG2 4.31Å; Y61-V65 HydrophobicContact CE1-CG2 4.26Å; Y61-V65 HydrophobicContact CE2-CG2 3.97Å; Y61-V65 WeakPolarHBondContact O-CG2 3.25Å; Y61-V65 PolarHBondContact O-N 3.49Å; Y61-T232 WeakPolarHBondContact CE1-O 3.4Å; Y61-T232 PolarHBondContact OH-O 2.88Å; Y61-R239 VanDerWaalsContact CE1-NH2 3.31Å; Y61-G242 VanDerWaalsContact CE2-O 3.31Å; Y61-G242 WeakPolarHBondContact CE2-O 3.02Å; Y61-A248 HydrophobicContact CE2-CB 4.39Å; Y61-A248 WeakPolarHBondContact OH-CB 3.38Å
62W84.1Confident78.5Confident96 Ų9679.9 Ų79.936%0.36440%0.396SS..Hα-helixtrans-66.4-32.7-175.168.5-94.5000112.1F57 P59 V65 L66F57-W62 AromaticContact CE1-CD1 3.48Å; F57-W62 VanDerWaalsContact CE1-CD1 3.48Å; F57-W62 AromaticContact CE1-NE1 3.89Å; F57-W62 HydrophobicContact CZ-CB 4.37Å; F57-W62 AromaticContact CZ-CD1 3.45Å; F57-W62 VanDerWaalsContact CZ-CD1 3.45Å; F57-W62 HydrophobicContact CZ-CG 4.18Å; P59-W62 PolarHBondContact O-NE1 3.37Å; P59-W62 VanDerWaalsContact O-NE1 3.14Å; W62-V65 PolarHBondContact O-N 2.92Å; W62-L66 HydrophobicContact CE3-CD1 3.8Å; W62-L66 HydrophobicContact CZ3-CD1 4.05Å; W62-L66 WeakPolarHBondContact O-CG 3.34Å; W62-L66 PolarHBondContact O-N 2.96Å
63K89Confident80.8Confident116 Ų11678.1 Ų78.150%0.50439%0.389SS..Hα-helixtrans-64.9-44173.1-66.9-178.1-179-173.10111.5P59 R60 Y61 L66 V67P59-K63 WeakPolarHBondContact O-CD 3.44Å; P59-K63 WeakPolarHBondContact O-CG 3.48Å; R60-K63 PolarHBondContact O-N 3.35Å; Y61-K63 VanDerWaalsContact C-N 3.28Å; Y61-K63 PolarHBondContact O-N 3.25Å; K63-L66 PolarHBondContact O-N 2.88Å; K63-V67 VanDerWaalsContact O-CB 3.32Å; K63-V67 WeakPolarHBondContact O-CB 3.43Å; K63-V67 VanDerWaalsContact O-CG2 3.23Å; K63-V67 WeakPolarHBondContact O-CG2 3.28Å; K63-V67 PolarHBondContact O-N 3.21Å
64Q91Very high83.1Confident86 Ų8676.3 Ų76.340%0.40239%0.388SS..Hα-helixtrans-63.4-42.2176-74172.1-20.200112R60 Y61 L68 Y245R60-Q64 WeakPolarHBondContact O-CG 3.39Å; R60-Q64 PolarHBondContact O-N 3.2Å; Y61-Q64 PolarHBondContact O-N 3.5Å; Y61-Q64 VanDerWaalsContact O-N 3.12Å; Q64-L68 WeakPolarHBondContact O-CB 3.49Å; Q64-L68 WeakPolarHBondContact O-CG 3.4Å; Q64-L68 PolarHBondContact O-N 3.38Å; Q64-Y245 HydrophobicContact CB-CD2 4.27Å; Q64-Y245 HydrophobicContact CB-CG 4.11Å
65V92.3Very high85.3Confident0 Ų071.1 Ų71.10%036%0.361CS..Hα-helixtrans-61.6-50.2175.7176.90000111.3Y61 W62 L68 L69 F233 A248 L252Y61-V65 HydrophobicContact CD2-CG2 4.31Å; Y61-V65 HydrophobicContact CE1-CG2 4.26Å; Y61-V65 HydrophobicContact CE2-CG2 3.97Å; Y61-V65 WeakPolarHBondContact O-CG2 3.25Å; Y61-V65 PolarHBondContact O-N 3.49Å; W62-V65 PolarHBondContact O-N 2.92Å; V65-L68 PolarHBondContact O-N 2.93Å; V65-L69 WeakPolarHBondContact O-CB 3.32Å; V65-L69 PolarHBondContact O-N 3.04Å; V65-F233 HydrophobicContact CG1-CE1 4.18Å; V65-F233 HydrophobicContact CG1-CZ 3.87Å; V65-A248 HydrophobicContact CG1-CB 3.98Å; V65-A248 HydrophobicContact CG2-CB 3.65Å; V65-L252 HydrophobicContact CG1-CD1 3.55Å
66L92.9Very high87.6Confident83 Ų8364.9 Ų64.944%0.43533%0.334SS..Hα-helixtrans-68.4-35-179.3-68.8-177.4000113.3W62 K63 G70 F233W62-L66 HydrophobicContact CE3-CD1 3.8Å; W62-L66 HydrophobicContact CZ3-CD1 4.05Å; W62-L66 WeakPolarHBondContact O-CG 3.34Å; W62-L66 PolarHBondContact O-N 2.96Å; K63-L66 PolarHBondContact O-N 2.88Å; L66-G70 PolarHBondContact O-N 3.2Å; L66-F233 HydrophobicContact CD2-CE1 4.23Å; L66-F233 HydrophobicContact CD2-CZ 3.71Å; L66-F233 HydrophobicContact CG-CE1 4.39Å; L66-F233 HydrophobicContact CG-CZ 4.33Å
67V94.6Very high89.6Confident92 Ų9261.3 Ų61.356%0.55831%0.308SS*.Hα-helixtrans-67.9-45.7176167.60000111.1K63 G70 I71K63-V67 VanDerWaalsContact O-CB 3.32Å; K63-V67 WeakPolarHBondContact O-CB 3.43Å; K63-V67 VanDerWaalsContact O-CG2 3.23Å; K63-V67 WeakPolarHBondContact O-CG2 3.28Å; K63-V67 PolarHBondContact O-N 3.21Å; V67-G70 PolarHBondContact O-N 3.19Å; V67-I71 HydrophobicContact CG1-CD1 4.04Å; V67-I71 WeakPolarHBondContact O-CD1 3.49Å; V67-I71 VanDerWaalsContact O-CG1 3.3Å; V67-I71 WeakPolarHBondContact O-CG1 3.24Å; V67-I71 PolarHBondContact O-N 3.28Å
68L94.2Very high91.4Very high15 Ų1557.6 Ų57.68%0.07930%0.304CS..Hα-helixtrans-62.6-50.4175.9-73.2170.7000110.8Q64 V65 G70 I71 Q72 I141 L144 M145 Y245 S249Q64-L68 WeakPolarHBondContact O-CB 3.49Å; Q64-L68 WeakPolarHBondContact O-CG 3.4Å; Q64-L68 PolarHBondContact O-N 3.38Å; V65-L68 PolarHBondContact O-N 2.93Å; L68-G70 VanDerWaalsContact C-N 3.28Å; L68-G70 PolarHBondContact O-N 3.18Å; L68-I71 WeakPolarHBondContact O-CB 3.29Å; L68-I71 PolarHBondContact O-N 3.06Å; L68-I71 VanDerWaalsContact O-N 3.08Å; L68-Q72 VanDerWaalsContact O-CG 3.31Å; L68-Q72 WeakPolarHBondContact O-CG 3.23Å; L68-Q72 PolarHBondContact O-N 3.37Å; L68-I141 HydrophobicContact CD2-CG1 4.4Å; L68-I141 HydrophobicContact CD2-CG2 4.49Å; L68-L144 HydrophobicContact CB-CD2 4.39Å; L68-L144 HydrophobicContact CD1-CD2 4.12Å; L68-L144 HydrophobicContact CD2-CD2 4.38Å; L68-M145 HydrophobicContact CD2-CE 3.95Å; L68-Y245 HydrophobicContact CD1-CD2 3.61Å; L68-Y245 HydrophobicContact CD1-CE2 3.96Å; L68-S249 VanDerWaalsContact CB-OG 3.24Å; L68-S249 WeakPolarHBondContact CB-OG 3.4Å
69L95.4Very high92.6Very high7 Ų755.4 Ų55.44%0.03729%0.292CS..Hα-helixtrans-59.2-39178.5-176.262.6000112.2V65 Q72 I73 F178 S249 L252V65-L69 WeakPolarHBondContact O-CB 3.32Å; V65-L69 PolarHBondContact O-N 3.04Å; L69-Q72 PolarHBondContact O-N 2.92Å; L69-I73 HydrophobicContact CG-CD1 4.08Å; L69-I73 WeakPolarHBondContact O-CB 3.39Å; L69-I73 WeakPolarHBondContact O-CD1 3.41Å; L69-I73 VanDerWaalsContact O-CG1 3.27Å; L69-I73 WeakPolarHBondContact O-CG1 3.4Å; L69-I73 PolarHBondContact O-N 2.94Å; L69-F178 HydrophobicContact CD2-CE1 3.91Å; L69-F178 HydrophobicContact CD2-CZ 3.99Å; L69-S249 PolarHBondContact N-OG 3.24Å; L69-S249 VanDerWaalsContact N-OG 3.14Å; L69-L252 HydrophobicContact CD1-CB 4.02Å; L69-L252 HydrophobicContact CD2-CB 3.84Å; L69-L252 HydrophobicContact CD2-CD1 4.09Å; L69-L252 HydrophobicContact CD2-CG 4.43Å
70G96.2Very high93.5Very high29 Ų2952 Ų5230%0.29927%0.27SS..Hα-helixtrans-61.8-43173.600000113L66 V67 L68 Q72 I73 V74L66-G70 PolarHBondContact O-N 3.2Å; V67-G70 PolarHBondContact O-N 3.19Å; L68-G70 VanDerWaalsContact C-N 3.28Å; L68-G70 PolarHBondContact O-N 3.18Å; G70-Q72 VanDerWaalsContact C-N 3.35Å; G70-I73 PolarHBondContact O-N 3.22Å; G70-V74 WeakPolarHBondContact O-CG2 3.24Å; G70-V74 PolarHBondContact O-N 3.25Å
71I97Very high93.9Very high78 Ų7845.9 Ų45.940%0.425%0.25SS..Hα-helixtrans-63.3-42.7172.8-64.1160.5000110.3V67 L68 I73 V74 L75 M145V67-I71 HydrophobicContact CG1-CD1 4.04Å; V67-I71 WeakPolarHBondContact O-CD1 3.49Å; V67-I71 VanDerWaalsContact O-CG1 3.3Å; V67-I71 WeakPolarHBondContact O-CG1 3.24Å; V67-I71 PolarHBondContact O-N 3.28Å; L68-I71 WeakPolarHBondContact O-CB 3.29Å; L68-I71 PolarHBondContact O-N 3.06Å; L68-I71 VanDerWaalsContact O-N 3.08Å; I71-I73 PolarHBondContact O-N 3.47Å; I71-V74 PolarHBondContact O-N 2.95Å; I71-L75 WeakPolarHBondContact O-CB 3.4Å; I71-L75 PolarHBondContact O-N 3.45Å; I71-M145 HydrophobicContact CB-CE 4.05Å; I71-M145 HydrophobicContact CD1-CE 4.38Å; I71-M145 HydrophobicContact CG2-CE 3.54Å; I71-M145 HydrophobicContact CG2-SD 3.87Å
72Q97.6Very high94.2Very high0 Ų046.8 Ų46.80%026%0.263CS..Hα-helixtrans-63.5-39.5178.7-63.7177.6-81.500112.2L68 L69 G70 S76 T148 S249 Y253L68-Q72 VanDerWaalsContact O-CG 3.31Å; L68-Q72 WeakPolarHBondContact O-CG 3.23Å; L68-Q72 PolarHBondContact O-N 3.37Å; L69-Q72 PolarHBondContact O-N 2.92Å; G70-Q72 VanDerWaalsContact C-N 3.35Å; Q72-S76 WeakPolarHBondContact O-CB 3.49Å; Q72-S76 PolarHBondContact O-N 2.98Å; Q72-S76 PolarHBondContact O-OG 3.19Å; Q72-T148 HydrophobicContact CB-CG2 4.08Å; Q72-T148 HydrophobicContact CG-CG2 4.31Å; Q72-T148 VanDerWaalsContact CG-OG1 3.27Å; Q72-T148 WeakPolarHBondContact CG-OG1 3.49Å; Q72-T148 PolarHBondContact NE2-OG1 3.2Å; Q72-S249 PolarHBondContact OE1-O 3.28Å; Q72-S249 PolarHBondContact OE1-OG 3.42Å; Q72-Y253 HydrophobicContact CB-CD2 3.55Å; Q72-Y253 HydrophobicContact CB-CE2 3.91Å; Q72-Y253 HydrophobicContact CB-CG 4.14Å; Q72-Y253 HydrophobicContact CG-CD2 4.42Å
73I97.2Very high94.5Very high29 Ų2943.7 Ų43.715%0.14925%0.253CS..Hα-helixtrans-60.9-53.5173.2-74161.8000110.9L69 G70 I71 L75 S76 I77 L175 M256L69-I73 HydrophobicContact CG-CD1 4.08Å; L69-I73 WeakPolarHBondContact O-CB 3.39Å; L69-I73 WeakPolarHBondContact O-CD1 3.41Å; L69-I73 VanDerWaalsContact O-CG1 3.27Å; L69-I73 WeakPolarHBondContact O-CG1 3.4Å; L69-I73 PolarHBondContact O-N 2.94Å; G70-I73 PolarHBondContact O-N 3.22Å; I71-I73 PolarHBondContact O-N 3.47Å; I73-L75 VanDerWaalsContact C-N 3.3Å; I73-L75 PolarHBondContact O-N 3.05Å; I73-S76 PolarHBondContact O-N 3.46Å; I73-I77 HydrophobicContact CG2-CD1 3.69Å; I73-I77 WeakPolarHBondContact O-CG1 3.12Å; I73-I77 PolarHBondContact O-N 3.49Å; I73-L175 HydrophobicContact CD1-CD2 4.12Å; I73-L175 HydrophobicContact CG1-CD2 4.36Å; I73-L175 HydrophobicContact CG2-CD2 3.93Å; I73-M256 HydrophobicContact CD1-SD 3.91Å; I73-M256 HydrophobicContact CG1-CE 3.75Å; I73-M256 HydrophobicContact CG1-SD 3.47Å; I73-M256 WeakPolarHBondContact CG1-SD 3.39Å
74V97.4Very high94.3Very high105 Ų10539 Ų3964%0.63624%0.235SC*.Hα-helixtrans-62.1-39.7-178.4171.20000111.1G70 I71 G78G70-V74 WeakPolarHBondContact O-CG2 3.24Å; G70-V74 PolarHBondContact O-N 3.25Å; I71-V74 PolarHBondContact O-N 2.95Å; V74-G78 PolarHBondContact O-N 3.35Å
75L96.8Very high94.1Very high49 Ų4938.7 Ų38.726%0.25724%0.238SC..Hα-helixtrans-65.6-43.6177.3-173.352.5000111.9I71 I73 G78 I79 M145 T148 M149I71-L75 WeakPolarHBondContact O-CB 3.4Å; I71-L75 PolarHBondContact O-N 3.45Å; I73-L75 VanDerWaalsContact C-N 3.3Å; I73-L75 PolarHBondContact O-N 3.05Å; L75-G78 PolarHBondContact O-N 2.89Å; L75-I79 HydrophobicContact CD1-CD1 4.01Å; L75-I79 HydrophobicContact CD1-CG1 4.42Å; L75-I79 HydrophobicContact CG-CD1 4.06Å; L75-I79 VanDerWaalsContact O-CG1 3.31Å; L75-I79 WeakPolarHBondContact O-CG1 3.28Å; L75-I79 PolarHBondContact O-N 3.38Å; L75-M145 HydrophobicContact CD2-SD 4.27Å; L75-T148 HydrophobicContact CB-CG2 4.17Å; L75-T148 HydrophobicContact CD2-CG2 3.84Å; L75-T148 HydrophobicContact CG-CG2 4.07Å; L75-M149 HydrophobicContact CD1-CG 4.35Å; L75-M149 HydrophobicContact CD2-CG 3.68Å; L75-M149 HydrophobicContact CD2-SD 4.47Å; L75-M149 HydrophobicContact CG-CG 4.14Å
76S96.9Very high93.7Very high0 Ų043 Ų430%026%0.261CS..Hα-helixtrans-64.7-44.3174.8-75.60000113.4Q72 I73 G78 I79 T80 S152 W171 Y253Q72-S76 WeakPolarHBondContact O-CB 3.49Å; Q72-S76 PolarHBondContact O-N 2.98Å; Q72-S76 PolarHBondContact O-OG 3.19Å; I73-S76 PolarHBondContact O-N 3.46Å; S76-G78 VanDerWaalsContact C-N 3.32Å; S76-G78 PolarHBondContact O-N 3.41Å; S76-I79 PolarHBondContact O-N 3.02Å; S76-T80 WeakPolarHBondContact O-CB 3.28Å; S76-T80 PolarHBondContact O-N 3.49Å; S76-T80 PolarHBondContact O-OG1 2.96Å; S76-T80 VanDerWaalsContact O-OG1 3.11Å; S76-S152 WeakPolarHBondContact CA-OG 3.48Å; S76-S152 PolarHBondContact OG-OG 2.86Å; S76-W171 VanDerWaalsContact CB-CH2 3.48Å; S76-Y253 WeakPolarHBondContact OG-CE2 3.35Å; S76-Y253 PolarHBondContact OG-OH 3.37Å
77I96Very high93.1Very high44 Ų4442.2 Ų42.223%0.22625%0.254CS..Hα-helixtrans-60.2-45.9175.3-67.6165.6000109.8I73 I79 T80 L81 W171 L175I73-I77 HydrophobicContact CG2-CD1 3.69Å; I73-I77 WeakPolarHBondContact O-CG1 3.12Å; I73-I77 PolarHBondContact O-N 3.49Å; I77-I79 PolarHBondContact O-N 3.42Å; I77-T80 PolarHBondContact O-N 2.87Å; I77-L81 HydrophobicContact CG2-CD1 3.74Å; I77-L81 HydrophobicContact CG2-CG 4.29Å; I77-L81 WeakPolarHBondContact O-CB 3.37Å; I77-L81 VanDerWaalsContact O-CG 3.29Å; I77-L81 WeakPolarHBondContact O-CG 3.17Å; I77-L81 PolarHBondContact O-N 3.47Å; I77-W171 HydrophobicContact CD1-CD2 4.31Å; I77-W171 HydrophobicContact CD1-CE3 4.26Å; I77-W171 HydrophobicContact CG1-CD2 3.52Å; I77-W171 HydrophobicContact CG1-CE3 3.79Å; I77-W171 HydrophobicContact CG1-CG 3.97Å; I77-W171 HydrophobicContact CG1-CH2 4.25Å; I77-W171 HydrophobicContact CG1-CZ2 3.99Å; I77-W171 HydrophobicContact CG1-CZ3 4.15Å; I77-L175 HydrophobicContact CD1-CD1 4.32Å
78G95.9Very high92.2Very high44 Ų4446.1 Ų46.145%0.45426%0.26SS..Hα-helixtrans-58.8-43.317700000113.3V74 L75 S76 G82V74-G78 PolarHBondContact O-N 3.35Å; L75-G78 PolarHBondContact O-N 2.89Å; S76-G78 VanDerWaalsContact C-N 3.32Å; S76-G78 PolarHBondContact O-N 3.41Å; G78-G82 PolarHBondContact O-N 3.16Å
79I95.5Very high91.3Very high30 Ų3051.5 Ų51.515%0.15429%0.287CS..Hα-helixtrans-67.4-49.5177-70.9165.7000110.9L75 S76 I77 L81 G82 L83 M149L75-I79 HydrophobicContact CD1-CD1 4.01Å; L75-I79 HydrophobicContact CD1-CG1 4.42Å; L75-I79 HydrophobicContact CG-CD1 4.06Å; L75-I79 VanDerWaalsContact O-CG1 3.31Å; L75-I79 WeakPolarHBondContact O-CG1 3.28Å; L75-I79 PolarHBondContact O-N 3.38Å; S76-I79 PolarHBondContact O-N 3.02Å; I77-I79 PolarHBondContact O-N 3.42Å; I79-L81 VanDerWaalsContact C-N 3.33Å; I79-L81 PolarHBondContact O-N 2.87Å; I79-G82 PolarHBondContact O-N 3.23Å; I79-L83 HydrophobicContact CG2-CD1 3.72Å; I79-L83 HydrophobicContact CG2-CG 4.29Å; I79-L83 WeakPolarHBondContact O-CB 3.37Å; I79-L83 VanDerWaalsContact O-CG 3.26Å; I79-L83 WeakPolarHBondContact O-CG 3.42Å; I79-L83 PolarHBondContact O-N 2.67Å; I79-M149 HydrophobicContact CD1-CB 4.12Å; I79-M149 HydrophobicContact CD1-CG 4.06Å
80T93.5Very high90.2Very high2 Ų257.4 Ų57.41%0.01231%0.312CS..Hα-helixtrans-59.2-42179.3-62.40000112.3S76 I77 T84 A156 K167 W260S76-T80 WeakPolarHBondContact O-CB 3.28Å; S76-T80 PolarHBondContact O-N 3.49Å; S76-T80 PolarHBondContact O-OG1 2.96Å; S76-T80 VanDerWaalsContact O-OG1 3.11Å; I77-T80 PolarHBondContact O-N 2.87Å; T80-T84 PolarHBondContact O-N 2.85Å; T80-T84 PolarHBondContact O-OG1 2.83Å; T80-A156 HydrophobicContact CG2-CB 4.23Å; T80-A156 WeakPolarHBondContact OG1-CB 3.31Å; T80-K167 HydrophobicContact CG2-CB 4.46Å; T80-K167 HydrophobicContact CG2-CD 4.13Å; T80-W260 HydrophobicContact CG2-CH2 3.86Å; T80-W260 HydrophobicContact CG2-CZ2 3.7Å
81L92.5Very high88.8Confident48 Ų4865.2 Ų65.225%0.25134%0.338SS..Hα-helixtrans-73.3-41.9177.1-64.1179.1000111.7I77 I79 L83 T84 V85 I164 I168I77-L81 HydrophobicContact CG2-CD1 3.74Å; I77-L81 HydrophobicContact CG2-CG 4.29Å; I77-L81 WeakPolarHBondContact O-CB 3.37Å; I77-L81 VanDerWaalsContact O-CG 3.29Å; I77-L81 WeakPolarHBondContact O-CG 3.17Å; I77-L81 PolarHBondContact O-N 3.47Å; I79-L81 VanDerWaalsContact C-N 3.33Å; I79-L81 PolarHBondContact O-N 2.87Å; L81-L83 PolarHBondContact O-N 2.92Å; L81-T84 WeakPolarHBondContact O-CA 3.25Å; L81-T84 VanDerWaalsContact O-CB 3.27Å; L81-T84 WeakPolarHBondContact O-CB 3.39Å; L81-T84 PolarHBondContact O-N 3.33Å; L81-T84 VanDerWaalsContact O-N 3.08Å; L81-V85 PolarHBondContact O-N 2.94Å; L81-I164 HydrophobicContact CD2-CD1 4.07Å; L81-I164 HydrophobicContact CD2-CG1 3.86Å; L81-I168 HydrophobicContact CD2-CG1 4.22Å
82G92.1Very high87.1Confident30 Ų3068.7 Ų68.731%0.30935%0.352SS..Hα-helixtrans-59.8-44.417700000113.1G78 I79 T84 V85 I86G78-G82 PolarHBondContact O-N 3.16Å; I79-G82 PolarHBondContact O-N 3.23Å; G82-T84 VanDerWaalsContact C-N 3.26Å; G82-T84 PolarHBondContact O-N 3.08Å; G82-V85 PolarHBondContact O-N 3.31Å; G82-I86 WeakPolarHBondContact O-CG1 3.44Å; G82-I86 PolarHBondContact O-N 3.14Å
83L90Very high85.2Confident31 Ų3170.8 Ų70.816%0.16237%0.367CS..Hα-helixtrans-60.4-35.6173.6-69.7166.9000112.3I79 L81 I86 Q87 L153 A156 L157 T160I79-L83 HydrophobicContact CG2-CD1 3.72Å; I79-L83 HydrophobicContact CG2-CG 4.29Å; I79-L83 WeakPolarHBondContact O-CB 3.37Å; I79-L83 VanDerWaalsContact O-CG 3.26Å; I79-L83 WeakPolarHBondContact O-CG 3.42Å; I79-L83 PolarHBondContact O-N 2.67Å; L81-L83 PolarHBondContact O-N 2.92Å; L83-I86 PolarHBondContact O-N 2.94Å; L83-Q87 PolarHBondContact O-N 2.66Å; L83-L153 HydrophobicContact CD1-CD1 3.77Å; L83-L153 HydrophobicContact CD2-CD1 3.77Å; L83-L153 HydrophobicContact CG-CD1 4.34Å; L83-A156 HydrophobicContact CD1-CB 3.92Å; L83-L157 HydrophobicContact CD2-CD2 4.35Å; L83-T160 HydrophobicContact CB-CG2 4.06Å
84T86.1Confident83.3Confident18 Ų1874.2 Ų74.211%0.1139%0.391CS..Hα-helixtrans-65.6-42.6175.9-520000111.5T80 L81 G82 Q87 Y88 I164 K167T80-T84 PolarHBondContact O-N 2.85Å; T80-T84 PolarHBondContact O-OG1 2.83Å; L81-T84 WeakPolarHBondContact O-CA 3.25Å; L81-T84 VanDerWaalsContact O-CB 3.27Å; L81-T84 WeakPolarHBondContact O-CB 3.39Å; L81-T84 PolarHBondContact O-N 3.33Å; L81-T84 VanDerWaalsContact O-N 3.08Å; G82-T84 VanDerWaalsContact C-N 3.26Å; G82-T84 PolarHBondContact O-N 3.08Å; T84-Q87 PolarHBondContact O-N 3.24Å; T84-Y88 PolarHBondContact O-N 3.46Å; T84-Y88 VanDerWaalsContact O-N 3.08Å; T84-I164 HydrophobicContact CG2-CB 4.23Å; T84-K167 WeakPolarHBondContact OG1-CD 3.23Å; T84-K167 PolarHBondContact OG1-NZ 3.46Å
85V86.7Confident81.3Confident78 Ų7873.1 Ų73.147%0.47339%0.388SS..Hα-helixtrans-65.4-43.1175.21770000111L81 G82 Q87 Y88 M89L81-V85 PolarHBondContact O-N 2.94Å; G82-V85 PolarHBondContact O-N 3.31Å; V85-Q87 VanDerWaalsContact C-N 3.34Å; V85-Q87 PolarHBondContact O-N 3.44Å; V85-Y88 PolarHBondContact O-N 3.02Å; V85-M89 HydrophobicContact CG1-CG 4.48Å; V85-M89 HydrophobicContact CG1-SD 4.27Å; V85-M89 WeakPolarHBondContact O-CG 3.38Å; V85-M89 PolarHBondContact O-N 3.37Å
86I84.4Confident79.3Confident92 Ų9275 Ų7547%0.47240%0.397SS..Hα-helixtrans-60.7-41.6178-68.9164.4000111.4G82 L83 M89 K90G82-I86 WeakPolarHBondContact O-CG1 3.44Å; G82-I86 PolarHBondContact O-N 3.14Å; L83-I86 PolarHBondContact O-N 2.94Å; I86-M89 PolarHBondContact O-N 3.03Å; I86-K90 WeakPolarHBondContact O-CG 3.43Å; I86-K90 PolarHBondContact O-N 2.84Å
87Q78.9Confident77.3Confident65 Ų6581.7 Ų81.730%0.30443%0.433SS..Hα-helixtrans-68-40.2176-166.1-172.514.700112.1L83 T84 V85 M89 K90 F91 T160 S161L83-Q87 PolarHBondContact O-N 2.66Å; T84-Q87 PolarHBondContact O-N 3.24Å; V85-Q87 VanDerWaalsContact C-N 3.34Å; V85-Q87 PolarHBondContact O-N 3.44Å; Q87-M89 VanDerWaalsContact C-N 3.31Å; Q87-M89 PolarHBondContact O-N 3.31Å; Q87-K90 PolarHBondContact O-N 3.01Å; Q87-K90 VanDerWaalsContact O-N 3.15Å; Q87-F91 PolarHBondContact O-N 2.93Å; Q87-T160 PolarHBondContact OE1-O 2.99Å; Q87-T160 PolarHBondContact OE1-OG1 3.33Å; Q87-S161 PolarHBondContact NE2-OG 3.01Å; Q87-S161 VanDerWaalsContact OE1-N 3.13Å
88Y77.1Confident75.1Confident175 Ų17590.5 Ų90.569%0.68646%0.463SS*.Hα-helixtrans-59-43.1175.2-174-96.3000111.7T84 V85 F91 H92T84-Y88 PolarHBondContact O-N 3.46Å; T84-Y88 VanDerWaalsContact O-N 3.08Å; V85-Y88 PolarHBondContact O-N 3.02Å; Y88-F91 PolarHBondContact O-N 3.28Å; Y88-H92 PolarHBondContact O-N 2.84Å
