A0A087YQZ7_POEFO Loading...

Lysophosphatidic acid receptor 5b

AlphaFold DB , UniProt , Accession A0A087YQZ7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 327 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
1S56.7Low63.6Low128 Ų128102 Ų10290%0.89557%0.573SS**  0-48.5048.90000112.3N4 N5S1-N4 PolarHBondContact O-N 3.14Å; S1-N5 PolarHBondContact O-N 3.15Å; S1-N5 VanDerWaalsContact O-N 3.11Å
2V55Low64.7Low99 Ų99100.3 Ų100.360%0.656%0.562SS**Hα-helixtrans-65.1-42.3179.9-178.80000113.8N4 N5 N6V2-N4 VanDerWaalsContact C-N 3.29Å; V2-N4 PolarHBondContact O-N 3.28Å; V2-N5 PolarHBondContact O-N 3.09Å; V2-N6 VanDerWaalsContact O-CG 3.29Å; V2-N6 PolarHBondContact O-N 3.24Å; V2-N6 PolarHBondContact O-OD1 3.28Å
3L57.3Low65.7Low138 Ų13898 Ų9872%0.72356%0.557SS**Hα-helixtrans-61.3-37.1175.3-113.996.2000112.7N6 N7L3-N6 PolarHBondContact O-N 3.03Å; L3-N7 WeakPolarHBondContact O-CB 3.32Å; L3-N7 VanDerWaalsContact O-CG 3.25Å; L3-N7 PolarHBondContact O-N 3.49Å
4N60.2Low66.8Low110 Ų110100.4 Ų100.459%0.58856%0.561SS**Hα-helixtrans-71.2-38.6180-148.836.6000111S1 V2 Q8S1-N4 PolarHBondContact O-N 3.14Å; V2-N4 VanDerWaalsContact C-N 3.29Å; V2-N4 PolarHBondContact O-N 3.28Å; N4-Q8 WeakPolarHBondContact O-CB 3.48Å; N4-Q8 PolarHBondContact O-N 3.4Å
5N61.7Low68Low101 Ų101100.1 Ų100.154%0.5456%0.556SS.*Hα-helixtrans-66.6-39.1175-73.3-0.6000112.3S1 V2 Q8 L9S1-N5 PolarHBondContact O-N 3.15Å; S1-N5 VanDerWaalsContact O-N 3.11Å; V2-N5 PolarHBondContact O-N 3.09Å; N5-Q8 PolarHBondContact O-N 3.28Å; N5-L9 WeakPolarHBondContact O-CB 3.22Å; N5-L9 PolarHBondContact O-N 3.37Å
6N66.4Low69.2Low95 Ų9599.6 Ų99.651%0.50855%0.55SS..Hα-helixtrans-68.9-42.2178.4-68.1-8.3000111.8V2 L3 Q8 L9 S10V2-N6 VanDerWaalsContact O-CG 3.29Å; V2-N6 PolarHBondContact O-N 3.24Å; V2-N6 PolarHBondContact O-OD1 3.28Å; L3-N6 PolarHBondContact O-N 3.03Å; N6-Q8 VanDerWaalsContact C-N 3.34Å; N6-L9 PolarHBondContact O-N 3.11Å; N6-S10 PolarHBondContact O-N 3.03Å; N6-S10 PolarHBondContact O-OG 2.99Å
7N65.1Low70.3Confident93 Ų9394.9 Ų94.950%0.49753%0.526SS..Hα-helixtrans-65.9-36.9175-71-4.4000111.9L3 S10 V11L3-N7 WeakPolarHBondContact O-CB 3.32Å; L3-N7 VanDerWaalsContact O-CG 3.25Å; L3-N7 PolarHBondContact O-N 3.49Å; N7-S10 WeakPolarHBondContact CA-OG 3.42Å; N7-S10 PolarHBondContact O-OG 3.24Å; N7-V11 WeakPolarHBondContact O-CB 3.36Å; N7-V11 WeakPolarHBondContact O-CG2 3.36Å; N7-V11 PolarHBondContact O-N 3.45Å
8Q68.1Low71.4Confident112 Ų11294.3 Ų94.352%0.52353%0.525SS..Hα-helixtrans-71-35.4176.8-166.1169.1-3.900111.7N4 N5 N6 N12N4-Q8 WeakPolarHBondContact O-CB 3.48Å; N4-Q8 PolarHBondContact O-N 3.4Å; N5-Q8 PolarHBondContact O-N 3.28Å; N6-Q8 VanDerWaalsContact C-N 3.34Å; Q8-N12 WeakPolarHBondContact O-CB 3.49Å; Q8-N12 PolarHBondContact O-N 2.94Å; Q8-N12 VanDerWaalsContact O-N 3.07Å; Q8-N12 PolarHBondContact O-ND2 2.99Å; Q8-N12 VanDerWaalsContact O-ND2 3.14Å
9L69.3Low72.5Confident127 Ų12795.6 Ų95.667%0.66552%0.524SS*.Hα-helixtrans-67.4-41.5174.8-156.682.4000111.8N5 N6 N12 S13N5-L9 WeakPolarHBondContact O-CB 3.22Å; N5-L9 PolarHBondContact O-N 3.37Å; N6-L9 PolarHBondContact O-N 3.11Å; L9-N12 PolarHBondContact O-N 3.32Å; L9-S13 PolarHBondContact O-N 3.45Å; L9-S13 PolarHBondContact O-OG 3.44Å
10S68.6Low73.5Confident48 Ų4891.9 Ų91.934%0.33650%0.502SS..Hα-helixtrans-68.1-43.2178.764.70000112.3N6 N7 N12 S13 E14N6-S10 PolarHBondContact O-N 3.03Å; N6-S10 PolarHBondContact O-OG 2.99Å; N7-S10 WeakPolarHBondContact CA-OG 3.42Å; N7-S10 PolarHBondContact O-OG 3.24Å; S10-N12 VanDerWaalsContact C-N 3.33Å; S10-N12 PolarHBondContact O-N 2.96Å; S10-S13 WeakPolarHBondContact CA-OG 3.43Å; S10-S13 PolarHBondContact O-N 3.35Å; S10-S13 PolarHBondContact O-OG 2.93Å; S10-E14 PolarHBondContact O-N 3.05Å
11V71.4Confident74.5Confident71 Ų7188 Ų8843%0.4348%0.482SS..Hα-helixtrans-61.8-42.4175.1170.50000110.8N7 S13 E14 I15N7-V11 WeakPolarHBondContact O-CB 3.36Å; N7-V11 WeakPolarHBondContact O-CG2 3.36Å; N7-V11 PolarHBondContact O-N 3.45Å; V11-S13 VanDerWaalsContact C-N 3.35Å; V11-S13 PolarHBondContact O-N 3.26Å; V11-E14 PolarHBondContact O-N 3.47Å; V11-I15 HydrophobicContact CG1-CD1 3.75Å; V11-I15 HydrophobicContact CG1-CG1 4.46Å; V11-I15 VanDerWaalsContact O-CG1 3.27Å; V11-I15 WeakPolarHBondContact O-CG1 3.47Å; V11-I15 PolarHBondContact O-N 3.47Å
12N77.3Confident76.3Confident81 Ų8186 Ų8643%0.43347%0.465SS..Hα-helixtrans-63.9-38.6176.4-72.5-19.5000112.2Q8 L9 S10 M16Q8-N12 WeakPolarHBondContact O-CB 3.49Å; Q8-N12 PolarHBondContact O-N 2.94Å; Q8-N12 VanDerWaalsContact O-N 3.07Å; Q8-N12 PolarHBondContact O-ND2 2.99Å; Q8-N12 VanDerWaalsContact O-ND2 3.14Å; L9-N12 PolarHBondContact O-N 3.32Å; S10-N12 VanDerWaalsContact C-N 3.33Å; S10-N12 PolarHBondContact O-N 2.96Å; N12-M16 VanDerWaalsContact O-CG 3.23Å; N12-M16 WeakPolarHBondContact O-CG 3.43Å; N12-M16 PolarHBondContact O-N 3.43Å; N12-M16 VanDerWaalsContact O-N 3.08Å
13S77.5Confident78.2Confident71 Ų7182.9 Ų82.950%0.49745%0.446SS..Hα-helixtrans-67.6-38.9176.758.50000113.1L9 S10 V11 M16 S17L9-S13 PolarHBondContact O-N 3.45Å; L9-S13 PolarHBondContact O-OG 3.44Å; S10-S13 WeakPolarHBondContact CA-OG 3.43Å; S10-S13 PolarHBondContact O-N 3.35Å; S10-S13 PolarHBondContact O-OG 2.93Å; V11-S13 VanDerWaalsContact C-N 3.35Å; V11-S13 PolarHBondContact O-N 3.26Å; S13-M16 PolarHBondContact O-N 2.97Å; S13-S17 WeakPolarHBondContact O-CB 3.34Å; S13-S17 PolarHBondContact O-N 3.39Å
14E81.3Confident80Confident131 Ų13176.3 Ų76.361%0.61241%0.411SS*.Hα-helixtrans-65.4-45.3176.9-74.3177.7-171.900111.3S10 V11 M16 S17 V18S10-E14 PolarHBondContact O-N 3.05Å; V11-E14 PolarHBondContact O-N 3.47Å; E14-M16 VanDerWaalsContact C-N 3.32Å; E14-M16 PolarHBondContact O-N 3.47Å; E14-S17 PolarHBondContact O-N 3.01Å; E14-V18 WeakPolarHBondContact O-CG2 3.45Å; E14-V18 PolarHBondContact O-N 3.07Å
15I84.6Confident81.7Confident96 Ų9671.9 Ų71.949%0.49239%0.392SS..Hα-helixtrans-59.1-44.4176.6-68.5167.8000110.9V11 V18 F19V11-I15 HydrophobicContact CG1-CD1 3.75Å; V11-I15 HydrophobicContact CG1-CG1 4.46Å; V11-I15 VanDerWaalsContact O-CG1 3.27Å; V11-I15 WeakPolarHBondContact O-CG1 3.47Å; V11-I15 PolarHBondContact O-N 3.47Å; I15-V18 PolarHBondContact O-N 3.01Å; I15-F19 WeakPolarHBondContact O-CB 3.45Å; I15-F19 PolarHBondContact O-N 3.44Å
16M86.8Confident83.3Confident93 Ų9370 Ų7046%0.45839%0.386SS..Hα-helixtrans-66.2-39.8178.5-68.9-61.9143.100112N12 S13 E14 F19 Y20N12-M16 VanDerWaalsContact O-CG 3.23Å; N12-M16 WeakPolarHBondContact O-CG 3.43Å; N12-M16 PolarHBondContact O-N 3.43Å; N12-M16 VanDerWaalsContact O-N 3.08Å; S13-M16 PolarHBondContact O-N 2.97Å; E14-M16 VanDerWaalsContact C-N 3.32Å; E14-M16 PolarHBondContact O-N 3.47Å; M16-F19 WeakPolarHBondContact O-CB 3.49Å; M16-F19 PolarHBondContact O-N 2.98Å; M16-Y20 HydrophobicContact CB-CE2 4.16Å; M16-Y20 WeakPolarHBondContact O-CD2 3.5Å; M16-Y20 VanDerWaalsContact O-CG 3.24Å; M16-Y20 PolarHBondContact O-N 3.13Å
17S87.9Confident84.6Confident20 Ų2066 Ų6614%0.1436%0.364CS..Hα-helixtrans-61.4-48.2175.9-162.80000111.5S13 E14 F19 Y20 A21 Y77S13-S17 WeakPolarHBondContact O-CB 3.34Å; S13-S17 PolarHBondContact O-N 3.39Å; E14-S17 PolarHBondContact O-N 3.01Å; S17-F19 VanDerWaalsContact C-N 3.32Å; S17-F19 PolarHBondContact O-N 3.45Å; S17-Y20 PolarHBondContact O-N 3.39Å; S17-A21 PolarHBondContact O-N 2.78Å; S17-Y77 CarbonylContact C-O 3.04Å; S17-Y77 WeakPolarHBondContact O-CB 3.34Å; S17-Y77 WeakPolarHBondContact OG-CA 3.42Å; S17-Y77 PolarHBondContact OG-O 3.07Å
18V90.1Very high86.1Confident84 Ų8463.2 Ų63.251%0.50935%0.35SS..Hα-helixtrans-60.9-42175.8173.90000111.3E14 I15 Y20 A21 V22E14-V18 WeakPolarHBondContact O-CG2 3.45Å; E14-V18 PolarHBondContact O-N 3.07Å; I15-V18 PolarHBondContact O-N 3.01Å; V18-Y20 VanDerWaalsContact C-N 3.35Å; V18-Y20 PolarHBondContact O-N 3.48Å; V18-A21 WeakPolarHBondContact O-CB 3.49Å; V18-A21 PolarHBondContact O-N 3.32Å; V18-V22 WeakPolarHBondContact O-CG2 3.34Å; V18-V22 PolarHBondContact O-N 3.41Å
19F92.2Very high87.4Confident118 Ų11862.4 Ų62.452%0.51835%0.352SS..Hα-helixtrans-57.6-46.3175.1174.1-99.1000111.8I15 M16 S17 A21 V22 V23I15-F19 WeakPolarHBondContact O-CB 3.45Å; I15-F19 PolarHBondContact O-N 3.44Å; M16-F19 WeakPolarHBondContact O-CB 3.49Å; M16-F19 PolarHBondContact O-N 2.98Å; S17-F19 VanDerWaalsContact C-N 3.32Å; S17-F19 PolarHBondContact O-N 3.45Å; F19-A21 PolarHBondContact O-N 3.05Å; F19-V22 PolarHBondContact O-N 3.33Å; F19-V23 HydrophobicContact CD1-CG2 4.31Å; F19-V23 HydrophobicContact CE1-CG2 3.88Å; F19-V23 HydrophobicContact CE2-CG2 4.18Å; F19-V23 HydrophobicContact CZ-CG2 3.8Å; F19-V23 WeakPolarHBondContact O-CG2 3.44Å; F19-V23 PolarHBondContact O-N 3.02Å
20Y92.4Very high88.5Confident21 Ų2162.1 Ų62.18%0.08235%0.346CS..Hα-helixtrans-65.1-38.8176.9-61.4-44.5000112.7M16 S17 V18 V22 V23 F24 Y77 D253 T255 P256M16-Y20 HydrophobicContact CB-CE2 4.16Å; M16-Y20 WeakPolarHBondContact O-CD2 3.5Å; M16-Y20 VanDerWaalsContact O-CG 3.24Å; M16-Y20 PolarHBondContact O-N 3.13Å; S17-Y20 PolarHBondContact O-N 3.39Å; V18-Y20 VanDerWaalsContact C-N 3.35Å; V18-Y20 PolarHBondContact O-N 3.48Å; Y20-V22 VanDerWaalsContact C-N 3.3Å; Y20-V22 PolarHBondContact O-N 2.98Å; Y20-V23 PolarHBondContact O-N 2.99Å; Y20-F24 WeakPolarHBondContact O-CD2 3.41Å; Y20-F24 PolarHBondContact O-N 3.34Å; Y20-Y77 HydrophobicContact CD2-CD1 4.1Å; Y20-Y77 AromaticContact CD2-CE1 3.88Å; Y20-Y77 HydrophobicContact CD2-CE1 3.88Å; Y20-Y77 HydrophobicContact CG-CE1 4.42Å; Y20-D253 WeakPolarHBondContact CE2-OD2 3.28Å; Y20-D253 PolarHBondContact OH-OD2 3.49Å; Y20-T255 HydrophobicContact CD1-CG2 3.55Å; Y20-T255 HydrophobicContact CD2-CG2 3.41Å; Y20-T255 VanDerWaalsContact CD2-CG2 3.41Å; Y20-T255 HydrophobicContact CE1-CG2 3.72Å; Y20-T255 HydrophobicContact CE2-CG2 3.56Å; Y20-T255 HydrophobicContact CG-CG2 3.39Å; Y20-P256 HydrophobicContact CE1-CG 4.42Å; Y20-P256 WeakPolarHBondContact OH-CD 3.48Å; Y20-P256 WeakPolarHBondContact OH-CG 3.44Å
21A94Very high89.7Confident10 Ų1059.9 Ų59.98%0.08333%0.33CS..Hα-helixtrans-57.9-44.3173.600000111.3S17 V18 F19 G25 V74 A78S17-A21 PolarHBondContact O-N 2.78Å; V18-A21 WeakPolarHBondContact O-CB 3.49Å; V18-A21 PolarHBondContact O-N 3.32Å; F19-A21 PolarHBondContact O-N 3.05Å; A21-G25 PolarHBondContact O-N 2.87Å; A21-V74 HydrophobicContact CB-CG1 4.49Å; A21-A78 HydrophobicContact CB-CB 4.25Å
22V94.9Very high90.8Very high86 Ų8659.5 Ų59.552%0.52133%0.326SS..Hα-helixtrans-63.1-45.4176172.90000111.1V18 F19 Y20 G25 C26V18-V22 WeakPolarHBondContact O-CG2 3.34Å; V18-V22 PolarHBondContact O-N 3.41Å; F19-V22 PolarHBondContact O-N 3.33Å; Y20-V22 VanDerWaalsContact C-N 3.3Å; Y20-V22 PolarHBondContact O-N 2.98Å; V22-G25 PolarHBondContact O-N 3.35Å; V22-C26 PolarHBondContact O-N 2.75Å; V22-C26 PolarHBondContact O-SG 2.97Å
23V94.6Very high91.6Very high34 Ų3458.7 Ų58.721%0.20633%0.325CS..Hα-helixtrans-61.3-50.3179.2171.40000111.5F19 Y20 G25 C26 I27 C259F19-V23 HydrophobicContact CD1-CG2 4.31Å; F19-V23 HydrophobicContact CE1-CG2 3.88Å; F19-V23 HydrophobicContact CE2-CG2 4.18Å; F19-V23 HydrophobicContact CZ-CG2 3.8Å; F19-V23 WeakPolarHBondContact O-CG2 3.44Å; F19-V23 PolarHBondContact O-N 3.02Å; Y20-V23 PolarHBondContact O-N 2.99Å; V23-G25 VanDerWaalsContact C-N 3.28Å; V23-G25 PolarHBondContact O-N 3.01Å; V23-C26 PolarHBondContact O-N 3.06Å; V23-I27 HydrophobicContact CG1-CD1 3.98Å; V23-I27 WeakPolarHBondContact O-CG1 3.39Å; V23-I27 PolarHBondContact O-N 3.27Å; V23-C259 HydrophobicContact CG1-CB 4.15Å
24F94.8Very high92.4Very high0 Ų058.9 Ų58.90%032%0.32CS..Hα-helixtrans-64.5-34.2176.7-70.7-59.8000112.1Y20 I27 L28 L70 R73 V74 Y77 T255 I258 C259 T262Y20-F24 WeakPolarHBondContact O-CD2 3.41Å; Y20-F24 PolarHBondContact O-N 3.34Å; F24-I27 HydrophobicContact CD1-CD1 4.38Å; F24-I27 PolarHBondContact O-N 3.41Å; F24-L28 WeakPolarHBondContact O-CB 3.25Å; F24-L28 PolarHBondContact O-N 3.23Å; F24-L70 HydrophobicContact CD1-CD2 4.17Å; F24-R73 HydrophobicContact CD2-CG 3.91Å; F24-R73 HydrophobicContact CE2-CG 4.02Å; F24-R73 HydrophobicContact CG-CG 4.25Å; F24-R73 HydrophobicContact CZ-CG 4.43Å; F24-V74 HydrophobicContact CB-CG2 3.61Å; F24-Y77 AromaticContact CD2-CD2 3.75Å; F24-Y77 HydrophobicContact CD2-CD2 3.75Å; F24-Y77 AromaticContact CD2-CE2 3.84Å; F24-Y77 HydrophobicContact CD2-CE2 3.84Å; F24-Y77 AromaticContact CE2-CD2 3.8Å; F24-Y77 HydrophobicContact CE2-CD2 3.8Å; F24-Y77 AromaticContact CE2-CE2 3.39Å; F24-Y77 HydrophobicContact CE2-CE2 3.39Å; F24-Y77 HydrophobicContact CZ-CE2 4.4Å; F24-T255 HydrophobicContact CE2-CG2 4.22Å; F24-I258 HydrophobicContact CE1-CG2 4.44Å; F24-I258 HydrophobicContact CZ-CG2 4.04Å; F24-C259 HydrophobicContact CZ-CB 4.44Å; F24-C259 WeakPolarHBondContact CZ-SG 3.35Å; F24-T262 HydrophobicContact CD1-CG2 4.13Å; F24-T262 HydrophobicContact CE1-CG2 4.12Å
25G96Very high93Very high18 Ų1852.6 Ų52.619%0.18629%0.29CS..Hα-helixtrans-62.7-46173.800000112.3A21 V22 V23 I27 L28 V29A21-G25 PolarHBondContact O-N 2.87Å; V22-G25 PolarHBondContact O-N 3.35Å; V23-G25 VanDerWaalsContact C-N 3.28Å; V23-G25 PolarHBondContact O-N 3.01Å; G25-I27 PolarHBondContact O-N 3.23Å; G25-L28 WeakPolarHBondContact O-CB 3.41Å; G25-L28 PolarHBondContact O-N 3.47Å; G25-V29 VanDerWaalsContact O-CG2 3.31Å; G25-V29 WeakPolarHBondContact O-CG2 3.41Å; G25-V29 PolarHBondContact O-N 2.89Å
26C95.4Very high93.5Very high62 Ų6250.1 Ų50.142%0.41928%0.284SS..Hα-helixtrans-60-46.2173.5-71.40000111.2V22 V23 L28 V29 F30V22-C26 PolarHBondContact O-N 2.75Å; V22-C26 PolarHBondContact O-SG 2.97Å; V23-C26 PolarHBondContact O-N 3.06Å; C26-L28 VanDerWaalsContact C-N 3.28Å; C26-L28 PolarHBondContact O-N 3.07Å; C26-V29 PolarHBondContact O-N 3.03Å; C26-F30 HydrophobicContact CB-CD2 4.5Å; C26-F30 HydrophobicContact CB-CE2 4.49Å; C26-F30 WeakPolarHBondContact O-CD2 3.35Å; C26-F30 PolarHBondContact O-N 3.06Å
27I95Very high93.7Very high9 Ų949.6 Ų49.65%0.04629%0.286CS..Hα-helixtrans-61.3-38.4178.2-63.8163.4000111.2V23 F24 G25 G31 L70 T262 V263V23-I27 HydrophobicContact CG1-CD1 3.98Å; V23-I27 WeakPolarHBondContact O-CG1 3.39Å; V23-I27 PolarHBondContact O-N 3.27Å; F24-I27 HydrophobicContact CD1-CD1 4.38Å; F24-I27 PolarHBondContact O-N 3.41Å; G25-I27 PolarHBondContact O-N 3.23Å; I27-G31 VanDerWaalsContact O-CA 3.24Å; I27-G31 WeakPolarHBondContact O-CA 3.38Å; I27-G31 PolarHBondContact O-N 3.23Å; I27-L70 HydrophobicContact CB-CD1 4.35Å; I27-L70 HydrophobicContact CG2-CD1 3.82Å; I27-T262 HydrophobicContact CD1-CG2 4.01Å; I27-T262 HydrophobicContact CG2-CG2 3.93Å; I27-V263 HydrophobicContact CD1-CG2 3.94Å; I27-V263 HydrophobicContact CG1-CG2 4.39Å
28L95.6Very high93.9Very high36 Ų3649.6 Ų49.619%0.18829%0.286CS..Hα-helixtrans-62.7-49.8173.3171.565.8000111.7F24 G25 C26 F30 L32 A67 L70 P71F24-L28 WeakPolarHBondContact O-CB 3.25Å; F24-L28 PolarHBondContact O-N 3.23Å; G25-L28 WeakPolarHBondContact O-CB 3.41Å; G25-L28 PolarHBondContact O-N 3.47Å; C26-L28 VanDerWaalsContact C-N 3.28Å; C26-L28 PolarHBondContact O-N 3.07Å; L28-F30 VanDerWaalsContact C-N 3.29Å; L28-F30 PolarHBondContact O-N 3.46Å; L28-L32 HydrophobicContact CD1-CB 4.25Å; L28-L32 HydrophobicContact CD1-CD2 4.34Å; L28-L32 VanDerWaalsContact O-CB 3.26Å; L28-L32 WeakPolarHBondContact O-CB 3.38Å; L28-L32 PolarHBondContact O-N 3.2Å; L28-L32 VanDerWaalsContact O-N 3.12Å; L28-A67 VanDerWaalsContact CD1-O 3.32Å; L28-A67 WeakPolarHBondContact CD1-O 3.22Å; L28-L70 HydrophobicContact CB-CB 4.29Å; L28-L70 HydrophobicContact CB-CD1 4.29Å; L28-L70 HydrophobicContact CD1-CB 4.45Å; L28-P71 HydrophobicContact CD1-CG 4.25Å; L28-P71 HydrophobicContact CD2-CB 4.49Å; L28-P71 HydrophobicContact CD2-CG 3.79Å
29V95.4Very high94Very high95 Ų9547 Ų4758%0.57627%0.269SS*.Hα-helixtrans-62.3-34.4-176.8168.20000112.1G25 C26 P33G25-V29 VanDerWaalsContact O-CG2 3.31Å; G25-V29 WeakPolarHBondContact O-CG2 3.41Å; G25-V29 PolarHBondContact O-N 2.89Å; C26-V29 PolarHBondContact O-N 3.03Å; V29-P33 WeakPolarHBondContact O-CD 3.49Å; V29-P33 WeakPolarHBondContact O-CG 3.49Å
30F93.6Very high93.9Very high120 Ų12048.5 Ų48.553%0.52627%0.271SS..Hα-helixtrans-91.7-49.4176.8-66-65.1000112.5C26 L28 L32 P33 L34C26-F30 HydrophobicContact CB-CD2 4.5Å; C26-F30 HydrophobicContact CB-CE2 4.49Å; C26-F30 WeakPolarHBondContact O-CD2 3.35Å; C26-F30 PolarHBondContact O-N 3.06Å; L28-F30 VanDerWaalsContact C-N 3.29Å; L28-F30 PolarHBondContact O-N 3.46Å; F30-L32 PolarHBondContact O-N 3.18Å; F30-P33 WeakPolarHBondContact O-CD 3.43Å; F30-L34 HydrophobicContact CB-CD1 4.21Å; F30-L34 VanDerWaalsContact O-CB 3.23Å; F30-L34 WeakPolarHBondContact O-CB 3.45Å; F30-L34 WeakPolarHBondContact O-CD1 3.38Å; F30-L34 WeakPolarHBondContact O-CG 3.31Å; F30-L34 PolarHBondContact O-N 3.32Å; F30-L34 VanDerWaalsContact O-N 3.08Å
31G93.1Very high93.7Very high1 Ų150.4 Ų50.41%0.0128%0.282CS..Hα-helixtrans-63.1-42.3-172.900000113.3I27 N35I27-G31 VanDerWaalsContact O-CA 3.24Å; I27-G31 WeakPolarHBondContact O-CA 3.38Å; I27-G31 PolarHBondContact O-N 3.23Å; G31-N35 WeakPolarHBondContact O-CB 3.46Å; G31-N35 PolarHBondContact O-N 3.22Å; G31-N35 PolarHBondContact O-ND2 2.93Å
32L94.7Very high93.3Very high64 Ų6450 Ų5034%0.33528%0.279SS..Hα-helixtrans-64.2-57-179.2-170.676.8000112.4L28 F30 L34 A36 L64 A67 I68L28-L32 HydrophobicContact CD1-CB 4.25Å; L28-L32 HydrophobicContact CD1-CD2 4.34Å; L28-L32 VanDerWaalsContact O-CB 3.26Å; L28-L32 WeakPolarHBondContact O-CB 3.38Å; L28-L32 PolarHBondContact O-N 3.2Å; L28-L32 VanDerWaalsContact O-N 3.12Å; F30-L32 PolarHBondContact O-N 3.18Å; L32-L34 PolarHBondContact O-N 3.4Å; L32-A36 VanDerWaalsContact O-CB 3.23Å; L32-A36 WeakPolarHBondContact O-CB 3.21Å; L32-A36 PolarHBondContact O-N 3.01Å; L32-L64 HydrophobicContact CD1-CD2 3.84Å; L32-A67 HydrophobicContact CB-CB 4.17Å; L32-A67 HydrophobicContact CD1-CB 3.72Å; L32-I68 HydrophobicContact CD1-CG1 4.12Å
33P94.6Very high93Very high64 Ų6449.7 Ų49.742%0.41627%0.274SS..Hα-helixtrans-66.2-39-179.823.7-31.9000112.6V29 F30 N35 A36 V37V29-P33 WeakPolarHBondContact O-CD 3.49Å; V29-P33 WeakPolarHBondContact O-CG 3.49Å; F30-P33 WeakPolarHBondContact O-CD 3.43Å; P33-N35 PolarHBondContact O-N 2.94Å; P33-A36 PolarHBondContact O-N 3.42Å; P33-V37 WeakPolarHBondContact O-CB 3.32Å; P33-V37 VanDerWaalsContact O-CG2 3.26Å; P33-V37 WeakPolarHBondContact O-CG2 3.32Å; P33-V37 PolarHBondContact O-N 2.87Å
34L93.4Very high92.3Very high74 Ų7454.4 Ų54.439%0.38729%0.292SS..Hα-helixtrans-63.2-43.9179.9-70.3171.6000111.9F30 L32 S38 P269F30-L34 HydrophobicContact CB-CD1 4.21Å; F30-L34 VanDerWaalsContact O-CB 3.23Å; F30-L34 WeakPolarHBondContact O-CB 3.45Å; F30-L34 WeakPolarHBondContact O-CD1 3.38Å; F30-L34 WeakPolarHBondContact O-CG 3.31Å; F30-L34 PolarHBondContact O-N 3.32Å; F30-L34 VanDerWaalsContact O-N 3.08Å; L32-L34 PolarHBondContact O-N 3.4Å; L34-S38 VanDerWaalsContact O-CB 3.26Å; L34-S38 WeakPolarHBondContact O-CB 3.33Å; L34-S38 PolarHBondContact O-N 3.47Å; L34-S38 PolarHBondContact O-OG 2.91Å; L34-P269 HydrophobicContact CB-CB 4.06Å; L34-P269 HydrophobicContact CB-CG 3.57Å; L34-P269 HydrophobicContact CD1-CG 4.33Å
35N94.6Very high91.2Very high0 Ų060.7 Ų60.70%032%0.321CS..Hα-helixtrans-72.8-35.3177.2-74.5-67.6000112.4G31 P33 S38 L39 D63 L64 C265G31-N35 WeakPolarHBondContact O-CB 3.46Å; G31-N35 PolarHBondContact O-N 3.22Å; G31-N35 PolarHBondContact O-ND2 2.93Å; P33-N35 PolarHBondContact O-N 2.94Å; N35-S38 PolarHBondContact O-N 3.46Å; N35-L39 VanDerWaalsContact O-CB 3.28Å; N35-L39 WeakPolarHBondContact O-CB 3.49Å; N35-L39 PolarHBondContact O-N 3.41Å; N35-D63 HydrophobicContact CB-CB 4.36Å; N35-D63 PolarHBondContact OD1-OD2 2.95Å; N35-L64 HydrophobicContact CB-CD2 3.92Å; N35-L64 HydrophobicContact CB-CG 3.95Å; N35-C265 PolarHBondContact ND2-O 3.25Å
36A94.6Very high89.9Confident43 Ų4361.3 Ų61.336%0.35532%0.319SS..Hα-helixtrans-64-46.7176.300000111.7L32 P33 L39 W40 L64L32-A36 VanDerWaalsContact O-CB 3.23Å; L32-A36 WeakPolarHBondContact O-CB 3.21Å; L32-A36 PolarHBondContact O-N 3.01Å; P33-A36 PolarHBondContact O-N 3.42Å; A36-L39 PolarHBondContact O-N 3.31Å; A36-W40 WeakPolarHBondContact O-CB 3.38Å; A36-W40 PolarHBondContact O-N 3.24Å; A36-L64 HydrophobicContact CB-CD2 4.13Å
37V91.5Very high88Confident83 Ų8359.2 Ų59.250%0.50331%0.307SS..Hα-helixtrans-63.3-43.3175.5170.90000110.6P33 L39 W40 I41P33-V37 WeakPolarHBondContact O-CB 3.32Å; P33-V37 VanDerWaalsContact O-CG2 3.26Å; P33-V37 WeakPolarHBondContact O-CG2 3.32Å; P33-V37 PolarHBondContact O-N 2.87Å; V37-L39 PolarHBondContact O-N 3Å; V37-W40 WeakPolarHBondContact O-CB 3.28Å; V37-W40 PolarHBondContact O-N 3.48Å; V37-I41 HydrophobicContact CG1-CD1 3.66Å; V37-I41 HydrophobicContact CG1-CG1 4.35Å; V37-I41 WeakPolarHBondContact O-CB 3.3Å; V37-I41 VanDerWaalsContact O-CG1 3.27Å; V37-I41 WeakPolarHBondContact O-CG1 3.44Å; V37-I41 PolarHBondContact O-N 3.27Å
38S90.9Very high86.5Confident19 Ų1963 Ų6313%0.13333%0.328CS..Hα-helixtrans-61-45.9177.5-62.30000111.7L34 N35 I41 L42 Y272L34-S38 VanDerWaalsContact O-CB 3.26Å; L34-S38 WeakPolarHBondContact O-CB 3.33Å; L34-S38 PolarHBondContact O-N 3.47Å; L34-S38 PolarHBondContact O-OG 2.91Å; N35-S38 PolarHBondContact O-N 3.46Å; S38-I41 PolarHBondContact O-N 2.91Å; S38-L42 WeakPolarHBondContact O-CB 3.5Å; S38-L42 WeakPolarHBondContact O-CD1 3.49Å; S38-L42 WeakPolarHBondContact O-CG 3.27Å; S38-L42 PolarHBondContact O-N 3.34Å; S38-Y272 VanDerWaalsContact CB-CD2 3.49Å
39L92.4Very high85.3Confident29 Ų2970 Ų7015%0.15235%0.352CS..Hα-helixtrans-61.8-44.7176.7-178.261.2000111.3N35 A36 V37 I41 L42 L43 I57 A60 I61 L64N35-L39 VanDerWaalsContact O-CB 3.28Å; N35-L39 WeakPolarHBondContact O-CB 3.49Å; N35-L39 PolarHBondContact O-N 3.41Å; A36-L39 PolarHBondContact O-N 3.31Å; V37-L39 PolarHBondContact O-N 3Å; L39-I41 PolarHBondContact O-N 3.49Å; L39-L42 PolarHBondContact O-N 3.48Å; L39-L43 HydrophobicContact CD1-CD1 3.84Å; L39-L43 HydrophobicContact CD1-CG 4.01Å; L39-L43 HydrophobicContact CG-CD1 3.85Å; L39-L43 HydrophobicContact CG-CG 4.4Å; L39-L43 WeakPolarHBondContact O-CB 3.4Å; L39-L43 VanDerWaalsContact O-CG 3.3Å; L39-L43 WeakPolarHBondContact O-CG 3.49Å; L39-L43 PolarHBondContact O-N 2.87Å; L39-I57 HydrophobicContact CD1-CB 4.35Å; L39-I57 HydrophobicContact CD1-CG1 4.34Å; L39-I57 HydrophobicContact CD1-CG2 3.79Å; L39-A60 HydrophobicContact CB-CB 4.19Å; L39-A60 HydrophobicContact CD1-CB 4.44Å; L39-I61 HydrophobicContact CD1-CG1 4.19Å; L39-I61 HydrophobicContact CD2-CG1 4.16Å; L39-L64 HydrophobicContact CB-CD1 4.4Å; L39-L64 HydrophobicContact CD2-CD1 3.56Å