89M75.2Confident73Confident128 Ų12894.8 Ų94.863%0.63148%0.475SS*.Hα-helixtrans-65.3-36.4174.3-68.2-177.575.900113.2V85 I86 Q87 S93V85-M89 HydrophobicContact CG1-CG 4.48Å; V85-M89 HydrophobicContact CG1-SD 4.27Å; V85-M89 WeakPolarHBondContact O-CG 3.38Å; V85-M89 PolarHBondContact O-N 3.37Å; I86-M89 PolarHBondContact O-N 3.03Å; Q87-M89 VanDerWaalsContact C-N 3.31Å; Q87-M89 PolarHBondContact O-N 3.31Å; M89-S93 WeakPolarHBondContact O-CB 3.4Å; M89-S93 PolarHBondContact O-N 3.41Å
90K72Confident70.9Confident131 Ų13199.1 Ų99.157%0.5750%0.498SS*.Hα-helixtrans-64.1-48.1173.3-76.5-178.5177.6-175.20111.5I86 Q87 H92 S93 I96I86-K90 WeakPolarHBondContact O-CG 3.43Å; I86-K90 PolarHBondContact O-N 2.84Å; Q87-K90 PolarHBondContact O-N 3.01Å; Q87-K90 VanDerWaalsContact O-N 3.15Å; K90-H92 VanDerWaalsContact C-N 3.32Å; K90-H92 PolarHBondContact O-N 3.29Å; K90-S93 PolarHBondContact O-N 2.97Å; K90-S93 VanDerWaalsContact O-N 3.08Å; K90-I96 HydrophobicContact CG-CD1 4.43Å
91F66.4Low69Low192 Ų192102.7 Ų102.784%0.84254%0.536SS*.Hα-helixtrans-65.6-32.7-178.3-170.3-96.4000112.9Q87 Y88 S93Q87-F91 PolarHBondContact O-N 2.93Å; Y88-F91 PolarHBondContact O-N 3.28Å; F91-S93 VanDerWaalsContact C-N 3.33Å
92H62.1Low67.2Low152 Ų152110.8 Ų110.870%0.70457%0.569SS**THydrogen-bonded Turntrans-84.2-1.1174.5-162.369.7000114.1Y88 K90 P94Y88-H92 PolarHBondContact O-N 2.84Å; K90-H92 VanDerWaalsContact C-N 3.32Å; K90-H92 PolarHBondContact O-N 3.29Å; H92-P94 WeakPolarHBondContact O-CD 3.49Å
93S56.4Low65.3Low44 Ų44114.5 Ų114.531%0.30858%0.581SS.*  trans-106.393.4177.1-172.10000110.9M89 K90 F91 S95M89-S93 WeakPolarHBondContact O-CB 3.4Å; M89-S93 PolarHBondContact O-N 3.41Å; K90-S93 PolarHBondContact O-N 2.97Å; K90-S93 VanDerWaalsContact O-N 3.08Å; F91-S93 VanDerWaalsContact C-N 3.33Å; S93-S95 PolarHBondContact O-N 2.85Å; S93-S95 PolarHBondContact OG-OG 2.86Å
94P56.6Low63.8Low101 Ų101117.7 Ų117.766%0.65660%0.598SS**THydrogen-bonded Turntrans-68.110.2-178.330.6-38.1000114.3H92H92-P94 WeakPolarHBondContact O-CD 3.49Å
95S56.6Low62.8Low81 Ų81122.5 Ų122.557%0.56662%0.622SS**THydrogen-bonded Turntrans-76-29.5-177.7-43.90000113S93S93-S95 PolarHBondContact O-N 2.85Å; S93-S95 PolarHBondContact OG-OG 2.86Å
96I54.7Low61.9Low89 Ų89120.3 Ų120.346%0.45661%0.61SS.*SBendtrans-85.8-40.1-167.4-58.7-179.9000111.8K90 R98 I99K90-I96 HydrophobicContact CG-CD1 4.43Å; I96-R98 PolarHBondContact O-N 2.97Å; I96-I99 PolarHBondContact O-N 3.09Å
97D54.4Low61.2Low140 Ų140121.2 Ų121.275%0.74962%0.616SS**THydrogen-bonded Turntrans-61-19-175.9-68.2-6000114.5
98R50.5Low61.1Low229 Ų229122 Ų12286%0.86462%0.624SS**THydrogen-bonded Turntrans-84.8-11.2-174.1-75.2-174.669.4157.70.4115.6I96I96-R98 PolarHBondContact O-N 2.97Å
99I52.1Low61.1Low134 Ų134117.3 Ų117.369%0.68761%0.611SS**SBendtrans-91.1-43.2-166.1-63-177.2000113.6I96I96-I99 PolarHBondContact O-N 3.09Å
100N51Low61.4Low121 Ų121113.8 Ų113.865%0.64759%0.594SS**SBendtrans-122.8104.9-175.6-73.2-31.2000111.6K102N100-K102 PolarHBondContact O-N 2.86Å
101G52.4Low62Low78 Ų78110.7 Ų110.780%0.80459%0.587SS**THydrogen-bonded Turntrans-66.2119.9-177.900000113.3L103G101-L103 PolarHBondContact O-N 3.01Å
102K55.1Low62.9Low217 Ų217105.8 Ų105.894%0.94357%0.573SS**THydrogen-bonded Turntrans56.414.4170.6-63.5-169.5176.7-173.60117.3N100 D104N100-K102 PolarHBondContact O-N 2.86Å; K102-D104 VanDerWaalsContact C-N 3.35Å; K102-D104 PolarHBondContact O-N 2.77Å
103L51.9Low64Low109 Ų10999.2 Ų99.257%0.57154%0.542SS*.  trans-73.797.1160.7-170.875.9000107.5G101 I105 V108G101-L103 PolarHBondContact O-N 3.01Å; L103-I105 PolarHBondContact O-N 2.89Å; L103-I105 VanDerWaalsContact O-N 3.12Å; L103-V108 HydrophobicContact CD2-CG2 4.25Å
104D59.2Low65.4Low97 Ų9799.6 Ų99.652%0.51954%0.543SS..  trans-59116.3-178.6-163.3-31.3000109.9K102 S106 L107K102-D104 VanDerWaalsContact C-N 3.35Å; K102-D104 PolarHBondContact O-N 2.77Å; D104-S106 PolarHBondContact O-N 2.92Å; D104-S106 VanDerWaalsContact O-N 3.17Å; D104-S106 WeakPolarHBondContact OD1-CB 3.31Å; D104-S106 PolarHBondContact OD1-N 3.16Å; D104-S106 PolarHBondContact OD1-OG 3.1Å; D104-L107 HydrophobicContact CB-CD1 4.23Å; D104-L107 HydrophobicContact CB-CG 4.47Å; D104-L107 WeakPolarHBondContact O-CB 3.49Å; D104-L107 PolarHBondContact O-N 3.4Å; D104-L107 VanDerWaalsContact O-N 3.1Å
105I64.5Low67.1Low119 Ų11998.8 Ų98.861%0.6154%0.536SS*.Hα-helixtrans-65.8-23-170.9-61175.7000110.7L103 L107 V108 L109L103-I105 PolarHBondContact O-N 2.89Å; L103-I105 VanDerWaalsContact O-N 3.12Å; I105-L107 PolarHBondContact O-N 2.94Å; I105-V108 PolarHBondContact O-N 3.49Å; I105-L109 PolarHBondContact O-N 3.43Å; I105-L109 VanDerWaalsContact O-N 3.12Å
106S67.4Low68.7Low33 Ų3396.3 Ų96.323%0.23152%0.517CS..Hα-helixtrans-55.2-45.3171.460.10000112.8D104 V108 L109 I110D104-S106 PolarHBondContact O-N 2.92Å; D104-S106 VanDerWaalsContact O-N 3.17Å; D104-S106 WeakPolarHBondContact OD1-CB 3.31Å; D104-S106 PolarHBondContact OD1-N 3.16Å; D104-S106 PolarHBondContact OD1-OG 3.1Å; S106-V108 PolarHBondContact O-N 2.86Å; S106-L109 PolarHBondContact O-N 2.78Å; S106-I110 WeakPolarHBondContact O-CG1 3.48Å; S106-I110 PolarHBondContact O-N 2.97Å; S106-I110 VanDerWaalsContact O-N 3.1Å
107L71.7Confident70.4Confident111 Ų11192.9 Ų92.958%0.58150%0.501SS*.Hα-helixtrans-62.4-25.8-177.8-74170.5000113.3D104 I105 P111D104-L107 HydrophobicContact CB-CD1 4.23Å; D104-L107 HydrophobicContact CB-CG 4.47Å; D104-L107 WeakPolarHBondContact O-CB 3.49Å; D104-L107 PolarHBondContact O-N 3.4Å; D104-L107 VanDerWaalsContact O-N 3.1Å; I105-L107 PolarHBondContact O-N 2.94Å; L107-P111 WeakPolarHBondContact O-CD 3.33Å; L107-P111 WeakPolarHBondContact O-CG 3.21Å
108V75.8Confident72.1Confident80 Ų8092 Ų9249%0.48550%0.496SS..Hα-helixtrans-90.9-28.8176.2-175.80000111.5L103 I105 S106 P111 V112L103-V108 HydrophobicContact CD2-CG2 4.25Å; I105-V108 PolarHBondContact O-N 3.49Å; S106-V108 PolarHBondContact O-N 2.86Å; V108-P111 WeakPolarHBondContact O-CD 3.3Å; V108-P111 WeakPolarHBondContact O-CG 3.5Å; V108-V112 WeakPolarHBondContact O-CG2 3.38Å
109L77.4Confident74.1Confident78 Ų7885.4 Ų85.441%0.40848%0.476SS..Hα-helixtrans-72.9-43.2-179.4-174.860.3000112.7I105 S106 V112 E113I105-L109 PolarHBondContact O-N 3.43Å; I105-L109 VanDerWaalsContact O-N 3.12Å; S106-L109 PolarHBondContact O-N 2.78Å; L109-V112 WeakPolarHBondContact O-CB 3.27Å; L109-V112 PolarHBondContact O-N 2.93Å; L109-V112 VanDerWaalsContact O-N 3.11Å; L109-E113 HydrophobicContact CD1-CG 4.26Å; L109-E113 HydrophobicContact CG-CG 4.36Å; L109-E113 PolarHBondContact O-N 3.27Å
110I81.6Confident76.1Confident53 Ų5379.2 Ų79.227%0.27245%0.445SS..Hα-helixtrans-54.7-50.7-179.5-65.7162.4000113.7Q19 S106 V112 E113 T114Q19-I110 HydrophobicContact CB-CD1 4.16Å; Q19-I110 HydrophobicContact CG-CD1 4.36Å; S106-I110 WeakPolarHBondContact O-CG1 3.48Å; S106-I110 PolarHBondContact O-N 2.97Å; S106-I110 VanDerWaalsContact O-N 3.1Å; I110-V112 VanDerWaalsContact C-N 3.28Å; I110-V112 PolarHBondContact O-N 3.15Å; I110-E113 PolarHBondContact O-N 3.33Å; I110-T114 WeakPolarHBondContact O-CG2 3.4Å; I110-T114 PolarHBondContact O-N 3.15Å; I110-T114 PolarHBondContact O-OG1 3.43Å
111P84.7Confident78Confident66 Ų6675.6 Ų75.643%0.42943%0.425SS..Hα-helixtrans-66.3-29177.725-34000112.8L107 V108 T114 V115L107-P111 WeakPolarHBondContact O-CD 3.33Å; L107-P111 WeakPolarHBondContact O-CG 3.21Å; V108-P111 WeakPolarHBondContact O-CD 3.3Å; V108-P111 WeakPolarHBondContact O-CG 3.5Å; P111-T114 WeakPolarHBondContact CA-OG1 3.31Å; P111-T114 PolarHBondContact O-OG1 3.01Å; P111-V115 WeakPolarHBondContact O-CB 3.33Å; P111-V115 VanDerWaalsContact O-CG2 3.26Å; P111-V115 WeakPolarHBondContact O-CG2 3.38Å; P111-V115 PolarHBondContact O-N 3.26Å; P111-V115 VanDerWaalsContact O-N 3.15Å
112V85.2Confident79.8Confident90 Ų9073.9 Ų73.955%0.54541%0.407SS..Hα-helixtrans-70.3-43.6174.8174.70000110.9V108 L109 I110 L116V108-V112 WeakPolarHBondContact O-CG2 3.38Å; L109-V112 WeakPolarHBondContact O-CB 3.27Å; L109-V112 PolarHBondContact O-N 2.93Å; L109-V112 VanDerWaalsContact O-N 3.11Å; I110-V112 VanDerWaalsContact C-N 3.28Å; I110-V112 PolarHBondContact O-N 3.15Å; V112-L116 WeakPolarHBondContact O-CB 3.36Å; V112-L116 PolarHBondContact O-N 3.23Å
113E85.4Confident81.6Confident13 Ų1364.6 Ų64.66%0.06137%0.368CS..Hα-helixtrans-66.1-39.7177.7-76.5-163-135.200113.3R27 L109 I110 L116 A117 L157 P158R27-E113 IonicContact CZ-OE2 3.84Å; R27-E113 IonicContact NH2-OE2 2.67Å; R27-E113 PolarHBondContact NH2-OE2 3.45Å; L109-E113 HydrophobicContact CD1-CG 4.26Å; L109-E113 HydrophobicContact CG-CG 4.36Å; L109-E113 PolarHBondContact O-N 3.27Å; I110-E113 PolarHBondContact O-N 3.33Å; E113-L116 PolarHBondContact O-N 3.48Å; E113-A117 WeakPolarHBondContact O-CB 3.47Å; E113-A117 PolarHBondContact O-N 3.37Å; E113-L157 HydrophobicContact CG-CB 4.33Å; E113-L157 HydrophobicContact CG-CD1 3.9Å; E113-L157 WeakPolarHBondContact OE2-CB 3.08Å; E113-P158 WeakPolarHBondContact OE2-CD 3.37Å; E113-P158 WeakPolarHBondContact OE2-CG 3.19Å
114T86Confident83.5Confident53 Ų5359.7 Ų59.733%0.32534%0.342SS..Hα-helixtrans-68.6-41.5177.950.30000112I110 P111 L116 A117 I118I110-T114 WeakPolarHBondContact O-CG2 3.4Å; I110-T114 PolarHBondContact O-N 3.15Å; I110-T114 PolarHBondContact O-OG1 3.43Å; P111-T114 WeakPolarHBondContact CA-OG1 3.31Å; P111-T114 PolarHBondContact O-OG1 3.01Å; T114-L116 VanDerWaalsContact C-N 3.34Å; T114-L116 PolarHBondContact O-N 3.33Å; T114-A117 PolarHBondContact O-N 2.99Å; T114-I118 WeakPolarHBondContact O-CD1 3.39Å; T114-I118 VanDerWaalsContact O-CG1 3.28Å; T114-I118 WeakPolarHBondContact O-CG1 3.2Å; T114-I118 PolarHBondContact O-N 3.31Å
115V90.5Very high85Confident83 Ų8357.2 Ų57.250%0.50333%0.331SS..Hα-helixtrans-61.3-41.8171.7168.90000111.4P111 A117 I118 I119P111-V115 WeakPolarHBondContact O-CB 3.33Å; P111-V115 VanDerWaalsContact O-CG2 3.26Å; P111-V115 WeakPolarHBondContact O-CG2 3.38Å; P111-V115 PolarHBondContact O-N 3.26Å; P111-V115 VanDerWaalsContact O-N 3.15Å; V115-A117 PolarHBondContact O-N 3.34Å; V115-I118 PolarHBondContact O-N 2.88Å; V115-I119 HydrophobicContact CG1-CD1 3.85Å; V115-I119 VanDerWaalsContact O-CG1 3.31Å; V115-I119 WeakPolarHBondContact O-CG1 3.28Å; V115-I119 PolarHBondContact O-N 3.15Å
116L91.5Very high86.2Confident30 Ų3056.4 Ų56.416%0.15732%0.323CS..Hα-helixtrans-62.4-41.7177.3-165.975.1000112.1V112 E113 T114 I119 N120 L150 L153 T154 L157V112-L116 WeakPolarHBondContact O-CB 3.36Å; V112-L116 PolarHBondContact O-N 3.23Å; E113-L116 PolarHBondContact O-N 3.48Å; T114-L116 VanDerWaalsContact C-N 3.34Å; T114-L116 PolarHBondContact O-N 3.33Å; L116-I119 PolarHBondContact O-N 2.95Å; L116-N120 WeakPolarHBondContact O-CB 3.38Å; L116-N120 PolarHBondContact O-N 3.47Å; L116-L150 HydrophobicContact CD1-CD2 3.52Å; L116-L150 HydrophobicContact CG-CD2 4.24Å; L116-L153 HydrophobicContact CD2-CB 4.18Å; L116-L153 HydrophobicContact CD2-CD2 3.69Å; L116-L153 HydrophobicContact CD2-CG 3.64Å; L116-T154 WeakPolarHBondContact CD2-OG1 3.44Å; L116-T154 WeakPolarHBondContact CG-OG1 3.24Å; L116-L157 HydrophobicContact CD2-CD1 4.33Å
117A90.1Very high87.3Confident16 Ų1654.9 Ų54.913%0.13231%0.312CS..Hα-helixtrans-62.4-45.817500000112.2E113 T114 V115 I119 N120 D121 T154E113-A117 WeakPolarHBondContact O-CB 3.47Å; E113-A117 PolarHBondContact O-N 3.37Å; T114-A117 PolarHBondContact O-N 2.99Å; V115-A117 PolarHBondContact O-N 3.34Å; A117-I119 VanDerWaalsContact C-N 3.31Å; A117-I119 PolarHBondContact O-N 3.03Å; A117-N120 WeakPolarHBondContact O-CB 3.28Å; A117-N120 PolarHBondContact O-N 3.47Å; A117-N120 VanDerWaalsContact O-N 3.15Å; A117-D121 PolarHBondContact O-N 3.39Å; A117-T154 HydrophobicContact CB-CG2 3.82Å
118I90.9Very high88Confident123 Ų12350.2 Ų50.263%0.63129%0.288SS*.Hα-helixtrans-60.7-40.5178-67.7162000111.2T114 V115 G122T114-I118 WeakPolarHBondContact O-CD1 3.39Å; T114-I118 VanDerWaalsContact O-CG1 3.28Å; T114-I118 WeakPolarHBondContact O-CG1 3.2Å; T114-I118 PolarHBondContact O-N 3.31Å; V115-I118 PolarHBondContact O-N 2.88Å; I118-G122 PolarHBondContact O-N 2.98Å
119I92.8Very high88.6Confident89 Ų8951.3 Ų51.346%0.45629%0.294SS..Hα-helixtrans-65.2-43.4175.6-67164.9000110.9V115 L116 A117 G122 I123 L150V115-I119 HydrophobicContact CG1-CD1 3.85Å; V115-I119 VanDerWaalsContact O-CG1 3.31Å; V115-I119 WeakPolarHBondContact O-CG1 3.28Å; V115-I119 PolarHBondContact O-N 3.15Å; L116-I119 PolarHBondContact O-N 2.95Å; A117-I119 VanDerWaalsContact C-N 3.31Å; A117-I119 PolarHBondContact O-N 3.03Å; I119-G122 PolarHBondContact O-N 3.01Å; I119-I123 HydrophobicContact CG2-CD1 4.08Å; I119-I123 WeakPolarHBondContact O-CG1 3.21Å; I119-I123 PolarHBondContact O-N 3.13Å; I119-L150 HydrophobicContact CG2-CD1 4.15Å
120N93.1Very high89Confident5 Ų548.9 Ų48.93%0.02728%0.284CS..Hα-helixtrans-60.8-47.2178.5-174.969.4000112.4L116 A117 G122 I123 L124 Y147 L150 T151L116-N120 WeakPolarHBondContact O-CB 3.38Å; L116-N120 PolarHBondContact O-N 3.47Å; A117-N120 WeakPolarHBondContact O-CB 3.28Å; A117-N120 PolarHBondContact O-N 3.47Å; A117-N120 VanDerWaalsContact O-N 3.15Å; N120-G122 VanDerWaalsContact C-N 3.34Å; N120-I123 PolarHBondContact O-N 3.26Å; N120-L124 PolarHBondContact O-N 2.91Å; N120-Y147 WeakPolarHBondContact ND2-CE2 3.35Å; N120-Y147 VanDerWaalsContact OD1-CD2 3.28Å; N120-Y147 WeakPolarHBondContact OD1-CD2 3.27Å; N120-Y147 WeakPolarHBondContact OD1-CE2 3.49Å; N120-Y147 PolarHBondContact OD1-O 2.93Å; N120-Y147 VanDerWaalsContact OD1-O 3.1Å; N120-L150 HydrophobicContact CB-CB 4.08Å; N120-L150 VanDerWaalsContact OD1-CB 3.28Å; N120-L150 WeakPolarHBondContact OD1-CB 3.42Å; N120-T151 VanDerWaalsContact CG-OG1 3.31Å; N120-T151 PolarHBondContact ND2-OG1 3.03Å; N120-T151 PolarHBondContact OD1-N 3.48Å; N120-T151 PolarHBondContact OD1-OG1 3.38Å
121D90.6Very high89.2Confident44 Ų4449.6 Ų49.624%0.23529%0.291CS..Hα-helixtrans-71-31.9-179.8-70.2-2.7000111.4A117 I123 L124 V125A117-D121 PolarHBondContact O-N 3.39Å; D121-I123 VanDerWaalsContact C-N 3.34Å; D121-I123 PolarHBondContact O-N 3.44Å; D121-L124 WeakPolarHBondContact O-CB 3.5Å; D121-L124 PolarHBondContact O-N 3.26Å; D121-V125 WeakPolarHBondContact O-CG2 3.41Å; D121-V125 PolarHBondContact O-N 3.38Å
122G91.4Very high89.3Confident42 Ų4250.6 Ų50.643%0.43330%0.296SS..Hα-helixtrans-58.7-42.2168.100000112.9I118 I119 N120 F126I118-G122 PolarHBondContact O-N 2.98Å; I119-G122 PolarHBondContact O-N 3.01Å; N120-G122 VanDerWaalsContact C-N 3.34Å; G122-F126 VanDerWaalsContact O-CB 3.25Å; G122-F126 WeakPolarHBondContact O-CB 3.15Å; G122-F126 PolarHBondContact O-N 3.08Å
123I92.1Very high89.4Confident23 Ų2347.6 Ų47.612%0.11828%0.277CS..Hα-helixtrans-69.7-38.6175.7-64.9160.9000111.1I119 N120 D121 F126 L127 L146 L150I119-I123 HydrophobicContact CG2-CD1 4.08Å; I119-I123 WeakPolarHBondContact O-CG1 3.21Å; I119-I123 PolarHBondContact O-N 3.13Å; N120-I123 PolarHBondContact O-N 3.26Å; D121-I123 VanDerWaalsContact C-N 3.34Å; D121-I123 PolarHBondContact O-N 3.44Å; I123-F126 PolarHBondContact O-N 2.9Å; I123-L127 HydrophobicContact CG2-CD1 4.07Å; I123-L127 HydrophobicContact CG2-CG 4.4Å; I123-L127 WeakPolarHBondContact O-CB 3.28Å; I123-L127 WeakPolarHBondContact O-CG 3.46Å; I123-L127 PolarHBondContact O-N 3.46Å; I123-L146 HydrophobicContact CD1-CD2 3.92Å; I123-L146 HydrophobicContact CD1-CG 4.11Å; I123-L150 HydrophobicContact CD1-CD1 3.39Å
124L91.6Very high89.5Confident5 Ų547.3 Ų47.33%0.02628%0.276CS..Hα-helixtrans-58.2-52.4174.3-17956.8000111.3F34 N120 D121 F126 L127 L128 Y147 L250 T254F34-L124 HydrophobicContact CB-CD2 4.45Å; F34-L124 HydrophobicContact CD2-CD1 4.15Å; F34-L124 HydrophobicContact CD2-CD2 3.95Å; F34-L124 HydrophobicContact CD2-CG 4.34Å; F34-L124 HydrophobicContact CE2-CD1 4.23Å; N120-L124 PolarHBondContact O-N 2.91Å; D121-L124 WeakPolarHBondContact O-CB 3.5Å; D121-L124 PolarHBondContact O-N 3.26Å; L124-F126 PolarHBondContact O-N 3.36Å; L124-L127 PolarHBondContact O-N 3.02Å; L124-L128 HydrophobicContact CD1-CD1 3.68Å; L124-L128 HydrophobicContact CD1-CG 4.24Å; L124-L128 HydrophobicContact CG-CD1 3.82Å; L124-L128 WeakPolarHBondContact O-CB 3.41Å; L124-L128 VanDerWaalsContact O-CG 3.23Å; L124-L128 WeakPolarHBondContact O-CG 3.38Å; L124-L128 PolarHBondContact O-N 3.28Å; L124-Y147 HydrophobicContact CB-CD2 4.18Å; L124-Y147 HydrophobicContact CB-CE2 3.66Å; L124-Y147 HydrophobicContact CD1-CE1 4.22Å; L124-Y147 HydrophobicContact CD1-CE2 4.05Å; L124-Y147 HydrophobicContact CD2-CE2 4.28Å; L124-Y147 HydrophobicContact CG-CE2 4.2Å; L124-L250 HydrophobicContact CD1-CD1 3.94Å; L124-L250 HydrophobicContact CD1-CD2 4.22Å; L124-L250 HydrophobicContact CD1-CG 4.13Å; L124-T254 HydrophobicContact CD2-CG2 4.43Å
125V90.2Very high89.5Confident46 Ų4652.7 Ų52.728%0.27929%0.29SS..Hα-helixtrans-63.9-41.6178.2174.80000111Y33 D121 L127 L128 V129Y33-V125 HydrophobicContact CD1-CG2 4.36Å; Y33-V125 HydrophobicContact CE1-CG2 3.88Å; D121-V125 WeakPolarHBondContact O-CG2 3.41Å; D121-V125 PolarHBondContact O-N 3.38Å; V125-L127 PolarHBondContact O-N 2.95Å; V125-L128 PolarHBondContact O-N 2.89Å; V125-V129 HydrophobicContact CG1-CG2 4.21Å; V125-V129 WeakPolarHBondContact O-CB 3.41Å; V125-V129 WeakPolarHBondContact O-CG2 3.49Å; V125-V129 PolarHBondContact O-N 3.39Å
126F90.8Very high89.3Confident102 Ų10254.9 Ų54.945%0.44729%0.293SS..Hα-helixtrans-60.1-45.1175.7-179.6-111.3000112.2G122 I123 L124 S130 V133 L143G122-F126 VanDerWaalsContact O-CB 3.25Å; G122-F126 WeakPolarHBondContact O-CB 3.15Å; G122-F126 PolarHBondContact O-N 3.08Å; I123-F126 PolarHBondContact O-N 2.9Å; L124-F126 PolarHBondContact O-N 3.36Å; F126-S130 WeakPolarHBondContact O-CA 3.39Å; F126-S130 WeakPolarHBondContact O-CB 3.49Å; F126-S130 PolarHBondContact O-N 3.42Å; F126-V133 HydrophobicContact CE1-CB 4.46Å; F126-V133 HydrophobicContact CE1-CG1 4.09Å; F126-V133 HydrophobicContact CE1-CG2 4.24Å; F126-V133 HydrophobicContact CZ-CG2 3.94Å; F126-L143 HydrophobicContact CD1-CD1 4.38Å; F126-L143 HydrophobicContact CE1-CD1 3.96Å
127L89.8Confident89Confident0 Ų057.6 Ų57.60%031%0.314CS..Hα-helixtrans-64.7-40.1175.1-78172.8000112.2I123 L124 V125 R134 L143 L250I123-L127 HydrophobicContact CG2-CD1 4.07Å; I123-L127 HydrophobicContact CG2-CG 4.4Å; I123-L127 WeakPolarHBondContact O-CB 3.28Å; I123-L127 WeakPolarHBondContact O-CG 3.46Å; I123-L127 PolarHBondContact O-N 3.46Å; L124-L127 PolarHBondContact O-N 3.02Å; V125-L127 PolarHBondContact O-N 2.95Å; L127-R134 HydrophobicContact CD2-CG 4.32Å; L127-R134 WeakPolarHBondContact O-CD 3.4Å; L127-R134 WeakPolarHBondContact O-CG 3.34Å; L127-R134 PolarHBondContact O-NH1 3.48Å; L127-L143 HydrophobicContact CD1-CB 4.41Å; L127-L143 HydrophobicContact CD2-CB 3.9Å; L127-L143 HydrophobicContact CD2-CD1 4.3Å; L127-L143 HydrophobicContact CG-CB 4.43Å; L127-L250 HydrophobicContact CB-CD2 3.73Å; L127-L250 HydrophobicContact CD1-CD1 4.07Å; L127-L250 HydrophobicContact CD1-CD2 4.25Å