40W91Very high84.4Confident150 Ų15066.2 Ų66.257%0.56833%0.329SS*.Hα-helixtrans-57.2-49.8175.1177.6-94.4000111.7A36 V37 L42 L43 F44A36-W40 WeakPolarHBondContact O-CB 3.38Å; A36-W40 PolarHBondContact O-N 3.24Å; V37-W40 WeakPolarHBondContact O-CB 3.28Å; V37-W40 PolarHBondContact O-N 3.48Å; W40-L42 VanDerWaalsContact C-N 3.35Å; W40-L42 PolarHBondContact O-N 2.98Å; W40-L43 PolarHBondContact O-N 2.85Å; W40-F44 AromaticContact CD2-CD2 3.48Å; W40-F44 HydrophobicContact CD2-CD2 3.48Å; W40-F44 VanDerWaalsContact CD2-CD2 3.48Å; W40-F44 AromaticContact CD2-CE2 3.86Å; W40-F44 HydrophobicContact CD2-CE2 3.86Å; W40-F44 HydrophobicContact CD2-CG 4.36Å; W40-F44 AromaticContact CE2-CD2 3.8Å; W40-F44 AromaticContact CE3-CD2 3.39Å; W40-F44 HydrophobicContact CE3-CD2 3.39Å; W40-F44 AromaticContact CE3-CE2 3.22Å; W40-F44 HydrophobicContact CE3-CE2 3.22Å; W40-F44 HydrophobicContact CE3-CG 4.46Å; W40-F44 HydrophobicContact CE3-CZ 4.18Å; W40-F44 HydrophobicContact CG-CD2 4.12Å; W40-F44 AromaticContact CH2-CD2 3.91Å; W40-F44 HydrophobicContact CH2-CD2 3.91Å; W40-F44 HydrophobicContact CH2-CE1 4.41Å; W40-F44 AromaticContact CH2-CE2 3.78Å; W40-F44 HydrophobicContact CH2-CE2 3.78Å; W40-F44 HydrophobicContact CH2-CG 4.31Å; W40-F44 HydrophobicContact CH2-CZ 4.03Å; W40-F44 HydrophobicContact CZ2-CD2 4.01Å; W40-F44 HydrophobicContact CZ2-CE2 4.35Å; W40-F44 HydrophobicContact CZ2-CG 4.22Å; W40-F44 AromaticContact CZ3-CD2 3.61Å; W40-F44 HydrophobicContact CZ3-CD2 3.61Å; W40-F44 HydrophobicContact CZ3-CE1 4.47Å; W40-F44 AromaticContact CZ3-CE2 3.17Å; W40-F44 HydrophobicContact CZ3-CE2 3.17Å; W40-F44 HydrophobicContact CZ3-CG 4.44Å; W40-F44 AromaticContact CZ3-CZ 3.67Å; W40-F44 HydrophobicContact CZ3-CZ 3.67Å; W40-F44 WeakPolarHBondContact O-CB 3.37Å; W40-F44 WeakPolarHBondContact O-CD2 3.45Å; W40-F44 PolarHBondContact O-N 3.44Å
41I87Confident83.9Confident62 Ų6261.4 Ų61.432%0.31831%0.31SS..Iπ-helixtrans-62-42.9178.6-68.5168.3000111V37 S38 L39 H45 H46V37-I41 HydrophobicContact CG1-CD1 3.66Å; V37-I41 HydrophobicContact CG1-CG1 4.35Å; V37-I41 WeakPolarHBondContact O-CB 3.3Å; V37-I41 VanDerWaalsContact O-CG1 3.27Å; V37-I41 WeakPolarHBondContact O-CG1 3.44Å; V37-I41 PolarHBondContact O-N 3.27Å; S38-I41 PolarHBondContact O-N 2.91Å; L39-I41 PolarHBondContact O-N 3.49Å; I41-H45 HydrophobicContact CG2-CB 4.28Å; I41-H45 WeakPolarHBondContact O-CA 3.37Å; I41-H45 VanDerWaalsContact O-CB 3.32Å; I41-H45 WeakPolarHBondContact O-CB 3.11Å; I41-H45 PolarHBondContact O-N 2.86Å; I41-H46 WeakPolarHBondContact CG2-NE2 3.35Å; I41-H46 PolarHBondContact O-N 2.98Å
42L86.7Confident83.6Confident1 Ų161.5 Ų61.51%0.00531%0.31CS..Iπ-helixtrans-64.6-42.1179.6-73.4166.8000112.4S38 L39 W40 G47 M56 I57 L276S38-L42 WeakPolarHBondContact O-CB 3.5Å; S38-L42 WeakPolarHBondContact O-CD1 3.49Å; S38-L42 WeakPolarHBondContact O-CG 3.27Å; S38-L42 PolarHBondContact O-N 3.34Å; L39-L42 PolarHBondContact O-N 3.48Å; W40-L42 VanDerWaalsContact C-N 3.35Å; W40-L42 PolarHBondContact O-N 2.98Å; L42-G47 PolarHBondContact O-N 2.68Å; L42-M56 HydrophobicContact CD1-CB 3.85Å; L42-M56 HydrophobicContact CD2-CB 4.33Å; L42-M56 HydrophobicContact CD2-CE 3.88Å; L42-I57 HydrophobicContact CB-CD1 4.18Å; L42-I57 HydrophobicContact CB-CG1 3.67Å; L42-I57 HydrophobicContact CD1-CG1 4.11Å; L42-I57 HydrophobicContact CG-CG1 4.43Å; L42-L276 HydrophobicContact CD2-CD1 4.07Å; L42-L276 HydrophobicContact CD2-CD2 4.16Å
43L87.3Confident83.3Confident80 Ų8058.5 Ų58.542%0.41929%0.294SS..Iπ-helixtrans-73.1-49.2-179.9-69.2174.1000112.2L39 W40 I57L39-L43 HydrophobicContact CD1-CD1 3.84Å; L39-L43 HydrophobicContact CD1-CG 4.01Å; L39-L43 HydrophobicContact CG-CD1 3.85Å; L39-L43 HydrophobicContact CG-CG 4.4Å; L39-L43 WeakPolarHBondContact O-CB 3.4Å; L39-L43 VanDerWaalsContact O-CG 3.3Å; L39-L43 WeakPolarHBondContact O-CG 3.49Å; L39-L43 PolarHBondContact O-N 2.87Å; W40-L43 PolarHBondContact O-N 2.85Å; L43-I57 HydrophobicContact CD2-CD1 3.91Å; L43-I57 HydrophobicContact CD2-CG1 4.42Å; L43-I57 HydrophobicContact CD2-CG2 4.36Å
44F81.2Confident83.2Confident133 Ų13355.7 Ų55.758%0.58328%0.276SS*.Iπ-helixtrans-95.2-36.3-168.4-67.1-79.6000114.2W40W40-F44 AromaticContact CD2-CD2 3.48Å; W40-F44 HydrophobicContact CD2-CD2 3.48Å; W40-F44 VanDerWaalsContact CD2-CD2 3.48Å; W40-F44 AromaticContact CD2-CE2 3.86Å; W40-F44 HydrophobicContact CD2-CE2 3.86Å; W40-F44 HydrophobicContact CD2-CG 4.36Å; W40-F44 AromaticContact CE2-CD2 3.8Å; W40-F44 AromaticContact CE3-CD2 3.39Å; W40-F44 HydrophobicContact CE3-CD2 3.39Å; W40-F44 AromaticContact CE3-CE2 3.22Å; W40-F44 HydrophobicContact CE3-CE2 3.22Å; W40-F44 HydrophobicContact CE3-CG 4.46Å; W40-F44 HydrophobicContact CE3-CZ 4.18Å; W40-F44 HydrophobicContact CG-CD2 4.12Å; W40-F44 AromaticContact CH2-CD2 3.91Å; W40-F44 HydrophobicContact CH2-CD2 3.91Å; W40-F44 HydrophobicContact CH2-CE1 4.41Å; W40-F44 AromaticContact CH2-CE2 3.78Å; W40-F44 HydrophobicContact CH2-CE2 3.78Å; W40-F44 HydrophobicContact CH2-CG 4.31Å; W40-F44 HydrophobicContact CH2-CZ 4.03Å; W40-F44 HydrophobicContact CZ2-CD2 4.01Å; W40-F44 HydrophobicContact CZ2-CE2 4.35Å; W40-F44 HydrophobicContact CZ2-CG 4.22Å; W40-F44 AromaticContact CZ3-CD2 3.61Å; W40-F44 HydrophobicContact CZ3-CD2 3.61Å; W40-F44 HydrophobicContact CZ3-CE1 4.47Å; W40-F44 AromaticContact CZ3-CE2 3.17Å; W40-F44 HydrophobicContact CZ3-CE2 3.17Å; W40-F44 HydrophobicContact CZ3-CG 4.44Å; W40-F44 AromaticContact CZ3-CZ 3.67Å; W40-F44 HydrophobicContact CZ3-CZ 3.67Å; W40-F44 WeakPolarHBondContact O-CB 3.37Å; W40-F44 WeakPolarHBondContact O-CD2 3.45Å; W40-F44 PolarHBondContact O-N 3.44Å
45H71.9Confident83.1Confident131 Ų13153.1 Ų53.161%0.60626%0.262SS*.Iπ-helixtrans-91.8-44.8-179.2-85-86.2000112.8I41 R49I41-H45 HydrophobicContact CG2-CB 4.28Å; I41-H45 WeakPolarHBondContact O-CA 3.37Å; I41-H45 VanDerWaalsContact O-CB 3.32Å; I41-H45 WeakPolarHBondContact O-CB 3.11Å; I41-H45 PolarHBondContact O-N 2.86Å; H45-R49 PolarHBondContact O-NH1 3.2Å
46H67.6Low83.1Confident31 Ų3153.2 Ų53.214%0.14426%0.262CS..Iπ-helixtrans-82.1-35-178.2-67.8-55000112.4I41 R49 W280I41-H46 WeakPolarHBondContact CG2-NE2 3.35Å; I41-H46 PolarHBondContact O-N 2.98Å; H46-R49 VanDerWaalsContact O-CD 3.3Å; H46-R49 WeakPolarHBondContact O-CD 3.42Å; H46-R49 VanDerWaalsContact O-CG 3.32Å; H46-R49 WeakPolarHBondContact O-CG 3.3Å; H46-R49 PolarHBondContact O-NH1 3.38Å; H46-W280 AromaticContact CE1-CE2 3.56Å; H46-W280 AromaticContact CE1-CZ2 3.63Å; H46-W280 AromaticContact CE1-NE1 2.95Å; H46-W280 PolarHBondContact CE1-NE1 3.49Å; H46-W280 AromaticContact ND1-CE2 3.55Å; H46-W280 AromaticContact ND1-CZ2 3.33Å; H46-W280 VanDerWaalsContact ND1-CZ2 3.33Å; H46-W280 WeakPolarHBondContact ND1-CZ2 3.05Å; H46-W280 AromaticContact ND1-NE1 3.23Å; H46-W280 PolarHBondContact ND1-NE1 3.27Å
47G56.5Low83Confident18 Ų1851.7 Ų51.719%0.18625%0.248CC..  trans60.1163.9-167.100000110.7L42 R49L42-G47 PolarHBondContact O-N 2.68Å; G47-R49 PolarHBondContact O-N 3.46Å
48L63.5Low83.2Confident90 Ų9048.9 Ų48.947%0.47123%0.23SC..SBendtrans-69.346.3176-67.4165.9000112.8V54 I57 L130L48-V54 HydrophobicContact CD2-CG2 4.07Å; L48-I57 HydrophobicContact CD2-CD1 3.47Å; L48-I57 VanDerWaalsContact CD2-CD1 3.47Å; L48-I57 HydrophobicContact CG-CD1 4.42Å; L48-L130 HydrophobicContact CB-CD1 4.1Å; L48-L130 HydrophobicContact CB-CD2 4.38Å
49R68.9Low83.4Confident183 Ų18348 Ų4869%0.69122%0.224SC*.  trans-82.2-12.2-173.2-65.8-172.3178.6114.4-6113.3H45 H46 G47H45-R49 PolarHBondContact O-NH1 3.2Å; H46-R49 VanDerWaalsContact O-CD 3.3Å; H46-R49 WeakPolarHBondContact O-CD 3.42Å; H46-R49 VanDerWaalsContact O-CG 3.32Å; H46-R49 WeakPolarHBondContact O-CG 3.3Å; H46-R49 PolarHBondContact O-NH1 3.38Å; G47-R49 PolarHBondContact O-N 3.46Å
50S77.9Confident83.6Confident14 Ų1446.6 Ų46.610%0.09822%0.217CC..SBendtrans-137145.4179.270.50000111.9I52 A53S50-I52 PolarHBondContact O-N 3.23Å; S50-I52 VanDerWaalsContact OG-CG2 3.26Å; S50-I52 WeakPolarHBondContact OG-CG2 3.4Å; S50-A53 WeakPolarHBondContact O-CB 3.39Å; S50-A53 PolarHBondContact O-N 2.93Å; S50-A53 VanDerWaalsContact O-N 3.09Å; S50-A53 WeakPolarHBondContact OG-CB 3.47Å; S50-A53 PolarHBondContact OG-N 3.06Å
51P82.9Confident83.8Confident20 Ų2042.4 Ų42.413%0.1321%0.205CC..Hα-helixtrans-55.4-39.8176.8-22.330.3000112.6A53 V54 R128 A133P51-A53 VanDerWaalsContact C-N 3.29Å; P51-A53 PolarHBondContact O-N 3Å; P51-V54 WeakPolarHBondContact O-CB 3.26Å; P51-V54 PolarHBondContact O-N 3.2Å; P51-V54 VanDerWaalsContact O-N 3.14Å; P51-R128 HydrophobicContact CG-CB 4.25Å; P51-R128 WeakPolarHBondContact CG-O 3.32Å; P51-A133 HydrophobicContact CB-CB 3.85Å; P51-A133 WeakPolarHBondContact O-CB 3.4Å
52I86Confident84.3Confident2 Ų239.5 Ų39.51%0.0119%0.19CC..Hα-helixtrans-63.7-31.6178.5-171.9152.6000113.3S50 V54 F55 M56 I110 D113 R114S50-I52 PolarHBondContact O-N 3.23Å; S50-I52 VanDerWaalsContact OG-CG2 3.26Å; S50-I52 WeakPolarHBondContact OG-CG2 3.4Å; I52-V54 PolarHBondContact O-N 2.85Å; I52-F55 PolarHBondContact O-N 3.38Å; I52-M56 HydrophobicContact CG1-CE 4.23Å; I52-M56 HydrophobicContact CG1-CG 4.47Å; I52-M56 HydrophobicContact CG1-SD 4.48Å; I52-M56 HydrophobicContact CG2-CE 4.35Å; I52-M56 WeakPolarHBondContact O-CG 3.12Å; I52-M56 PolarHBondContact O-N 2.95Å; I52-I110 HydrophobicContact CD1-CG2 3.99Å; I52-I110 HydrophobicContact CG1-CG1 4.45Å; I52-I110 HydrophobicContact CG1-CG2 4.45Å; I52-D113 HydrophobicContact CD1-CB 4.44Å; I52-R114 HydrophobicContact CD1-CG 3.92Å; I52-R114 VanDerWaalsContact CD1-NH2 3.29Å
53A88.5Confident84.7Confident1 Ų139.4 Ų39.41%0.00819%0.19CC..Hα-helixtrans-63.8-31.4176.100000111.9S50 P51 M56 I57S50-A53 WeakPolarHBondContact O-CB 3.39Å; S50-A53 PolarHBondContact O-N 2.93Å; S50-A53 VanDerWaalsContact O-N 3.09Å; S50-A53 WeakPolarHBondContact OG-CB 3.47Å; S50-A53 PolarHBondContact OG-N 3.06Å; P51-A53 VanDerWaalsContact C-N 3.29Å; P51-A53 PolarHBondContact O-N 3Å; A53-M56 HydrophobicContact CB-CE 4.28Å; A53-M56 PolarHBondContact O-N 2.68Å; A53-I57 WeakPolarHBondContact O-CB 3.34Å; A53-I57 WeakPolarHBondContact O-CD1 3.32Å; A53-I57 WeakPolarHBondContact O-CG1 3.43Å; A53-I57 PolarHBondContact O-N 2.67Å
54V92Very high85.2Confident5 Ų536.9 Ų36.93%0.0318%0.176CC..Hα-helixtrans-62.1-47.5174.7-177.50000110.6L48 P51 I52 I57 N58 L130 A133 V134 A137L48-V54 HydrophobicContact CD2-CG2 4.07Å; P51-V54 WeakPolarHBondContact O-CB 3.26Å; P51-V54 PolarHBondContact O-N 3.2Å; P51-V54 VanDerWaalsContact O-N 3.14Å; I52-V54 PolarHBondContact O-N 2.85Å; V54-I57 PolarHBondContact O-N 2.95Å; V54-N58 PolarHBondContact O-N 2.86Å; V54-N58 PolarHBondContact O-ND2 3.1Å; V54-L130 HydrophobicContact CG2-CD1 3.32Å; V54-A133 HydrophobicContact CB-CB 3.95Å; V54-A133 HydrophobicContact CG1-CB 4.33Å; V54-A133 HydrophobicContact CG2-CB 3.99Å; V54-V134 HydrophobicContact CG1-CG2 4.16Å; V54-V134 HydrophobicContact CG2-CG2 4.23Å; V54-A137 HydrophobicContact CG1-CB 4.17Å
55F93.1Very high85.8Confident21 Ų2133.4 Ų33.49%0.09216%0.162CC..Hα-helixtrans-64.7-41.6179.3-56.4-42.9000111.6I52 I57 N58 L59 F106 F109 I110 A133I52-F55 PolarHBondContact O-N 3.38Å; F55-I57 PolarHBondContact O-N 3.23Å; F55-N58 PolarHBondContact O-N 3.31Å; F55-L59 WeakPolarHBondContact O-CB 3.26Å; F55-L59 PolarHBondContact O-N 3.13Å; F55-F106 HydrophobicContact CB-CD1 4.32Å; F55-F106 HydrophobicContact CD1-CD1 4.11Å; F55-F106 HydrophobicContact CD1-CE1 4.34Å; F55-F109 HydrophobicContact CD1-CB 4.14Å; F55-F109 AromaticContact CD1-CD2 3.91Å; F55-F109 HydrophobicContact CD1-CD2 3.91Å; F55-F109 HydrophobicContact CD2-CB 3.9Å; F55-F109 HydrophobicContact CE1-CB 4.21Å; F55-F109 AromaticContact CE1-CD2 3.59Å; F55-F109 HydrophobicContact CE1-CD2 3.59Å; F55-F109 HydrophobicContact CE1-CE2 4.37Å; F55-F109 HydrophobicContact CE1-CG 4.32Å; F55-F109 HydrophobicContact CE2-CB 3.97Å; F55-F109 HydrophobicContact CG-CB 4Å; F55-F109 HydrophobicContact CZ-CB 4.12Å; F55-F109 HydrophobicContact CZ-CD2 4.02Å; F55-F109 HydrophobicContact CZ-CG 4.38Å; F55-I110 HydrophobicContact CB-CD1 4.33Å; F55-I110 HydrophobicContact CB-CG1 3.77Å; F55-A133 HydrophobicContact CE1-CB 4.05Å; F55-A133 HydrophobicContact CE2-CB 4.34Å; F55-A133 HydrophobicContact CZ-CB 3.82Å