128L87.3Confident89.1Confident13 Ų1360.9 Ų60.97%0.06833%0.333CS..Hα-helixtrans-70.9-35.8-178.9-69.8168.7000112.7F34 L37 L124 V125 R134 L247 L250 L251F34-L128 HydrophobicContact CD2-CD1 3.85Å; F34-L128 HydrophobicContact CE2-CD1 4.05Å; L37-L128 HydrophobicContact CD2-CB 3.58Å; L37-L128 HydrophobicContact CD2-CD1 3.61Å; L37-L128 HydrophobicContact CD2-CG 4.2Å; L124-L128 HydrophobicContact CD1-CD1 3.68Å; L124-L128 HydrophobicContact CD1-CG 4.24Å; L124-L128 HydrophobicContact CG-CD1 3.82Å; L124-L128 WeakPolarHBondContact O-CB 3.41Å; L124-L128 VanDerWaalsContact O-CG 3.23Å; L124-L128 WeakPolarHBondContact O-CG 3.38Å; L124-L128 PolarHBondContact O-N 3.28Å; V125-L128 PolarHBondContact O-N 2.89Å; L128-R134 VanDerWaalsContact C-NH1 3.34Å; L128-R134 PolarHBondContact O-NH1 3.49Å; L128-L247 HydrophobicContact CD2-CD1 3.55Å; L128-L250 HydrophobicContact CD2-CD2 3.85Å; L128-L250 HydrophobicContact CG-CD2 4.04Å; L128-L251 HydrophobicContact CD2-CD2 3.83Å
129V87.4Confident89.1Confident103 Ų10358.5 Ų58.562%0.62432%0.324SS*.Hα-helixtrans-80.1-43.2175.31770000112.1V125 T131V125-V129 HydrophobicContact CG1-CG2 4.21Å; V125-V129 WeakPolarHBondContact O-CB 3.41Å; V125-V129 WeakPolarHBondContact O-CG2 3.49Å; V125-V129 PolarHBondContact O-N 3.39Å; V129-T131 PolarHBondContact O-N 3.05Å
130S87Confident89Confident27 Ų2754.2 Ų54.219%0.18930%0.303CS..  trans-86.374.2-168.3-162.40000113.9F126 T132 V133 R134F126-S130 WeakPolarHBondContact O-CA 3.39Å; F126-S130 WeakPolarHBondContact O-CB 3.49Å; F126-S130 PolarHBondContact O-N 3.42Å; S130-T132 PolarHBondContact O-N 2.85Å; S130-V133 PolarHBondContact O-N 2.74Å; S130-V133 VanDerWaalsContact OG-CG2 3.24Å; S130-V133 WeakPolarHBondContact OG-CG2 3.46Å; S130-R134 PolarHBondContact O-N 3.34Å
131T85.2Confident89Confident68 Ų6856.8 Ų56.842%0.41732%0.316SS..Hα-helixtrans-47.2-41170.250.60000113.3V129 V133 R134 R135V129-T131 PolarHBondContact O-N 3.05Å; T131-V133 VanDerWaalsContact C-N 3.29Å; T131-V133 PolarHBondContact O-N 3.4Å; T131-R134 PolarHBondContact O-N 3.07Å; T131-R135 WeakPolarHBondContact O-CG 3.5Å; T131-R135 PolarHBondContact O-N 2.69Å
132T87.1Confident89.2Confident88 Ų8859.1 Ų59.154%0.5433%0.331SS..Hα-helixtrans-63.5-33.1-179.9-59.20000112.4S130 K136S130-T132 PolarHBondContact O-N 2.85Å; T132-K136 WeakPolarHBondContact O-CG 3.31Å
133V86.3Confident89.3Confident26 Ų2658.6 Ų58.616%0.15832%0.318CS..Hα-helixtrans-82.1-44.2178172.20000110.7F126 S130 T131 R135 K136 V139 L143F126-V133 HydrophobicContact CE1-CB 4.46Å; F126-V133 HydrophobicContact CE1-CG1 4.09Å; F126-V133 HydrophobicContact CE1-CG2 4.24Å; F126-V133 HydrophobicContact CZ-CG2 3.94Å; S130-V133 PolarHBondContact O-N 2.74Å; S130-V133 VanDerWaalsContact OG-CG2 3.24Å; S130-V133 WeakPolarHBondContact OG-CG2 3.46Å; T131-V133 VanDerWaalsContact C-N 3.29Å; T131-V133 PolarHBondContact O-N 3.4Å; V133-R135 PolarHBondContact O-N 3.05Å; V133-K136 PolarHBondContact O-N 2.79Å; V133-V139 HydrophobicContact CG1-CG1 4.06Å; V133-L143 HydrophobicContact CG1-CD1 3.34Å
134R88.1Confident89.4Confident8 Ų857.5 Ų57.53%0.0331%0.313CS..Hα-helixtrans-55.1-27175.9-68.6-158.7-55.4-101.710.4114.4L127 L128 S130 T131 N140 D244L127-R134 HydrophobicContact CD2-CG 4.32Å; L127-R134 WeakPolarHBondContact O-CD 3.4Å; L127-R134 WeakPolarHBondContact O-CG 3.34Å; L127-R134 PolarHBondContact O-NH1 3.48Å; L128-R134 VanDerWaalsContact C-NH1 3.34Å; L128-R134 PolarHBondContact O-NH1 3.49Å; S130-R134 PolarHBondContact O-N 3.34Å; T131-R134 PolarHBondContact O-N 3.07Å; R134-N140 WeakPolarHBondContact O-CB 3.44Å; R134-N140 PolarHBondContact O-ND2 3.03Å; R134-D244 IonicContact NE-OD2 3.24Å; R134-D244 IonicContact NH2-OD2 3.95Å; R134-D244 PolarHBondContact NH2-OD2 3.04Å
135R85.2Confident89.6Confident166 Ų16658.9 Ų58.963%0.62632%0.32SS*.THydrogen-bonded Turntrans-92.7-9.1-178.9-68.6179.5-179.5-165.2-1.7114.4T131 V133 D244T131-R135 WeakPolarHBondContact O-CG 3.5Å; T131-R135 PolarHBondContact O-N 2.69Å; V133-R135 PolarHBondContact O-N 3.05Å; R135-D244 WeakPolarHBondContact CG-OD1 3.27Å; R135-D244 IonicContact CZ-OD1 3.02Å; R135-D244 VanDerWaalsContact CZ-OD1 3.24Å; R135-D244 IonicContact CZ-OD2 2.96Å; R135-D244 IonicContact NE-OD1 3.59Å; R135-D244 PolarHBondContact NE-OD1 2.84Å; R135-D244 IonicContact NE-OD2 3.39Å; R135-D244 PolarHBondContact NE-OD2 2.62Å; R135-D244 VanDerWaalsContact NH2-CG 3.29Å; R135-D244 IonicContact NH2-OD1 2.71Å; R135-D244 PolarHBondContact NH2-OD1 3.03Å; R135-D244 IonicContact NH2-OD2 3.41Å; R135-D244 PolarHBondContact NH2-OD2 3.03Å
136K87.4Confident89.9Confident128 Ų12860.4 Ų60.456%0.55733%0.326SS*.SBendtrans-95.8102.1179.5-76.7179.6179-172.60111.1T132 V133 V139 N140T132-K136 WeakPolarHBondContact O-CG 3.31Å; V133-K136 PolarHBondContact O-N 2.79Å; K136-V139 WeakPolarHBondContact O-CB 3.35Å; K136-V139 PolarHBondContact O-N 2.91Å; K136-N140 PolarHBondContact O-N 3.27Å; K136-N140 PolarHBondContact O-OD1 2.85Å
137C85.1Confident90.1Very high88 Ų8855.5 Ų55.560%0.59530%0.304SS*.THydrogen-bonded Turntrans-70.1140.6166.2-169.60000110N140C137-N140 WeakPolarHBondContact CA-OD1 3.26Å
138P90.9Very high90.4Very high84 Ų8455.5 Ų55.555%0.54530%0.304SS..THydrogen-bonded Turncis-88.4-1.2-436.7-36.1000114.2N140 I141 V142P138-N140 PolarHBondContact O-N 3.36Å; P138-N140 VanDerWaalsContact O-N 3.17Å; P138-I141 PolarHBondContact O-N 2.99Å; P138-V142 PolarHBondContact O-N 2.95Å
139V91.6Very high90.8Very high73 Ų7359.4 Ų59.444%0.44232%0.323SS..Hα-helixtrans-54.6-38-174.5-172.60000112.2V133 K136 V142 L143V133-V139 HydrophobicContact CG1-CG1 4.06Å; K136-V139 WeakPolarHBondContact O-CB 3.35Å; K136-V139 PolarHBondContact O-N 2.91Å; V139-V142 PolarHBondContact O-N 3.42Å; V139-L143 HydrophobicContact CG1-CD1 3.97Å; V139-L143 WeakPolarHBondContact O-CB 3.49Å; V139-L143 WeakPolarHBondContact O-CG 3.43Å; V139-L143 PolarHBondContact O-N 2.87Å
140N90.8Very high91.2Very high0 Ų055.6 Ų55.60%030%0.299CS..Hα-helixtrans-61.1-44.7175.366.6-18.3000113.3R134 K136 C137 P138 L144 Y245 C246R134-N140 WeakPolarHBondContact O-CB 3.44Å; R134-N140 PolarHBondContact O-ND2 3.03Å; K136-N140 PolarHBondContact O-N 3.27Å; K136-N140 PolarHBondContact O-OD1 2.85Å; C137-N140 WeakPolarHBondContact CA-OD1 3.26Å; P138-N140 PolarHBondContact O-N 3.36Å; P138-N140 VanDerWaalsContact O-N 3.17Å; N140-L144 VanDerWaalsContact O-CB 3.22Å; N140-L144 WeakPolarHBondContact O-CB 3.46Å; N140-L144 PolarHBondContact O-N 3.12Å; N140-Y245 PolarHBondContact ND2-OH 2.68Å; N140-Y245 VanDerWaalsContact ND2-OH 3.08Å; N140-C246 HydrophobicContact CB-CB 4.47Å
141I93.5Very high91.5Very high59 Ų5954.4 Ų54.430%0.30329%0.291SS..Hα-helixtrans-68.1-43.4176.9-63.2167.4000110L68 P138 L143 L144 M145L68-I141 HydrophobicContact CD2-CG1 4.4Å; L68-I141 HydrophobicContact CD2-CG2 4.49Å; P138-I141 PolarHBondContact O-N 2.99Å; I141-L143 PolarHBondContact O-N 3.46Å; I141-L144 PolarHBondContact O-N 3.08Å; I141-M145 HydrophobicContact CG2-CE 4.26Å; I141-M145 HydrophobicContact CG2-CG 4.22Å; I141-M145 VanDerWaalsContact O-CG 3.29Å; I141-M145 WeakPolarHBondContact O-CG 3.21Å; I141-M145 PolarHBondContact O-N 3.45Å
142V94.4Very high92Very high93 Ų9351.1 Ų51.156%0.56427%0.271SS*.Hα-helixtrans-59.9-46.4179.1174.70000111.3P138 V139 M145 L146P138-V142 PolarHBondContact O-N 2.95Å; V139-V142 PolarHBondContact O-N 3.42Å; V142-M145 PolarHBondContact O-N 2.94Å; V142-L146 WeakPolarHBondContact O-CB 3.28Å; V142-L146 PolarHBondContact O-N 3.46Å
143L93.8Very high92.2Very high30 Ų3049.5 Ų49.516%0.15726%0.259CS..Hα-helixtrans-69.6-35.1176.9-73.4168.3000113F126 L127 V133 V139 I141 L146 Y147F126-L143 HydrophobicContact CD1-CD1 4.38Å; F126-L143 HydrophobicContact CE1-CD1 3.96Å; L127-L143 HydrophobicContact CD1-CB 4.41Å; L127-L143 HydrophobicContact CD2-CB 3.9Å; L127-L143 HydrophobicContact CD2-CD1 4.3Å; L127-L143 HydrophobicContact CG-CB 4.43Å; V133-L143 HydrophobicContact CG1-CD1 3.34Å; V139-L143 HydrophobicContact CG1-CD1 3.97Å; V139-L143 WeakPolarHBondContact O-CB 3.49Å; V139-L143 WeakPolarHBondContact O-CG 3.43Å; V139-L143 PolarHBondContact O-N 2.87Å; I141-L143 PolarHBondContact O-N 3.46Å; L143-L146 HydrophobicContact CD2-CD2 4.46Å; L143-L146 PolarHBondContact O-N 3.33Å; L143-Y147 WeakPolarHBondContact O-CB 3.42Å; L143-Y147 PolarHBondContact O-N 3.34Å
144L94.4Very high92.4Very high0 Ų048.6 Ų48.60%025%0.253CS..Hα-helixtrans-65.3-41.6175.5-17566.9000111.5L68 N140 I141 T148 L250L68-L144 HydrophobicContact CB-CD2 4.39Å; L68-L144 HydrophobicContact CD1-CD2 4.12Å; L68-L144 HydrophobicContact CD2-CD2 4.38Å; N140-L144 VanDerWaalsContact O-CB 3.22Å; N140-L144 WeakPolarHBondContact O-CB 3.46Å; N140-L144 PolarHBondContact O-N 3.12Å; I141-L144 PolarHBondContact O-N 3.08Å; L144-T148 WeakPolarHBondContact O-CB 3.36Å; L144-T148 PolarHBondContact O-N 3.09Å; L144-T148 PolarHBondContact O-OG1 3.39Å; L144-L250 HydrophobicContact CD1-CB 3.88Å; L144-L250 HydrophobicContact CD1-CD1 3.89Å
145M96.3Very high92.5Very high35 Ų3548.4 Ų48.417%0.17225%0.253CS..Hα-helixtrans-69.3-40.1175.2-64.8-59.3167.900111.7L68 I71 L75 I141 V142 T148 M149L68-M145 HydrophobicContact CD2-CE 3.95Å; I71-M145 HydrophobicContact CB-CE 4.05Å; I71-M145 HydrophobicContact CD1-CE 4.38Å; I71-M145 HydrophobicContact CG2-CE 3.54Å; I71-M145 HydrophobicContact CG2-SD 3.87Å; L75-M145 HydrophobicContact CD2-SD 4.27Å; I141-M145 HydrophobicContact CG2-CE 4.26Å; I141-M145 HydrophobicContact CG2-CG 4.22Å; I141-M145 VanDerWaalsContact O-CG 3.29Å; I141-M145 WeakPolarHBondContact O-CG 3.21Å; I141-M145 PolarHBondContact O-N 3.45Å; V142-M145 PolarHBondContact O-N 2.94Å; M145-T148 PolarHBondContact O-N 3.17Å; M145-M149 WeakPolarHBondContact O-CG 3.45Å; M145-M149 PolarHBondContact O-N 3.34Å
146L95.1Very high92.7Very high77 Ų7740.6 Ų40.640%0.40322%0.224SC..Hα-helixtrans-60.6-47.6174-179.462.7000111.6I123 V142 L143 T148 M149 L150I123-L146 HydrophobicContact CD1-CD2 3.92Å; I123-L146 HydrophobicContact CD1-CG 4.11Å; V142-L146 WeakPolarHBondContact O-CB 3.28Å; V142-L146 PolarHBondContact O-N 3.46Å; L143-L146 HydrophobicContact CD2-CD2 4.46Å; L143-L146 PolarHBondContact O-N 3.33Å; L146-T148 VanDerWaalsContact C-N 3.32Å; L146-T148 PolarHBondContact O-N 2.85Å; L146-M149 PolarHBondContact O-N 3.36Å; L146-L150 HydrophobicContact CD1-CD1 3.94Å; L146-L150 HydrophobicContact CD1-CG 4.21Å; L146-L150 HydrophobicContact CG-CD1 3.9Å; L146-L150 WeakPolarHBondContact O-CB 3.31Å; L146-L150 VanDerWaalsContact O-CG 3.28Å; L146-L150 WeakPolarHBondContact O-CG 3.41Å; L146-L150 PolarHBondContact O-N 2.93Å
147Y95.8Very high92.7Very high0 Ų036 Ų360%021%0.205CC..Hα-helixtrans-58.5-43.3173.2173.2-109.5000111.8N120 L124 L143 T151 L250 Y253 T254N120-Y147 WeakPolarHBondContact ND2-CE2 3.35Å; N120-Y147 VanDerWaalsContact OD1-CD2 3.28Å; N120-Y147 WeakPolarHBondContact OD1-CD2 3.27Å; N120-Y147 WeakPolarHBondContact OD1-CE2 3.49Å; N120-Y147 PolarHBondContact OD1-O 2.93Å; N120-Y147 VanDerWaalsContact OD1-O 3.1Å; L124-Y147 HydrophobicContact CB-CD2 4.18Å; L124-Y147 HydrophobicContact CB-CE2 3.66Å; L124-Y147 HydrophobicContact CD1-CE1 4.22Å; L124-Y147 HydrophobicContact CD1-CE2 4.05Å; L124-Y147 HydrophobicContact CD2-CE2 4.28Å; L124-Y147 HydrophobicContact CG-CE2 4.2Å; L143-Y147 WeakPolarHBondContact O-CB 3.42Å; L143-Y147 PolarHBondContact O-N 3.34Å; Y147-T151 WeakPolarHBondContact CE2-OG1 3.47Å; Y147-T151 VanDerWaalsContact CZ-OG1 3.24Å; Y147-T151 WeakPolarHBondContact O-CB 3.5Å; Y147-T151 PolarHBondContact O-N 3.49Å; Y147-T151 PolarHBondContact O-OG1 3.27Å; Y147-L250 HydrophobicContact CD1-CD1 3.29Å; Y147-L250 HydrophobicContact CE1-CD1 3.36Å; Y147-L250 HydrophobicContact CG-CD1 4.11Å; Y147-Y253 HydrophobicContact CD1-CD1 4.2Å; Y147-Y253 HydrophobicContact CD1-CE1 4.24Å; Y147-Y253 AromaticContact CE1-CD1 3.77Å; Y147-Y253 HydrophobicContact CE1-CD1 3.77Å; Y147-Y253 AromaticContact CE1-CE1 3.93Å; Y147-Y253 HydrophobicContact CE1-CE1 3.93Å; Y147-T254 WeakPolarHBondContact CE1-OG1 3.47Å; Y147-T254 PolarHBondContact OH-OG1 2.85Å
148T96.6Very high92.7Very high0 Ų032.6 Ų32.60%018%0.182CC..Hα-helixtrans-58.2-57.1174-78.80000111Q72 L75 L144 M145 L146 L150 T151 S152 Y253Q72-T148 HydrophobicContact CB-CG2 4.08Å; Q72-T148 HydrophobicContact CG-CG2 4.31Å; Q72-T148 VanDerWaalsContact CG-OG1 3.27Å; Q72-T148 WeakPolarHBondContact CG-OG1 3.49Å; Q72-T148 PolarHBondContact NE2-OG1 3.2Å; L75-T148 HydrophobicContact CB-CG2 4.17Å; L75-T148 HydrophobicContact CD2-CG2 3.84Å; L75-T148 HydrophobicContact CG-CG2 4.07Å; L144-T148 WeakPolarHBondContact O-CB 3.36Å; L144-T148 PolarHBondContact O-N 3.09Å; L144-T148 PolarHBondContact O-OG1 3.39Å; M145-T148 PolarHBondContact O-N 3.17Å; L146-T148 VanDerWaalsContact C-N 3.32Å; L146-T148 PolarHBondContact O-N 2.85Å; T148-L150 VanDerWaalsContact C-N 3.31Å; T148-L150 PolarHBondContact O-N 3.49Å; T148-T151 CarbonylContact O-C 3.57Å; T148-T151 PolarHBondContact O-N 3.45Å; T148-T151 VanDerWaalsContact O-N 3.09Å; T148-S152 PolarHBondContact O-N 3.3Å; T148-S152 PolarHBondContact O-OG 3.26Å; T148-Y253 HydrophobicContact CG2-CE1 4.44Å; T148-Y253 HydrophobicContact CG2-CE2 4.06Å; T148-Y253 PolarHBondContact O-OH 3.14Å; T148-Y253 VanDerWaalsContact O-OH 3.12Å; T148-Y253 WeakPolarHBondContact OG1-CE1 3.4Å
149M95.6Very high92.5Very high95 Ų9528.7 Ų28.747%0.46816%0.156SC..Hα-helixtrans-57.2-42.3-176.8-67.1179.579.100112.7L75 I79 M145 L146 L153L75-M149 HydrophobicContact CD1-CG 4.35Å; L75-M149 HydrophobicContact CD2-CG 3.68Å; L75-M149 HydrophobicContact CD2-SD 4.47Å; L75-M149 HydrophobicContact CG-CG 4.14Å; I79-M149 HydrophobicContact CD1-CB 4.12Å; I79-M149 HydrophobicContact CD1-CG 4.06Å; M145-M149 WeakPolarHBondContact O-CG 3.45Å; M145-M149 PolarHBondContact O-N 3.34Å; L146-M149 PolarHBondContact O-N 3.36Å; M149-L153 WeakPolarHBondContact O-CB 3.49Å; M149-L153 PolarHBondContact O-N 3.33Å
150L94.9Very high92.1Very high23 Ų2326.4 Ų26.412%0.1214%0.143CC..Hα-helixtrans-66.8-44.7176.3-69170.8000111.5L116 I119 N120 I123 L146 T148 L153 T154L116-L150 HydrophobicContact CD1-CD2 3.52Å; L116-L150 HydrophobicContact CG-CD2 4.24Å; I119-L150 HydrophobicContact CG2-CD1 4.15Å; N120-L150 HydrophobicContact CB-CB 4.08Å; N120-L150 VanDerWaalsContact OD1-CB 3.28Å; N120-L150 WeakPolarHBondContact OD1-CB 3.42Å; I123-L150 HydrophobicContact CD1-CD1 3.39Å; L146-L150 HydrophobicContact CD1-CD1 3.94Å; L146-L150 HydrophobicContact CD1-CG 4.21Å; L146-L150 HydrophobicContact CG-CD1 3.9Å; L146-L150 WeakPolarHBondContact O-CB 3.31Å; L146-L150 VanDerWaalsContact O-CG 3.28Å; L146-L150 WeakPolarHBondContact O-CG 3.41Å; L146-L150 PolarHBondContact O-N 2.93Å; T148-L150 VanDerWaalsContact C-N 3.31Å; T148-L150 PolarHBondContact O-N 3.49Å; L150-L153 PolarHBondContact O-N 3.11Å; L150-T154 WeakPolarHBondContact O-CB 3.43Å; L150-T154 PolarHBondContact O-N 3.3Å; L150-T154 PolarHBondContact O-OG1 3.21Å
151T94.1Very high91.6Very high1 Ų130.9 Ų30.91%0.00617%0.174CC..Hα-helixtrans-61.1-46.4174.9-62.90000110.8N120 Y147 T148 L153 V155 Y253 M257N120-T151 VanDerWaalsContact CG-OG1 3.31Å; N120-T151 PolarHBondContact ND2-OG1 3.03Å; N120-T151 PolarHBondContact OD1-N 3.48Å; N120-T151 PolarHBondContact OD1-OG1 3.38Å; Y147-T151 WeakPolarHBondContact CE2-OG1 3.47Å; Y147-T151 VanDerWaalsContact CZ-OG1 3.24Å; Y147-T151 WeakPolarHBondContact O-CB 3.5Å; Y147-T151 PolarHBondContact O-N 3.49Å; Y147-T151 PolarHBondContact O-OG1 3.27Å; T148-T151 CarbonylContact O-C 3.57Å; T148-T151 PolarHBondContact O-N 3.45Å; T148-T151 VanDerWaalsContact O-N 3.09Å; T151-L153 VanDerWaalsContact C-N 3.34Å; T151-L153 PolarHBondContact O-N 3.38Å; T151-V155 HydrophobicContact CG2-CG2 4.02Å; T151-V155 WeakPolarHBondContact O-CB 3.36Å; T151-V155 WeakPolarHBondContact O-CG2 3.38Å; T151-V155 PolarHBondContact O-N 2.95Å; T151-Y253 HydrophobicContact CG2-CE1 3.91Å; T151-M257 HydrophobicContact CG2-CB 4.06Å; T151-M257 HydrophobicContact CG2-CE 4.33Å; T151-M257 HydrophobicContact CG2-CG 3.9Å
152S94.5Very high91.2Very high0 Ų028.9 Ų28.90%016%0.164CC..Hα-helixtrans-59.4-45.9177.5-40.70000111S76 T148 A156 Y253S76-S152 WeakPolarHBondContact CA-OG 3.48Å; S76-S152 PolarHBondContact OG-OG 2.86Å; T148-S152 PolarHBondContact O-N 3.3Å; T148-S152 PolarHBondContact O-OG 3.26Å; S152-A156 WeakPolarHBondContact O-CB 3.09Å; S152-A156 PolarHBondContact O-N 3.01Å; S152-Y253 PolarHBondContact OG-OH 2.91Å
153L92.3Very high90.9Very high54 Ų5431.8 Ų31.828%0.28317%0.165SC..Hα-helixtrans-66.1-55.6-178.4-178.758.6000111L83 L116 M149 L150 T151 V155 A156 L157L83-L153 HydrophobicContact CD1-CD1 3.77Å; L83-L153 HydrophobicContact CD2-CD1 3.77Å; L83-L153 HydrophobicContact CG-CD1 4.34Å; L116-L153 HydrophobicContact CD2-CB 4.18Å; L116-L153 HydrophobicContact CD2-CD2 3.69Å; L116-L153 HydrophobicContact CD2-CG 3.64Å; M149-L153 WeakPolarHBondContact O-CB 3.49Å; M149-L153 PolarHBondContact O-N 3.33Å; L150-L153 PolarHBondContact O-N 3.11Å; T151-L153 VanDerWaalsContact C-N 3.34Å; T151-L153 PolarHBondContact O-N 3.38Å; L153-V155 PolarHBondContact O-N 3.18Å; L153-A156 PolarHBondContact O-N 3.02Å; L153-L157 HydrophobicContact CD1-CD1 3.8Å; L153-L157 HydrophobicContact CD1-CD2 4.33Å; L153-L157 HydrophobicContact CD1-CG 3.94Å; L153-L157 HydrophobicContact CG-CD1 3.91Å; L153-L157 HydrophobicContact CG-CG 4.47Å; L153-L157 WeakPolarHBondContact O-CB 3.3Å; L153-L157 WeakPolarHBondContact O-CD1 3.19Å; L153-L157 WeakPolarHBondContact O-CG 3.29Å; L153-L157 PolarHBondContact O-N 3.24Å; L153-L157 VanDerWaalsContact O-N 3.09Å
154T90.3Very high90.7Very high6 Ų633.8 Ų33.84%0.03718%0.175CC..Hα-helixtrans-53.3-56175.1-64.60000110.4R27 L116 A117 L150 A156 L157R27-T154 PolarHBondContact NH1-O 3.28Å; R27-T154 PolarHBondContact NH2-O 3.14Å; L116-T154 WeakPolarHBondContact CD2-OG1 3.44Å; L116-T154 WeakPolarHBondContact CG-OG1 3.24Å; A117-T154 HydrophobicContact CB-CG2 3.82Å; L150-T154 WeakPolarHBondContact O-CB 3.43Å; L150-T154 PolarHBondContact O-N 3.3Å; L150-T154 PolarHBondContact O-OG1 3.21Å; T154-A156 VanDerWaalsContact C-N 3.34Å; T154-A156 PolarHBondContact O-N 3.38Å; T154-L157 PolarHBondContact O-N 3.01Å