56M92.8Very high87Confident1 Ų127.2 Ų27.21%0.00513%0.134CC..Hα-helixtrans-63.6-39.9176-66.7-173.9-65.100112.7L42 I52 A53 L59 A60 I110 Y272 L276L42-M56 HydrophobicContact CD1-CB 3.85Å; L42-M56 HydrophobicContact CD2-CB 4.33Å; L42-M56 HydrophobicContact CD2-CE 3.88Å; I52-M56 HydrophobicContact CG1-CE 4.23Å; I52-M56 HydrophobicContact CG1-CG 4.47Å; I52-M56 HydrophobicContact CG1-SD 4.48Å; I52-M56 HydrophobicContact CG2-CE 4.35Å; I52-M56 WeakPolarHBondContact O-CG 3.12Å; I52-M56 PolarHBondContact O-N 2.95Å; A53-M56 HydrophobicContact CB-CE 4.28Å; A53-M56 PolarHBondContact O-N 2.68Å; M56-L59 PolarHBondContact O-N 3.37Å; M56-A60 WeakPolarHBondContact O-CB 3.25Å; M56-A60 PolarHBondContact O-N 2.91Å; M56-I110 HydrophobicContact CG-CD1 3.88Å; M56-I110 HydrophobicContact CG-CG1 4.4Å; M56-Y272 HydrophobicContact CB-CD1 3.73Å; M56-Y272 HydrophobicContact CB-CE1 3.79Å; M56-Y272 HydrophobicContact CG-CD1 3.71Å; M56-Y272 HydrophobicContact CG-CE1 4.04Å; M56-Y272 HydrophobicContact SD-CD1 3.9Å; M56-L276 HydrophobicContact CE-CD2 3.92Å; M56-L276 HydrophobicContact CE-CG 4.32Å
57I93.6Very high88.3Confident12 Ų1225.9 Ų25.96%0.06213%0.128CC..Hα-helixtrans-63.7-45175.9-75.1163000110.8L39 L42 L43 L48 A53 V54 F55 A60 I61L39-I57 HydrophobicContact CD1-CB 4.35Å; L39-I57 HydrophobicContact CD1-CG1 4.34Å; L39-I57 HydrophobicContact CD1-CG2 3.79Å; L42-I57 HydrophobicContact CB-CD1 4.18Å; L42-I57 HydrophobicContact CB-CG1 3.67Å; L42-I57 HydrophobicContact CD1-CG1 4.11Å; L42-I57 HydrophobicContact CG-CG1 4.43Å; L43-I57 HydrophobicContact CD2-CD1 3.91Å; L43-I57 HydrophobicContact CD2-CG1 4.42Å; L43-I57 HydrophobicContact CD2-CG2 4.36Å; L48-I57 HydrophobicContact CD2-CD1 3.47Å; L48-I57 VanDerWaalsContact CD2-CD1 3.47Å; L48-I57 HydrophobicContact CG-CD1 4.42Å; A53-I57 WeakPolarHBondContact O-CB 3.34Å; A53-I57 WeakPolarHBondContact O-CD1 3.32Å; A53-I57 WeakPolarHBondContact O-CG1 3.43Å; A53-I57 PolarHBondContact O-N 2.67Å; V54-I57 PolarHBondContact O-N 2.95Å; F55-I57 PolarHBondContact O-N 3.23Å; I57-A60 PolarHBondContact O-N 2.89Å; I57-I61 HydrophobicContact CG2-CD1 3.81Å; I57-I61 VanDerWaalsContact O-CG1 3.26Å; I57-I61 WeakPolarHBondContact O-CG1 3.48Å; I57-I61 PolarHBondContact O-N 3.27Å
58N95.6Very high90.2Very high24 Ų2430.6 Ų30.613%0.12815%0.148CC..Hα-helixtrans-69.5-34.2-180-76.1-89.9000112.4V54 F55 I61 S62 F106 W141V54-N58 PolarHBondContact O-N 2.86Å; V54-N58 PolarHBondContact O-ND2 3.1Å; F55-N58 PolarHBondContact O-N 3.31Å; N58-I61 PolarHBondContact O-N 3.49Å; N58-S62 PolarHBondContact O-N 3.44Å; N58-F106 HydrophobicContact CB-CD1 4.2Å; N58-F106 HydrophobicContact CB-CD2 4.13Å; N58-F106 HydrophobicContact CB-CE1 3.65Å; N58-F106 HydrophobicContact CB-CE2 3.58Å; N58-F106 HydrophobicContact CB-CG 4.45Å; N58-F106 HydrophobicContact CB-CZ 3.34Å; N58-W141 PolarHBondContact OD1-NE1 3.41Å
59L95.1Very high91.6Very high0 Ų026.7 Ų26.70%013%0.128CC..Hα-helixtrans-60.2-51.4170.7-17459.8000110.4F55 M56 I61 S62 D63 S103 F106 I107 I110 D268 Y272F55-L59 WeakPolarHBondContact O-CB 3.26Å; F55-L59 PolarHBondContact O-N 3.13Å; M56-L59 PolarHBondContact O-N 3.37Å; L59-I61 VanDerWaalsContact C-N 3.3Å; L59-I61 PolarHBondContact O-N 2.92Å; L59-S62 WeakPolarHBondContact O-CA 3.36Å; L59-S62 VanDerWaalsContact O-CB 3.28Å; L59-S62 WeakPolarHBondContact O-CB 3.26Å; L59-S62 PolarHBondContact O-N 3.31Å; L59-D63 PolarHBondContact O-N 3.48Å; L59-D63 VanDerWaalsContact O-OD2 3.13Å; L59-S103 VanDerWaalsContact CD1-CB 3.47Å; L59-S103 WeakPolarHBondContact CD1-OG 3.44Å; L59-F106 HydrophobicContact CB-CB 4.11Å; L59-F106 HydrophobicContact CD1-CB 4.14Å; L59-I107 HydrophobicContact CD1-CG1 4.24Å; L59-I107 HydrophobicContact CD2-CG1 3.85Å; L59-I110 HydrophobicContact CD2-CD1 3.98Å; L59-D268 HydrophobicContact CD2-CB 4.17Å; L59-D268 HydrophobicContact CG-CB 4.4Å; L59-Y272 HydrophobicContact CB-CE1 4.31Å; L59-Y272 WeakPolarHBondContact CB-OH 3.36Å; L59-Y272 HydrophobicContact CD2-CE1 3.87Å; L59-Y272 HydrophobicContact CG-CE1 4.31Å; L59-Y272 WeakPolarHBondContact CG-OH 2.98Å
60A95.6Very high92.8Very high0 Ų018.1 Ų18.10%010%0.096CC..Hα-helixtrans-60.7-36.7177.800000113L39 M56 I57 D63 L64 Y272L39-A60 HydrophobicContact CB-CB 4.19Å; L39-A60 HydrophobicContact CD1-CB 4.44Å; M56-A60 WeakPolarHBondContact O-CB 3.25Å; M56-A60 PolarHBondContact O-N 2.91Å; I57-A60 PolarHBondContact O-N 2.89Å; A60-D63 PolarHBondContact O-N 3.34Å; A60-L64 WeakPolarHBondContact O-CB 3.19Å; A60-L64 VanDerWaalsContact O-CG 3.23Å; A60-L64 WeakPolarHBondContact O-CG 3.28Å; A60-L64 PolarHBondContact O-N 3.09Å; A60-Y272 WeakPolarHBondContact CA-OH 3.2Å; A60-Y272 HydrophobicContact CB-CE2 4.26Å; A60-Y272 PolarHBondContact N-OH 3.03Å
61I96Very high93.7Very high62 Ų6220.2 Ų20.232%0.31811%0.109SC..Hα-helixtrans-63.5-45.8173.6-70.6165.8000110.6L39 I57 N58 L59 D63 L64 M65 W141L39-I61 HydrophobicContact CD1-CG1 4.19Å; L39-I61 HydrophobicContact CD2-CG1 4.16Å; I57-I61 HydrophobicContact CG2-CD1 3.81Å; I57-I61 VanDerWaalsContact O-CG1 3.26Å; I57-I61 WeakPolarHBondContact O-CG1 3.48Å; I57-I61 PolarHBondContact O-N 3.27Å; N58-I61 PolarHBondContact O-N 3.49Å; L59-I61 VanDerWaalsContact C-N 3.3Å; L59-I61 PolarHBondContact O-N 2.92Å; I61-D63 VanDerWaalsContact C-N 3.32Å; I61-D63 PolarHBondContact O-N 3.38Å; I61-L64 PolarHBondContact O-N 3.3Å; I61-M65 HydrophobicContact CG2-CG 4.47Å; I61-M65 HydrophobicContact CG2-SD 3.94Å; I61-M65 VanDerWaalsContact O-CG 3.26Å; I61-M65 WeakPolarHBondContact O-CG 3.27Å; I61-M65 PolarHBondContact O-N 2.97Å; I61-W141 HydrophobicContact CG2-CZ2 4.32Å
62S96.8Very high94.2Very high0 Ų021.8 Ų21.80%012%0.116CC..Hα-helixtrans-57.3-44.5175.6170.80000112N58 L59 M65 L66 N99 S102 S103N58-S62 PolarHBondContact O-N 3.44Å; L59-S62 WeakPolarHBondContact O-CA 3.36Å; L59-S62 VanDerWaalsContact O-CB 3.28Å; L59-S62 WeakPolarHBondContact O-CB 3.26Å; L59-S62 PolarHBondContact O-N 3.31Å; S62-M65 PolarHBondContact O-N 3.14Å; S62-L66 PolarHBondContact O-N 2.79Å; S62-L66 VanDerWaalsContact O-N 3.12Å; S62-N99 PolarHBondContact O-ND2 2.92Å; S62-N99 WeakPolarHBondContact OG-CA 3.48Å; S62-N99 PolarHBondContact OG-ND2 2.9Å; S62-S102 WeakPolarHBondContact CB-OG 3.23Å; S62-S102 PolarHBondContact OG-OG 3.48Å; S62-S103 PolarHBondContact OG-OG 3.44Å
63D96.4Very high94.5Very high0 Ų022 Ų220%012%0.117CC..Hα-helixtrans-68.7-38.8-179.1-60.8-34.6000112.1N35 L59 A60 I61 L66 A67 N99 S103 N264 C265 Y272N35-D63 HydrophobicContact CB-CB 4.36Å; N35-D63 PolarHBondContact OD1-OD2 2.95Å; L59-D63 PolarHBondContact O-N 3.48Å; L59-D63 VanDerWaalsContact O-OD2 3.13Å; A60-D63 PolarHBondContact O-N 3.34Å; I61-D63 VanDerWaalsContact C-N 3.32Å; I61-D63 PolarHBondContact O-N 3.38Å; D63-L66 PolarHBondContact O-N 2.89Å; D63-A67 VanDerWaalsContact O-CB 3.27Å; D63-A67 WeakPolarHBondContact O-CB 3.26Å; D63-A67 PolarHBondContact O-N 3.48Å; D63-N99 PolarHBondContact OD1-ND2 3.31Å; D63-S103 PolarHBondContact OD1-OG 2.95Å; D63-N264 PolarHBondContact OD1-OD1 2.92Å; D63-C265 HydrophobicContact CB-CB 4.04Å; D63-C265 PolarHBondContact OD1-SG 3.24Å; D63-Y272 PolarHBondContact OD2-OH 2.68Å
64L96.4Very high94.8Very high26 Ų2623.7 Ų23.714%0.13613%0.127CC..Hα-helixtrans-64.2-40.2173.3-72.7171.5000111.9L32 N35 A36 L39 A60 I61 L66 A67 I68L32-L64 HydrophobicContact CD1-CD2 3.84Å; N35-L64 HydrophobicContact CB-CD2 3.92Å; N35-L64 HydrophobicContact CB-CG 3.95Å; A36-L64 HydrophobicContact CB-CD2 4.13Å; L39-L64 HydrophobicContact CB-CD1 4.4Å; L39-L64 HydrophobicContact CD2-CD1 3.56Å; A60-L64 WeakPolarHBondContact O-CB 3.19Å; A60-L64 VanDerWaalsContact O-CG 3.23Å; A60-L64 WeakPolarHBondContact O-CG 3.28Å; A60-L64 PolarHBondContact O-N 3.09Å; I61-L64 PolarHBondContact O-N 3.3Å; L64-L66 VanDerWaalsContact C-N 3.31Å; L64-L66 PolarHBondContact O-N 3.37Å; L64-A67 PolarHBondContact O-N 3.27Å; L64-I68 WeakPolarHBondContact O-CD1 3.47Å; L64-I68 VanDerWaalsContact O-CG1 3.26Å; L64-I68 WeakPolarHBondContact O-CG1 3.32Å; L64-I68 PolarHBondContact O-N 3.4Å
65M95.7Very high94.9Very high60 Ų6028.4 Ų28.430%0.29615%0.145SC..Hα-helixtrans-60.3-41.3175.8-72.2171.872.500111.4I61 S62 T69 M95 W141I61-M65 HydrophobicContact CG2-CG 4.47Å; I61-M65 HydrophobicContact CG2-SD 3.94Å; I61-M65 VanDerWaalsContact O-CG 3.26Å; I61-M65 WeakPolarHBondContact O-CG 3.27Å; I61-M65 PolarHBondContact O-N 2.97Å; S62-M65 PolarHBondContact O-N 3.14Å; M65-T69 WeakPolarHBondContact O-CG2 3.34Å; M65-M95 HydrophobicContact CB-SD 4.27Å; M65-M95 HydrophobicContact CE-CE 3.56Å; M65-M95 HydrophobicContact CE-SD 3.46Å; M65-M95 WeakPolarHBondContact CE-SD 3.26Å; M65-W141 HydrophobicContact SD-CH2 3.93Å; M65-W141 HydrophobicContact SD-CZ3 4.29Å
66L95.8Very high94.9Very high2 Ų227.7 Ų27.71%0.0114%0.141CC..Hα-helixtrans-67.7-49.6172.7177.152.6000111.5S62 D63 L64 I68 T69 L70 F96 N99 T262S62-L66 PolarHBondContact O-N 2.79Å; S62-L66 VanDerWaalsContact O-N 3.12Å; D63-L66 PolarHBondContact O-N 2.89Å; L64-L66 VanDerWaalsContact C-N 3.31Å; L64-L66 PolarHBondContact O-N 3.37Å; L66-I68 VanDerWaalsContact C-N 3.28Å; L66-I68 PolarHBondContact O-N 2.93Å; L66-T69 WeakPolarHBondContact O-CA 3.45Å; L66-T69 PolarHBondContact O-N 3.15Å; L66-T69 PolarHBondContact O-OG1 3.31Å; L66-L70 HydrophobicContact CD1-CD2 4.15Å; L66-L70 HydrophobicContact CG-CD2 4.41Å; L66-L70 PolarHBondContact O-N 3.01Å; L66-F96 HydrophobicContact CD1-CB 4.08Å; L66-F96 HydrophobicContact CD1-CD2 4.04Å; L66-F96 HydrophobicContact CD2-CD2 4.23Å; L66-N99 HydrophobicContact CB-CB 3.81Å; L66-N99 HydrophobicContact CD2-CB 3.8Å; L66-N99 VanDerWaalsContact CD2-CG 3.43Å; L66-N99 WeakPolarHBondContact CD2-OD1 3.44Å; L66-N99 HydrophobicContact CG-CB 4.35Å; L66-T262 HydrophobicContact CD2-CG2 4.19Å
67A95.5Very high94.8Very high2 Ų228.1 Ų28.12%0.01714%0.143CC..Hα-helixtrans-55.8-41-176.300000112.4L28 L32 D63 L64 T69 L70 P71L28-A67 VanDerWaalsContact CD1-O 3.32Å; L28-A67 WeakPolarHBondContact CD1-O 3.22Å; L32-A67 HydrophobicContact CB-CB 4.17Å; L32-A67 HydrophobicContact CD1-CB 3.72Å; D63-A67 VanDerWaalsContact O-CB 3.27Å; D63-A67 WeakPolarHBondContact O-CB 3.26Å; D63-A67 PolarHBondContact O-N 3.48Å; L64-A67 PolarHBondContact O-N 3.27Å; A67-T69 PolarHBondContact O-N 2.85Å; A67-L70 WeakPolarHBondContact O-CB 3.39Å; A67-L70 PolarHBondContact O-N 3.08Å; A67-L70 VanDerWaalsContact O-N 3.16Å; A67-P71 WeakPolarHBondContact O-CD 3.37Å
68I95.2Very high94.6Very high117 Ų11730.6 Ų30.660%0.617%0.165SC*.Hα-helixtrans-62.2-26.4176.8-69.7165.5000112.4L32 L64 L66 P71L32-I68 HydrophobicContact CD1-CG1 4.12Å; L64-I68 WeakPolarHBondContact O-CD1 3.47Å; L64-I68 VanDerWaalsContact O-CG1 3.26Å; L64-I68 WeakPolarHBondContact O-CG1 3.32Å; L64-I68 PolarHBondContact O-N 3.4Å; L66-I68 VanDerWaalsContact C-N 3.28Å; L66-I68 PolarHBondContact O-N 2.93Å; I68-P71 VanDerWaalsContact O-CD 3.32Å; I68-P71 WeakPolarHBondContact O-CD 3.37Å
69T94.5Very high94.3Very high9 Ų932.4 Ų32.46%0.05518%0.177CC..Hα-helixtrans-89.5-16.3178.369.20000114M65 L66 A67 L72 F91 V92 M95M65-T69 WeakPolarHBondContact O-CG2 3.34Å; L66-T69 WeakPolarHBondContact O-CA 3.45Å; L66-T69 PolarHBondContact O-N 3.15Å; L66-T69 PolarHBondContact O-OG1 3.31Å; A67-T69 PolarHBondContact O-N 2.85Å; T69-L72 PolarHBondContact O-N 2.93Å; T69-F91 HydrophobicContact CG2-CE1 4.47Å; T69-V92 HydrophobicContact CG2-CG2 4.33Å; T69-M95 HydrophobicContact CG2-CB 4Å; T69-M95 HydrophobicContact CG2-CG 4.14Å
70L94.4Very high93.9Very high3 Ų336.6 Ų36.62%0.01620%0.2CC..Hα-helixtrans-58.6-35.2179.9-67.2179.6000115.1F24 I27 L28 L66 A67 L72 R73 V74 T262F24-L70 HydrophobicContact CD1-CD2 4.17Å; I27-L70 HydrophobicContact CB-CD1 4.35Å; I27-L70 HydrophobicContact CG2-CD1 3.82Å; L28-L70 HydrophobicContact CB-CB 4.29Å; L28-L70 HydrophobicContact CB-CD1 4.29Å; L28-L70 HydrophobicContact CD1-CB 4.45Å; L66-L70 HydrophobicContact CD1-CD2 4.15Å; L66-L70 HydrophobicContact CG-CD2 4.41Å; L66-L70 PolarHBondContact O-N 3.01Å; A67-L70 WeakPolarHBondContact O-CB 3.39Å; A67-L70 PolarHBondContact O-N 3.08Å; A67-L70 VanDerWaalsContact O-N 3.16Å; L70-L72 PolarHBondContact O-N 2.89Å; L70-L72 VanDerWaalsContact O-N 3.16Å; L70-R73 WeakPolarHBondContact O-CA 3.38Å; L70-R73 WeakPolarHBondContact O-CB 3.4Å; L70-R73 PolarHBondContact O-N 3.48Å; L70-V74 WeakPolarHBondContact O-CG2 3.43Å; L70-V74 PolarHBondContact O-N 2.69Å; L70-T262 HydrophobicContact CD1-CG2 4.2Å; L70-T262 HydrophobicContact CD2-CG2 3.7Å
71P95.3Very high93.4Very high58 Ų5838.8 Ų38.838%0.37722%0.215SC..Hα-helixtrans-54.2-35.7176.6-25.832.9000113.2L28 A67 I68 R73 V74 Y75L28-P71 HydrophobicContact CD1-CG 4.25Å; L28-P71 HydrophobicContact CD2-CB 4.49Å; L28-P71 HydrophobicContact CD2-CG 3.79Å; A67-P71 WeakPolarHBondContact O-CD 3.37Å; I68-P71 VanDerWaalsContact O-CD 3.32Å; I68-P71 WeakPolarHBondContact O-CD 3.37Å; P71-R73 VanDerWaalsContact C-N 3.33Å; P71-V74 PolarHBondContact O-N 2.98Å; P71-Y75 WeakPolarHBondContact O-CB 3.15Å; P71-Y75 PolarHBondContact O-N 2.86Å
72L94Very high93.1Very high53 Ų5337.8 Ų37.828%0.27721%0.207SC..Hα-helixtrans-69.2-34.1178.1-62.4178.1000112T69 L70 F76 W82 L84 T88 V92T69-L72 PolarHBondContact O-N 2.93Å; L70-L72 PolarHBondContact O-N 2.89Å; L70-L72 VanDerWaalsContact O-N 3.16Å; L72-F76 WeakPolarHBondContact O-CB 3.3Å; L72-F76 PolarHBondContact O-N 3.36Å; L72-F76 VanDerWaalsContact O-N 3.07Å; L72-W82 HydrophobicContact CB-CH2 4.19Å; L72-W82 HydrophobicContact CB-CZ3 4.05Å; L72-W82 HydrophobicContact CD1-CH2 4.31Å; L72-L84 HydrophobicContact CD1-CD1 3.99Å; L72-L84 HydrophobicContact CD2-CD1 3.5Å; L72-L84 VanDerWaalsContact CD2-CD1 3.5Å; L72-L84 HydrophobicContact CG-CD1 4.38Å; L72-T88 HydrophobicContact CD1-CG2 4.04Å; L72-V92 HydrophobicContact CD1-CG2 3.51Å
73R93.1Very high92.5Very high7 Ų741.7 Ų41.73%0.02623%0.233CC..Hα-helixtrans-73.2-39.7174.3-172.5173.3-93.2178.6-8.3111.6F24 L70 P71 F76 Y77 F168F24-R73 HydrophobicContact CD2-CG 3.91Å; F24-R73 HydrophobicContact CE2-CG 4.02Å; F24-R73 HydrophobicContact CG-CG 4.25Å; F24-R73 HydrophobicContact CZ-CG 4.43Å; L70-R73 WeakPolarHBondContact O-CA 3.38Å; L70-R73 WeakPolarHBondContact O-CB 3.4Å; L70-R73 PolarHBondContact O-N 3.48Å; P71-R73 VanDerWaalsContact C-N 3.33Å; R73-F76 WeakPolarHBondContact O-CB 3.2Å; R73-F76 PolarHBondContact O-N 3.3Å; R73-Y77 HydrophobicContact CG-CD2 3.82Å; R73-Y77 HydrophobicContact CG-CE2 3.6Å; R73-Y77 WeakPolarHBondContact O-CD2 3.26Å; R73-Y77 PolarHBondContact O-N 3.5Å; R73-Y77 VanDerWaalsContact O-N 3.12Å; R73-F168 HydrophobicContact CB-CE1 4.45Å; R73-F168 HydrophobicContact CB-CE2 3.97Å; R73-F168 HydrophobicContact CB-CZ 3.71Å; R73-F168 HydrophobicContact CG-CD2 4.49Å; R73-F168 HydrophobicContact CG-CE1 4.36Å; R73-F168 HydrophobicContact CG-CE2 4.03Å; R73-F168 HydrophobicContact CG-CZ 3.94Å
74V94.4Very high92.2Very high35 Ų3545.2 Ų45.221%0.21225%0.251CS..Hα-helixtrans-60-48.6173174.30000110.6A21 F24 L70 P71 F76 Y77 A78A21-V74 HydrophobicContact CB-CG1 4.49Å; F24-V74 HydrophobicContact CB-CG2 3.61Å; L70-V74 WeakPolarHBondContact O-CG2 3.43Å; L70-V74 PolarHBondContact O-N 2.69Å; P71-V74 PolarHBondContact O-N 2.98Å; V74-F76 VanDerWaalsContact C-N 3.33Å; V74-F76 PolarHBondContact O-N 2.95Å; V74-Y77 PolarHBondContact O-N 3.31Å; V74-A78 WeakPolarHBondContact O-CB 3.37Å; V74-A78 PolarHBondContact O-N 3.27Å
75Y93.8Very high91.9Very high104 Ų10446.9 Ų46.941%0.40827%0.265SS..Hα-helixtrans-55.5-50176.6-179.6-86000110.9P71 Y77 A78 T79 P83P71-Y75 WeakPolarHBondContact O-CB 3.15Å; P71-Y75 PolarHBondContact O-N 2.86Å; Y75-Y77 VanDerWaalsContact C-N 3.35Å; Y75-Y77 PolarHBondContact O-N 3.43Å; Y75-A78 PolarHBondContact O-N 3.06Å; Y75-T79 WeakPolarHBondContact CD1-OG1 2.94Å; Y75-T79 HydrophobicContact CD2-CG2 4.17Å; Y75-T79 HydrophobicContact CE1-CG2 4.16Å; Y75-T79 WeakPolarHBondContact CE1-OG1 3.33Å; Y75-T79 HydrophobicContact CE2-CG2 3.79Å; Y75-T79 PolarHBondContact O-N 3.06Å; Y75-T79 PolarHBondContact O-OG1 2.94Å; Y75-P83 HydrophobicContact CD1-CG 4.11Å; Y75-P83 HydrophobicContact CE1-CB 4.46Å; Y75-P83 HydrophobicContact CE1-CG 3.53Å
76F92.1Very high91.6Very high6 Ų647.2 Ų47.23%0.02627%0.268CS..Hα-helixtrans-54.3-48.3179.3175.7-98.3000113.1L72 R73 V74 A78 D80 W82 K166 F168L72-F76 WeakPolarHBondContact O-CB 3.3Å; L72-F76 PolarHBondContact O-N 3.36Å; L72-F76 VanDerWaalsContact O-N 3.07Å; R73-F76 WeakPolarHBondContact O-CB 3.2Å; R73-F76 PolarHBondContact O-N 3.3Å; V74-F76 VanDerWaalsContact C-N 3.33Å; V74-F76 PolarHBondContact O-N 2.95Å; F76-A78 VanDerWaalsContact C-N 3.3Å; F76-A78 PolarHBondContact O-N 3.12Å; F76-D80 WeakPolarHBondContact O-CA 3.32Å; F76-D80 PolarHBondContact O-N 3.05Å; F76-W82 HydrophobicContact CD2-CB 4.27Å; F76-W82 HydrophobicContact CD2-CE3 4.5Å; F76-K166 HydrophobicContact CE2-CB 3.59Å; F76-K166 HydrophobicContact CE2-CD 3.68Å; F76-K166 HydrophobicContact CE2-CG 3.93Å; F76-K166 HydrophobicContact CZ-CB 3.75Å; F76-K166 HydrophobicContact CZ-CD 3.79Å; F76-K166 HydrophobicContact CZ-CG 4.29Å; F76-F168 HydrophobicContact CB-CD2 3.77Å; F76-F168 HydrophobicContact CB-CE2 3.7Å; F76-F168 HydrophobicContact CD1-CB 4.23Å; F76-F168 AromaticContact CD1-CD2 3.4Å; F76-F168 HydrophobicContact CD1-CD2 3.4Å; F76-F168 HydrophobicContact CD1-CE2 4.2Å; F76-F168 HydrophobicContact CD1-CG 4.25Å; F76-F168 HydrophobicContact CD2-CD2 4.01Å; F76-F168 HydrophobicContact CE1-CB 3.94Å; F76-F168 AromaticContact CE1-CD2 3.94Å; F76-F168 HydrophobicContact CE1-CD2 3.94Å; F76-F168 HydrophobicContact CE1-CG 4.44Å; F76-F168 AromaticContact CG-CD2 3.42Å; F76-F168 HydrophobicContact CG-CD2 3.42Å; F76-F168 VanDerWaalsContact CG-CD2 3.42Å; F76-F168 AromaticContact CG-CE2 3.89Å; F76-F168 HydrophobicContact CG-CE2 3.89Å; F76-F168 HydrophobicContact CZ-CB 4.38Å; F76-F168 HydrophobicContact CZ-CD2 4.47Å
77Y90.9Very high91.4Very high11 Ų1153.5 Ų53.54%0.04330%0.301CS..Hα-helixtrans-72.8-22.8179.6-78.1-65.7000113.3S17 Y20 F24 R73 V74 Y75 Y172 T255S17-Y77 CarbonylContact C-O 3.04Å; S17-Y77 WeakPolarHBondContact O-CB 3.34Å; S17-Y77 WeakPolarHBondContact OG-CA 3.42Å; S17-Y77 PolarHBondContact OG-O 3.07Å; Y20-Y77 HydrophobicContact CD2-CD1 4.1Å; Y20-Y77 AromaticContact CD2-CE1 3.88Å; Y20-Y77 HydrophobicContact CD2-CE1 3.88Å; Y20-Y77 HydrophobicContact CG-CE1 4.42Å; F24-Y77 AromaticContact CD2-CD2 3.75Å; F24-Y77 HydrophobicContact CD2-CD2 3.75Å; F24-Y77 AromaticContact CD2-CE2 3.84Å; F24-Y77 HydrophobicContact CD2-CE2 3.84Å; F24-Y77 AromaticContact CE2-CD2 3.8Å; F24-Y77 HydrophobicContact CE2-CD2 3.8Å; F24-Y77 AromaticContact CE2-CE2 3.39Å; F24-Y77 HydrophobicContact CE2-CE2 3.39Å; F24-Y77 HydrophobicContact CZ-CE2 4.4Å; R73-Y77 HydrophobicContact CG-CD2 3.82Å; R73-Y77 HydrophobicContact CG-CE2 3.6Å; R73-Y77 WeakPolarHBondContact O-CD2 3.26Å; R73-Y77 PolarHBondContact O-N 3.5Å; R73-Y77 VanDerWaalsContact O-N 3.12Å; V74-Y77 PolarHBondContact O-N 3.31Å; Y75-Y77 VanDerWaalsContact C-N 3.35Å; Y75-Y77 PolarHBondContact O-N 3.43Å; Y77-Y172 PolarHBondContact OH-OH 3.42Å; Y77-T255 HydrophobicContact CE1-CG2 4.01Å; Y77-T255 HydrophobicContact CE2-CG2 4.26Å; Y77-T255 WeakPolarHBondContact OH-CG2 3.43Å; Y77-T255 PolarHBondContact OH-OG1 2.9Å; Y77-T255 VanDerWaalsContact OH-OG1 3.12Å
78A90.9Very high91.3Very high64 Ų6455.4 Ų55.453%0.52931%0.312SS..Hα-helixtrans-82.1-36.7177.700000113A21 V74 Y75 F76A21-A78 HydrophobicContact CB-CB 4.25Å; V74-A78 WeakPolarHBondContact O-CB 3.37Å; V74-A78 PolarHBondContact O-N 3.27Å; Y75-A78 PolarHBondContact O-N 3.06Å; F76-A78 VanDerWaalsContact C-N 3.3Å; F76-A78 PolarHBondContact O-N 3.12Å
79T88.7Confident91.2Very high62 Ų6249.8 Ų49.838%0.3828%0.284SS..Hα-helixtrans-111-0.2-173.766.50000113.7Y75 S81Y75-T79 WeakPolarHBondContact CD1-OG1 2.94Å; Y75-T79 HydrophobicContact CD2-CG2 4.17Å; Y75-T79 HydrophobicContact CE1-CG2 4.16Å; Y75-T79 WeakPolarHBondContact CE1-OG1 3.33Å; Y75-T79 HydrophobicContact CE2-CG2 3.79Å; Y75-T79 PolarHBondContact O-N 3.06Å; Y75-T79 PolarHBondContact O-OG1 2.94Å; T79-S81 VanDerWaalsContact CB-OG 3.31Å; T79-S81 WeakPolarHBondContact CB-OG 3.38Å; T79-S81 PolarHBondContact O-N 3.4Å; T79-S81 PolarHBondContact O-OG 2.71Å; T79-S81 PolarHBondContact OG1-OG 3.35Å
80D85.8Confident91.1Very high87 Ų8750.2 Ų50.247%0.46529%0.286SS..SBendtrans49.630.8-176.5-166.436.9000113.3F76 K166F76-D80 WeakPolarHBondContact O-CA 3.32Å; F76-D80 PolarHBondContact O-N 3.05Å; D80-K166 WeakPolarHBondContact O-CE 3.46Å; D80-K166 PolarHBondContact O-NZ 2.84Å; D80-K166 VanDerWaalsContact O-NZ 3.07Å; D80-K166 IonicContact OD1-NZ 3.97Å; D80-K166 PolarHBondContact OD1-NZ 3.38Å; D80-K166 IonicContact OD2-NZ 3.43Å; D80-K166 PolarHBondContact OD2-NZ 2.9Å
81S85.9Confident91.1Very high46 Ų4655.6 Ų55.632%0.32231%0.31SS..  trans-144.5144.8-172.846.50000111.7T79T79-S81 VanDerWaalsContact CB-OG 3.31Å; T79-S81 WeakPolarHBondContact CB-OG 3.38Å; T79-S81 PolarHBondContact O-N 3.4Å; T79-S81 PolarHBondContact O-OG 2.71Å; T79-S81 PolarHBondContact OG1-OG 3.35Å
82W88.6Confident91.1Very high41 Ų4153 Ų5316%0.15529%0.293CS..  trans-111.6106.2175.2-178.9-98.2000109.5L72 F76 L84 S85 T88 C89 V92 C167 F168L72-W82 HydrophobicContact CB-CH2 4.19Å; L72-W82 HydrophobicContact CB-CZ3 4.05Å; L72-W82 HydrophobicContact CD1-CH2 4.31Å; F76-W82 HydrophobicContact CD2-CB 4.27Å; F76-W82 HydrophobicContact CD2-CE3 4.5Å; W82-L84 HydrophobicContact CZ2-CB 3.88Å; W82-L84 PolarHBondContact NE1-O 2.94Å; W82-S85 PolarHBondContact NE1-O 3.36Å; W82-T88 HydrophobicContact CH2-CG2 4.49Å; W82-T88 HydrophobicContact CZ2-CG2 4.18Å; W82-C89 HydrophobicContact CZ2-CB 3.81Å; W82-V92 HydrophobicContact CH2-CG2 4.38Å; W82-C167 HydrophobicContact CB-CB 4.27Å; W82-C167 HydrophobicContact CD2-CB 3.47Å; W82-C167 VanDerWaalsContact CD2-CB 3.47Å; W82-C167 HydrophobicContact CE3-CB 3.77Å; W82-C167 HydrophobicContact CG-CB 3.69Å; W82-C167 HydrophobicContact CZ2-CB 4.46Å; W82-C167 HydrophobicContact CZ3-CB 4.36Å; W82-F168 HydrophobicContact CE3-CE2 4.12Å; W82-F168 AromaticContact CZ3-CE2 3.79Å; W82-F168 HydrophobicContact CZ3-CE2 3.79Å; W82-F168 HydrophobicContact CZ3-CZ 4.06Å
83P85.3Confident91.1Very high83 Ų8350.5 Ų50.554%0.53928%0.28SS..  trans-89.8-9.2-171.934.7-33.8000113.2Y75Y75-P83 HydrophobicContact CD1-CG 4.11Å; Y75-P83 HydrophobicContact CE1-CB 4.46Å; Y75-P83 HydrophobicContact CE1-CG 3.53Å
84L89.7Confident91.1Very high73 Ų7351.2 Ų51.238%0.38228%0.283SS..SBendtrans-98.5170.6-173.3-62.8178.1000112.1L72 W82 T88L72-L84 HydrophobicContact CD1-CD1 3.99Å; L72-L84 HydrophobicContact CD2-CD1 3.5Å; L72-L84 VanDerWaalsContact CD2-CD1 3.5Å; L72-L84 HydrophobicContact CG-CD1 4.38Å; W82-L84 HydrophobicContact CZ2-CB 3.88Å; W82-L84 PolarHBondContact NE1-O 2.94Å; L84-T88 HydrophobicContact CB-CG2 4.23Å; L84-T88 HydrophobicContact CD1-CG2 3.71Å