155V90Very high90.5Very high4 Ų438.5 Ų38.52%0.02420%0.197CC..Hα-helixtrans-62.8-36.8-174.4169.90000112.2F31 T151 L153 F159 M257 W260 L261F31-V155 HydrophobicContact CZ-CG2 4.27Å; T151-V155 HydrophobicContact CG2-CG2 4.02Å; T151-V155 WeakPolarHBondContact O-CB 3.36Å; T151-V155 WeakPolarHBondContact O-CG2 3.38Å; T151-V155 PolarHBondContact O-N 2.95Å; L153-V155 PolarHBondContact O-N 3.18Å; V155-F159 WeakPolarHBondContact O-CD2 3.48Å; V155-F159 VanDerWaalsContact O-CE2 3.27Å; V155-F159 WeakPolarHBondContact O-CE2 3.22Å; V155-M257 HydrophobicContact CB-CE 3.97Å; V155-M257 HydrophobicContact CG1-CE 3.79Å; V155-M257 HydrophobicContact CG2-CE 4.39Å; V155-W260 HydrophobicContact CG1-CE3 3.51Å; V155-W260 HydrophobicContact CG1-CZ3 3.69Å; V155-L261 HydrophobicContact CG1-CB 4.1Å; V155-L261 HydrophobicContact CG1-CD1 4.25Å
156A90.4Very high90.1Very high3 Ų340.4 Ų40.43%0.02520%0.202CC..Hα-helixtrans-83.6-22.2-177.300000115.3T80 L83 S152 L153 T154 F159 T160T80-A156 HydrophobicContact CG2-CB 4.23Å; T80-A156 WeakPolarHBondContact OG1-CB 3.31Å; L83-A156 HydrophobicContact CD1-CB 3.92Å; S152-A156 WeakPolarHBondContact O-CB 3.09Å; S152-A156 PolarHBondContact O-N 3.01Å; L153-A156 PolarHBondContact O-N 3.02Å; T154-A156 VanDerWaalsContact C-N 3.34Å; T154-A156 PolarHBondContact O-N 3.38Å; A156-F159 PolarHBondContact O-N 3.14Å; A156-T160 PolarHBondContact O-N 3.25Å
157L87.6Confident89.9Confident30 Ų3036.9 Ų36.916%0.15718%0.183CC..SBendtrans-59.2-48.3-170.2-88.8166.8000115.2L83 E113 L116 L153 T154 F159 T160L83-L157 HydrophobicContact CD2-CD2 4.35Å; E113-L157 HydrophobicContact CG-CB 4.33Å; E113-L157 HydrophobicContact CG-CD1 3.9Å; E113-L157 WeakPolarHBondContact OE2-CB 3.08Å; L116-L157 HydrophobicContact CD2-CD1 4.33Å; L153-L157 HydrophobicContact CD1-CD1 3.8Å; L153-L157 HydrophobicContact CD1-CD2 4.33Å; L153-L157 HydrophobicContact CD1-CG 3.94Å; L153-L157 HydrophobicContact CG-CD1 3.91Å; L153-L157 HydrophobicContact CG-CG 4.47Å; L153-L157 WeakPolarHBondContact O-CB 3.3Å; L153-L157 WeakPolarHBondContact O-CD1 3.19Å; L153-L157 WeakPolarHBondContact O-CG 3.29Å; L153-L157 PolarHBondContact O-N 3.24Å; L153-L157 VanDerWaalsContact O-N 3.09Å; T154-L157 PolarHBondContact O-N 3.01Å; L157-F159 PolarHBondContact O-N 3.27Å; L157-T160 HydrophobicContact CD2-CG2 4.42Å; L157-T160 WeakPolarHBondContact O-CB 3.39Å; L157-T160 WeakPolarHBondContact O-CG2 3.34Å; L157-T160 PolarHBondContact O-N 3.22Å; L157-T160 VanDerWaalsContact O-N 3.09Å; L157-T160 PolarHBondContact O-OG1 2.98Å; L157-T160 VanDerWaalsContact O-OG1 3.05Å
158P84.8Confident89.8Confident17 Ų1741.3 Ų41.311%0.1121%0.206CC..G310 helixtrans-64.4-27.6179.1-22.634000113N20 T23 R27 E113 T160N20-P158 WeakPolarHBondContact OD1-CB 3.1Å; T23-P158 HydrophobicContact CG2-CG 4.15Å; R27-P158 VanDerWaalsContact NH1-CD 3.31Å; R27-P158 VanDerWaalsContact NH1-CG 3.33Å; E113-P158 WeakPolarHBondContact OE2-CD 3.37Å; E113-P158 WeakPolarHBondContact OE2-CG 3.19Å; P158-T160 VanDerWaalsContact C-N 3.29Å; P158-T160 PolarHBondContact O-N 3.48Å
159F86.1Confident89.6Confident2 Ų245.6 Ų45.61%0.00923%0.227CC..G310 helixtrans-85.85-179.8-51.4-72.8000112.8V155 A156 L157 S161 L162 K167 W260 L261 V264 Q265V155-F159 WeakPolarHBondContact O-CD2 3.48Å; V155-F159 VanDerWaalsContact O-CE2 3.27Å; V155-F159 WeakPolarHBondContact O-CE2 3.22Å; A156-F159 PolarHBondContact O-N 3.14Å; L157-F159 PolarHBondContact O-N 3.27Å; F159-S161 PolarHBondContact O-N 3.3Å; F159-L162 HydrophobicContact CB-CD1 4.14Å; F159-L162 HydrophobicContact CD1-CD1 4.03Å; F159-L162 WeakPolarHBondContact O-CB 3.37Å; F159-L162 PolarHBondContact O-N 3.4Å; F159-L162 VanDerWaalsContact O-N 3.1Å; F159-K167 WeakPolarHBondContact O-CE 2.46Å; F159-K167 PolarHBondContact O-NZ 2.94Å; F159-W260 HydrophobicContact CD2-CH2 4.42Å; F159-W260 HydrophobicContact CD2-CZ3 4.1Å; F159-L261 HydrophobicContact CE2-CD1 3.47Å; F159-L261 VanDerWaalsContact CE2-CD1 3.47Å; F159-L261 HydrophobicContact CZ-CD1 3.68Å; F159-V264 HydrophobicContact CB-CG2 4.19Å; F159-V264 HydrophobicContact CD1-CB 4.4Å; F159-V264 HydrophobicContact CD1-CG1 3.74Å; F159-V264 HydrophobicContact CD1-CG2 3.85Å; F159-V264 HydrophobicContact CD2-CG1 3.75Å; F159-V264 HydrophobicContact CE1-CG1 3.76Å; F159-V264 HydrophobicContact CE2-CG1 3.77Å; F159-V264 HydrophobicContact CG-CG1 3.75Å; F159-V264 HydrophobicContact CG-CG2 3.96Å; F159-V264 HydrophobicContact CZ-CG1 3.79Å; F159-Q265 HydrophobicContact CE1-CG 3.89Å; F159-Q265 HydrophobicContact CZ-CG 3.66Å
160T83.1Confident89.4Confident26 Ų2641.1 Ų41.116%0.1621%0.205CC..G310 helixtrans-54.2-42178.653.40000111.2L83 Q87 A156 L157 P158 L162 K167L83-T160 HydrophobicContact CB-CG2 4.06Å; Q87-T160 PolarHBondContact OE1-O 2.99Å; Q87-T160 PolarHBondContact OE1-OG1 3.33Å; A156-T160 PolarHBondContact O-N 3.25Å; L157-T160 HydrophobicContact CD2-CG2 4.42Å; L157-T160 WeakPolarHBondContact O-CB 3.39Å; L157-T160 WeakPolarHBondContact O-CG2 3.34Å; L157-T160 PolarHBondContact O-N 3.22Å; L157-T160 VanDerWaalsContact O-N 3.09Å; L157-T160 PolarHBondContact O-OG1 2.98Å; L157-T160 VanDerWaalsContact O-OG1 3.05Å; P158-T160 VanDerWaalsContact C-N 3.29Å; P158-T160 PolarHBondContact O-N 3.48Å; T160-L162 PolarHBondContact O-N 2.67Å; T160-L162 VanDerWaalsContact O-N 3.15Å; T160-K167 PolarHBondContact O-NZ 2.7Å
161S81.2Confident89.4Confident93 Ų9340.4 Ų40.465%0.6520%0.201SC*.G310 helixtrans-69.9-8.6-177.6-56.60000115.1Q87 F159Q87-S161 PolarHBondContact NE2-OG 3.01Å; Q87-S161 VanDerWaalsContact OE1-N 3.13Å; F159-S161 PolarHBondContact O-N 3.3Å
162L85Confident89.4Confident18 Ų1843.1 Ų43.19%0.09422%0.223CC..SBendtrans-71144.8170.5-71.5178.7000111.5F159 T160 K167 V264 Q268 I271F159-L162 HydrophobicContact CB-CD1 4.14Å; F159-L162 HydrophobicContact CD1-CD1 4.03Å; F159-L162 WeakPolarHBondContact O-CB 3.37Å; F159-L162 PolarHBondContact O-N 3.4Å; F159-L162 VanDerWaalsContact O-N 3.1Å; T160-L162 PolarHBondContact O-N 2.67Å; T160-L162 VanDerWaalsContact O-N 3.15Å; L162-K167 HydrophobicContact CB-CG 4.49Å; L162-K167 WeakPolarHBondContact O-CE 2.47Å; L162-K167 PolarHBondContact O-NZ 3.1Å; L162-V264 HydrophobicContact CD1-CG2 3.46Å; L162-V264 VanDerWaalsContact CD1-CG2 3.46Å; L162-Q268 HydrophobicContact CD1-CB 4.22Å; L162-Q268 HydrophobicContact CD2-CB 4.1Å; L162-Q268 HydrophobicContact CD2-CG 4.01Å; L162-I271 HydrophobicContact CD2-CD1 4.33Å
163R86.9Confident89.3Confident154 Ų15446.1 Ų46.158%0.58124%0.242SC*.  trans-58.7144.4170.3-68.5170.161.2166.6-0.7110.9E165 W166R163-E165 IonicContact CZ-OE1 3.25Å; R163-E165 VanDerWaalsContact CZ-OE1 3.25Å; R163-E165 IonicContact CZ-OE2 3.45Å; R163-E165 IonicContact NE-OE1 2.86Å; R163-E165 PolarHBondContact NE-OE1 3.16Å; R163-E165 IonicContact NE-OE2 3.67Å; R163-E165 IonicContact NH2-OE1 2.82Å; R163-E165 PolarHBondContact NH2-OE1 2.71Å; R163-E165 IonicContact NH2-OE2 2.74Å; R163-E165 PolarHBondContact NH2-OE2 3.41Å; R163-E165 PolarHBondContact O-N 3.41Å; R163-W166 PolarHBondContact O-N 2.88Å; R163-W166 VanDerWaalsContact O-N 3.14Å
164I89.6Confident89.3Confident72 Ų7243.6 Ų43.637%0.36923%0.228SC..Hα-helixtrans-57-35-177.5-167170000113L81 T84 W166 K167 I168L81-I164 HydrophobicContact CD2-CD1 4.07Å; L81-I164 HydrophobicContact CD2-CG1 3.86Å; T84-I164 HydrophobicContact CG2-CB 4.23Å; I164-W166 VanDerWaalsContact C-N 3.34Å; I164-W166 PolarHBondContact O-N 3.32Å; I164-K167 PolarHBondContact O-N 3.32Å; I164-K167 VanDerWaalsContact O-N 3.14Å; I164-I168 HydrophobicContact CG1-CD1 3.98Å; I164-I168 HydrophobicContact CG1-CG1 4.4Å; I164-I168 WeakPolarHBondContact O-CG1 2.48Å; I164-I168 PolarHBondContact O-N 3.08Å
165E89.7Confident89.4Confident98 Ų9845.7 Ų45.746%0.45824%0.239SC..Hα-helixtrans-53.1-48175.8-63.6142.1-101.100112.2R163 K167 I168 M169R163-E165 IonicContact CZ-OE1 3.25Å; R163-E165 VanDerWaalsContact CZ-OE1 3.25Å; R163-E165 IonicContact CZ-OE2 3.45Å; R163-E165 IonicContact NE-OE1 2.86Å; R163-E165 PolarHBondContact NE-OE1 3.16Å; R163-E165 IonicContact NE-OE2 3.67Å; R163-E165 IonicContact NH2-OE1 2.82Å; R163-E165 PolarHBondContact NH2-OE1 2.71Å; R163-E165 IonicContact NH2-OE2 2.74Å; R163-E165 PolarHBondContact NH2-OE2 3.41Å; R163-E165 PolarHBondContact O-N 3.41Å; E165-K167 VanDerWaalsContact C-N 3.32Å; E165-K167 PolarHBondContact O-N 3.31Å; E165-I168 PolarHBondContact O-N 2.85Å; E165-M169 WeakPolarHBondContact O-CB 2.47Å; E165-M169 PolarHBondContact O-N 3.31Å
166W89.6Confident89.5Confident76 Ų7651.9 Ų51.929%0.28827%0.271SS..Hα-helixtrans-70.1-28.6-178.8-58.6120.4000112.6R163 I164 M169 A170 L267 I271R163-W166 PolarHBondContact O-N 2.88Å; R163-W166 VanDerWaalsContact O-N 3.14Å; I164-W166 VanDerWaalsContact C-N 3.34Å; I164-W166 PolarHBondContact O-N 3.32Å; W166-M169 HydrophobicContact CE3-SD 3.86Å; W166-M169 HydrophobicContact CZ3-SD 3.82Å; W166-A170 WeakPolarHBondContact O-CB 2.46Å; W166-A170 PolarHBondContact O-N 3.46Å; W166-L267 HydrophobicContact CE3-CD2 4.38Å; W166-I271 HydrophobicContact CB-CD1 4.17Å; W166-I271 VanDerWaalsContact CD1-CD1 3.49Å; W166-I271 HydrophobicContact CD2-CD1 3.52Å; W166-I271 HydrophobicContact CD2-CG1 4.18Å; W166-I271 HydrophobicContact CE3-CD1 4.18Å; W166-I271 HydrophobicContact CG-CD1 3.49Å; W166-I271 VanDerWaalsContact CG-CD1 3.49Å; W166-I271 HydrophobicContact CZ2-CD1 4.3Å; W166-I271 HydrophobicContact CZ2-CG1 4.08Å
167K90.6Very high89.4Confident3 Ų352.6 Ų52.61%0.01328%0.276CS..Hα-helixtrans-73.5-40175-61.5175.8-167.7177.10111.8T80 T84 F159 T160 L162 I164 E165 A170 W171T80-K167 HydrophobicContact CG2-CB 4.46Å; T80-K167 HydrophobicContact CG2-CD 4.13Å; T84-K167 WeakPolarHBondContact OG1-CD 3.23Å; T84-K167 PolarHBondContact OG1-NZ 3.46Å; F159-K167 WeakPolarHBondContact O-CE 2.46Å; F159-K167 PolarHBondContact O-NZ 2.94Å; T160-K167 PolarHBondContact O-NZ 2.7Å; L162-K167 HydrophobicContact CB-CG 4.49Å; L162-K167 WeakPolarHBondContact O-CE 2.47Å; L162-K167 PolarHBondContact O-NZ 3.1Å; I164-K167 PolarHBondContact O-N 3.32Å; I164-K167 VanDerWaalsContact O-N 3.14Å; E165-K167 VanDerWaalsContact C-N 3.32Å; E165-K167 PolarHBondContact O-N 3.31Å; K167-A170 PolarHBondContact O-N 3.42Å; K167-W171 VanDerWaalsContact O-CD1 3.22Å; K167-W171 PolarHBondContact O-N 3.15Å
168I93Very high89.5Confident93 Ų9351.7 Ų51.748%0.47727%0.271SS..Hα-helixtrans-65.5-42.7173.8-66.4169.4000109.5L81 I164 E165 W171 A172L81-I168 HydrophobicContact CD2-CG1 4.22Å; I164-I168 HydrophobicContact CG1-CD1 3.98Å; I164-I168 HydrophobicContact CG1-CG1 4.4Å; I164-I168 WeakPolarHBondContact O-CG1 2.48Å; I164-I168 PolarHBondContact O-N 3.08Å; E165-I168 PolarHBondContact O-N 2.85Å; I168-W171 PolarHBondContact O-N 3.46Å; I168-A172 WeakPolarHBondContact O-CB 3.46Å; I168-A172 PolarHBondContact O-N 2.94Å
169M91.6Very high89.7Confident90 Ų9054.6 Ų54.644%0.44329%0.288SS..Hα-helixtrans-60.6-45.6173-174.1177.6-179.800112E165 W166 W171 A172 V173 L267E165-M169 WeakPolarHBondContact O-CB 2.47Å; E165-M169 PolarHBondContact O-N 3.31Å; W166-M169 HydrophobicContact CE3-SD 3.86Å; W166-M169 HydrophobicContact CZ3-SD 3.82Å; M169-W171 PolarHBondContact O-N 2.9Å; M169-A172 PolarHBondContact O-N 3.19Å; M169-V173 HydrophobicContact CG-CG2 4.48Å; M169-V173 WeakPolarHBondContact O-CG2 2.46Å; M169-V173 PolarHBondContact O-N 3.27Å; M169-L267 HydrophobicContact CE-CD2 4.43Å; M169-L267 HydrophobicContact SD-CD2 4.24Å
170A92.5Very high89.7Confident0 Ų056.6 Ų56.60%031%0.305CS..Hα-helixtrans-57-51.4175.500000111.3W166 K167 A172 V173 T174 I263 V264 L267W166-A170 WeakPolarHBondContact O-CB 2.46Å; W166-A170 PolarHBondContact O-N 3.46Å; K167-A170 PolarHBondContact O-N 3.42Å; A170-A172 VanDerWaalsContact C-N 3.35Å; A170-A172 PolarHBondContact O-N 3.35Å; A170-V173 PolarHBondContact O-N 3.38Å; A170-T174 PolarHBondContact O-N 3.05Å; A170-T174 PolarHBondContact O-OG1 3.11Å; A170-I263 HydrophobicContact CB-CG2 3.96Å; A170-V264 HydrophobicContact CB-CB 4.1Å; A170-V264 HydrophobicContact CB-CG2 4.37Å; A170-L267 HydrophobicContact CB-CD1 3.85Å
171W94.5Very high89.8Confident9 Ų958 Ų583%0.03431%0.309CS..Hα-helixtrans-58-42.5176.1-84.3118000113.2S76 I77 K167 I168 M169 T174 L175 M256 M257 W260S76-W171 VanDerWaalsContact CB-CH2 3.48Å; I77-W171 HydrophobicContact CD1-CD2 4.31Å; I77-W171 HydrophobicContact CD1-CE3 4.26Å; I77-W171 HydrophobicContact CG1-CD2 3.52Å; I77-W171 HydrophobicContact CG1-CE3 3.79Å; I77-W171 HydrophobicContact CG1-CG 3.97Å; I77-W171 HydrophobicContact CG1-CH2 4.25Å; I77-W171 HydrophobicContact CG1-CZ2 3.99Å; I77-W171 HydrophobicContact CG1-CZ3 4.15Å; K167-W171 VanDerWaalsContact O-CD1 3.22Å; K167-W171 PolarHBondContact O-N 3.15Å; I168-W171 PolarHBondContact O-N 3.46Å; M169-W171 PolarHBondContact O-N 2.9Å; W171-T174 PolarHBondContact O-N 3.4Å; W171-L175 WeakPolarHBondContact O-CB 3.48Å; W171-L175 VanDerWaalsContact O-CG 3.26Å; W171-L175 WeakPolarHBondContact O-CG 3.44Å; W171-L175 PolarHBondContact O-N 3.32Å; W171-M256 HydrophobicContact CH2-CE 4.4Å; W171-M256 HydrophobicContact CZ3-CE 4.08Å; W171-M257 HydrophobicContact CH2-CE 4.43Å; W171-M257 HydrophobicContact CH2-SD 3.81Å; W171-W260 AromaticContact CD1-NE1 3.41Å; W171-W260 AromaticContact CD2-CD1 3.46Å; W171-W260 VanDerWaalsContact CD2-CD1 3.46Å; W171-W260 HydrophobicContact CD2-CG 4.4Å; W171-W260 AromaticContact CD2-NE1 3.28Å; W171-W260 VanDerWaalsContact CD2-NE1 3.28Å; W171-W260 AromaticContact CE2-CD1 3.73Å; W171-W260 AromaticContact CE2-CE2 3.78Å; W171-W260 AromaticContact CE2-NE1 3.31Å; W171-W260 VanDerWaalsContact CE2-NE1 3.31Å; W171-W260 AromaticContact CE3-CD1 3.61Å; W171-W260 HydrophobicContact CE3-CG 4.42Å; W171-W260 AromaticContact CE3-NE1 3.95Å; W171-W260 AromaticContact CG-CD1 3.89Å; W171-W260 AromaticContact CG-NE1 3.35Å; W171-W260 VanDerWaalsContact CG-NE1 3.35Å; W171-W260 HydrophobicContact CH2-CG 4.33Å; W171-W260 HydrophobicContact CZ2-CD2 4.36Å; W171-W260 HydrophobicContact CZ2-CG 4.33Å; W171-W260 AromaticContact CZ2-NE1 3.98Å; W171-W260 AromaticContact CZ3-CD1 3.98Å; W171-W260 HydrophobicContact CZ3-CG 4.39Å; W171-W260 AromaticContact NE1-CE2 3.71Å; W171-W260 AromaticContact NE1-CZ2 3.88Å; W171-W260 AromaticContact NE1-NE1 3.39Å
172A93.6Very high89.8Confident58 Ų5854 Ų5448%0.47928%0.281SS..Hα-helixtrans-64.2-43.6178.300000112.2I168 M169 A170 L176I168-A172 WeakPolarHBondContact O-CB 3.46Å; I168-A172 PolarHBondContact O-N 2.94Å; M169-A172 PolarHBondContact O-N 3.19Å; A170-A172 VanDerWaalsContact C-N 3.35Å; A170-A172 PolarHBondContact O-N 3.35Å; A172-L176 WeakPolarHBondContact O-CB 3.45Å; A172-L176 PolarHBondContact O-N 2.99Å; A172-L176 VanDerWaalsContact O-N 3.14Å
173V92.1Very high89.8Confident63 Ų6358.2 Ų58.238%0.38230%0.303SS..Hα-helixtrans-66.5-44.5176.6178.20000110.7M169 A170 L176 S177 I263M169-V173 HydrophobicContact CG-CG2 4.48Å; M169-V173 WeakPolarHBondContact O-CG2 2.46Å; M169-V173 PolarHBondContact O-N 3.27Å; A170-V173 PolarHBondContact O-N 3.38Å; V173-L176 PolarHBondContact O-N 2.84Å; V173-S177 PolarHBondContact O-N 3.36Å; V173-S177 PolarHBondContact O-OG 2.95Å; V173-I263 HydrophobicContact CB-CD1 4.36Å; V173-I263 HydrophobicContact CB-CG2 4.3Å; V173-I263 HydrophobicContact CG1-CD1 3.8Å; V173-I263 HydrophobicContact CG1-CG1 4.44Å; V173-I263 HydrophobicContact CG1-CG2 4.39Å
174T92.5Very high89.6Confident0 Ų055.3 Ų55.30%030%0.298CS..Hα-helixtrans-63.1-42.5178-54.90000112.6A170 W171 L176 S177 F178 M256 D259 W260 I263A170-T174 PolarHBondContact O-N 3.05Å; A170-T174 PolarHBondContact O-OG1 3.11Å; W171-T174 PolarHBondContact O-N 3.4Å; T174-L176 VanDerWaalsContact C-N 3.31Å; T174-L176 PolarHBondContact O-N 3.36Å; T174-S177 WeakPolarHBondContact CA-OG 3.43Å; T174-S177 PolarHBondContact O-OG 2.92Å; T174-F178 WeakPolarHBondContact O-CB 3.21Å; T174-F178 PolarHBondContact O-N 3.45Å; T174-M256 HydrophobicContact CG2-CG 4.02Å; T174-M256 WeakPolarHBondContact CG2-O 3.37Å; T174-D259 HydrophobicContact CG2-CB 4.27Å; T174-W260 HydrophobicContact CG2-CB 4.01Å; T174-W260 VanDerWaalsContact OG1-CA 3.29Å; T174-W260 WeakPolarHBondContact OG1-CA 3.39Å; T174-I263 WeakPolarHBondContact OG1-CD1 3.4Å
175L93.3Very high89Confident51 Ų5151.9 Ų51.927%0.26728%0.281SS..Hα-helixtrans-66.4-37.2178.7-71.4170.6000111.1I73 I77 W171 V179 M256I73-L175 HydrophobicContact CD1-CD2 4.12Å; I73-L175 HydrophobicContact CG1-CD2 4.36Å; I73-L175 HydrophobicContact CG2-CD2 3.93Å; I77-L175 HydrophobicContact CD1-CD1 4.32Å; W171-L175 WeakPolarHBondContact O-CB 3.48Å; W171-L175 VanDerWaalsContact O-CG 3.26Å; W171-L175 WeakPolarHBondContact O-CG 3.44Å; W171-L175 PolarHBondContact O-N 3.32Å; L175-V179 WeakPolarHBondContact O-CB 2.97Å; L175-V179 VanDerWaalsContact O-CG2 3.23Å; L175-V179 WeakPolarHBondContact O-CG2 3.47Å; L175-V179 PolarHBondContact O-N 3.11Å; L175-M256 HydrophobicContact CD2-SD 4.4Å
176L92.1Very high88.6Confident133 Ų13348.7 Ų48.770%0.69627%0.271SS*.Hα-helixtrans-68.6-46.6176.1-176.161.7000112.3A172 V173 T174 A180A172-L176 WeakPolarHBondContact O-CB 3.45Å; A172-L176 PolarHBondContact O-N 2.99Å; A172-L176 VanDerWaalsContact O-N 3.14Å; V173-L176 PolarHBondContact O-N 2.84Å; T174-L176 VanDerWaalsContact C-N 3.31Å; T174-L176 PolarHBondContact O-N 3.36Å; L176-A180 VanDerWaalsContact O-CB 3.29Å; L176-A180 WeakPolarHBondContact O-CB 3.49Å; L176-A180 PolarHBondContact O-N 3.2Å; L176-A180 VanDerWaalsContact O-N 3.11Å
177S88Confident88.1Confident19 Ų1949.2 Ų49.213%0.13329%0.286CS..Hα-helixtrans-61.7-53.7175.561.70000110.3V173 T174 V179 A180 F181 D259V173-S177 PolarHBondContact O-N 3.36Å; V173-S177 PolarHBondContact O-OG 2.95Å; T174-S177 WeakPolarHBondContact CA-OG 3.43Å; T174-S177 PolarHBondContact O-OG 2.92Å; S177-V179 PolarHBondContact O-N 3.36Å; S177-A180 PolarHBondContact O-N 3.34Å; S177-A180 VanDerWaalsContact O-N 3.15Å; S177-F181 WeakPolarHBondContact O-CD2 3.39Å; S177-F181 PolarHBondContact O-N 2.94Å; S177-D259 PolarHBondContact OG-OD2 2.86Å
178F89Confident87.4Confident10 Ų1051.8 Ų51.84%0.04430%0.3CS..Hα-helixtrans-57.9-45.7-176.5177.4-101.4000112.6L69 T174 T182 M225 L252 M256L69-F178 HydrophobicContact CD2-CE1 3.91Å; L69-F178 HydrophobicContact CD2-CZ 3.99Å; T174-F178 WeakPolarHBondContact O-CB 3.21Å; T174-F178 PolarHBondContact O-N 3.45Å; F178-T182 WeakPolarHBondContact CE2-OG1 3.49Å; F178-T182 WeakPolarHBondContact O-CB 3.49Å; F178-T182 PolarHBondContact O-N 2.93Å; F178-T182 PolarHBondContact O-OG1 2.73Å; F178-M225 HydrophobicContact CB-CE 4.15Å; F178-M225 HydrophobicContact CD2-CE 4.33Å; F178-L252 HydrophobicContact CE2-CD2 4.19Å; F178-L252 WeakPolarHBondContact CE2-O 3.22Å; F178-L252 HydrophobicContact CZ-CB 4.03Å; F178-L252 HydrophobicContact CZ-CD2 3.74Å; F178-L252 HydrophobicContact CZ-CG 4.49Å; F178-M256 HydrophobicContact CB-CG 4.21Å; F178-M256 HydrophobicContact CD1-CB 4.5Å; F178-M256 HydrophobicContact CD1-CG 4.16Å; F178-M256 HydrophobicContact CD1-SD 4.35Å; F178-M256 HydrophobicContact CD2-CB 3.64Å; F178-M256 HydrophobicContact CD2-CG 3.97Å; F178-M256 HydrophobicContact CE2-CB 3.75Å; F178-M256 HydrophobicContact CE2-CG 4.41Å; F178-M256 HydrophobicContact CG-CB 4.04Å; F178-M256 HydrophobicContact CG-CG 3.83Å; F178-M256 HydrophobicContact CZ-CB 4.23Å
179V89.2Confident86.2Confident79 Ų7957.8 Ų57.848%0.47932%0.316SS..Hα-helixtrans-64.5-46.2176.4170.50000110.9L175 S177 L183L175-V179 WeakPolarHBondContact O-CB 2.97Å; L175-V179 VanDerWaalsContact O-CG2 3.23Å; L175-V179 WeakPolarHBondContact O-CG2 3.47Å; L175-V179 PolarHBondContact O-N 3.11Å; S177-V179 PolarHBondContact O-N 3.36Å; V179-L183 HydrophobicContact CG1-CD1 3.76Å; V179-L183 HydrophobicContact CG1-CG 4.46Å; V179-L183 WeakPolarHBondContact O-CB 3.48Å; V179-L183 VanDerWaalsContact O-CG 3.25Å; V179-L183 WeakPolarHBondContact O-CG 3.26Å; V179-L183 PolarHBondContact O-N 3.43Å
180A87.1Confident85.1Confident43 Ų4359.1 Ų59.136%0.35532%0.324SS..Hα-helixtrans-61-52.6-179.800000112.3L176 S177 L183 L184L176-A180 VanDerWaalsContact O-CB 3.29Å; L176-A180 WeakPolarHBondContact O-CB 3.49Å; L176-A180 PolarHBondContact O-N 3.2Å; L176-A180 VanDerWaalsContact O-N 3.11Å; S177-A180 PolarHBondContact O-N 3.34Å; S177-A180 VanDerWaalsContact O-N 3.15Å; A180-L183 PolarHBondContact O-N 2.67Å; A180-L184 WeakPolarHBondContact O-CB 3.14Å; A180-L184 VanDerWaalsContact O-CG 3.25Å; A180-L184 WeakPolarHBondContact O-CG 3.47Å; A180-L184 PolarHBondContact O-N 2.92Å
181F84.7Confident83.7Confident55 Ų5564 Ų6424%0.24134%0.342CS..Hα-helixtrans-73.3-30.2-177.4-69-73.5000113.1S177 L184 G185 L222 M225 L226S177-F181 WeakPolarHBondContact O-CD2 3.39Å; S177-F181 PolarHBondContact O-N 2.94Å; F181-L184 HydrophobicContact CD1-CD1 4.2Å; F181-L184 HydrophobicContact CE1-CD1 4.45Å; F181-G185 PolarHBondContact O-N 3.4Å; F181-L222 HydrophobicContact CD1-CD2 4.32Å; F181-L222 HydrophobicContact CD2-CD2 3.51Å; F181-L222 HydrophobicContact CE1-CD1 4.12Å; F181-L222 HydrophobicContact CE1-CD2 4.18Å; F181-L222 HydrophobicContact CE1-CG 4.48Å; F181-L222 HydrophobicContact CE2-CD1 4.27Å; F181-L222 HydrophobicContact CE2-CD2 3.36Å; F181-L222 HydrophobicContact CE2-CG 4.37Å; F181-L222 HydrophobicContact CG-CD2 4.03Å; F181-L222 HydrophobicContact CZ-CD1 3.79Å; F181-L222 HydrophobicContact CZ-CD2 3.73Å; F181-L222 HydrophobicContact CZ-CG 4.27Å; F181-M225 HydrophobicContact CB-CB 3.65Å; F181-M225 HydrophobicContact CB-CG 4.33Å; F181-M225 HydrophobicContact CB-SD 3.65Å; F181-M225 HydrophobicContact CD2-SD 4.04Å; F181-M225 HydrophobicContact CG-SD 4.19Å; F181-L226 HydrophobicContact CD1-CD2 4.19Å; F181-L226 HydrophobicContact CD1-CG 4.32Å; F181-L226 WeakPolarHBondContact O-CD2 3.4Å
182T81.9Confident82.2Confident10 Ų1064.5 Ų64.56%0.06135%0.346CS..Hα-helixtrans-66.4-42.3172.3-59.60000111.2F178 G185 A186 F233 L252F178-T182 WeakPolarHBondContact CE2-OG1 3.49Å; F178-T182 WeakPolarHBondContact O-CB 3.49Å; F178-T182 PolarHBondContact O-N 2.93Å; F178-T182 PolarHBondContact O-OG1 2.73Å; T182-G185 PolarHBondContact O-N 2.97Å; T182-A186 WeakPolarHBondContact O-CB 3.34Å; T182-A186 PolarHBondContact O-N 3.25Å; T182-F233 HydrophobicContact CG2-CD2 3.82Å; T182-F233 HydrophobicContact CG2-CE2 3.82Å; T182-L252 HydrophobicContact CG2-CD2 3.78Å
183L84.6Confident80.9Confident107 Ų10762.5 Ų62.556%0.5633%0.327SS*.Hα-helixtrans-68.9-39.2176.6-71.2172.8000112.5V179 A180 A186 S187V179-L183 HydrophobicContact CG1-CD1 3.76Å; V179-L183 HydrophobicContact CG1-CG 4.46Å; V179-L183 WeakPolarHBondContact O-CB 3.48Å; V179-L183 VanDerWaalsContact O-CG 3.25Å; V179-L183 WeakPolarHBondContact O-CG 3.26Å; V179-L183 PolarHBondContact O-N 3.43Å; A180-L183 PolarHBondContact O-N 2.67Å; L183-A186 PolarHBondContact O-N 3.43Å; L183-S187 WeakPolarHBondContact O-CB 3.25Å; L183-S187 PolarHBondContact O-N 3.47Å; L183-S187 PolarHBondContact O-OG 2.8Å
184L82.9Confident79.4Confident92 Ų9265 Ų6548%0.48233%0.33SS..Hα-helixtrans-62.1-45.4172.1-72.2168.3000111A180 F181 A186 S187 I188 L226A180-L184 WeakPolarHBondContact O-CB 3.14Å; A180-L184 VanDerWaalsContact O-CG 3.25Å; A180-L184 WeakPolarHBondContact O-CG 3.47Å; A180-L184 PolarHBondContact O-N 2.92Å; F181-L184 HydrophobicContact CD1-CD1 4.2Å; F181-L184 HydrophobicContact CE1-CD1 4.45Å; L184-A186 PolarHBondContact O-N 3.16Å; L184-S187 WeakPolarHBondContact O-CB 3.37Å; L184-S187 PolarHBondContact O-N 3.46Å; L184-I188 WeakPolarHBondContact O-CD1 3.32Å; L184-I188 VanDerWaalsContact O-CG1 3.29Å; L184-I188 WeakPolarHBondContact O-CG1 3.4Å; L184-I188 PolarHBondContact O-N 3.32Å; L184-I188 VanDerWaalsContact O-N 3.08Å; L184-L226 HydrophobicContact CB-CD2 3.75Å
185G77.2Confident77.8Confident0 Ų068.8 Ų68.80%035%0.353CS..Hα-helixtrans-59-45.2176.400000112.9F181 T182 S187 I188 L226F181-G185 PolarHBondContact O-N 3.4Å; T182-G185 PolarHBondContact O-N 2.97Å; G185-S187 PolarHBondContact O-N 3.13Å; G185-I188 PolarHBondContact O-N 3.02Å; G185-L226 VanDerWaalsContact CA-O 3.3Å; G185-L226 WeakPolarHBondContact CA-O 3.23Å
186A79.8Confident76.2Confident31 Ų3167 Ų6726%0.25634%0.344SS..Hα-helixtrans-63.5-28.4174.600000113.4T182 L183 L184 F233T182-A186 WeakPolarHBondContact O-CB 3.34Å; T182-A186 PolarHBondContact O-N 3.25Å; L183-A186 PolarHBondContact O-N 3.43Å; L184-A186 PolarHBondContact O-N 3.16Å; A186-F233 HydrophobicContact CB-CB 3.78Å
187S80.2Confident74.4Confident87 Ų8764 Ų6461%0.60833%0.329SS*.Hα-helixtrans-82.7-22.4-180-58.60000113.7L183 L184 G185 R189L183-S187 WeakPolarHBondContact O-CB 3.25Å; L183-S187 PolarHBondContact O-N 3.47Å; L183-S187 PolarHBondContact O-OG 2.8Å; L184-S187 WeakPolarHBondContact O-CB 3.37Å; L184-S187 PolarHBondContact O-N 3.46Å; G185-S187 PolarHBondContact O-N 3.13Å; S187-R189 PolarHBondContact O-N 3.36Å
188I76.7Confident72.8Confident57 Ų5772.6 Ų72.629%0.29236%0.358SS..  trans-75.2125.2-176.6-72.4160.5000110.9L184 G185 I190 L192 L226 Q230L184-I188 WeakPolarHBondContact O-CD1 3.32Å; L184-I188 VanDerWaalsContact O-CG1 3.29Å; L184-I188 WeakPolarHBondContact O-CG1 3.4Å; L184-I188 PolarHBondContact O-N 3.32Å; L184-I188 VanDerWaalsContact O-N 3.08Å; G185-I188 PolarHBondContact O-N 3.02Å; I188-I190 HydrophobicContact CG2-CB 4.38Å; I188-I190 WeakPolarHBondContact CG2-O 3.26Å; I188-L192 HydrophobicContact CB-CD1 4.45Å; I188-L192 HydrophobicContact CD1-CD1 4.07Å; I188-L192 HydrophobicContact CD1-CD2 4.48Å; I188-L192 HydrophobicContact CG2-CD1 4.19Å; I188-L192 HydrophobicContact CG2-CD2 4.01Å; I188-L192 HydrophobicContact CG2-CG 3.94Å; I188-L226 HydrophobicContact CD1-CD2 4.02Å; I188-Q230 PolarHBondContact O-NE2 3.28Å
189R67.5Low71.2Confident220 Ų22077.1 Ų77.183%0.8338%0.378SS*.  trans-89.5-8.5-176.2-60.4-177.7-178.9-179.10.8114.7S187S187-R189 PolarHBondContact O-N 3.36Å
190I66.8Low69.4Low118 Ų11875 Ų7561%0.60536%0.364SS*.SBendtrans-96.9137.5-179.7-59171.4000108.4I188 L192 Q230I188-I190 HydrophobicContact CG2-CB 4.38Å; I188-I190 WeakPolarHBondContact CG2-O 3.26Å; I190-L192 PolarHBondContact O-N 2.86Å; I190-Q230 PolarHBondContact O-NE2 3.22Å; I190-Q230 PolarHBondContact O-OE1 2.9Å
191R64Low68Low101 Ų10177.2 Ų77.238%0.38137%0.373SS..  trans-6699.8178.1-72.4-173.2170.4169.9-4111.3L193 Y194 D237 F238R191-L193 VanDerWaalsContact C-N 3.29Å; R191-L193 PolarHBondContact O-N 2.8Å; R191-Y194 HydrophobicContact CB-CD2 3.94Å; R191-Y194 PolarHBondContact O-N 3.05Å; R191-D237 PolarHBondContact NH2-O 2.94Å; R191-F238 HydrophobicContact CG-CD1 3.56Å; R191-F238 HydrophobicContact CG-CE1 3.48Å; R191-F238 VanDerWaalsContact CG-CE1 3.48Å; R191-F238 HydrophobicContact CG-CG 4.43Å; R191-F238 HydrophobicContact CG-CZ 4.28Å; R191-F238 VanDerWaalsContact NE-CD1 3.26Å; R191-F238 VanDerWaalsContact NE-CE1 3.3Å
192L63.7Low66.7Low21 Ų2178.5 Ų78.511%0.1138%0.381CS..Hα-helixtrans-63.7-32.5-175-72.8173.5000113.1I188 I190 Y194 T195 N196 L226 I227I188-L192 HydrophobicContact CB-CD1 4.45Å; I188-L192 HydrophobicContact CD1-CD1 4.07Å; I188-L192 HydrophobicContact CD1-CD2 4.48Å; I188-L192 HydrophobicContact CG2-CD1 4.19Å; I188-L192 HydrophobicContact CG2-CD2 4.01Å; I188-L192 HydrophobicContact CG2-CG 3.94Å; I190-L192 PolarHBondContact O-N 2.86Å; L192-Y194 VanDerWaalsContact C-N 3.31Å; L192-Y194 PolarHBondContact O-N 3.3Å; L192-T195 PolarHBondContact O-N 3.47Å; L192-N196 VanDerWaalsContact O-CB 3.31Å; L192-N196 WeakPolarHBondContact O-CB 3.44Å; L192-N196 VanDerWaalsContact O-CG 3.27Å; L192-N196 PolarHBondContact O-N 3.11Å; L192-N196 PolarHBondContact O-ND2 3.38Å; L192-L226 HydrophobicContact CD1-CB 3.64Å; L192-I227 HydrophobicContact CB-CG1 4.03Å
193L65.3Low65.4Low15 Ų1580 Ų808%0.07939%0.393CS..Hα-helixtrans-60.8-38.9-176.6-156.6111.4000112.7L39 E42 R191 L197 I227L39-L193 HydrophobicContact CD2-CD1 3.96Å; L39-L193 HydrophobicContact CD2-CD2 3.76Å; L39-L193 HydrophobicContact CD2-CG 3.95Å; E42-L193 WeakPolarHBondContact OE2-CD1 3.22Å; E42-L193 WeakPolarHBondContact OE2-CD2 3.46Å; R191-L193 VanDerWaalsContact C-N 3.29Å; R191-L193 PolarHBondContact O-N 2.8Å; L193-L197 WeakPolarHBondContact O-CB 3.44Å; L193-L197 PolarHBondContact O-N 3.12Å; L193-L197 VanDerWaalsContact O-N 3.15Å; L193-I227 HydrophobicContact CD1-CD1 4.43Å; L193-I227 HydrophobicContact CD1-CG2 3.78Å
194Y61.7Low63.9Low116 Ų11679.8 Ų79.846%0.45540%0.396SS..Hα-helixtrans-74.6-36.5177.4-70.8-82.2000112.6R191 L192 L197R191-Y194 HydrophobicContact CB-CD2 3.94Å; R191-Y194 PolarHBondContact O-N 3.05Å; L192-Y194 VanDerWaalsContact C-N 3.31Å; L192-Y194 PolarHBondContact O-N 3.3Å; Y194-L197 HydrophobicContact CD1-CD1 4.41Å
195T58.9Low62.5Low79 Ų7980.2 Ų80.249%0.48540%0.402SS..Hα-helixtrans-68.2-41.5176.3-53.30000111.6L192L192-T195 PolarHBondContact O-N 3.47Å
196N59.3Low61.1Low15 Ų1583.7 Ų83.78%0.0842%0.419CS..Hα-helixtrans-86.3-5.7-175.3-61.7-25.3000113.5L192 W198 F199 L200 T223 I227L192-N196 VanDerWaalsContact O-CB 3.31Å; L192-N196 WeakPolarHBondContact O-CB 3.44Å; L192-N196 VanDerWaalsContact O-CG 3.27Å; L192-N196 PolarHBondContact O-N 3.11Å; L192-N196 PolarHBondContact O-ND2 3.38Å; N196-W198 PolarHBondContact O-N 3.4Å; N196-F199 PolarHBondContact O-N 3.45Å; N196-L200 PolarHBondContact O-N 3.1Å; N196-T223 HydrophobicContact CB-CG2 3.9Å; N196-T223 WeakPolarHBondContact ND2-CG2 3.14Å; N196-I227 HydrophobicContact CB-CD1 4.47Å
197L54.6Low59.5Low70 Ų7090.4 Ų90.437%0.36645%0.449SS..Hα-helixtrans-57.4-34.2-178.4-135.9159000112.5L193 Y194 F199 L200 V201L193-L197 WeakPolarHBondContact O-CB 3.44Å; L193-L197 PolarHBondContact O-N 3.12Å; L193-L197 VanDerWaalsContact O-N 3.15Å; Y194-L197 HydrophobicContact CD1-CD1 4.41Å; L197-F199 VanDerWaalsContact C-N 3.31Å; L197-F199 PolarHBondContact O-N 2.67Å; L197-L200 PolarHBondContact O-N 3.17Å; L197-V201 PolarHBondContact O-N 2.88Å
198W55Low57.9Low199 Ų19993.2 Ų93.275%0.75446%0.456SS*.Hα-helixtrans-59-37.2174-63.9103.3000113.4N196 V201 I202N196-W198 PolarHBondContact O-N 3.4Å; W198-V201 PolarHBondContact O-N 2.82Å; W198-I202 WeakPolarHBondContact O-CG1 3.49Å; W198-I202 PolarHBondContact O-N 3.37Å
199F53.4Low56.8Low105 Ų10593.1 Ų93.146%0.46146%0.463SS..Hα-helixtrans-76.5-25.9179.7-73.3-77.6000113.2N196 L197 V201 I202 S203 Y219N196-F199 PolarHBondContact O-N 3.45Å; L197-F199 VanDerWaalsContact C-N 3.31Å; L197-F199 PolarHBondContact O-N 2.67Å; F199-V201 VanDerWaalsContact C-N 3.32Å; F199-I202 HydrophobicContact CD1-CD1 4.02Å; F199-I202 HydrophobicContact CE1-CD1 4.29Å; F199-I202 PolarHBondContact O-N 3.14Å; F199-S203 WeakPolarHBondContact O-CB 3Å; F199-S203 PolarHBondContact O-N 3.36Å; F199-Y219 HydrophobicContact CD1-CE1 4.37Å; F199-Y219 HydrophobicContact CD2-CE1 4.16Å; F199-Y219 HydrophobicContact CE2-CE1 4.42Å; F199-Y219 HydrophobicContact CG-CE1 4.14Å
200L52.6Low56.3Low33 Ų3389.8 Ų89.817%0.17346%0.46CS..Hα-helixtrans-64.9-38171.6-99.1153.6000111.6L39 N196 L197 S203 F220L39-L200 HydrophobicContact CD1-CD1 3.76Å; L39-L200 HydrophobicContact CD1-CD2 4.27Å; L39-L200 HydrophobicContact CD2-CD1 3.77Å; L39-L200 HydrophobicContact CG-CD1 4.24Å; N196-L200 PolarHBondContact O-N 3.1Å; L197-L200 PolarHBondContact O-N 3.17Å; L200-S203 PolarHBondContact O-N 3.17Å; L200-S203 PolarHBondContact O-OG 2.74Å; L200-F220 HydrophobicContact CD2-CE2 4.2Å
201V56.7Low55.6Low91 Ų9190.4 Ų90.455%0.55246%0.464SS*.Hα-helixtrans-62.1-48.9171.8-177.60000110.5L197 W198 F199 S203 T204L197-V201 PolarHBondContact O-N 2.88Å; W198-V201 PolarHBondContact O-N 2.82Å; F199-V201 VanDerWaalsContact C-N 3.32Å; V201-S203 VanDerWaalsContact C-N 3.29Å; V201-S203 PolarHBondContact O-N 3.1Å; V201-T204 PolarHBondContact O-N 3.39Å; V201-T204 VanDerWaalsContact O-N 3.1Å; V201-T204 PolarHBondContact O-OG1 3.06Å
202I57.2Low55.2Low81 Ų8188.7 Ų88.742%0.41546%0.464SS..Hα-helixtrans-59-39.2178.3-63.7166.8000111.8W198 F199 T204 T205W198-I202 WeakPolarHBondContact O-CG1 3.49Å; W198-I202 PolarHBondContact O-N 3.37Å; F199-I202 HydrophobicContact CD1-CD1 4.02Å; F199-I202 HydrophobicContact CE1-CD1 4.29Å; F199-I202 PolarHBondContact O-N 3.14Å; I202-T204 PolarHBondContact O-N 3.35Å; I202-T204 VanDerWaalsContact O-N 3.08Å; I202-T205 PolarHBondContact O-N 3.4Å; I202-T205 PolarHBondContact O-OG1 3.08Å
203S54.6Low55.1Low43 Ų4389.9 Ų89.930%0.30148%0.477SS..Hα-helixtrans-61.6-19.1179.274.30000114.1F199 L200 V201 T205F199-S203 WeakPolarHBondContact O-CB 3Å; F199-S203 PolarHBondContact O-N 3.36Å; L200-S203 PolarHBondContact O-N 3.17Å; L200-S203 PolarHBondContact O-OG 2.74Å; V201-S203 VanDerWaalsContact C-N 3.29Å; V201-S203 PolarHBondContact O-N 3.1Å; S203-T205 VanDerWaalsContact C-N 3.33Å
204T54.2Low54.9Low102 Ų10293 Ų9363%0.62650%0.497SS*.THydrogen-bonded Turntrans-82.7-7.417566.10000113.8V201 I202V201-T204 PolarHBondContact O-N 3.39Å; V201-T204 VanDerWaalsContact O-N 3.1Å; V201-T204 PolarHBondContact O-OG1 3.06Å; I202-T204 PolarHBondContact O-N 3.35Å; I202-T204 VanDerWaalsContact O-N 3.08Å
205T54.1Low55Low101 Ų10194.9 Ų94.962%0.6251%0.507SS*.THydrogen-bonded Turntrans-110.16.6-176.161.90000114.2I202 S203 L207I202-T205 PolarHBondContact O-N 3.4Å; I202-T205 PolarHBondContact O-OG1 3.08Å; S203-T205 VanDerWaalsContact C-N 3.33Å; T205-L207 PolarHBondContact O-N 2.87Å
206E47.3Very low55.4Low73 Ų7393.1 Ų93.134%0.34150%0.497SS..  trans-79.181.4-173-59.3-144.2141.800113.4V216E206-V216 WeakPolarHBondContact OE1-CG2 3.17Å
207L45.1Very low56Low171 Ų17194.3 Ų94.390%0.89551%0.506SS*.  trans-113.714.5164.2-120.7176.6000112.6T205T205-L207 PolarHBondContact O-N 2.87Å
208I47.8Very low56.9Low147 Ų14793.9 Ų93.975%0.75450%0.502SS*.SBendtrans-125.4124.7-175.4-59.4-179.4000110.6
209A52.7Low57.8Low54 Ų5489.5 Ų89.545%0.44649%0.486SS..  trans62.2106.9172.500000117.1I211 V212 A213A209-I211 PolarHBondContact O-N 2.94Å; A209-V212 HydrophobicContact CB-CB 4.32Å; A209-V212 HydrophobicContact CB-CG2 3.87Å; A209-V212 WeakPolarHBondContact O-CB 3.25Å; A209-V212 PolarHBondContact O-N 2.85Å; A209-A213 PolarHBondContact O-N 3.14Å
210I57.4Low59Low150 Ų15087 Ų8777%0.76948%0.475SS*.Hα-helixtrans-50-33.5170.7-64.2163000112.5A213 V214I210-A213 PolarHBondContact O-N 3.31Å; I210-V214 PolarHBondContact O-N 3.47Å
211I51.8Low60.2Low131 Ų13186.1 Ų86.167%0.67247%0.47SS*.Hα-helixtrans-65.7-40.8176.7-62.7170.1000111.5A209 F215A209-I211 PolarHBondContact O-N 2.94Å; I211-F215 HydrophobicContact CG2-CD2 4.42Å; I211-F215 HydrophobicContact CG2-CE2 4.35Å; I211-F215 WeakPolarHBondContact O-CD2 3.45Å
212V56.6Low61.5Low66 Ų6683.5 Ų83.540%0.445%0.452SS..Hα-helixtrans-66.4-45.6176.9177.20000109.8A209 V214 F215 V216A209-V212 HydrophobicContact CB-CB 4.32Å; A209-V212 HydrophobicContact CB-CG2 3.87Å; A209-V212 WeakPolarHBondContact O-CB 3.25Å; A209-V212 PolarHBondContact O-N 2.85Å; V212-V214 VanDerWaalsContact C-N 3.26Å; V212-V214 PolarHBondContact O-N 2.95Å; V212-F215 PolarHBondContact O-N 3.22Å; V212-V216 HydrophobicContact CG1-CG2 3.79Å; V212-V216 WeakPolarHBondContact O-CG2 3.29Å; V212-V216 PolarHBondContact O-N 3.41Å
213A60.7Low62.7Low45 Ų4580.2 Ų80.237%0.37244%0.436SS..Hα-helixtrans-55.7-35.6179.800000113.6A209 I210 S217A209-A213 PolarHBondContact O-N 3.14Å; I210-A213 PolarHBondContact O-N 3.31Å; A213-S217 WeakPolarHBondContact O-CB 3.33Å; A213-S217 PolarHBondContact O-N 3.05Å
214V62.2Low64Low81 Ų8179 Ų7949%0.49143%0.426SS..Hα-helixtrans-66.7-47.5174.9174.20000111.6I210 V212 Q218I210-V214 PolarHBondContact O-N 3.47Å; V212-V214 VanDerWaalsContact C-N 3.26Å; V212-V214 PolarHBondContact O-N 2.95Å; V214-Q218 PolarHBondContact O-N 3.47Å; V214-Q218 VanDerWaalsContact O-N 3.13Å
215F63.4Low65.4Low155 Ų15574.2 Ų74.268%0.6840%0.397SS*.Hα-helixtrans-66.7-40.7178.4-79.8-72.6000112.2I211 V212 Q218 Y219I211-F215 HydrophobicContact CG2-CD2 4.42Å; I211-F215 HydrophobicContact CG2-CE2 4.35Å; I211-F215 WeakPolarHBondContact O-CD2 3.45Å; V212-F215 PolarHBondContact O-N 3.22Å; F215-Q218 PolarHBondContact O-N 3.08Å; F215-Y219 WeakPolarHBondContact O-CB 3.22Å; F215-Y219 PolarHBondContact O-N 3.08Å
216V66.4Low66.9Low43 Ų4371 Ų7126%0.26138%0.375SS..Hα-helixtrans-72.6-39.2-179.9175.40000111.2E206 V212 Q218 Y219 F220E206-V216 WeakPolarHBondContact OE1-CG2 3.17Å; V212-V216 HydrophobicContact CG1-CG2 3.79Å; V212-V216 WeakPolarHBondContact O-CG2 3.29Å; V212-V216 PolarHBondContact O-N 3.41Å; V216-Q218 VanDerWaalsContact C-N 3.3Å; V216-Q218 PolarHBondContact O-N 3.43Å; V216-Y219 PolarHBondContact O-N 3.36Å; V216-F220 WeakPolarHBondContact O-CB 3.3Å; V216-F220 PolarHBondContact O-N 2.77Å
217S71.7Confident68.6Low40 Ų4068.1 Ų68.128%0.2836%0.362SS..Hα-helixtrans-54.8-44.2168.8167.90000112.1A213 R221A213-S217 WeakPolarHBondContact O-CB 3.33Å; A213-S217 PolarHBondContact O-N 3.05Å; S217-R221 PolarHBondContact O-N 3.39Å; S217-R221 VanDerWaalsContact O-N 3.13Å; S217-R221 PolarHBondContact O-NE 2.95Å; S217-R221 VanDerWaalsContact O-NE 3.16Å; S217-R221 PolarHBondContact OG-NE 3.5Å; S217-R221 PolarHBondContact OG-NH2 3.39Å
218Q73.2Confident70.5Confident61 Ų6160.1 Ų60.129%0.28532%0.32SS..Hα-helixtrans-67.2-49.5177.2-169.861.758.300111.6V214 F215 V216 F220 R221 L222V214-Q218 PolarHBondContact O-N 3.47Å; V214-Q218 VanDerWaalsContact O-N 3.13Å; F215-Q218 PolarHBondContact O-N 3.08Å; V216-Q218 VanDerWaalsContact C-N 3.3Å; V216-Q218 PolarHBondContact O-N 3.43Å; Q218-F220 VanDerWaalsContact C-N 3.32Å; Q218-F220 PolarHBondContact O-N 2.79Å; Q218-R221 VanDerWaalsContact CA-NH2 3.28Å; Q218-R221 PolarHBondContact O-N 3.27Å; Q218-R221 VanDerWaalsContact OE1-CZ 3.26Å; Q218-L222 WeakPolarHBondContact O-CG 3.45Å; Q218-L222 PolarHBondContact O-N 2.97Å; Q218-L222 VanDerWaalsContact O-N 3.11Å