85S90.4Very high91.2Very high62 Ų6251.2 Ų51.243%0.43428%0.281SS..  trans-64.8160.6178.873.40000113.5W82 L87 T88 C89W82-S85 PolarHBondContact NE1-O 3.36Å; S85-L87 PolarHBondContact O-N 2.9Å; S85-L87 PolarHBondContact OG-N 3.43Å; S85-T88 PolarHBondContact O-N 3.49Å; S85-T88 VanDerWaalsContact O-N 3.16Å; S85-T88 PolarHBondContact OG-N 3.35Å; S85-T88 PolarHBondContact OG-OG1 3.24Å; S85-T88 VanDerWaalsContact OG-OG1 3.11Å; S85-C89 PolarHBondContact O-N 3.36Å
86N90.1Very high91.2Very high66 Ų6646.6 Ų46.635%0.35326%0.264SS..Hα-helixtrans-57.3-34.6169.4-72.7-1.3000111.8T88 C89 V90 L159 N160N86-T88 VanDerWaalsContact C-N 3.33Å; N86-T88 PolarHBondContact O-N 3.23Å; N86-C89 WeakPolarHBondContact O-CB 3.12Å; N86-C89 PolarHBondContact O-N 2.76Å; N86-C89 VanDerWaalsContact O-N 3.16Å; N86-V90 WeakPolarHBondContact O-CG2 3.44Å; N86-V90 PolarHBondContact O-N 2.79Å; N86-L159 HydrophobicContact CB-CD1 4.38Å; N86-N160 PolarHBondContact ND2-OD1 3.14Å; N86-N160 VanDerWaalsContact ND2-OD1 3.07Å
87L91Very high91.2Very high135 Ų13547.3 Ų47.371%0.70727%0.266SS*.Hα-helixtrans-60.8-43.4177.5-178.264.6000111.4S85 C89 V90 F91S85-L87 PolarHBondContact O-N 2.9Å; S85-L87 PolarHBondContact OG-N 3.43Å; L87-C89 VanDerWaalsContact C-N 3.32Å; L87-C89 PolarHBondContact O-N 2.74Å; L87-V90 PolarHBondContact O-N 3Å; L87-F91 WeakPolarHBondContact O-CB 3.25Å; L87-F91 PolarHBondContact O-N 3.35Å
88T92.7Very high91.5Very high41 Ų4147.2 Ų47.225%0.25227%0.266SS..Hα-helixtrans-66-37.4176.4-47.50000111.5L72 W82 L84 S85 N86 F91 V92L72-T88 HydrophobicContact CD1-CG2 4.04Å; W82-T88 HydrophobicContact CH2-CG2 4.49Å; W82-T88 HydrophobicContact CZ2-CG2 4.18Å; L84-T88 HydrophobicContact CB-CG2 4.23Å; L84-T88 HydrophobicContact CD1-CG2 3.71Å; S85-T88 PolarHBondContact O-N 3.49Å; S85-T88 VanDerWaalsContact O-N 3.16Å; S85-T88 PolarHBondContact OG-N 3.35Å; S85-T88 PolarHBondContact OG-OG1 3.24Å; S85-T88 VanDerWaalsContact OG-OG1 3.11Å; N86-T88 VanDerWaalsContact C-N 3.33Å; N86-T88 PolarHBondContact O-N 3.23Å; T88-F91 PolarHBondContact O-N 3.06Å; T88-V92 HydrophobicContact CG2-CG2 4.34Å; T88-V92 WeakPolarHBondContact O-CG2 3.42Å; T88-V92 PolarHBondContact O-N 2.72Å
89C92.9Very high91.7Very high0 Ų044.1 Ų44.10%024%0.241CC..Hα-helixtrans-61.6-46.1175.5177.60000111.8W82 S85 N86 L87 F91 T93 L159 C167W82-C89 HydrophobicContact CZ2-CB 3.81Å; S85-C89 PolarHBondContact O-N 3.36Å; N86-C89 WeakPolarHBondContact O-CB 3.12Å; N86-C89 PolarHBondContact O-N 2.76Å; N86-C89 VanDerWaalsContact O-N 3.16Å; L87-C89 VanDerWaalsContact C-N 3.32Å; L87-C89 PolarHBondContact O-N 2.74Å; C89-F91 VanDerWaalsContact C-N 3.35Å; C89-F91 PolarHBondContact O-N 3.18Å; C89-T93 VanDerWaalsContact O-CB 3.3Å; C89-T93 WeakPolarHBondContact O-CB 3.23Å; C89-T93 PolarHBondContact O-N 3.4Å; C89-T93 PolarHBondContact O-OG1 3.22Å; C89-L159 HydrophobicContact CB-CD1 4.1Å; C89-C167 WeakPolarHBondContact CA-SG 3.47Å; C89-C167 HydrophobicContact CB-CB 3.78Å; C89-C167 WeakPolarHBondContact CB-SG 3.26Å; C89-C167 WeakPolarHBondContact SG-CA 3.32Å; C89-C167 WeakPolarHBondContact SG-CB 3.43Å; C89-C167 CovalentContact SG-SG 2.02Å; C89-C167 PolarHBondContact SG-SG 3.39Å
90V93.8Very high91.9Very high17 Ų1741.5 Ų41.510%0.10322%0.224CC..Hα-helixtrans-58.8-49.1174.61760000109.8N86 L87 V92 T93 M94 F155 L159N86-V90 WeakPolarHBondContact O-CG2 3.44Å; N86-V90 PolarHBondContact O-N 2.79Å; L87-V90 PolarHBondContact O-N 3Å; V90-V92 PolarHBondContact O-N 2.94Å; V90-T93 PolarHBondContact O-N 2.99Å; V90-M94 HydrophobicContact CG1-CG 4.1Å; V90-M94 WeakPolarHBondContact O-CB 3.48Å; V90-M94 VanDerWaalsContact O-CG 3.25Å; V90-M94 WeakPolarHBondContact O-CG 3.3Å; V90-M94 PolarHBondContact O-N 3.41Å; V90-F155 HydrophobicContact CB-CD1 4.35Å; V90-F155 HydrophobicContact CG2-CD1 3.9Å; V90-F155 HydrophobicContact CG2-CE1 4.42Å; V90-L159 HydrophobicContact CG2-CD1 3.65Å
91F94.6Very high92.3Very high117 Ų11737.7 Ų37.751%0.51320%0.204SC..Hα-helixtrans-57.4-51.1-179.3179.9-97.9000112.7T69 L87 T88 C89 T93 M94 M95T69-F91 HydrophobicContact CG2-CE1 4.47Å; L87-F91 WeakPolarHBondContact O-CB 3.25Å; L87-F91 PolarHBondContact O-N 3.35Å; T88-F91 PolarHBondContact O-N 3.06Å; C89-F91 VanDerWaalsContact C-N 3.35Å; C89-F91 PolarHBondContact O-N 3.18Å; F91-T93 VanDerWaalsContact C-N 3.34Å; F91-T93 PolarHBondContact O-N 3.15Å; F91-M94 PolarHBondContact O-N 2.92Å; F91-M95 HydrophobicContact CD1-CG 4.38Å; F91-M95 HydrophobicContact CD2-CE 4.33Å; F91-M95 HydrophobicContact CE1-CE 4.26Å; F91-M95 HydrophobicContact CE1-CG 4.04Å; F91-M95 HydrophobicContact CE2-CE 3.42Å; F91-M95 VanDerWaalsContact CE2-CE 3.42Å; F91-M95 HydrophobicContact CE2-CG 4.47Å; F91-M95 HydrophobicContact CZ-CE 3.38Å; F91-M95 HydrophobicContact CZ-CG 4.1Å; F91-M95 WeakPolarHBondContact O-CG 3.01Å; F91-M95 PolarHBondContact O-N 3.42Å
92V94.5Very high92.8Very high4 Ų435.5 Ų35.52%0.02419%0.188CC..Hα-helixtrans-61.8-42.7178.9171.10000111.4T69 L72 W82 T88 V90 M95 F96 F168T69-V92 HydrophobicContact CG2-CG2 4.33Å; L72-V92 HydrophobicContact CD1-CG2 3.51Å; W82-V92 HydrophobicContact CH2-CG2 4.38Å; T88-V92 HydrophobicContact CG2-CG2 4.34Å; T88-V92 WeakPolarHBondContact O-CG2 3.42Å; T88-V92 PolarHBondContact O-N 2.72Å; V90-V92 PolarHBondContact O-N 2.94Å; V92-M95 PolarHBondContact O-N 3.43Å; V92-F96 PolarHBondContact O-N 3.22Å; V92-F96 VanDerWaalsContact O-N 3.08Å; V92-F168 HydrophobicContact CG1-CE1 4.07Å; V92-F168 HydrophobicContact CG1-CZ 3.98Å
93T93.4Very high93.2Very high0 Ų033.5 Ų33.50%018%0.181CC..Hα-helixtrans-65.2-41.2178.8-57.90000111.4C89 V90 F91 F96 R97 F155 V171C89-T93 VanDerWaalsContact O-CB 3.3Å; C89-T93 WeakPolarHBondContact O-CB 3.23Å; C89-T93 PolarHBondContact O-N 3.4Å; C89-T93 PolarHBondContact O-OG1 3.22Å; V90-T93 PolarHBondContact O-N 2.99Å; F91-T93 VanDerWaalsContact C-N 3.34Å; F91-T93 PolarHBondContact O-N 3.15Å; T93-F96 PolarHBondContact O-N 2.94Å; T93-R97 WeakPolarHBondContact O-CG 3.25Å; T93-R97 PolarHBondContact O-N 3.13Å; T93-R97 VanDerWaalsContact O-N 3.07Å; T93-F155 HydrophobicContact CG2-CD1 4.25Å; T93-F155 HydrophobicContact CG2-CE1 3.89Å; T93-F155 HydrophobicContact CG2-CZ 4.11Å; T93-F155 WeakPolarHBondContact OG1-CE1 3.17Å; T93-V171 HydrophobicContact CG2-CG1 4.43Å; T93-V171 HydrophobicContact CG2-CG2 3.74Å
94M94.7Very high93.7Very high21 Ų2129.6 Ų29.610%0.10316%0.155CC..Hα-helixtrans-68.9-35.2176.7-66.9-50.7110.700111.9V90 F91 F96 R97 N98 N148 E151 G152 F155V90-M94 HydrophobicContact CG1-CG 4.1Å; V90-M94 WeakPolarHBondContact O-CB 3.48Å; V90-M94 VanDerWaalsContact O-CG 3.25Å; V90-M94 WeakPolarHBondContact O-CG 3.3Å; V90-M94 PolarHBondContact O-N 3.41Å; F91-M94 PolarHBondContact O-N 2.92Å; M94-F96 VanDerWaalsContact C-N 3.35Å; M94-F96 PolarHBondContact O-N 2.89Å; M94-R97 PolarHBondContact O-N 3.34Å; M94-N98 WeakPolarHBondContact O-CB 3.42Å; M94-N98 PolarHBondContact O-N 3.25Å; M94-N148 HydrophobicContact SD-CB 4.49Å; M94-E151 HydrophobicContact SD-CG 4.49Å; M94-G152 VanDerWaalsContact SD-CA 3.5Å; M94-F155 HydrophobicContact CE-CB 4.12Å; M94-F155 HydrophobicContact CE-CD1 4.13Å; M94-F155 HydrophobicContact CE-CG 4.29Å
95M95.1Very high94Very high35 Ų3526.6 Ų26.617%0.17214%0.14CC..Hα-helixtrans-62.9-40.7173.5-75.5-60.3172.300112.3M65 T69 F91 V92 N98 N99M65-M95 HydrophobicContact CB-SD 4.27Å; M65-M95 HydrophobicContact CE-CE 3.56Å; M65-M95 HydrophobicContact CE-SD 3.46Å; M65-M95 WeakPolarHBondContact CE-SD 3.26Å; T69-M95 HydrophobicContact CG2-CB 4Å; T69-M95 HydrophobicContact CG2-CG 4.14Å; F91-M95 HydrophobicContact CD1-CG 4.38Å; F91-M95 HydrophobicContact CD2-CE 4.33Å; F91-M95 HydrophobicContact CE1-CE 4.26Å; F91-M95 HydrophobicContact CE1-CG 4.04Å; F91-M95 HydrophobicContact CE2-CE 3.42Å; F91-M95 VanDerWaalsContact CE2-CE 3.42Å; F91-M95 HydrophobicContact CE2-CG 4.47Å; F91-M95 HydrophobicContact CZ-CE 3.38Å; F91-M95 HydrophobicContact CZ-CG 4.1Å; F91-M95 WeakPolarHBondContact O-CG 3.01Å; F91-M95 PolarHBondContact O-N 3.42Å; V92-M95 PolarHBondContact O-N 3.43Å; M95-N98 PolarHBondContact O-N 2.86Å; M95-N99 WeakPolarHBondContact O-CB 3.43Å; M95-N99 PolarHBondContact O-N 3.4Å
96F94.3Very high94.3Very high8 Ų823.7 Ų23.74%0.03512%0.119CC..Hα-helixtrans-62.2-47.1173.1171.8-104.8000112.7L66 V92 T93 M94 N98 N99 I100 L241 I258 A261L66-F96 HydrophobicContact CD1-CB 4.08Å; L66-F96 HydrophobicContact CD1-CD2 4.04Å; L66-F96 HydrophobicContact CD2-CD2 4.23Å; V92-F96 PolarHBondContact O-N 3.22Å; V92-F96 VanDerWaalsContact O-N 3.08Å; T93-F96 PolarHBondContact O-N 2.94Å; M94-F96 VanDerWaalsContact C-N 3.35Å; M94-F96 PolarHBondContact O-N 2.89Å; F96-N98 VanDerWaalsContact C-N 3.33Å; F96-N98 PolarHBondContact O-N 3.32Å; F96-N99 PolarHBondContact O-N 3.24Å; F96-I100 HydrophobicContact CD1-CD1 4.12Å; F96-I100 HydrophobicContact CD2-CD1 4.28Å; F96-I100 HydrophobicContact CE1-CD1 3.5Å; F96-I100 HydrophobicContact CE2-CD1 3.69Å; F96-I100 HydrophobicContact CE2-CG1 4.4Å; F96-I100 HydrophobicContact CG-CD1 4.48Å; F96-I100 HydrophobicContact CZ-CD1 3.26Å; F96-I100 HydrophobicContact CZ-CG1 4.4Å; F96-I100 PolarHBondContact O-N 3.41Å; F96-I100 VanDerWaalsContact O-N 3.15Å; F96-L241 HydrophobicContact CZ-CD2 4.36Å; F96-I258 HydrophobicContact CE1-CG1 4.41Å; F96-I258 HydrophobicContact CE1-CG2 4.37Å; F96-I258 HydrophobicContact CE2-CG2 4.01Å; F96-I258 HydrophobicContact CZ-CB 4.26Å; F96-I258 HydrophobicContact CZ-CG1 4.15Å; F96-I258 HydrophobicContact CZ-CG2 3.7Å; F96-A261 HydrophobicContact CE2-CB 4.48Å; F96-A261 HydrophobicContact CZ-CB 4.3Å
97R93Very high94.4Very high20 Ų2020.6 Ų20.68%0.07510%0.103CC..Hα-helixtrans-65-38.5177.2-68.8-179.2-177.3-176.12.8112.1T93 M94 R101 E151 D174T93-R97 WeakPolarHBondContact O-CG 3.25Å; T93-R97 PolarHBondContact O-N 3.13Å; T93-R97 VanDerWaalsContact O-N 3.07Å; M94-R97 PolarHBondContact O-N 3.34Å; R97-R101 WeakPolarHBondContact O-CG 3.48Å; R97-R101 PolarHBondContact O-N 3.09Å; R97-E151 WeakPolarHBondContact CD-OE1 3.19Å; R97-E151 IonicContact CZ-OE1 2.72Å; R97-E151 IonicContact NE-OE1 2.68Å; R97-E151 IonicContact NH1-OE1 3.64Å; R97-E151 PolarHBondContact NH1-OE1 3.32Å; R97-D174 IonicContact CZ-OD2 2.95Å; R97-D174 IonicContact NH1-OD2 2.66Å; R97-D174 PolarHBondContact NH1-OD2 3.29Å; R97-D174 IonicContact NH2-OD2 3.39Å; R97-D174 PolarHBondContact NH2-OD2 3.24Å
98N95.3Very high94.6Very high9 Ų914.4 Ų14.45%0.0487%0.071CC..Hα-helixtrans-60.3-46173.4-178.577.9000111.7M94 M95 F96 R101 S102 W141 V144 N148M94-N98 WeakPolarHBondContact O-CB 3.42Å; M94-N98 PolarHBondContact O-N 3.25Å; M95-N98 PolarHBondContact O-N 2.86Å; F96-N98 VanDerWaalsContact C-N 3.33Å; F96-N98 PolarHBondContact O-N 3.32Å; N98-R101 PolarHBondContact O-N 3.06Å; N98-S102 WeakPolarHBondContact O-CB 3.49Å; N98-S102 PolarHBondContact O-N 2.96Å; N98-S102 PolarHBondContact O-OG 2.76Å; N98-W141 WeakPolarHBondContact ND2-CZ3 3.45Å; N98-V144 WeakPolarHBondContact OD1-CG2 3.27Å; N98-N148 WeakPolarHBondContact CB-ND2 3.43Å; N98-N148 PolarHBondContact OD1-ND2 3.04Å
99N95.6Very high94.7Very high0 Ų015.8 Ų15.80%07%0.073CC..Hα-helixtrans-59.9-52.9178.8171.7-94.5000111.4S62 D63 L66 M95 F96 R101 S102 S103 N264S62-N99 PolarHBondContact O-ND2 2.92Å; S62-N99 WeakPolarHBondContact OG-CA 3.48Å; S62-N99 PolarHBondContact OG-ND2 2.9Å; D63-N99 PolarHBondContact OD1-ND2 3.31Å; L66-N99 HydrophobicContact CB-CB 3.81Å; L66-N99 HydrophobicContact CD2-CB 3.8Å; L66-N99 VanDerWaalsContact CD2-CG 3.43Å; L66-N99 WeakPolarHBondContact CD2-OD1 3.44Å; L66-N99 HydrophobicContact CG-CB 4.35Å; M95-N99 WeakPolarHBondContact O-CB 3.43Å; M95-N99 PolarHBondContact O-N 3.4Å; F96-N99 PolarHBondContact O-N 3.24Å; N99-R101 VanDerWaalsContact C-N 3.29Å; N99-R101 PolarHBondContact O-N 2.95Å; N99-S102 PolarHBondContact O-N 3.12Å; N99-S102 PolarHBondContact O-OG 3.25Å; N99-S103 PolarHBondContact ND2-OG 3.06Å; N99-S103 WeakPolarHBondContact O-CB 3.26Å; N99-S103 PolarHBondContact O-N 3.36Å; N99-S103 PolarHBondContact O-OG 2.83Å; N99-S103 VanDerWaalsContact O-OG 3.08Å; N99-N264 PolarHBondContact OD1-ND2 3.43Å