219Y74.9Confident72.1Confident106 Ų10653.1 Ų53.142%0.41629%0.285SS..Hα-helixtrans-61-39.3179-178.5-101.5000112.7F199 F215 V216 L222 T223F199-Y219 HydrophobicContact CD1-CE1 4.37Å; F199-Y219 HydrophobicContact CD2-CE1 4.16Å; F199-Y219 HydrophobicContact CE2-CE1 4.42Å; F199-Y219 HydrophobicContact CG-CE1 4.14Å; F215-Y219 WeakPolarHBondContact O-CB 3.22Å; F215-Y219 PolarHBondContact O-N 3.08Å; V216-Y219 PolarHBondContact O-N 3.36Å; Y219-L222 PolarHBondContact O-N 2.88Å; Y219-T223 WeakPolarHBondContact O-CB 3.48Å; Y219-T223 PolarHBondContact O-N 3.28Å; Y219-T223 PolarHBondContact O-OG1 2.91Å
220F78.4Confident73.5Confident54 Ų5451 Ų5124%0.23727%0.266CS..Hα-helixtrans-65.3-44.8177.9-179.1-105.1000112.2L200 V216 Q218 T223 L224L200-F220 HydrophobicContact CD2-CE2 4.2Å; V216-F220 WeakPolarHBondContact O-CB 3.3Å; V216-F220 PolarHBondContact O-N 2.77Å; Q218-F220 VanDerWaalsContact C-N 3.32Å; Q218-F220 PolarHBondContact O-N 2.79Å; F220-T223 WeakPolarHBondContact O-CB 3.27Å; F220-T223 PolarHBondContact O-N 3.4Å; F220-L224 HydrophobicContact CD1-CD1 3.94Å; F220-L224 HydrophobicContact CE1-CD1 3.51Å; F220-L224 HydrophobicContact CE1-CG 4.31Å; F220-L224 HydrophobicContact CZ-CD1 3.92Å; F220-L224 HydrophobicContact CZ-CG 4.37Å; F220-L224 WeakPolarHBondContact O-CG 3.29Å; F220-L224 PolarHBondContact O-N 3.46Å
221R78.8Confident74.5Confident13 Ų1344 Ų445%0.04923%0.23CC..Hα-helixtrans-60.6-46174.3-80177.9-74.5122.5-3112.3S217 Q218 T223 L224 M225 D259 T262S217-R221 PolarHBondContact O-N 3.39Å; S217-R221 VanDerWaalsContact O-N 3.13Å; S217-R221 PolarHBondContact O-NE 2.95Å; S217-R221 VanDerWaalsContact O-NE 3.16Å; S217-R221 PolarHBondContact OG-NE 3.5Å; S217-R221 PolarHBondContact OG-NH2 3.39Å; Q218-R221 VanDerWaalsContact CA-NH2 3.28Å; Q218-R221 PolarHBondContact O-N 3.27Å; Q218-R221 VanDerWaalsContact OE1-CZ 3.26Å; R221-T223 VanDerWaalsContact C-N 3.32Å; R221-T223 PolarHBondContact O-N 2.9Å; R221-L224 PolarHBondContact O-N 3.21Å; R221-M225 PolarHBondContact O-N 2.87Å; R221-D259 IonicContact CZ-OD1 3.78Å; R221-D259 IonicContact NH1-OD1 2.73Å; R221-D259 PolarHBondContact NH1-OD1 3.36Å; R221-T262 VanDerWaalsContact CZ-CB 3.48Å; R221-T262 VanDerWaalsContact NH2-CG2 3.27Å
222L83Confident76Confident36 Ų3637.8 Ų37.819%0.18820%0.198CC..Hα-helixtrans-63.3-40.3176.4-61.9-173.8000111.7F181 Q218 Y219 M225 L226F181-L222 HydrophobicContact CD1-CD2 4.32Å; F181-L222 HydrophobicContact CD2-CD2 3.51Å; F181-L222 HydrophobicContact CE1-CD1 4.12Å; F181-L222 HydrophobicContact CE1-CD2 4.18Å; F181-L222 HydrophobicContact CE1-CG 4.48Å; F181-L222 HydrophobicContact CE2-CD1 4.27Å; F181-L222 HydrophobicContact CE2-CD2 3.36Å; F181-L222 HydrophobicContact CE2-CG 4.37Å; F181-L222 HydrophobicContact CG-CD2 4.03Å; F181-L222 HydrophobicContact CZ-CD1 3.79Å; F181-L222 HydrophobicContact CZ-CD2 3.73Å; F181-L222 HydrophobicContact CZ-CG 4.27Å; Q218-L222 WeakPolarHBondContact O-CG 3.45Å; Q218-L222 PolarHBondContact O-N 2.97Å; Q218-L222 VanDerWaalsContact O-N 3.11Å; Y219-L222 PolarHBondContact O-N 2.88Å; L222-M225 HydrophobicContact CD2-SD 4.44Å; L222-M225 PolarHBondContact O-N 2.96Å; L222-L226 VanDerWaalsContact O-CG 3.3Å; L222-L226 WeakPolarHBondContact O-CG 3.39Å; L222-L226 PolarHBondContact O-N 2.66Å
223T82.2Confident77.2Confident13 Ų1337.2 Ų37.28%0.0819%0.19CC..Hα-helixtrans-60.6-43.9174.3-68.40000111.9N196 Y219 F220 R221 L226 I227N196-T223 HydrophobicContact CB-CG2 3.9Å; N196-T223 WeakPolarHBondContact ND2-CG2 3.14Å; Y219-T223 WeakPolarHBondContact O-CB 3.48Å; Y219-T223 PolarHBondContact O-N 3.28Å; Y219-T223 PolarHBondContact O-OG1 2.91Å; F220-T223 WeakPolarHBondContact O-CB 3.27Å; F220-T223 PolarHBondContact O-N 3.4Å; R221-T223 VanDerWaalsContact C-N 3.32Å; R221-T223 PolarHBondContact O-N 2.9Å; T223-L226 PolarHBondContact O-N 3.22Å; T223-I227 HydrophobicContact CG2-CD1 3.71Å; T223-I227 HydrophobicContact CG2-CG1 4.49Å; T223-I227 WeakPolarHBondContact O-CB 3.37Å; T223-I227 VanDerWaalsContact O-CG1 3.27Å; T223-I227 WeakPolarHBondContact O-CG1 3.13Å; T223-I227 PolarHBondContact O-N 3.01Å
224L82.7Confident77.8Confident17 Ų1735.5 Ų35.59%0.08918%0.177CC..Hα-helixtrans-63.5-39.7174.9-76.3176000112.5F220 R221 I227 V228 V255F220-L224 HydrophobicContact CD1-CD1 3.94Å; F220-L224 HydrophobicContact CE1-CD1 3.51Å; F220-L224 HydrophobicContact CE1-CG 4.31Å; F220-L224 HydrophobicContact CZ-CD1 3.92Å; F220-L224 HydrophobicContact CZ-CG 4.37Å; F220-L224 WeakPolarHBondContact O-CG 3.29Å; F220-L224 PolarHBondContact O-N 3.46Å; R221-L224 PolarHBondContact O-N 3.21Å; L224-I227 PolarHBondContact O-N 3.15Å; L224-V228 WeakPolarHBondContact O-CB 3.48Å; L224-V228 WeakPolarHBondContact O-CG2 3.41Å; L224-V228 PolarHBondContact O-N 2.88Å; L224-V255 HydrophobicContact CB-CG1 3.98Å; L224-V255 HydrophobicContact CB-CG2 4.2Å
225M83.4Confident78.1Confident2 Ų240.2 Ų40.21%0.0119%0.186CC..Hα-helixtrans-61.7-46.7174.4-71-175.4-179.500112F178 F181 R221 L222 I227 V228 G229 V255 D259F178-M225 HydrophobicContact CB-CE 4.15Å; F178-M225 HydrophobicContact CD2-CE 4.33Å; F181-M225 HydrophobicContact CB-CB 3.65Å; F181-M225 HydrophobicContact CB-CG 4.33Å; F181-M225 HydrophobicContact CB-SD 3.65Å; F181-M225 HydrophobicContact CD2-SD 4.04Å; F181-M225 HydrophobicContact CG-SD 4.19Å; R221-M225 PolarHBondContact O-N 2.87Å; L222-M225 HydrophobicContact CD2-SD 4.44Å; L222-M225 PolarHBondContact O-N 2.96Å; M225-I227 PolarHBondContact O-N 3.32Å; M225-V228 PolarHBondContact O-N 3.02Å; M225-G229 PolarHBondContact O-N 2.97Å; M225-V255 HydrophobicContact CB-CG1 4.41Å; M225-V255 HydrophobicContact CG-CG1 3.66Å; M225-D259 HydrophobicContact CE-CB 3.26Å; M225-D259 WeakPolarHBondContact CE-OD2 3.26Å
226L84.5Confident78.1Confident32 Ų3235.1 Ų35.117%0.16816%0.164CC..Hα-helixtrans-62.9-43179.1-66.3163.8000111.1F181 L184 G185 I188 L192 L222 T223 Q230F181-L226 HydrophobicContact CD1-CD2 4.19Å; F181-L226 HydrophobicContact CD1-CG 4.32Å; F181-L226 WeakPolarHBondContact O-CD2 3.4Å; L184-L226 HydrophobicContact CB-CD2 3.75Å; G185-L226 VanDerWaalsContact CA-O 3.3Å; G185-L226 WeakPolarHBondContact CA-O 3.23Å; I188-L226 HydrophobicContact CD1-CD2 4.02Å; L192-L226 HydrophobicContact CD1-CB 3.64Å; L222-L226 VanDerWaalsContact O-CG 3.3Å; L222-L226 WeakPolarHBondContact O-CG 3.39Å; L222-L226 PolarHBondContact O-N 2.66Å; T223-L226 PolarHBondContact O-N 3.22Å; L226-Q230 WeakPolarHBondContact O-CB 3.32Å; L226-Q230 PolarHBondContact O-N 2.68Å
227I83.4Confident77.7Confident14 Ų1436.6 Ų36.67%0.07217%0.171CC..Hα-helixtrans-62.7-48.9175.5-74.2168.9000111.3L192 L193 N196 T223 L224 M225 Q230 A231L192-I227 HydrophobicContact CB-CG1 4.03Å; L193-I227 HydrophobicContact CD1-CD1 4.43Å; L193-I227 HydrophobicContact CD1-CG2 3.78Å; N196-I227 HydrophobicContact CB-CD1 4.47Å; T223-I227 HydrophobicContact CG2-CD1 3.71Å; T223-I227 HydrophobicContact CG2-CG1 4.49Å; T223-I227 WeakPolarHBondContact O-CB 3.37Å; T223-I227 VanDerWaalsContact O-CG1 3.27Å; T223-I227 WeakPolarHBondContact O-CG1 3.13Å; T223-I227 PolarHBondContact O-N 3.01Å; L224-I227 PolarHBondContact O-N 3.15Å; M225-I227 PolarHBondContact O-N 3.32Å; I227-Q230 PolarHBondContact O-N 3.1Å; I227-A231 VanDerWaalsContact O-CB 3.25Å; I227-A231 WeakPolarHBondContact O-CB 3.4Å; I227-A231 PolarHBondContact O-N 3.3Å
228V84.5Confident77.1Confident2 Ų237 Ų371%0.01217%0.167CC..Hα-helixtrans-69.8-35.9-178.6171.90000111.6M38 L224 M225 A231 T232 L251 L252 V255M38-V228 HydrophobicContact CE-CG2 4.18Å; L224-V228 WeakPolarHBondContact O-CB 3.48Å; L224-V228 WeakPolarHBondContact O-CG2 3.41Å; L224-V228 PolarHBondContact O-N 2.88Å; M225-V228 PolarHBondContact O-N 3.02Å; V228-A231 PolarHBondContact O-N 3.4Å; V228-T232 HydrophobicContact CG1-CG2 4.09Å; V228-T232 WeakPolarHBondContact O-CB 3.29Å; V228-T232 WeakPolarHBondContact O-CG2 3.4Å; V228-T232 PolarHBondContact O-N 3.04Å; V228-T232 PolarHBondContact O-OG1 3.05Å; V228-L251 HydrophobicContact CG1-CB 3.95Å; V228-L252 HydrophobicContact CG1-CD2 3.77Å; V228-L252 HydrophobicContact CG1-CG 3.88Å; V228-V255 HydrophobicContact CB-CG2 4.46Å; V228-V255 HydrophobicContact CG2-CG2 3.78Å
229G81.9Confident76.8Confident0 Ų034.6 Ų34.60%016%0.156CC..Hα-helixtrans-58.8-46.2170.700000112.2M225 F233 G234M225-G229 PolarHBondContact O-N 2.97Å; G229-F233 PolarHBondContact O-N 3.45Å; G229-G234 PolarHBondContact O-N 3.06Å
230Q81.6Confident76.3Confident11 Ų1129.7 Ų29.75%0.05114%0.137CC..Hα-helixtrans-63-44.3173.7-174.3167.762.300112.1I188 I190 L226 I227 T232 G234 F238I188-Q230 PolarHBondContact O-NE2 3.28Å; I190-Q230 PolarHBondContact O-NE2 3.22Å; I190-Q230 PolarHBondContact O-OE1 2.9Å; L226-Q230 WeakPolarHBondContact O-CB 3.32Å; L226-Q230 PolarHBondContact O-N 2.68Å; I227-Q230 PolarHBondContact O-N 3.1Å; Q230-T232 VanDerWaalsContact C-N 3.29Å; Q230-T232 PolarHBondContact O-N 3.43Å; Q230-G234 VanDerWaalsContact O-CA 3.24Å; Q230-G234 WeakPolarHBondContact O-CA 3.4Å; Q230-G234 PolarHBondContact O-N 3.09Å; Q230-F238 HydrophobicContact CG-CB 4.21Å
231A80Confident75.5Confident2 Ų227.2 Ų27.22%0.01713%0.126CC..Hα-helixtrans-69.3-20.1-177.400000115.1I227 V228 R239 I240 A241I227-A231 VanDerWaalsContact O-CB 3.25Å; I227-A231 WeakPolarHBondContact O-CB 3.4Å; I227-A231 PolarHBondContact O-N 3.3Å; V228-A231 PolarHBondContact O-N 3.4Å; A231-R239 CarbonylContact O-C 3.57Å; A231-R239 VanDerWaalsContact O-CA 3.31Å; A231-R239 WeakPolarHBondContact O-CA 3.39Å; A231-I240 HydrophobicContact CB-CB 4.02Å; A231-I240 HydrophobicContact CB-CD1 3.48Å; A231-I240 VanDerWaalsContact CB-CD1 3.48Å; A231-I240 HydrophobicContact CB-CG1 3.69Å; A231-I240 PolarHBondContact O-N 2.87Å; A231-A241 PolarHBondContact O-N 3.24Å
232T83.2Confident75.1Confident0 Ų027.4 Ų27.40%013%0.132CC..Hα-helixtrans-111.5-39.3-175.456.10000113.6Y61 V228 Q230 A241 A248 L252Y61-T232 WeakPolarHBondContact CE1-O 3.4Å; Y61-T232 PolarHBondContact OH-O 2.88Å; V228-T232 HydrophobicContact CG1-CG2 4.09Å; V228-T232 WeakPolarHBondContact O-CB 3.29Å; V228-T232 WeakPolarHBondContact O-CG2 3.4Å; V228-T232 PolarHBondContact O-N 3.04Å; V228-T232 PolarHBondContact O-OG1 3.05Å; Q230-T232 VanDerWaalsContact C-N 3.29Å; Q230-T232 PolarHBondContact O-N 3.43Å; T232-A241 HydrophobicContact CG2-CB 4.33Å; T232-A248 HydrophobicContact CG2-CB 3.67Å; T232-L252 HydrophobicContact CG2-CD1 4.14Å; T232-L252 HydrophobicContact CG2-CG 4.11Å
233F81.9Confident74.7Confident55 Ų5530 Ų3024%0.24115%0.146CC..Hα-helixtrans-116.7-8.4-177-60.9-67.7000114.4V65 L66 T182 A186 G229 L252V65-F233 HydrophobicContact CG1-CE1 4.18Å; V65-F233 HydrophobicContact CG1-CZ 3.87Å; L66-F233 HydrophobicContact CD2-CE1 4.23Å; L66-F233 HydrophobicContact CD2-CZ 3.71Å; L66-F233 HydrophobicContact CG-CE1 4.39Å; L66-F233 HydrophobicContact CG-CZ 4.33Å; T182-F233 HydrophobicContact CG2-CD2 3.82Å; T182-F233 HydrophobicContact CG2-CE2 3.82Å; A186-F233 HydrophobicContact CB-CB 3.78Å; G229-F233 PolarHBondContact O-N 3.45Å; F233-L252 HydrophobicContact CD2-CD1 4.47Å; F233-L252 HydrophobicContact CE2-CD1 3.49Å; F233-L252 VanDerWaalsContact CE2-CD1 3.49Å; F233-L252 HydrophobicContact CE2-CD2 3.93Å; F233-L252 HydrophobicContact CE2-CG 4.38Å; F233-L252 HydrophobicContact CZ-CD1 3.71Å
234G73.7Confident74.8Confident9 Ų930.1 Ų30.19%0.09315%0.147CC..SBendtrans-67.5-174.7178.800000114.3G229 Q230 R239G229-G234 PolarHBondContact O-N 3.06Å; Q230-G234 VanDerWaalsContact O-CA 3.24Å; Q230-G234 WeakPolarHBondContact O-CA 3.4Å; Q230-G234 PolarHBondContact O-N 3.09Å; G234-R239 WeakPolarHBondContact O-CD 3.29Å; G234-R239 WeakPolarHBondContact O-CG 3.48Å
235R67Low75.1Confident179 Ų17931.8 Ų31.868%0.67515%0.152SC*.  trans-59.6150.2178.1-156172.5-173.5150.24.8110.9D237 F238 R239R235-D237 VanDerWaalsContact CD-OD2 3.24Å; R235-D237 WeakPolarHBondContact CD-OD2 3.27Å; R235-D237 WeakPolarHBondContact CG-OD2 3.38Å; R235-D237 IonicContact NE-OD2 2.68Å; R235-D237 PolarHBondContact O-N 3.32Å; R235-D237 VanDerWaalsContact O-N 3.13Å; R235-F238 HydrophobicContact CB-CD2 3.9Å; R235-F238 HydrophobicContact CB-CE2 4.2Å; R235-F238 PolarHBondContact O-N 3.4Å; R235-R239 PolarHBondContact O-N 2.89Å
236H63.2Low75.4Confident48 Ų4831.8 Ų31.822%0.22215%0.152CC..G310 helixtrans-47.8-45.5-175.6-174.6-88.9000112.5K52 F238 R239K52-H236 PolarHBondContact O-CE1 3.42Å; K52-H236 VanDerWaalsContact O-CE1 3.32Å; H236-F238 PolarHBondContact O-N 3.19Å; H236-R239 PolarHBondContact O-N 3.04Å; H236-R239 VanDerWaalsContact O-N 3.11Å
237D59.1Low75.6Confident75 Ų7530.3 Ų30.340%0.40114%0.144SC..G310 helixtrans-63.7-5.1-179.4-15.7-49.1000114.9R191 R235R191-D237 PolarHBondContact NH2-O 2.94Å; R235-D237 VanDerWaalsContact CD-OD2 3.24Å; R235-D237 WeakPolarHBondContact CD-OD2 3.27Å; R235-D237 WeakPolarHBondContact CG-OD2 3.38Å; R235-D237 IonicContact NE-OD2 2.68Å; R235-D237 PolarHBondContact O-N 3.32Å; R235-D237 VanDerWaalsContact O-N 3.13Å
238F58.6Low76Confident48 Ų4829.6 Ų29.621%0.21114%0.141CC..G310 helixtrans-126.6-5.1179.2-50-39.6000113.6R191 Q230 R235 H236 I240R191-F238 HydrophobicContact CG-CD1 3.56Å; R191-F238 HydrophobicContact CG-CE1 3.48Å; R191-F238 VanDerWaalsContact CG-CE1 3.48Å; R191-F238 HydrophobicContact CG-CG 4.43Å; R191-F238 HydrophobicContact CG-CZ 4.28Å; R191-F238 VanDerWaalsContact NE-CD1 3.26Å; R191-F238 VanDerWaalsContact NE-CE1 3.3Å; Q230-F238 HydrophobicContact CG-CB 4.21Å; R235-F238 HydrophobicContact CB-CD2 3.9Å; R235-F238 HydrophobicContact CB-CE2 4.2Å; R235-F238 PolarHBondContact O-N 3.4Å; H236-F238 PolarHBondContact O-N 3.19Å; F238-I240 PolarHBondContact O-N 3.3Å
239R66.6Low76.4Confident10 Ų1029.5 Ų29.54%0.03814%0.14CC..  trans-81.187.5-174.2-92175.454.3-159.5-7.1112.2Y61 A231 G234 R235 H236 A241 G242Y61-R239 VanDerWaalsContact CE1-NH2 3.31Å; A231-R239 CarbonylContact O-C 3.57Å; A231-R239 VanDerWaalsContact O-CA 3.31Å; A231-R239 WeakPolarHBondContact O-CA 3.39Å; G234-R239 WeakPolarHBondContact O-CD 3.29Å; G234-R239 WeakPolarHBondContact O-CG 3.48Å; R235-R239 PolarHBondContact O-N 2.89Å; H236-R239 PolarHBondContact O-N 3.04Å; H236-R239 VanDerWaalsContact O-N 3.11Å; R239-A241 PolarHBondContact O-N 3.3Å; R239-A241 VanDerWaalsContact O-N 3.14Å; R239-G242 PolarHBondContact NH2-O 2.74Å; R239-G242 PolarHBondContact O-N 3.17Å
240I63.8Low76.9Confident4 Ų429.5 Ų29.52%0.02114%0.14CC..THydrogen-bonded Turntrans-51.7-34.5173.2-44.3171.6000111.8M38 T41 E42 I45 A231 F238 G242M38-I240 HydrophobicContact CE-CD1 4Å; T41-I240 HydrophobicContact CG2-CG2 4.24Å; E42-I240 HydrophobicContact CB-CD1 4.02Å; E42-I240 HydrophobicContact CB-CG1 4.31Å; E42-I240 HydrophobicContact CB-CG2 4.23Å; E42-I240 HydrophobicContact CG-CD1 4.12Å; E42-I240 HydrophobicContact CG-CG1 4.05Å; E42-I240 WeakPolarHBondContact OE2-CD1 2.94Å; I45-I240 HydrophobicContact CD1-CG2 4.27Å; I45-I240 VanDerWaalsContact CD1-O 3.29Å; I45-I240 WeakPolarHBondContact CD1-O 3.46Å; A231-I240 HydrophobicContact CB-CB 4.02Å; A231-I240 HydrophobicContact CB-CD1 3.48Å; A231-I240 VanDerWaalsContact CB-CD1 3.48Å; A231-I240 HydrophobicContact CB-CG1 3.69Å; A231-I240 PolarHBondContact O-N 2.87Å; F238-I240 PolarHBondContact O-N 3.3Å; I240-G242 PolarHBondContact O-N 3.12Å
241A62.5Low77.4Confident2 Ų229 Ų292%0.01714%0.138CC..THydrogen-bonded Turntrans-69.1-19177.500000113.9A231 T232 R239 D243 D244 A248A231-A241 PolarHBondContact O-N 3.24Å; T232-A241 HydrophobicContact CG2-CB 4.33Å; R239-A241 PolarHBondContact O-N 3.3Å; R239-A241 VanDerWaalsContact O-N 3.14Å; A241-D243 PolarHBondContact O-N 3.13Å; A241-D244 WeakPolarHBondContact O-CB 3.21Å; A241-D244 PolarHBondContact O-N 2.87Å; A241-A248 HydrophobicContact CB-CB 3.82Å
242G70.6Confident78Confident17 Ų1729 Ų2918%0.17514%0.137CC..THydrogen-bonded Turntrans50.8-132.9-171.400000111.1Y61 R239 I240Y61-G242 VanDerWaalsContact CE2-O 3.31Å; Y61-G242 WeakPolarHBondContact CE2-O 3.02Å; R239-G242 PolarHBondContact NH2-O 2.74Å; R239-G242 PolarHBondContact O-N 3.17Å; I240-G242 PolarHBondContact O-N 3.12Å
243D74Confident78.6Confident89 Ų8929 Ų2948%0.47614%0.137SC..THydrogen-bonded Turntrans-88.2-0.8176.2-50.3-54.8000113.3K52 A241 Y245K52-D243 IonicContact NZ-OD2 3.64Å; K52-D243 PolarHBondContact NZ-OD2 3.34Å; A241-D243 PolarHBondContact O-N 3.13Å; D243-Y245 VanDerWaalsContact C-N 3.34Å; D243-Y245 PolarHBondContact O-N 3.02Å
244D84.5Confident79.1Confident17 Ų1726.3 Ų26.39%0.09113%0.126CC..  trans-76.679-177.7-73.3-24.2000110.9R134 R135 A241 C246 L247 A248R134-D244 IonicContact NE-OD2 3.24Å; R134-D244 IonicContact NH2-OD2 3.95Å; R134-D244 PolarHBondContact NH2-OD2 3.04Å; R135-D244 WeakPolarHBondContact CG-OD1 3.27Å; R135-D244 IonicContact CZ-OD1 3.02Å; R135-D244 VanDerWaalsContact CZ-OD1 3.24Å; R135-D244 IonicContact CZ-OD2 2.96Å; R135-D244 IonicContact NE-OD1 3.59Å; R135-D244 PolarHBondContact NE-OD1 2.84Å; R135-D244 IonicContact NE-OD2 3.39Å; R135-D244 PolarHBondContact NE-OD2 2.62Å; R135-D244 VanDerWaalsContact NH2-CG 3.29Å; R135-D244 IonicContact NH2-OD1 2.71Å; R135-D244 PolarHBondContact NH2-OD1 3.03Å; R135-D244 IonicContact NH2-OD2 3.41Å; R135-D244 PolarHBondContact NH2-OD2 3.03Å; A241-D244 WeakPolarHBondContact O-CB 3.21Å; A241-D244 PolarHBondContact O-N 2.87Å; D244-C246 PolarHBondContact O-N 3.26Å; D244-C246 VanDerWaalsContact O-N 3.1Å; D244-L247 HydrophobicContact CB-CB 3.79Å; D244-L247 WeakPolarHBondContact O-CA 3.49Å; D244-L247 WeakPolarHBondContact O-CB 3.33Å; D244-L247 PolarHBondContact O-N 3.3Å; D244-A248 PolarHBondContact O-N 3.05Å; D244-A248 VanDerWaalsContact O-N 3.07Å
245Y89Confident80Confident51 Ų5126.2 Ų26.220%0.212%0.123CC..Hα-helixtrans-51.4-35.3177.762.6-95.2000113.3Q64 L68 N140 D243 L247 A248 S249Q64-Y245 HydrophobicContact CB-CD2 4.27Å; Q64-Y245 HydrophobicContact CB-CG 4.11Å; L68-Y245 HydrophobicContact CD1-CD2 3.61Å; L68-Y245 HydrophobicContact CD1-CE2 3.96Å; N140-Y245 PolarHBondContact ND2-OH 2.68Å; N140-Y245 VanDerWaalsContact ND2-OH 3.08Å; D243-Y245 VanDerWaalsContact C-N 3.34Å; D243-Y245 PolarHBondContact O-N 3.02Å; Y245-L247 VanDerWaalsContact C-N 3.34Å; Y245-L247 PolarHBondContact O-N 3.23Å; Y245-A248 PolarHBondContact O-N 3.2Å; Y245-S249 WeakPolarHBondContact O-CB 3.48Å; Y245-S249 PolarHBondContact O-N 3.38Å
246C89.6Confident81.2Confident2 Ų217.7 Ų17.71%0.0149%0.091CC..Hα-helixtrans-65.8-34175.9-178.70000112.5N140 D244 L250N140-C246 HydrophobicContact CB-CB 4.47Å; D244-C246 PolarHBondContact O-N 3.26Å; D244-C246 VanDerWaalsContact O-N 3.1Å; C246-L250 VanDerWaalsContact O-CB 3.28Å; C246-L250 WeakPolarHBondContact O-CB 3.4Å; C246-L250 PolarHBondContact O-N 3.46Å
247L89.8Confident82.6Confident1 Ų115.4 Ų15.41%0.0058%0.08CC..Hα-helixtrans-71.3-47.4173.5178.960.1000110L128 D244 Y245 S249 L250 L251L128-L247 HydrophobicContact CD2-CD1 3.55Å; D244-L247 HydrophobicContact CB-CB 3.79Å; D244-L247 WeakPolarHBondContact O-CA 3.49Å; D244-L247 WeakPolarHBondContact O-CB 3.33Å; D244-L247 PolarHBondContact O-N 3.3Å; Y245-L247 VanDerWaalsContact C-N 3.34Å; Y245-L247 PolarHBondContact O-N 3.23Å; L247-S249 PolarHBondContact O-N 3.18Å; L247-L250 WeakPolarHBondContact O-CB 3.38Å; L247-L250 PolarHBondContact O-N 3.4Å; L247-L251 HydrophobicContact CD1-CD1 4.02Å; L247-L251 HydrophobicContact CD1-CD2 4.21Å; L247-L251 HydrophobicContact CD1-CG 3.95Å; L247-L251 HydrophobicContact CG-CD1 3.96Å; L247-L251 HydrophobicContact CG-CG 4.29Å; L247-L251 VanDerWaalsContact O-CG 3.28Å; L247-L251 WeakPolarHBondContact O-CG 3.33Å; L247-L251 PolarHBondContact O-N 3.18Å
248A90.7Very high84.1Confident0 Ų012.7 Ų12.70%07%0.066CC..Hα-helixtrans-56.9-47178.700000112.5Y61 V65 T232 A241 D244 Y245 L250 L251 L252Y61-A248 HydrophobicContact CE2-CB 4.39Å; Y61-A248 WeakPolarHBondContact OH-CB 3.38Å; V65-A248 HydrophobicContact CG1-CB 3.98Å; V65-A248 HydrophobicContact CG2-CB 3.65Å; T232-A248 HydrophobicContact CG2-CB 3.67Å; A241-A248 HydrophobicContact CB-CB 3.82Å; D244-A248 PolarHBondContact O-N 3.05Å; D244-A248 VanDerWaalsContact O-N 3.07Å; Y245-A248 PolarHBondContact O-N 3.2Å; A248-L250 PolarHBondContact O-N 3.06Å; A248-L251 PolarHBondContact O-N 3.46Å; A248-L252 WeakPolarHBondContact O-CB 3.17Å; A248-L252 WeakPolarHBondContact O-CD1 3.42Å; A248-L252 WeakPolarHBondContact O-CG 3.33Å; A248-L252 PolarHBondContact O-N 2.99Å
249S93.2Very high85.6Confident0 Ų010.4 Ų10.40%06%0.056CC..Hα-helixtrans-62.5-42.5177.4-152.50000112.2L68 L69 Q72 Y245 L247 Y253L68-S249 VanDerWaalsContact CB-OG 3.24Å; L68-S249 WeakPolarHBondContact CB-OG 3.4Å; L69-S249 PolarHBondContact N-OG 3.24Å; L69-S249 VanDerWaalsContact N-OG 3.14Å; Q72-S249 PolarHBondContact OE1-O 3.28Å; Q72-S249 PolarHBondContact OE1-OG 3.42Å; Y245-S249 WeakPolarHBondContact O-CB 3.48Å; Y245-S249 PolarHBondContact O-N 3.38Å; L247-S249 PolarHBondContact O-N 3.18Å; S249-Y253 WeakPolarHBondContact O-CB 3.13Å; S249-Y253 PolarHBondContact O-N 3.14Å
250L93.2Very high86.7Confident0 Ų010 Ų100%05%0.054CC..Hα-helixtrans-57.3-50.8175.2-179.567.2000111.5L124 L127 L128 L144 Y147 C246 L247 A248 Y253 T254L124-L250 HydrophobicContact CD1-CD1 3.94Å; L124-L250 HydrophobicContact CD1-CD2 4.22Å; L124-L250 HydrophobicContact CD1-CG 4.13Å; L127-L250 HydrophobicContact CB-CD2 3.73Å; L127-L250 HydrophobicContact CD1-CD1 4.07Å; L127-L250 HydrophobicContact CD1-CD2 4.25Å; L128-L250 HydrophobicContact CD2-CD2 3.85Å; L128-L250 HydrophobicContact CG-CD2 4.04Å; L144-L250 HydrophobicContact CD1-CB 3.88Å; L144-L250 HydrophobicContact CD1-CD1 3.89Å; Y147-L250 HydrophobicContact CD1-CD1 3.29Å; Y147-L250 HydrophobicContact CE1-CD1 3.36Å; Y147-L250 HydrophobicContact CG-CD1 4.11Å; C246-L250 VanDerWaalsContact O-CB 3.28Å; C246-L250 WeakPolarHBondContact O-CB 3.4Å; C246-L250 PolarHBondContact O-N 3.46Å; L247-L250 WeakPolarHBondContact O-CB 3.38Å; L247-L250 PolarHBondContact O-N 3.4Å; A248-L250 PolarHBondContact O-N 3.06Å; L250-Y253 PolarHBondContact O-N 3.37Å; L250-T254 WeakPolarHBondContact O-CB 3.43Å; L250-T254 PolarHBondContact O-N 2.89Å; L250-T254 PolarHBondContact O-OG1 2.85Å
251L91.5Very high88Confident1 Ų19.8 Ų9.81%0.0055%0.053CC..Hα-helixtrans-65.2-44.4-177.4-63.1177.2000112.6F34 M38 L128 V228 L247 A248 T254 V255F34-L251 HydrophobicContact CE2-CD2 3.58Å; F34-L251 HydrophobicContact CZ-CD2 3.54Å; M38-L251 HydrophobicContact CE-CD1 3.98Å; M38-L251 HydrophobicContact CG-CD2 4.14Å; M38-L251 HydrophobicContact SD-CD1 3.54Å; M38-L251 VanDerWaalsContact SD-CD1 3.54Å; M38-L251 HydrophobicContact SD-CD2 3.37Å; M38-L251 WeakPolarHBondContact SD-CD2 3.19Å; M38-L251 HydrophobicContact SD-CG 4.04Å; L128-L251 HydrophobicContact CD2-CD2 3.83Å; V228-L251 HydrophobicContact CG1-CB 3.95Å; L247-L251 HydrophobicContact CD1-CD1 4.02Å; L247-L251 HydrophobicContact CD1-CD2 4.21Å; L247-L251 HydrophobicContact CD1-CG 3.95Å; L247-L251 HydrophobicContact CG-CD1 3.96Å; L247-L251 HydrophobicContact CG-CG 4.29Å; L247-L251 VanDerWaalsContact O-CG 3.28Å; L247-L251 WeakPolarHBondContact O-CG 3.33Å; L247-L251 PolarHBondContact O-N 3.18Å; A248-L251 PolarHBondContact O-N 3.46Å; L251-T254 PolarHBondContact O-N 3.22Å; L251-V255 PolarHBondContact O-N 3.36Å; L251-V255 VanDerWaalsContact O-N 3.16Å
252L93Very high89.1Confident0 Ų010.1 Ų10.10%06%0.055CC..Hα-helixtrans-61-48.1176.8-77.6162.1000111.2V65 L69 F178 T182 V228 T232 F233 A248 M256V65-L252 HydrophobicContact CG1-CD1 3.55Å; L69-L252 HydrophobicContact CD1-CB 4.02Å; L69-L252 HydrophobicContact CD2-CB 3.84Å; L69-L252 HydrophobicContact CD2-CD1 4.09Å; L69-L252 HydrophobicContact CD2-CG 4.43Å; F178-L252 HydrophobicContact CE2-CD2 4.19Å; F178-L252 WeakPolarHBondContact CE2-O 3.22Å; F178-L252 HydrophobicContact CZ-CB 4.03Å; F178-L252 HydrophobicContact CZ-CD2 3.74Å; F178-L252 HydrophobicContact CZ-CG 4.49Å; T182-L252 HydrophobicContact CG2-CD2 3.78Å; V228-L252 HydrophobicContact CG1-CD2 3.77Å; V228-L252 HydrophobicContact CG1-CG 3.88Å; T232-L252 HydrophobicContact CG2-CD1 4.14Å; T232-L252 HydrophobicContact CG2-CG 4.11Å; F233-L252 HydrophobicContact CD2-CD1 4.47Å; F233-L252 HydrophobicContact CE2-CD1 3.49Å; F233-L252 VanDerWaalsContact CE2-CD1 3.49Å; F233-L252 HydrophobicContact CE2-CD2 3.93Å; F233-L252 HydrophobicContact CE2-CG 4.38Å; F233-L252 HydrophobicContact CZ-CD1 3.71Å; A248-L252 WeakPolarHBondContact O-CB 3.17Å; A248-L252 WeakPolarHBondContact O-CD1 3.42Å; A248-L252 WeakPolarHBondContact O-CG 3.33Å; A248-L252 PolarHBondContact O-N 2.99Å; L252-M256 WeakPolarHBondContact O-CB 3.32Å; L252-M256 PolarHBondContact O-N 3.43Å
253Y95.2Very high89.9Confident0 Ų010.1 Ų10.10%05%0.051CC..Hα-helixtrans-63-45178174.6-102.6000112.3Q72 S76 Y147 T148 T151 S152 S249 L250 V255 M256 M257Q72-Y253 HydrophobicContact CB-CD2 3.55Å; Q72-Y253 HydrophobicContact CB-CE2 3.91Å; Q72-Y253 HydrophobicContact CB-CG 4.14Å; Q72-Y253 HydrophobicContact CG-CD2 4.42Å; S76-Y253 WeakPolarHBondContact OG-CE2 3.35Å; S76-Y253 PolarHBondContact OG-OH 3.37Å; Y147-Y253 HydrophobicContact CD1-CD1 4.2Å; Y147-Y253 HydrophobicContact CD1-CE1 4.24Å; Y147-Y253 AromaticContact CE1-CD1 3.77Å; Y147-Y253 HydrophobicContact CE1-CD1 3.77Å; Y147-Y253 AromaticContact CE1-CE1 3.93Å; Y147-Y253 HydrophobicContact CE1-CE1 3.93Å; T148-Y253 HydrophobicContact CG2-CE1 4.44Å; T148-Y253 HydrophobicContact CG2-CE2 4.06Å; T148-Y253 PolarHBondContact O-OH 3.14Å; T148-Y253 VanDerWaalsContact O-OH 3.12Å; T148-Y253 WeakPolarHBondContact OG1-CE1 3.4Å; T151-Y253 HydrophobicContact CG2-CE1 3.91Å; S152-Y253 PolarHBondContact OG-OH 2.91Å; S249-Y253 WeakPolarHBondContact O-CB 3.13Å; S249-Y253 PolarHBondContact O-N 3.14Å; L250-Y253 PolarHBondContact O-N 3.37Å; Y253-V255 PolarHBondContact O-N 2.82Å; Y253-M256 HydrophobicContact CD2-CE 3.8Å; Y253-M256 HydrophobicContact CE2-CE 4.05Å; Y253-M256 PolarHBondContact O-N 3.4Å; Y253-M257 HydrophobicContact CD1-CG 4.3Å; Y253-M257 HydrophobicContact CD2-CG 4.05Å; Y253-M257 HydrophobicContact CE1-CG 3.81Å; Y253-M257 HydrophobicContact CE2-CG 3.53Å; Y253-M257 HydrophobicContact CE2-SD 3.69Å; Y253-M257 HydrophobicContact CG-CG 4.41Å; Y253-M257 WeakPolarHBondContact O-CG 3.34Å; Y253-M257 PolarHBondContact O-N 3.15Å
254T92.8Very high90.6Very high0 Ų05.9 Ų5.90%03%0.028CC..Hα-helixtrans-60.4-47.3179.5-59.60000111.4F31 F34 L124 Y147 L250 L251 M256 M257 M258F31-T254 HydrophobicContact CD1-CG2 3.95Å; F31-T254 HydrophobicContact CE1-CG2 3.87Å; F34-T254 HydrophobicContact CD1-CG2 3.93Å; F34-T254 HydrophobicContact CD2-CG2 3.87Å; F34-T254 HydrophobicContact CE1-CG2 3.8Å; F34-T254 HydrophobicContact CE2-CG2 3.71Å; F34-T254 HydrophobicContact CG-CG2 3.96Å; F34-T254 HydrophobicContact CZ-CG2 3.67Å; L124-T254 HydrophobicContact CD2-CG2 4.43Å; Y147-T254 WeakPolarHBondContact CE1-OG1 3.47Å; Y147-T254 PolarHBondContact OH-OG1 2.85Å; L250-T254 WeakPolarHBondContact O-CB 3.43Å; L250-T254 PolarHBondContact O-N 2.89Å; L250-T254 PolarHBondContact O-OG1 2.85Å; L251-T254 PolarHBondContact O-N 3.22Å; T254-M256 PolarHBondContact O-N 2.92Å; T254-M257 PolarHBondContact O-N 3Å; T254-M258 WeakPolarHBondContact O-CG 3.27Å; T254-M258 PolarHBondContact O-N 3.2Å
255V91.7Very high90.8Very high6 Ų66.5 Ų6.54%0.0363%0.031CC..Hα-helixtrans-67.1-37.1178.1175.70000112.3F34 L224 M225 V228 L251 Y253 M258 D259F34-V255 HydrophobicContact CE1-CG2 3.88Å; F34-V255 HydrophobicContact CZ-CG2 4.49Å; L224-V255 HydrophobicContact CB-CG1 3.98Å; L224-V255 HydrophobicContact CB-CG2 4.2Å; M225-V255 HydrophobicContact CB-CG1 4.41Å; M225-V255 HydrophobicContact CG-CG1 3.66Å; V228-V255 HydrophobicContact CB-CG2 4.46Å; V228-V255 HydrophobicContact CG2-CG2 3.78Å; L251-V255 PolarHBondContact O-N 3.36Å; L251-V255 VanDerWaalsContact O-N 3.16Å; Y253-V255 PolarHBondContact O-N 2.82Å; V255-M258 PolarHBondContact O-N 2.93Å; V255-D259 PolarHBondContact O-N 3.08Å
256M93.3Very high90.6Very high0 Ų07.2 Ų7.20%04%0.038CC..Hα-helixtrans-61-45.3174.3-174.3-163.571.700112.1I73 W171 T174 L175 F178 L252 Y253 T254 M258 D259 W260I73-M256 HydrophobicContact CD1-SD 3.91Å; I73-M256 HydrophobicContact CG1-CE 3.75Å; I73-M256 HydrophobicContact CG1-SD 3.47Å; I73-M256 WeakPolarHBondContact CG1-SD 3.39Å; W171-M256 HydrophobicContact CH2-CE 4.4Å; W171-M256 HydrophobicContact CZ3-CE 4.08Å; T174-M256 HydrophobicContact CG2-CG 4.02Å; T174-M256 WeakPolarHBondContact CG2-O 3.37Å; L175-M256 HydrophobicContact CD2-SD 4.4Å; F178-M256 HydrophobicContact CB-CG 4.21Å; F178-M256 HydrophobicContact CD1-CB 4.5Å; F178-M256 HydrophobicContact CD1-CG 4.16Å; F178-M256 HydrophobicContact CD1-SD 4.35Å; F178-M256 HydrophobicContact CD2-CB 3.64Å; F178-M256 HydrophobicContact CD2-CG 3.97Å; F178-M256 HydrophobicContact CE2-CB 3.75Å; F178-M256 HydrophobicContact CE2-CG 4.41Å; F178-M256 HydrophobicContact CG-CB 4.04Å; F178-M256 HydrophobicContact CG-CG 3.83Å; F178-M256 HydrophobicContact CZ-CB 4.23Å; L252-M256 WeakPolarHBondContact O-CB 3.32Å; L252-M256 PolarHBondContact O-N 3.43Å; Y253-M256 HydrophobicContact CD2-CE 3.8Å; Y253-M256 HydrophobicContact CE2-CE 4.05Å; Y253-M256 PolarHBondContact O-N 3.4Å; T254-M256 PolarHBondContact O-N 2.92Å; M256-M258 PolarHBondContact O-N 3.38Å; M256-D259 PolarHBondContact O-N 2.96Å; M256-W260 PolarHBondContact O-N 2.89Å
257M93Very high90.4Very high0 Ų08.2 Ų8.20%04%0.043CC..Hα-helixtrans-65.2-28.2178.9-70.3-57.7-58.600112.6T151 V155 W171 Y253 T254 L261T151-M257 HydrophobicContact CG2-CB 4.06Å; T151-M257 HydrophobicContact CG2-CE 4.33Å; T151-M257 HydrophobicContact CG2-CG 3.9Å; V155-M257 HydrophobicContact CB-CE 3.97Å; V155-M257 HydrophobicContact CG1-CE 3.79Å; V155-M257 HydrophobicContact CG2-CE 4.39Å; W171-M257 HydrophobicContact CH2-CE 4.43Å; W171-M257 HydrophobicContact CH2-SD 3.81Å; Y253-M257 HydrophobicContact CD1-CG 4.3Å; Y253-M257 HydrophobicContact CD2-CG 4.05Å; Y253-M257 HydrophobicContact CE1-CG 3.81Å; Y253-M257 HydrophobicContact CE2-CG 3.53Å; Y253-M257 HydrophobicContact CE2-SD 3.69Å; Y253-M257 HydrophobicContact CG-CG 4.41Å; Y253-M257 WeakPolarHBondContact O-CG 3.34Å; Y253-M257 PolarHBondContact O-N 3.15Å; T254-M257 PolarHBondContact O-N 3Å; M257-L261 WeakPolarHBondContact O-CB 3.33Å; M257-L261 PolarHBondContact O-N 3.06Å
258M89.4Confident90.2Very high18 Ų1810 Ų109%0.0895%0.051CC..Hα-helixtrans-71.3-39.2173.8-66.1-50.9-178.700113.1F31 T254 V255 M256 W260 L261 T262F31-M258 HydrophobicContact CB-CE 3.6Å; F31-M258 HydrophobicContact CB-CG 3.99Å; F31-M258 HydrophobicContact CB-SD 3.63Å; F31-M258 HydrophobicContact CD1-CB 4.27Å; F31-M258 HydrophobicContact CD1-CE 2.33Å; F31-M258 HydrophobicContact CD1-CG 2.75Å; F31-M258 HydrophobicContact CD1-SD 2.48Å; F31-M258 WeakPolarHBondContact CD1-SD 3.46Å; F31-M258 HydrophobicContact CD2-CE 2.34Å; F31-M258 HydrophobicContact CD2-CG 3.99Å; F31-M258 HydrophobicContact CD2-SD 2.46Å; F31-M258 WeakPolarHBondContact CD2-SD 3.4Å; F31-M258 HydrophobicContact CE1-CB 4.46Å; F31-M258 HydrophobicContact CE1-CE 2.34Å; F31-M258 HydrophobicContact CE1-CG 3.07Å; F31-M258 HydrophobicContact CE1-SD 2.47Å; F31-M258 WeakPolarHBondContact CE1-SD 3.36Å; F31-M258 HydrophobicContact CE2-CE 2.34Å; F31-M258 HydrophobicContact CE2-CG 4.23Å; F31-M258 HydrophobicContact CE2-SD 2.46Å; F31-M258 WeakPolarHBondContact CE2-SD 3.48Å; F31-M258 HydrophobicContact CG-CE 2.34Å; F31-M258 HydrophobicContact CG-CG 3.28Å; F31-M258 HydrophobicContact CG-SD 2.46Å; F31-M258 WeakPolarHBondContact CG-SD 3.08Å; F31-M258 HydrophobicContact CZ-CE 2.35Å; F31-M258 HydrophobicContact CZ-CG 3.83Å; F31-M258 HydrophobicContact CZ-SD 2.47Å; F31-M258 WeakPolarHBondContact CZ-SD 3.47Å; T254-M258 WeakPolarHBondContact O-CG 3.27Å; T254-M258 PolarHBondContact O-N 3.2Å; V255-M258 PolarHBondContact O-N 2.93Å; M256-M258 PolarHBondContact O-N 3.38Å; M258-W260 VanDerWaalsContact C-N 3.35Å; M258-L261 PolarHBondContact O-N 2.88Å; M258-L261 HydrophobicContact SD-CD2 4.25Å; M258-T262 PolarHBondContact O-N 3.47Å; M258-T262 PolarHBondContact O-OG1 2.94Å
259D89.3Confident89.9Confident1 Ų117.8 Ų17.81%0.0058%0.082CC..Hα-helixtrans-70.6-34.2173.9-159.352.6000111.5T174 S177 R221 M225 V255 M256 I263T174-D259 HydrophobicContact CG2-CB 4.27Å; S177-D259 PolarHBondContact OG-OD2 2.86Å; R221-D259 IonicContact CZ-OD1 3.78Å; R221-D259 IonicContact NH1-OD1 2.73Å; R221-D259 PolarHBondContact NH1-OD1 3.36Å; M225-D259 HydrophobicContact CE-CB 3.26Å; M225-D259 WeakPolarHBondContact CE-OD2 3.26Å; V255-D259 PolarHBondContact O-N 3.08Å; M256-D259 PolarHBondContact O-N 2.96Å; D259-I263 VanDerWaalsContact O-CB 3.22Å; D259-I263 WeakPolarHBondContact O-CB 3.43Å; D259-I263 WeakPolarHBondContact O-CD1 3.22Å; D259-I263 WeakPolarHBondContact O-CG1 3.43Å; D259-I263 PolarHBondContact O-N 2.97Å; D259-I263 WeakPolarHBondContact OD2-CD1 3.34Å
260W91Very high89.4Confident0 Ų023.8 Ų23.80%011%0.108CC..Hα-helixtrans-58.9-50.7168.8-167.581.6000112.1T80 V155 F159 W171 T174 M256 M258 T262 I263 V264T80-W260 HydrophobicContact CG2-CH2 3.86Å; T80-W260 HydrophobicContact CG2-CZ2 3.7Å; V155-W260 HydrophobicContact CG1-CE3 3.51Å; V155-W260 HydrophobicContact CG1-CZ3 3.69Å; F159-W260 HydrophobicContact CD2-CH2 4.42Å; F159-W260 HydrophobicContact CD2-CZ3 4.1Å; W171-W260 AromaticContact CD1-NE1 3.41Å; W171-W260 AromaticContact CD2-CD1 3.46Å; W171-W260 VanDerWaalsContact CD2-CD1 3.46Å; W171-W260 HydrophobicContact CD2-CG 4.4Å; W171-W260 AromaticContact CD2-NE1 3.28Å; W171-W260 VanDerWaalsContact CD2-NE1 3.28Å; W171-W260 AromaticContact CE2-CD1 3.73Å; W171-W260 AromaticContact CE2-CE2 3.78Å; W171-W260 AromaticContact CE2-NE1 3.31Å; W171-W260 VanDerWaalsContact CE2-NE1 3.31Å; W171-W260 AromaticContact CE3-CD1 3.61Å; W171-W260 HydrophobicContact CE3-CG 4.42Å; W171-W260 AromaticContact CE3-NE1 3.95Å; W171-W260 AromaticContact CG-CD1 3.89Å; W171-W260 AromaticContact CG-NE1 3.35Å; W171-W260 VanDerWaalsContact CG-NE1 3.35Å; W171-W260 HydrophobicContact CH2-CG 4.33Å; W171-W260 HydrophobicContact CZ2-CD2 4.36Å; W171-W260 HydrophobicContact CZ2-CG 4.33Å; W171-W260 AromaticContact CZ2-NE1 3.98Å; W171-W260 AromaticContact CZ3-CD1 3.98Å; W171-W260 HydrophobicContact CZ3-CG 4.39Å; W171-W260 AromaticContact NE1-CE2 3.71Å; W171-W260 AromaticContact NE1-CZ2 3.88Å; W171-W260 AromaticContact NE1-NE1 3.39Å; T174-W260 HydrophobicContact CG2-CB 4.01Å; T174-W260 VanDerWaalsContact OG1-CA 3.29Å; T174-W260 WeakPolarHBondContact OG1-CA 3.39Å; M256-W260 PolarHBondContact O-N 2.89Å; M258-W260 VanDerWaalsContact C-N 3.35Å; W260-T262 PolarHBondContact O-N 2.83Å; W260-I263 PolarHBondContact O-N 3.39Å; W260-V264 HydrophobicContact CD2-CG1 4.42Å; W260-V264 HydrophobicContact CE3-CG1 3.9Å; W260-V264 HydrophobicContact CH2-CB 4.29Å; W260-V264 HydrophobicContact CH2-CG1 3.96Å; W260-V264 HydrophobicContact CH2-CG2 4.24Å; W260-V264 HydrophobicContact CZ2-CB 4.34Å; W260-V264 HydrophobicContact CZ2-CG1 4.44Å; W260-V264 HydrophobicContact CZ2-CG2 4.33Å; W260-V264 HydrophobicContact CZ3-CB 4.4Å; W260-V264 HydrophobicContact CZ3-CG1 3.65Å; W260-V264 WeakPolarHBondContact O-CG1 3.43Å; W260-V264 PolarHBondContact O-N 3.38Å
261L90Very high89Confident0 Ų024.8 Ų24.80%011%0.113CC..Hα-helixtrans-55.4-48.5179.3176.358.1000111.3R27 F31 V155 F159 M257 M258 V264 Q265R27-L261 HydrophobicContact CB-CD2 4.28Å; F31-L261 HydrophobicContact CD2-CD2 4.35Å; F31-L261 HydrophobicContact CE2-CD2 3.58Å; V155-L261 HydrophobicContact CG1-CB 4.1Å; V155-L261 HydrophobicContact CG1-CD1 4.25Å; F159-L261 HydrophobicContact CE2-CD1 3.47Å; F159-L261 VanDerWaalsContact CE2-CD1 3.47Å; F159-L261 HydrophobicContact CZ-CD1 3.68Å; M257-L261 WeakPolarHBondContact O-CB 3.33Å; M257-L261 PolarHBondContact O-N 3.06Å; M258-L261 PolarHBondContact O-N 2.88Å; M258-L261 HydrophobicContact SD-CD2 4.25Å; L261-V264 VanDerWaalsContact O-CG1 3.27Å; L261-V264 WeakPolarHBondContact O-CG1 3.43Å; L261-Q265 HydrophobicContact CD1-CG 4.39Å; L261-Q265 VanDerWaalsContact CD1-NE2 3.32Å; L261-Q265 WeakPolarHBondContact O-CB 3.36Å; L261-Q265 VanDerWaalsContact O-CD 3.27Å; L261-Q265 WeakPolarHBondContact O-CG 3.49Å; L261-Q265 PolarHBondContact O-N 3.34Å; L261-Q265 PolarHBondContact O-OE1 2.82Å
262T86.4Confident88.5Confident9 Ų928.3 Ų28.36%0.05513%0.132CC..Hα-helixtrans-77.8-28.6-179-47.90000113.7R221 M258 W260 N266R221-T262 VanDerWaalsContact CZ-CB 3.48Å; R221-T262 VanDerWaalsContact NH2-CG2 3.27Å; M258-T262 PolarHBondContact O-N 3.47Å; M258-T262 PolarHBondContact O-OG1 2.94Å; W260-T262 PolarHBondContact O-N 2.83Å; T262-N266 VanDerWaalsContact O-CB 3.32Å; T262-N266 WeakPolarHBondContact O-CB 3.49Å; T262-N266 PolarHBondContact O-N 2.86Å; T262-N266 PolarHBondContact O-ND2 2.74Å
263I87.6Confident88Confident18 Ų1831.1 Ų31.19%0.09215%0.147CC..Hα-helixtrans-64.9-45.3170.8-74.5164.4000110.6A170 V173 T174 D259 W260 N266 L267A170-I263 HydrophobicContact CB-CG2 3.96Å; V173-I263 HydrophobicContact CB-CD1 4.36Å; V173-I263 HydrophobicContact CB-CG2 4.3Å; V173-I263 HydrophobicContact CG1-CD1 3.8Å; V173-I263 HydrophobicContact CG1-CG1 4.44Å; V173-I263 HydrophobicContact CG1-CG2 4.39Å; T174-I263 WeakPolarHBondContact OG1-CD1 3.4Å; D259-I263 VanDerWaalsContact O-CB 3.22Å; D259-I263 WeakPolarHBondContact O-CB 3.43Å; D259-I263 WeakPolarHBondContact O-CD1 3.22Å; D259-I263 WeakPolarHBondContact O-CG1 3.43Å; D259-I263 PolarHBondContact O-N 2.97Å; D259-I263 WeakPolarHBondContact OD2-CD1 3.34Å; W260-I263 PolarHBondContact O-N 3.39Å; I263-N266 PolarHBondContact O-N 2.88Å; I263-L267 HydrophobicContact CG2-CD1 3.95Å; I263-L267 WeakPolarHBondContact O-CB 3.33Å; I263-L267 WeakPolarHBondContact O-CG 3.46Å; I263-L267 PolarHBondContact O-N 2.99Å