100I93.7Very high94.7Very high6 Ų616 Ų163%0.0317%0.074CC..Hα-helixtrans-53.5-47.9179.7-71.6161.8000111.5F96 S104 F238 L241 A261F96-I100 HydrophobicContact CD1-CD1 4.12Å; F96-I100 HydrophobicContact CD2-CD1 4.28Å; F96-I100 HydrophobicContact CE1-CD1 3.5Å; F96-I100 HydrophobicContact CE2-CD1 3.69Å; F96-I100 HydrophobicContact CE2-CG1 4.4Å; F96-I100 HydrophobicContact CG-CD1 4.48Å; F96-I100 HydrophobicContact CZ-CD1 3.26Å; F96-I100 HydrophobicContact CZ-CG1 4.4Å; F96-I100 PolarHBondContact O-N 3.41Å; F96-I100 VanDerWaalsContact O-N 3.15Å; I100-S104 WeakPolarHBondContact O-CB 3.26Å; I100-S104 PolarHBondContact O-N 3.2Å; I100-S104 VanDerWaalsContact O-N 3.07Å; I100-S104 PolarHBondContact O-OG 3.02Å; I100-S104 VanDerWaalsContact O-OG 3.05Å; I100-F238 HydrophobicContact CG2-CD1 4.03Å; I100-F238 HydrophobicContact CG2-CE1 4.45Å; I100-L241 HydrophobicContact CD1-CD2 3.42Å; I100-L241 VanDerWaalsContact CD1-CD2 3.42Å; I100-A261 HydrophobicContact CD1-CB 4.08Å; I100-A261 HydrophobicContact CG1-CB 4.37Å
101R94.5Very high94.5Very high7 Ų715.1 Ų15.13%0.0267%0.069CC..Hα-helixtrans-65.4-50.7-179.3-71.4171.9-178.5142.35.9112.8R97 N98 N99 S104 I105 V144 N148 E151R97-R101 WeakPolarHBondContact O-CG 3.48Å; R97-R101 PolarHBondContact O-N 3.09Å; N98-R101 PolarHBondContact O-N 3.06Å; N99-R101 VanDerWaalsContact C-N 3.29Å; N99-R101 PolarHBondContact O-N 2.95Å; R101-S104 PolarHBondContact O-OG 3.39Å; R101-I105 VanDerWaalsContact O-CD1 3.29Å; R101-I105 WeakPolarHBondContact O-CD1 3.38Å; R101-I105 WeakPolarHBondContact O-CG1 3.32Å; R101-I105 PolarHBondContact O-N 3.39Å; R101-V144 HydrophobicContact CB-CG1 3.7Å; R101-N148 PolarHBondContact NH1-OD1 3.43Å; R101-E151 IonicContact CZ-OE2 3.17Å; R101-E151 IonicContact NH1-OE2 2.73Å; R101-E151 PolarHBondContact NH1-OE2 3.16Å; R101-E151 IonicContact NH2-OE1 3.56Å; R101-E151 PolarHBondContact NH2-OE1 3.3Å; R101-E151 IonicContact NH2-OE2 2.68Å; R101-E151 PolarHBondContact NH2-OE2 3.22Å
102S96.5Very high94.4Very high0 Ų011.8 Ų11.80%06%0.058CC..Hα-helixtrans-71-40.7-175.556.60000110.7S62 N98 N99 I105 F106S62-S102 WeakPolarHBondContact CB-OG 3.23Å; S62-S102 PolarHBondContact OG-OG 3.48Å; N98-S102 WeakPolarHBondContact O-CB 3.49Å; N98-S102 PolarHBondContact O-N 2.96Å; N98-S102 PolarHBondContact O-OG 2.76Å; N99-S102 PolarHBondContact O-N 3.12Å; N99-S102 PolarHBondContact O-OG 3.25Å; S102-I105 PolarHBondContact O-N 3.19Å; S102-F106 WeakPolarHBondContact O-CB 3.28Å; S102-F106 WeakPolarHBondContact O-CD2 3.46Å; S102-F106 WeakPolarHBondContact O-CG 3.44Å; S102-F106 PolarHBondContact O-N 3.27Å
103S95.9Very high94.1Very high0 Ų012 Ų120%06%0.059CC..Hα-helixtrans-63.5-46.4177.7-62.30000111.9L59 S62 D63 N99 I105 F106 I107L59-S103 VanDerWaalsContact CD1-CB 3.47Å; L59-S103 WeakPolarHBondContact CD1-OG 3.44Å; S62-S103 PolarHBondContact OG-OG 3.44Å; D63-S103 PolarHBondContact OD1-OG 2.95Å; N99-S103 PolarHBondContact ND2-OG 3.06Å; N99-S103 WeakPolarHBondContact O-CB 3.26Å; N99-S103 PolarHBondContact O-N 3.36Å; N99-S103 PolarHBondContact O-OG 2.83Å; N99-S103 VanDerWaalsContact O-OG 3.08Å; S103-I105 VanDerWaalsContact C-N 3.34Å; S103-I105 PolarHBondContact O-N 3.12Å; S103-F106 PolarHBondContact O-N 3.08Å; S103-I107 WeakPolarHBondContact O-CB 3.23Å; S103-I107 WeakPolarHBondContact O-CD1 3.25Å; S103-I107 WeakPolarHBondContact O-CG1 3.46Å; S103-I107 PolarHBondContact O-N 3.5Å
104S95.3Very high93.8Very high0 Ų012.9 Ų12.90%06%0.062CC..Hα-helixtrans-61.9-39.7176.767.80000112.6I100 R101 T108 E189 L192I100-S104 WeakPolarHBondContact O-CB 3.26Å; I100-S104 PolarHBondContact O-N 3.2Å; I100-S104 VanDerWaalsContact O-N 3.07Å; I100-S104 PolarHBondContact O-OG 3.02Å; I100-S104 VanDerWaalsContact O-OG 3.05Å; R101-S104 PolarHBondContact O-OG 3.39Å; S104-T108 WeakPolarHBondContact O-CB 3.4Å; S104-T108 PolarHBondContact O-N 2.97Å; S104-T108 VanDerWaalsContact O-N 3.14Å; S104-T108 PolarHBondContact O-OG1 3.44Å; S104-E189 WeakPolarHBondContact CB-OE1 3.49Å; S104-E189 WeakPolarHBondContact CB-OE2 3.28Å; S104-E189 PolarHBondContact OG-OE1 3.04Å; S104-E189 PolarHBondContact OG-OE2 2.96Å; S104-L192 WeakPolarHBondContact OG-CD1 3.47Å
105I96.7Very high93.4Very high11 Ų1113 Ų136%0.0566%0.063CC..Hα-helixtrans-68-46176-63.3164.7000111.4R101 S102 S103 T108 F109 V140 F143 V144 L188 L192R101-I105 VanDerWaalsContact O-CD1 3.29Å; R101-I105 WeakPolarHBondContact O-CD1 3.38Å; R101-I105 WeakPolarHBondContact O-CG1 3.32Å; R101-I105 PolarHBondContact O-N 3.39Å; S102-I105 PolarHBondContact O-N 3.19Å; S103-I105 VanDerWaalsContact C-N 3.34Å; S103-I105 PolarHBondContact O-N 3.12Å; I105-T108 WeakPolarHBondContact O-CB 3.48Å; I105-T108 PolarHBondContact O-N 3.27Å; I105-F109 HydrophobicContact CG2-CD1 4.36Å; I105-F109 HydrophobicContact CG2-CD2 4.38Å; I105-F109 HydrophobicContact CG2-CE1 4.01Å; I105-F109 HydrophobicContact CG2-CE2 4.05Å; I105-F109 HydrophobicContact CG2-CZ 3.85Å; I105-F109 PolarHBondContact O-N 3.05Å; I105-V140 HydrophobicContact CB-CG1 4.27Å; I105-V140 HydrophobicContact CB-CG2 4.48Å; I105-V140 HydrophobicContact CD1-CG1 4.2Å; I105-V140 HydrophobicContact CG2-CB 4.49Å; I105-V140 HydrophobicContact CG2-CG1 4.13Å; I105-V140 HydrophobicContact CG2-CG2 3.49Å; I105-V140 VanDerWaalsContact CG2-CG2 3.49Å; I105-F143 HydrophobicContact CD1-CD1 3.94Å; I105-F143 HydrophobicContact CD1-CE1 4.05Å; I105-V144 HydrophobicContact CD1-CG1 4.47Å; I105-L188 HydrophobicContact CD1-CD2 4.38Å; I105-L192 HydrophobicContact CG1-CD1 3.82Å
106F96.1Very high93Very high0 Ų013 Ų130%06%0.064CC..Hα-helixtrans-66-40.6-179.6-75.5-53.4000112.4F55 N58 L59 S102 S103 T108 F109 I110 A137 V140 W141F55-F106 HydrophobicContact CB-CD1 4.32Å; F55-F106 HydrophobicContact CD1-CD1 4.11Å; F55-F106 HydrophobicContact CD1-CE1 4.34Å; N58-F106 HydrophobicContact CB-CD1 4.2Å; N58-F106 HydrophobicContact CB-CD2 4.13Å; N58-F106 HydrophobicContact CB-CE1 3.65Å; N58-F106 HydrophobicContact CB-CE2 3.58Å; N58-F106 HydrophobicContact CB-CG 4.45Å; N58-F106 HydrophobicContact CB-CZ 3.34Å; L59-F106 HydrophobicContact CB-CB 4.11Å; L59-F106 HydrophobicContact CD1-CB 4.14Å; S102-F106 WeakPolarHBondContact O-CB 3.28Å; S102-F106 WeakPolarHBondContact O-CD2 3.46Å; S102-F106 WeakPolarHBondContact O-CG 3.44Å; S102-F106 PolarHBondContact O-N 3.27Å; S103-F106 PolarHBondContact O-N 3.08Å; F106-T108 VanDerWaalsContact C-N 3.26Å; F106-T108 PolarHBondContact O-N 2.92Å; F106-F109 HydrophobicContact CD1-CD2 4.46Å; F106-F109 PolarHBondContact O-N 3.2Å; F106-I110 VanDerWaalsContact O-CG1 3.28Å; F106-I110 WeakPolarHBondContact O-CG1 3.32Å; F106-I110 PolarHBondContact O-N 3.07Å; F106-A137 HydrophobicContact CE1-CB 3.98Å; F106-A137 HydrophobicContact CZ-CB 4.3Å; F106-V140 HydrophobicContact CE1-CB 4.2Å; F106-V140 HydrophobicContact CE1-CG1 4.24Å; F106-V140 HydrophobicContact CE1-CG2 4.27Å; F106-V140 HydrophobicContact CE2-CG1 3.93Å; F106-V140 HydrophobicContact CZ-CB 3.94Å; F106-V140 HydrophobicContact CZ-CG1 3.73Å; F106-V140 HydrophobicContact CZ-CG2 4.49Å; F106-W141 HydrophobicContact CE2-CZ2 4.27Å; F106-W141 AromaticContact CZ-NE1 3.96Å
107I93.8Very high92.4Very high2 Ų213.1 Ų13.11%0.017%0.066CC..Hα-helixtrans-58.3-42.8172.7-68.9163.9000110.1L59 S103 I110 S111 N230 M233 F234 F238L59-I107 HydrophobicContact CD1-CG1 4.24Å; L59-I107 HydrophobicContact CD2-CG1 3.85Å; S103-I107 WeakPolarHBondContact O-CB 3.23Å; S103-I107 WeakPolarHBondContact O-CD1 3.25Å; S103-I107 WeakPolarHBondContact O-CG1 3.46Å; S103-I107 PolarHBondContact O-N 3.5Å; I107-I110 WeakPolarHBondContact O-CB 3.35Å; I107-I110 PolarHBondContact O-N 2.84Å; I107-S111 PolarHBondContact O-N 3.38Å; I107-S111 PolarHBondContact O-OG 3.44Å; I107-N230 HydrophobicContact CG2-CB 3.97Å; I107-M233 HydrophobicContact CD1-CE 3.57Å; I107-F234 HydrophobicContact CB-CE2 4.48Å; I107-F234 HydrophobicContact CG2-CE2 3.92Å; I107-F238 HydrophobicContact CD1-CE2 3.78Å; I107-F238 HydrophobicContact CD1-CZ 3.99Å
108T95.1Very high91.7Very high5 Ų514 Ų143%0.0317%0.074CC..Hα-helixtrans-64.2-42.5176.7-55.30000112S104 I105 F106 I110 S111 V112 L192 V195 N196 F234S104-T108 WeakPolarHBondContact O-CB 3.4Å; S104-T108 PolarHBondContact O-N 2.97Å; S104-T108 VanDerWaalsContact O-N 3.14Å; S104-T108 PolarHBondContact O-OG1 3.44Å; I105-T108 WeakPolarHBondContact O-CB 3.48Å; I105-T108 PolarHBondContact O-N 3.27Å; F106-T108 VanDerWaalsContact C-N 3.26Å; F106-T108 PolarHBondContact O-N 2.92Å; T108-I110 VanDerWaalsContact C-N 3.3Å; T108-I110 PolarHBondContact O-N 3.48Å; T108-S111 WeakPolarHBondContact O-CB 3.3Å; T108-S111 PolarHBondContact O-N 3.32Å; T108-V112 HydrophobicContact CG2-CG2 4.45Å; T108-V112 WeakPolarHBondContact O-CG2 3.48Å; T108-V112 PolarHBondContact O-N 3.36Å; T108-L192 HydrophobicContact CG2-CD2 3.92Å; T108-V195 HydrophobicContact CG2-CB 4.14Å; T108-V195 HydrophobicContact CG2-CG1 3.68Å; T108-N196 PolarHBondContact OG1-ND2 3.46Å; T108-F234 WeakPolarHBondContact OG1-CZ 3.3Å
109F94.5Very high91Very high70 Ų7014.9 Ų14.931%0.3078%0.079SC..Hα-helixtrans-62.5-37.2174.8-74.7-0.9000112.3F55 I105 F106 V112 D113 V140F55-F109 HydrophobicContact CD1-CB 4.14Å; F55-F109 AromaticContact CD1-CD2 3.91Å; F55-F109 HydrophobicContact CD1-CD2 3.91Å; F55-F109 HydrophobicContact CD2-CB 3.9Å; F55-F109 HydrophobicContact CE1-CB 4.21Å; F55-F109 AromaticContact CE1-CD2 3.59Å; F55-F109 HydrophobicContact CE1-CD2 3.59Å; F55-F109 HydrophobicContact CE1-CE2 4.37Å; F55-F109 HydrophobicContact CE1-CG 4.32Å; F55-F109 HydrophobicContact CE2-CB 3.97Å; F55-F109 HydrophobicContact CG-CB 4Å; F55-F109 HydrophobicContact CZ-CB 4.12Å; F55-F109 HydrophobicContact CZ-CD2 4.02Å; F55-F109 HydrophobicContact CZ-CG 4.38Å; I105-F109 HydrophobicContact CG2-CD1 4.36Å; I105-F109 HydrophobicContact CG2-CD2 4.38Å; I105-F109 HydrophobicContact CG2-CE1 4.01Å; I105-F109 HydrophobicContact CG2-CE2 4.05Å; I105-F109 HydrophobicContact CG2-CZ 3.85Å; I105-F109 PolarHBondContact O-N 3.05Å; F106-F109 HydrophobicContact CD1-CD2 4.46Å; F106-F109 PolarHBondContact O-N 3.2Å; F109-V112 PolarHBondContact O-N 3.45Å; F109-D113 WeakPolarHBondContact O-CB 3.43Å; F109-D113 PolarHBondContact O-N 2.98Å; F109-V140 HydrophobicContact CD2-CG2 4.28Å; F109-V140 HydrophobicContact CE2-CG2 3.43Å; F109-V140 VanDerWaalsContact CE2-CG2 3.43Å; F109-V140 HydrophobicContact CZ-CG2 3.94Å
110I91.4Very high90.1Very high3 Ų319.3 Ų19.32%0.01510%0.097CC..Hα-helixtrans-62.8-48.2172.7-68.5164.4000110.3I52 F55 M56 L59 F106 I107 T108 V112 D113 R114I52-I110 HydrophobicContact CD1-CG2 3.99Å; I52-I110 HydrophobicContact CG1-CG1 4.45Å; I52-I110 HydrophobicContact CG1-CG2 4.45Å; F55-I110 HydrophobicContact CB-CD1 4.33Å; F55-I110 HydrophobicContact CB-CG1 3.77Å; M56-I110 HydrophobicContact CG-CD1 3.88Å; M56-I110 HydrophobicContact CG-CG1 4.4Å; L59-I110 HydrophobicContact CD2-CD1 3.98Å; F106-I110 VanDerWaalsContact O-CG1 3.28Å; F106-I110 WeakPolarHBondContact O-CG1 3.32Å; F106-I110 PolarHBondContact O-N 3.07Å; I107-I110 WeakPolarHBondContact O-CB 3.35Å; I107-I110 PolarHBondContact O-N 2.84Å; T108-I110 VanDerWaalsContact C-N 3.3Å; T108-I110 PolarHBondContact O-N 3.48Å; I110-V112 VanDerWaalsContact C-N 3.34Å; I110-V112 PolarHBondContact O-N 3.14Å; I110-D113 PolarHBondContact O-N 3.43Å; I110-R114 WeakPolarHBondContact O-CB 3.45Å; I110-R114 VanDerWaalsContact O-CG 3.27Å; I110-R114 WeakPolarHBondContact O-CG 3.25Å; I110-R114 PolarHBondContact O-N 2.95Å