264V89.2Confident87.3Confident0 Ų034 Ų340%017%0.165CC..Hα-helixtrans-69.2-34.7179.574.80000112.2F159 L162 A170 W260 L261 L267 Q268F159-V264 HydrophobicContact CB-CG2 4.19Å; F159-V264 HydrophobicContact CD1-CB 4.4Å; F159-V264 HydrophobicContact CD1-CG1 3.74Å; F159-V264 HydrophobicContact CD1-CG2 3.85Å; F159-V264 HydrophobicContact CD2-CG1 3.75Å; F159-V264 HydrophobicContact CE1-CG1 3.76Å; F159-V264 HydrophobicContact CE2-CG1 3.77Å; F159-V264 HydrophobicContact CG-CG1 3.75Å; F159-V264 HydrophobicContact CG-CG2 3.96Å; F159-V264 HydrophobicContact CZ-CG1 3.79Å; L162-V264 HydrophobicContact CD1-CG2 3.46Å; L162-V264 VanDerWaalsContact CD1-CG2 3.46Å; A170-V264 HydrophobicContact CB-CB 4.1Å; A170-V264 HydrophobicContact CB-CG2 4.37Å; W260-V264 HydrophobicContact CD2-CG1 4.42Å; W260-V264 HydrophobicContact CE3-CG1 3.9Å; W260-V264 HydrophobicContact CH2-CB 4.29Å; W260-V264 HydrophobicContact CH2-CG1 3.96Å; W260-V264 HydrophobicContact CH2-CG2 4.24Å; W260-V264 HydrophobicContact CZ2-CB 4.34Å; W260-V264 HydrophobicContact CZ2-CG1 4.44Å; W260-V264 HydrophobicContact CZ2-CG2 4.33Å; W260-V264 HydrophobicContact CZ3-CB 4.4Å; W260-V264 HydrophobicContact CZ3-CG1 3.65Å; W260-V264 WeakPolarHBondContact O-CG1 3.43Å; W260-V264 PolarHBondContact O-N 3.38Å; L261-V264 VanDerWaalsContact O-CG1 3.27Å; L261-V264 WeakPolarHBondContact O-CG1 3.43Å; V264-L267 PolarHBondContact O-N 3.22Å; V264-Q268 WeakPolarHBondContact O-CB 3.47Å; V264-Q268 PolarHBondContact O-N 3.1Å
265Q87.2Confident86.5Confident30 Ų3038.3 Ų38.314%0.1419%0.187CC..Hα-helixtrans-60.6-50.3169.7-74.1162.6-12.200112.1V24 F159 L261 L267 Q268 Y269V24-Q265 HydrophobicContact CG2-CG 4.47Å; F159-Q265 HydrophobicContact CE1-CG 3.89Å; F159-Q265 HydrophobicContact CZ-CG 3.66Å; L261-Q265 HydrophobicContact CD1-CG 4.39Å; L261-Q265 VanDerWaalsContact CD1-NE2 3.32Å; L261-Q265 WeakPolarHBondContact O-CB 3.36Å; L261-Q265 VanDerWaalsContact O-CD 3.27Å; L261-Q265 WeakPolarHBondContact O-CG 3.49Å; L261-Q265 PolarHBondContact O-N 3.34Å; L261-Q265 PolarHBondContact O-OE1 2.82Å; Q265-L267 VanDerWaalsContact C-N 3.29Å; Q265-L267 PolarHBondContact O-N 3.44Å; Q265-Q268 PolarHBondContact O-N 3.02Å; Q265-Y269 WeakPolarHBondContact O-CB 3.34Å; Q265-Y269 PolarHBondContact O-N 3.48Å
266N85.4Confident85.6Confident65 Ų6542.1 Ų42.135%0.34821%0.207SC..Hα-helixtrans-61.5-38.6179.3-74.6-18000111.7T262 I263 F270T262-N266 VanDerWaalsContact O-CB 3.32Å; T262-N266 WeakPolarHBondContact O-CB 3.49Å; T262-N266 PolarHBondContact O-N 2.86Å; T262-N266 PolarHBondContact O-ND2 2.74Å; I263-N266 PolarHBondContact O-N 2.88Å; N266-F270 WeakPolarHBondContact O-CB 3.45Å; N266-F270 PolarHBondContact O-N 2.74Å
267L86.1Confident84.6Confident24 Ų2449.3 Ų49.313%0.12624%0.239CC..Hα-helixtrans-64.6-47.6173.2-73.3167.5000111.6W166 M169 A170 I263 V264 Q265 Y269 F270 I271W166-L267 HydrophobicContact CE3-CD2 4.38Å; M169-L267 HydrophobicContact CE-CD2 4.43Å; M169-L267 HydrophobicContact SD-CD2 4.24Å; A170-L267 HydrophobicContact CB-CD1 3.85Å; I263-L267 HydrophobicContact CG2-CD1 3.95Å; I263-L267 WeakPolarHBondContact O-CB 3.33Å; I263-L267 WeakPolarHBondContact O-CG 3.46Å; I263-L267 PolarHBondContact O-N 2.99Å; V264-L267 PolarHBondContact O-N 3.22Å; Q265-L267 VanDerWaalsContact C-N 3.29Å; Q265-L267 PolarHBondContact O-N 3.44Å; L267-Y269 PolarHBondContact O-N 2.82Å; L267-F270 PolarHBondContact O-N 3.14Å; L267-I271 WeakPolarHBondContact O-CB 3.41Å; L267-I271 VanDerWaalsContact O-CD1 3.24Å; L267-I271 WeakPolarHBondContact O-CD1 3.28Å; L267-I271 WeakPolarHBondContact O-CG1 3.33Å; L267-I271 PolarHBondContact O-N 3Å
268Q85.4Confident83.3Confident37 Ų3752.3 Ų52.317%0.17326%0.257CS..Hα-helixtrans-58.6-45.8176.8-176.81700.600112.1L162 V264 Q265 F270 I271 N272L162-Q268 HydrophobicContact CD1-CB 4.22Å; L162-Q268 HydrophobicContact CD2-CB 4.1Å; L162-Q268 HydrophobicContact CD2-CG 4.01Å; V264-Q268 WeakPolarHBondContact O-CB 3.47Å; V264-Q268 PolarHBondContact O-N 3.1Å; Q265-Q268 PolarHBondContact O-N 3.02Å; Q268-F270 PolarHBondContact O-N 2.79Å; Q268-I271 PolarHBondContact O-N 2.92Å; Q268-N272 WeakPolarHBondContact O-CB 3.37Å; Q268-N272 PolarHBondContact O-N 3.2Å; Q268-N272 PolarHBondContact O-OD1 3.4Å
269Y84.9Confident81.9Confident164 Ų16458 Ų5864%0.64328%0.283SS*.Hα-helixtrans-60.9-43.3175.9-178.4-100.7000111.9Q265 L267 N273Q265-Y269 WeakPolarHBondContact O-CB 3.34Å; Q265-Y269 PolarHBondContact O-N 3.48Å; L267-Y269 PolarHBondContact O-N 2.82Å; Y269-N273 WeakPolarHBondContact CD1-ND2 3.48Å; Y269-N273 WeakPolarHBondContact CD2-ND2 3.15Å; Y269-N273 VanDerWaalsContact CE1-ND2 3.28Å; Y269-N273 WeakPolarHBondContact CE1-ND2 3.38Å; Y269-N273 VanDerWaalsContact CE2-ND2 3.28Å; Y269-N273 WeakPolarHBondContact CE2-ND2 3.38Å; Y269-N273 WeakPolarHBondContact O-CB 3.24Å; Y269-N273 PolarHBondContact O-N 2.74Å; Y269-N273 VanDerWaalsContact O-N 3.1Å; Y269-N273 PolarHBondContact O-ND2 2.97Å
270F82.6Confident80.8Confident127 Ų12762 Ų6256%0.55731%0.308SS*.Hα-helixtrans-63.9-43.7176.3178.7-96.3000112.5N266 L267 Q268 T274N266-F270 WeakPolarHBondContact O-CB 3.45Å; N266-F270 PolarHBondContact O-N 2.74Å; L267-F270 PolarHBondContact O-N 3.14Å; Q268-F270 PolarHBondContact O-N 2.79Å; F270-T274 WeakPolarHBondContact O-CB 3.47Å; F270-T274 PolarHBondContact O-N 3.41Å; F270-T274 PolarHBondContact O-OG1 3.4Å
271I83.3Confident79.4Confident21 Ų2164.3 Ų64.311%0.10832%0.324CS..Hα-helixtrans-62.1-52.1178.5-67.4156000110.3L162 W166 L267 Q268 N273 T274 L275L162-I271 HydrophobicContact CD2-CD1 4.33Å; W166-I271 HydrophobicContact CB-CD1 4.17Å; W166-I271 VanDerWaalsContact CD1-CD1 3.49Å; W166-I271 HydrophobicContact CD2-CD1 3.52Å; W166-I271 HydrophobicContact CD2-CG1 4.18Å; W166-I271 HydrophobicContact CE3-CD1 4.18Å; W166-I271 HydrophobicContact CG-CD1 3.49Å; W166-I271 VanDerWaalsContact CG-CD1 3.49Å; W166-I271 HydrophobicContact CZ2-CD1 4.3Å; W166-I271 HydrophobicContact CZ2-CG1 4.08Å; L267-I271 WeakPolarHBondContact O-CB 3.41Å; L267-I271 VanDerWaalsContact O-CD1 3.24Å; L267-I271 WeakPolarHBondContact O-CD1 3.28Å; L267-I271 WeakPolarHBondContact O-CG1 3.33Å; L267-I271 PolarHBondContact O-N 3Å; Q268-I271 PolarHBondContact O-N 2.92Å; I271-N273 PolarHBondContact O-N 3.41Å; I271-T274 PolarHBondContact O-N 3.26Å; I271-T274 VanDerWaalsContact O-N 3.14Å; I271-L275 HydrophobicContact CG2-CD1 3.8Å; I271-L275 HydrophobicContact CG2-CG 4.38Å; I271-L275 WeakPolarHBondContact O-CG 3.44Å; I271-L275 PolarHBondContact O-N 3.04Å
272N82.4Confident78Confident75 Ų7568.5 Ų68.540%0.40135%0.347SS..Hα-helixtrans-59-46.8-178.6-70.2-0.2000111.3Q268 T274 L275 N276Q268-N272 WeakPolarHBondContact O-CB 3.37Å; Q268-N272 PolarHBondContact O-N 3.2Å; Q268-N272 PolarHBondContact O-OD1 3.4Å; N272-T274 VanDerWaalsContact C-N 3.32Å; N272-T274 PolarHBondContact O-N 3.42Å; N272-L275 PolarHBondContact O-N 3.06Å; N272-N276 WeakPolarHBondContact O-CB 3.32Å; N272-N276 PolarHBondContact O-N 3.29Å; N272-N276 PolarHBondContact O-OD1 3.45Å
273N82.2Confident76.8Confident58 Ų5871.2 Ų71.231%0.3137%0.366SS..Hα-helixtrans-66.2-31.7177.6-77.1-57.4000113.6Y269 I271 K277Y269-N273 WeakPolarHBondContact CD1-ND2 3.48Å; Y269-N273 WeakPolarHBondContact CD2-ND2 3.15Å; Y269-N273 VanDerWaalsContact CE1-ND2 3.28Å; Y269-N273 WeakPolarHBondContact CE1-ND2 3.38Å; Y269-N273 VanDerWaalsContact CE2-ND2 3.28Å; Y269-N273 WeakPolarHBondContact CE2-ND2 3.38Å; Y269-N273 WeakPolarHBondContact O-CB 3.24Å; Y269-N273 PolarHBondContact O-N 2.74Å; Y269-N273 VanDerWaalsContact O-N 3.1Å; Y269-N273 PolarHBondContact O-ND2 2.97Å; I271-N273 PolarHBondContact O-N 3.41Å; N273-K277 WeakPolarHBondContact O-CG 3.28Å; N273-K277 PolarHBondContact O-N 3.48Å
274T80.7Confident75.6Confident62 Ų6272.9 Ų72.938%0.3838%0.379SS..Hα-helixtrans-71.4-45.8176.1-58.70000110.9F270 I271 N272 K277 T278F270-T274 WeakPolarHBondContact O-CB 3.47Å; F270-T274 PolarHBondContact O-N 3.41Å; F270-T274 PolarHBondContact O-OG1 3.4Å; I271-T274 PolarHBondContact O-N 3.26Å; I271-T274 VanDerWaalsContact O-N 3.14Å; N272-T274 VanDerWaalsContact C-N 3.32Å; N272-T274 PolarHBondContact O-N 3.42Å; T274-K277 PolarHBondContact O-N 3.29Å; T274-T278 PolarHBondContact O-N 2.93Å
275L75.6Confident74.1Confident90 Ų9079 Ų7947%0.47141%0.408SS..Hα-helixtrans-60.6-47.3176.9-69171.9000111.6I271 N272 K277 T278 Q279I271-L275 HydrophobicContact CG2-CD1 3.8Å; I271-L275 HydrophobicContact CG2-CG 4.38Å; I271-L275 WeakPolarHBondContact O-CG 3.44Å; I271-L275 PolarHBondContact O-N 3.04Å; N272-L275 PolarHBondContact O-N 3.06Å; L275-K277 VanDerWaalsContact C-N 3.28Å; L275-K277 PolarHBondContact O-N 3.27Å; L275-T278 PolarHBondContact O-N 3.09Å; L275-T278 PolarHBondContact O-OG1 3.33Å; L275-Q279 PolarHBondContact O-N 3.08Å
276N73.7Confident73Confident85 Ų8581.9 Ų81.946%0.45543%0.428SS..Hα-helixtrans-59.4-37.2178.2-68.4-5.3000112.4N272 Q279 T280N272-N276 WeakPolarHBondContact O-CB 3.32Å; N272-N276 PolarHBondContact O-N 3.29Å; N272-N276 PolarHBondContact O-OD1 3.45Å; N276-Q279 PolarHBondContact O-N 2.94Å; N276-T280 PolarHBondContact O-N 2.93Å; N276-T280 VanDerWaalsContact O-N 3.13Å; N276-T280 PolarHBondContact O-OG1 3.06Å
277K70.6Confident71.9Confident151 Ų15182 Ų8266%0.65743%0.434SS*.Hα-helixtrans-66.3-40.7173.3-75.1176-177.6-179.20112.4N273 T274 L275 T280 S281N273-K277 WeakPolarHBondContact O-CG 3.28Å; N273-K277 PolarHBondContact O-N 3.48Å; T274-K277 PolarHBondContact O-N 3.29Å; L275-K277 VanDerWaalsContact C-N 3.28Å; L275-K277 PolarHBondContact O-N 3.27Å; K277-T280 WeakPolarHBondContact CA-OG1 3.39Å; K277-T280 PolarHBondContact O-N 2.86Å; K277-T280 PolarHBondContact O-OG1 3.13Å; K277-T280 VanDerWaalsContact O-OG1 3.06Å; K277-S281 PolarHBondContact O-N 3.5Å; K277-S281 PolarHBondContact O-OG 3.48Å
278T66.1Low71Confident64 Ų6488 Ų8839%0.39346%0.459SS..Hα-helixtrans-67.9-33.5176.359.50000113.4T274 L275 S281 N282T274-T278 PolarHBondContact O-N 2.93Å; L275-T278 PolarHBondContact O-N 3.09Å; L275-T278 PolarHBondContact O-OG1 3.33Å; T278-S281 WeakPolarHBondContact CA-OG 3.44Å; T278-S281 PolarHBondContact O-OG 3.28Å; T278-N282 WeakPolarHBondContact O-CB 3.34Å; T278-N282 PolarHBondContact O-N 2.77Å; T278-N282 VanDerWaalsContact O-N 3.08Å; T278-N282 PolarHBondContact O-ND2 3.38Å; T278-N282 PolarHBondContact O-OD1 3.47Å; T278-N282 VanDerWaalsContact O-OD1 3.09Å
279Q61.4Low70Confident136 Ų13693 Ų9364%0.63648%0.482SS*.Hα-helixtrans-68.5-42.7175.2-70-175.50.200111.7L275 N276 N282 S283L275-Q279 PolarHBondContact O-N 3.08Å; N276-Q279 PolarHBondContact O-N 2.94Å; Q279-N282 PolarHBondContact O-N 3.17Å; Q279-S283 PolarHBondContact O-N 2.72Å; Q279-S283 PolarHBondContact O-OG 2.95Å
280T65.2Low69.2Low87 Ų8789 Ų8953%0.53448%0.475SS..Hα-helixtrans-71.3-32.7178.1480000113.5N276 K277 S283 S284N276-T280 PolarHBondContact O-N 2.93Å; N276-T280 VanDerWaalsContact O-N 3.13Å; N276-T280 PolarHBondContact O-OG1 3.06Å; K277-T280 WeakPolarHBondContact CA-OG1 3.39Å; K277-T280 PolarHBondContact O-N 2.86Å; K277-T280 PolarHBondContact O-OG1 3.13Å; K277-T280 VanDerWaalsContact O-OG1 3.06Å; T280-S283 PolarHBondContact O-OG 3.03Å; T280-S284 WeakPolarHBondContact O-CB 3.35Å; T280-S284 PolarHBondContact O-N 3.33Å; T280-S284 VanDerWaalsContact O-N 3.17Å; T280-S284 PolarHBondContact O-OG 2.95Å
281S60.8Low68.5Low47 Ų4788.1 Ų88.133%0.32948%0.475SS..Hα-helixtrans-64.9-43168.962.90000111.7K277 T278 S284 Q285K277-S281 PolarHBondContact O-N 3.5Å; K277-S281 PolarHBondContact O-OG 3.48Å; T278-S281 WeakPolarHBondContact CA-OG 3.44Å; T278-S281 PolarHBondContact O-OG 3.28Å; S281-S284 PolarHBondContact O-OG 2.97Å; S281-Q285 WeakPolarHBondContact O-CB 3.38Å; S281-Q285 WeakPolarHBondContact O-CG 3.44Å; S281-Q285 PolarHBondContact O-N 3.15Å
282N61.4Low67.9Low88 Ų8894 Ų9447%0.47150%0.5SS..Hα-helixtrans-71.7-41.9-176.8-65.55.5000111.8T278 Q279 S284 Q285 V286T278-N282 WeakPolarHBondContact O-CB 3.34Å; T278-N282 PolarHBondContact O-N 2.77Å; T278-N282 VanDerWaalsContact O-N 3.08Å; T278-N282 PolarHBondContact O-ND2 3.38Å; T278-N282 PolarHBondContact O-OD1 3.47Å; T278-N282 VanDerWaalsContact O-OD1 3.09Å; Q279-N282 PolarHBondContact O-N 3.17Å; N282-S284 VanDerWaalsContact C-N 3.34Å; N282-S284 PolarHBondContact O-N 3.35Å; N282-Q285 PolarHBondContact O-N 2.96Å; N282-V286 WeakPolarHBondContact O-CG2 3.42Å; N282-V286 PolarHBondContact O-N 3.36Å
283S61Low67.1Low67 Ų6793.6 Ų93.647%0.46950%0.503SS..Hα-helixtrans-65.5-36.6176.6620000112.6Q279 T280 S287Q279-S283 PolarHBondContact O-N 2.72Å; Q279-S283 PolarHBondContact O-OG 2.95Å; T280-S283 PolarHBondContact O-OG 3.03Å; S283-S287 WeakPolarHBondContact O-CB 3.46Å; S283-S287 PolarHBondContact O-N 3.03Å; S283-S287 PolarHBondContact O-OG 3.3Å
284S62.6Low66.2Low53 Ų5395.3 Ų95.337%0.37151%0.512SS..Hα-helixtrans-70.6-40.6175590000112.1T280 S281 N282 S287 F288T280-S284 WeakPolarHBondContact O-CB 3.35Å; T280-S284 PolarHBondContact O-N 3.33Å; T280-S284 VanDerWaalsContact O-N 3.17Å; T280-S284 PolarHBondContact O-OG 2.95Å; S281-S284 PolarHBondContact O-OG 2.97Å; N282-S284 VanDerWaalsContact C-N 3.34Å; N282-S284 PolarHBondContact O-N 3.35Å; S284-S287 WeakPolarHBondContact O-CB 3.21Å; S284-S287 PolarHBondContact O-N 3.47Å; S284-F288 WeakPolarHBondContact O-CD2 3.37Å; S284-F288 PolarHBondContact O-N 3.27Å
285Q57Low65.3Low127 Ų127100.3 Ų100.359%0.59353%0.529SS*.Hα-helixtrans-59.8-49172.4-79-176-22.200112.4S281 N282 S287 F288 E289S281-Q285 WeakPolarHBondContact O-CB 3.38Å; S281-Q285 WeakPolarHBondContact O-CG 3.44Å; S281-Q285 PolarHBondContact O-N 3.15Å; N282-Q285 PolarHBondContact O-N 2.96Å; Q285-S287 VanDerWaalsContact C-N 3.27Å; Q285-S287 PolarHBondContact O-N 2.98Å; Q285-F288 PolarHBondContact O-N 2.93Å; Q285-F288 VanDerWaalsContact O-N 3.08Å; Q285-E289 PolarHBondContact O-N 2.9Å
286V65.3Low64.4Low92 Ų92102.6 Ų102.656%0.55854%0.541SS*.Hα-helixtrans-58.6-40.3175.9171.10000111.2N282 F288 E289 V290N282-V286 WeakPolarHBondContact O-CG2 3.42Å; N282-V286 PolarHBondContact O-N 3.36Å; V286-F288 PolarHBondContact O-N 3Å; V286-E289 PolarHBondContact O-N 3.08Å; V286-V290 WeakPolarHBondContact O-CG2 3.28Å; V286-V290 PolarHBondContact O-N 3Å
287S61.1Low63.6Low68 Ų68105 Ų10548%0.47655%0.552SS.*Hα-helixtrans-62.7-40.5175.5-57.30000112.4S283 S284 Q285 L291S283-S287 WeakPolarHBondContact O-CB 3.46Å; S283-S287 PolarHBondContact O-N 3.03Å; S283-S287 PolarHBondContact O-OG 3.3Å; S284-S287 WeakPolarHBondContact O-CB 3.21Å; S284-S287 PolarHBondContact O-N 3.47Å; Q285-S287 VanDerWaalsContact C-N 3.27Å; Q285-S287 PolarHBondContact O-N 2.98Å; S287-L291 WeakPolarHBondContact O-CB 3.38Å; S287-L291 VanDerWaalsContact O-CG 3.3Å; S287-L291 WeakPolarHBondContact O-CG 3.3Å; S287-L291 PolarHBondContact O-N 3.11Å
288F66.9Low62.7Low148 Ų148107.9 Ų107.965%0.64957%0.574SS**Hα-helixtrans-67.3-37.6174.7-83.5-66000112.9S284 Q285 V286 L291 K292S284-F288 WeakPolarHBondContact O-CD2 3.37Å; S284-F288 PolarHBondContact O-N 3.27Å; Q285-F288 PolarHBondContact O-N 2.93Å; Q285-F288 VanDerWaalsContact O-N 3.08Å; V286-F288 PolarHBondContact O-N 3Å; F288-L291 PolarHBondContact O-N 2.99Å; F288-K292 VanDerWaalsContact O-CB 3.28Å; F288-K292 WeakPolarHBondContact O-CB 3.45Å; F288-K292 PolarHBondContact O-N 3.48Å
289E64.4Low62.5Low144 Ų144110.1 Ų110.167%0.67358%0.583SS**Hα-helixtrans-67.9-41.2176-66.3-146130.100112.4Q285 V286 K292 S293Q285-E289 PolarHBondContact O-N 2.9Å; V286-E289 PolarHBondContact O-N 3.08Å; E289-K292 PolarHBondContact O-N 2.83Å; E289-S293 WeakPolarHBondContact O-CB 3.42Å; E289-S293 PolarHBondContact O-N 3.24Å
290V68.7Low62.5Low80 Ų80108.7 Ų108.749%0.48558%0.581SS.*Hα-helixtrans-61.5-44.7173.5171.40000111.2V286 K292 S293 N294V286-V290 WeakPolarHBondContact O-CG2 3.28Å; V286-V290 PolarHBondContact O-N 3Å; V290-K292 VanDerWaalsContact C-N 3.33Å; V290-K292 PolarHBondContact O-N 3.43Å; V290-S293 PolarHBondContact O-N 3.21Å; V290-N294 PolarHBondContact O-N 3.06Å
291L67.7Low62.4Low107 Ų107109.9 Ų109.956%0.5658%0.583SS**Hα-helixtrans-63.7-36.5175.4-74.4169.7000112.7S287 F288 K295S287-L291 WeakPolarHBondContact O-CB 3.38Å; S287-L291 VanDerWaalsContact O-CG 3.3Å; S287-L291 WeakPolarHBondContact O-CG 3.3Å; S287-L291 PolarHBondContact O-N 3.11Å; F288-L291 PolarHBondContact O-N 2.99Å; L291-K295 PolarHBondContact O-N 3.34Å
292K70.3Confident62.5Low145 Ų145113.6 Ų113.663%0.6360%0.598SS**Hα-helixtrans-70-39.5176.1-173.2-179.8177.2-172.80111.9F288 E289 V290 K295 L296F288-K292 VanDerWaalsContact O-CB 3.28Å; F288-K292 WeakPolarHBondContact O-CB 3.45Å; F288-K292 PolarHBondContact O-N 3.48Å; E289-K292 PolarHBondContact O-N 2.83Å; V290-K292 VanDerWaalsContact C-N 3.33Å; V290-K292 PolarHBondContact O-N 3.43Å; K292-K295 PolarHBondContact O-N 3.36Å; K292-L296 PolarHBondContact O-N 3.45Å
293S66.7Low62.6Low67 Ų67115.3 Ų115.347%0.46961%0.606SS.*Hα-helixtrans-66.2-43.3176.5-174.30000111.7E289 V290 K295 L296E289-S293 WeakPolarHBondContact O-CB 3.42Å; E289-S293 PolarHBondContact O-N 3.24Å; V290-S293 PolarHBondContact O-N 3.21Å; S293-K295 VanDerWaalsContact C-N 3.28Å; S293-K295 PolarHBondContact O-N 3.2Å; S293-L296 PolarHBondContact O-N 3.36Å
294N62Low62.7Low93 Ų93118.5 Ų118.550%0.49762%0.615SS.*Hα-helixtrans-63.6-32.1175.2-75.1-13.3000112.9V290 L296 L297V290-N294 PolarHBondContact O-N 3.06Å; N294-L296 PolarHBondContact O-N 3.35Å; N294-L297 PolarHBondContact O-N 3.31Å
295K61.8Low62.7Low168 Ų168123.1 Ų123.173%0.7363%0.633SS**THydrogen-bonded Turntrans-73.8-5.7173.6-81.8-167.3174.2-170.30115.1L291 K292 S293L291-K295 PolarHBondContact O-N 3.34Å; K292-K295 PolarHBondContact O-N 3.36Å; S293-K295 VanDerWaalsContact C-N 3.28Å; S293-K295 PolarHBondContact O-N 3.2Å
296L58.7Low63.1Low138 Ų138122.8 Ų122.872%0.72364%0.636SS**THydrogen-bonded Turntrans-1036.1172.7-69.9168.5000112.4K292 S293 N294K292-L296 PolarHBondContact O-N 3.45Å; S293-L296 PolarHBondContact O-N 3.36Å; N294-L296 PolarHBondContact O-N 3.35Å
297L55.6Low62.9Low134 Ų134125.4 Ų125.470%0.70264%0.642SS**  trans-116.716.9177.9-63.8173.9000112.3N294N294-L297 PolarHBondContact O-N 3.31Å
298L50.9Low63.1Low213 Ų213130.6 Ų130.6100%1.11566%0.658SS**  trans-130.60176.3-67.8175.2000109.5

Retrieved 298 of 298 residues in 618.3 ms (Link to these results)