111S91.4Very high89.1Confident0 Ų022.2 Ų22.20%012%0.116CC..Hα-helixtrans-56.7-45.7175.6-69.80000112.6I107 T108 R114 L115 N196 N230I107-S111 PolarHBondContact O-N 3.38Å; I107-S111 PolarHBondContact O-OG 3.44Å; T108-S111 WeakPolarHBondContact O-CB 3.3Å; T108-S111 PolarHBondContact O-N 3.32Å; S111-R114 PolarHBondContact O-N 3.42Å; S111-L115 WeakPolarHBondContact O-CB 3.4Å; S111-L115 PolarHBondContact O-N 3.34Å; S111-N196 WeakPolarHBondContact CB-OD1 3.31Å; S111-N196 PolarHBondContact OG-OD1 2.96Å; S111-N230 PolarHBondContact OG-ND2 3.36Å
112V91.9Very high88.1Confident46 Ų4629.2 Ų29.228%0.27915%0.153SC..Hα-helixtrans-66.8-46179.6172.60000110.6T108 F109 I110 R114 L115 L116 V195T108-V112 HydrophobicContact CG2-CG2 4.45Å; T108-V112 WeakPolarHBondContact O-CG2 3.48Å; T108-V112 PolarHBondContact O-N 3.36Å; F109-V112 PolarHBondContact O-N 3.45Å; I110-V112 VanDerWaalsContact C-N 3.34Å; I110-V112 PolarHBondContact O-N 3.14Å; V112-R114 PolarHBondContact O-N 3.44Å; V112-L115 WeakPolarHBondContact O-CB 3.12Å; V112-L115 PolarHBondContact O-N 3.03Å; V112-L116 HydrophobicContact CG1-CD1 3.99Å; V112-L116 HydrophobicContact CG1-CG 4.24Å; V112-L116 VanDerWaalsContact O-CG 3.25Å; V112-L116 WeakPolarHBondContact O-CG 3.25Å; V112-L116 PolarHBondContact O-N 3.36Å; V112-V195 HydrophobicContact CG2-CG1 3.86Å
113D88.7Confident86.9Confident9 Ų936.9 Ų36.95%0.04819%0.186CC..Hα-helixtrans-58-40.2176.1-179.384.1000111.5I52 F109 I110 L116 A117 R128I52-D113 HydrophobicContact CD1-CB 4.44Å; F109-D113 WeakPolarHBondContact O-CB 3.43Å; F109-D113 PolarHBondContact O-N 2.98Å; I110-D113 PolarHBondContact O-N 3.43Å; D113-L116 PolarHBondContact O-N 2.89Å; D113-A117 WeakPolarHBondContact O-CB 3.39Å; D113-A117 PolarHBondContact O-N 2.98Å; D113-R128 IonicContact OD1-CZ 2.75Å; D113-R128 IonicContact OD1-NE 2.68Å; D113-R128 PolarHBondContact OD1-NE 3.03Å; D113-R128 IonicContact OD1-NH2 3.4Å; D113-R128 PolarHBondContact OD1-NH2 2.97Å; D113-R128 IonicContact OD2-CZ 3.63Å; D113-R128 IonicContact OD2-NE 2.69Å; D113-R128 IonicContact OD2-NH2 3.18Å; D113-R128 PolarHBondContact OD2-NH2 3.26Å
114R85.4Confident85.9Confident19 Ų1937.3 Ų37.37%0.07219%0.189CC..Hα-helixtrans-65.8-45.5175.9-70.2-65.2-178.6-156.5-8.8112.4I52 I110 S111 V112 L116 A117 V118 F227 S275I52-R114 HydrophobicContact CD1-CG 3.92Å; I52-R114 VanDerWaalsContact CD1-NH2 3.29Å; I110-R114 WeakPolarHBondContact O-CB 3.45Å; I110-R114 VanDerWaalsContact O-CG 3.27Å; I110-R114 WeakPolarHBondContact O-CG 3.25Å; I110-R114 PolarHBondContact O-N 2.95Å; S111-R114 PolarHBondContact O-N 3.42Å; V112-R114 PolarHBondContact O-N 3.44Å; R114-L116 VanDerWaalsContact C-N 3.34Å; R114-L116 PolarHBondContact O-N 2.98Å; R114-A117 WeakPolarHBondContact O-CB 3.24Å; R114-A117 PolarHBondContact O-N 2.95Å; R114-V118 WeakPolarHBondContact O-CG2 3.31Å; R114-V118 PolarHBondContact O-N 3.46Å; R114-F227 HydrophobicContact CB-CE2 4.21Å; R114-F227 HydrophobicContact CB-CZ 3.69Å; R114-S275 PolarHBondContact NH2-O 2.91Å; R114-S275 PolarHBondContact NH2-OG 2.91Å
115L87.8Confident84.9Confident22 Ų2246.9 Ų46.912%0.11523%0.225CC..Hα-helixtrans-54.5-51.8173.8169.872.7000110.4S111 V112 A117 V118 V119 C199 M202 V203S111-L115 WeakPolarHBondContact O-CB 3.4Å; S111-L115 PolarHBondContact O-N 3.34Å; V112-L115 WeakPolarHBondContact O-CB 3.12Å; V112-L115 PolarHBondContact O-N 3.03Å; L115-A117 VanDerWaalsContact C-N 3.27Å; L115-A117 PolarHBondContact O-N 3.42Å; L115-V118 PolarHBondContact O-N 3.24Å; L115-V118 VanDerWaalsContact O-N 3.14Å; L115-V119 HydrophobicContact CD1-CB 4.3Å; L115-V119 HydrophobicContact CD1-CG2 3.54Å; L115-V119 HydrophobicContact CG-CG2 4.46Å; L115-V119 WeakPolarHBondContact O-CB 3.43Å; L115-V119 PolarHBondContact O-N 3.47Å; L115-C199 HydrophobicContact CB-CB 4.31Å; L115-C199 HydrophobicContact CD2-CB 4.2Å; L115-M202 HydrophobicContact CD1-CB 3.69Å; L115-V203 HydrophobicContact CB-CG2 4.24Å; L115-V203 HydrophobicContact CD1-CG2 3.52Å; L115-V203 HydrophobicContact CG-CG2 4.49Å
116L86.1Confident83.9Confident37 Ų3752.8 Ų52.819%0.19425%0.252CS..Hα-helixtrans-62.1-36.3-179.3-63.6176.5000111.7V112 D113 R114 V118 Y120 T124V112-L116 HydrophobicContact CG1-CD1 3.99Å; V112-L116 HydrophobicContact CG1-CG 4.24Å; V112-L116 VanDerWaalsContact O-CG 3.25Å; V112-L116 WeakPolarHBondContact O-CG 3.25Å; V112-L116 PolarHBondContact O-N 3.36Å; D113-L116 PolarHBondContact O-N 2.89Å; R114-L116 VanDerWaalsContact C-N 3.34Å; R114-L116 PolarHBondContact O-N 2.98Å; L116-V118 VanDerWaalsContact C-N 3.33Å; L116-V118 PolarHBondContact O-N 2.89Å; L116-Y120 HydrophobicContact CD2-CD2 4.28Å; L116-Y120 CarbonylContact O-C 3.54Å; L116-Y120 WeakPolarHBondContact O-CA 3.32Å; L116-Y120 PolarHBondContact O-N 2.93Å; L116-Y120 VanDerWaalsContact O-N 3.07Å; L116-T124 HydrophobicContact CB-CG2 3.93Å; L116-T124 HydrophobicContact CD1-CG2 4.33Å; L116-T124 HydrophobicContact CD2-CG2 3.59Å; L116-T124 HydrophobicContact CG-CG2 4.12Å; L116-T124 PolarHBondContact O-OG1 3.42Å
117A80.9Confident83.1Confident10 Ų1057 Ų578%0.08327%0.274CS..Hα-helixtrans-67-30.5176.700000114.3D113 R114 L115D113-A117 WeakPolarHBondContact O-CB 3.39Å; D113-A117 PolarHBondContact O-N 2.98Å; R114-A117 WeakPolarHBondContact O-CB 3.24Å; R114-A117 PolarHBondContact O-N 2.95Å; L115-A117 VanDerWaalsContact C-N 3.27Å; L115-A117 PolarHBondContact O-N 3.42Å
118V78.3Confident82.5Confident39 Ų3959.8 Ų59.824%0.23628%0.284CS..Hα-helixtrans-92.4-48.3-176.1173.20000111R114 L115 L116 V203 L207 V223R114-V118 WeakPolarHBondContact O-CG2 3.31Å; R114-V118 PolarHBondContact O-N 3.46Å; L115-V118 PolarHBondContact O-N 3.24Å; L115-V118 VanDerWaalsContact O-N 3.14Å; L116-V118 VanDerWaalsContact C-N 3.33Å; L116-V118 PolarHBondContact O-N 2.89Å; V118-V203 HydrophobicContact CG1-CG1 4.34Å; V118-L207 HydrophobicContact CG1-CD2 4.09Å; V118-V223 HydrophobicContact CG2-CG1 4.06Å
119V80.4Confident82.1Confident27 Ų2761.9 Ų61.916%0.16430%0.297CS..Hα-helixtrans-90-34.8-171.5-173.60000112L115 P121 V203 T206L115-V119 HydrophobicContact CD1-CB 4.3Å; L115-V119 HydrophobicContact CD1-CG2 3.54Å; L115-V119 HydrophobicContact CG-CG2 4.46Å; L115-V119 WeakPolarHBondContact O-CB 3.43Å; L115-V119 PolarHBondContact O-N 3.47Å; V119-P121 VanDerWaalsContact C-CD 3.45Å; V119-V203 HydrophobicContact CG2-CG2 4.24Å; V119-T206 HydrophobicContact CB-CG2 4.49Å; V119-T206 HydrophobicContact CG1-CG2 4.37Å; V119-T206 HydrophobicContact CG2-CG2 4.08Å; V119-T206 WeakPolarHBondContact CG2-OG1 3.43Å
120Y78.6Confident81.8Confident93 Ų9361.9 Ų61.937%0.36530%0.3SS..  trans-131.751.8-173.5-55.7-67.2000113.8L116 L122 K123 T124L116-Y120 HydrophobicContact CD2-CD2 4.28Å; L116-Y120 CarbonylContact O-C 3.54Å; L116-Y120 WeakPolarHBondContact O-CA 3.32Å; L116-Y120 PolarHBondContact O-N 2.93Å; L116-Y120 VanDerWaalsContact O-N 3.07Å; Y120-L122 VanDerWaalsContact C-N 3.33Å; Y120-L122 PolarHBondContact O-N 3.33Å; Y120-K123 PolarHBondContact O-N 3.45Å; Y120-T124 WeakPolarHBondContact O-CG2 3.41Å; Y120-T124 PolarHBondContact O-N 2.9Å; Y120-T124 PolarHBondContact O-OG1 3.19Å
121P72.4Confident81.7Confident66 Ų6665 Ų6543%0.42932%0.322SS..THydrogen-bonded Turntrans-60.2-35.8-169.422.8-34000114.4V119V119-P121 VanDerWaalsContact C-CD 3.45Å
122L72.3Confident81.8Confident154 Ų15468 Ų6881%0.80634%0.338SS*.THydrogen-bonded Turntrans-87.8-39.2-178.8-62.6177.2000112.7Y120 T124Y120-L122 VanDerWaalsContact C-N 3.33Å; Y120-L122 PolarHBondContact O-N 3.33Å; L122-T124 VanDerWaalsContact C-N 3.32Å; L122-T124 PolarHBondContact O-N 2.86Å
123K71.6Confident81.8Confident162 Ų16266 Ų6670%0.70433%0.326SS*.THydrogen-bonded Turntrans-68.4-31-177-68-172.8177.6-175.90112.5Y120 H126Y120-K123 PolarHBondContact O-N 3.45Å; K123-H126 PolarHBondContact O-CE1 3.44Å; K123-H126 PolarHBondContact O-ND1 3.07Å
124T75.4Confident82Confident9 Ų968.7 Ų68.76%0.05534%0.343CS..THydrogen-bonded Turntrans-992-170.861.20000114L116 Y120 L122 H126 I127 R128L116-T124 HydrophobicContact CB-CG2 3.93Å; L116-T124 HydrophobicContact CD1-CG2 4.33Å; L116-T124 HydrophobicContact CD2-CG2 3.59Å; L116-T124 HydrophobicContact CG-CG2 4.12Å; L116-T124 PolarHBondContact O-OG1 3.42Å; Y120-T124 WeakPolarHBondContact O-CG2 3.41Å; Y120-T124 PolarHBondContact O-N 2.9Å; Y120-T124 PolarHBondContact O-OG1 3.19Å; L122-T124 VanDerWaalsContact C-N 3.32Å; L122-T124 PolarHBondContact O-N 2.86Å; T124-H126 PolarHBondContact O-N 3.29Å; T124-H126 VanDerWaalsContact O-N 3.15Å; T124-I127 PolarHBondContact O-N 3.36Å; T124-R128 WeakPolarHBondContact O-CG 3.43Å; T124-R128 PolarHBondContact O-N 2.81Å
125R73.8Confident82.5Confident200 Ų20073.7 Ų73.776%0.75537%0.365SS*.THydrogen-bonded Turntrans-56.1-34.5-177.8-174.1176.6177.1178.6-1.2113.3
126H75.9Confident82.9Confident136 Ų13673.3 Ų73.363%0.6337%0.366SS*.THydrogen-bonded Turntrans-73.9-26.3178.768.8-79.8000113.5K123 T124 T129K123-H126 PolarHBondContact O-CE1 3.44Å; K123-H126 PolarHBondContact O-ND1 3.07Å; T124-H126 PolarHBondContact O-N 3.29Å; T124-H126 VanDerWaalsContact O-N 3.15Å; H126-T129 WeakPolarHBondContact O-CG2 3.27Å
127I78.4Confident83.3Confident88 Ų8871.7 Ų71.745%0.45136%0.358SS..THydrogen-bonded Turntrans-83.8-39.2177.7-58.6172.5000110T124 T129 N132T124-I127 PolarHBondContact O-N 3.36Å; I127-T129 PolarHBondContact O-N 3.33Å; I127-N132 WeakPolarHBondContact O-CB 3.13Å; I127-N132 PolarHBondContact O-ND2 3.23Å
128R82.9Confident84.1Confident60 Ų6074.8 Ų74.823%0.22638%0.376CS..SBendtrans-78.358.9-178-61.9-177.470.9-146.8-0.2111.9P51 D113 T124P51-R128 HydrophobicContact CG-CB 4.25Å; P51-R128 WeakPolarHBondContact CG-O 3.32Å; D113-R128 IonicContact OD1-CZ 2.75Å; D113-R128 IonicContact OD1-NE 2.68Å; D113-R128 PolarHBondContact OD1-NE 3.03Å; D113-R128 IonicContact OD1-NH2 3.4Å; D113-R128 PolarHBondContact OD1-NH2 2.97Å; D113-R128 IonicContact OD2-CZ 3.63Å; D113-R128 IonicContact OD2-NE 2.69Å; D113-R128 IonicContact OD2-NH2 3.18Å; D113-R128 PolarHBondContact OD2-NH2 3.26Å; T124-R128 WeakPolarHBondContact O-CG 3.43Å; T124-R128 PolarHBondContact O-N 2.81Å
129T86.2Confident85Confident50 Ų5078.5 Ų78.531%0.30739%0.394SS..  trans-109.3154.5175.866.20000110.5H126 I127 S131 N132 A133H126-T129 WeakPolarHBondContact O-CG2 3.27Å; I127-T129 PolarHBondContact O-N 3.33Å; T129-S131 VanDerWaalsContact C-N 3.28Å; T129-S131 PolarHBondContact O-N 3.43Å; T129-N132 PolarHBondContact O-N 3.5Å; T129-N132 VanDerWaalsContact OG1-CG 3.26Å; T129-N132 PolarHBondContact OG1-N 2.96Å; T129-N132 PolarHBondContact OG1-ND2 3.47Å; T129-A133 PolarHBondContact O-N 2.85Å; T129-A133 VanDerWaalsContact O-N 3.13Å
130L88.3Confident85.8Confident70 Ų7077.5 Ų77.537%0.36639%0.388SS..Hα-helixtrans-59.2-41.9177-177.766000111.4L48 V54 N132 A133 V134L48-L130 HydrophobicContact CB-CD1 4.1Å; L48-L130 HydrophobicContact CB-CD2 4.38Å; V54-L130 HydrophobicContact CG2-CD1 3.32Å; L130-N132 VanDerWaalsContact C-N 3.35Å; L130-N132 PolarHBondContact O-N 3Å; L130-A133 PolarHBondContact O-N 3.19Å; L130-V134 HydrophobicContact CD1-CG2 4.43Å; L130-V134 HydrophobicContact CG-CG2 4.46Å; L130-V134 WeakPolarHBondContact O-CG2 3.4Å; L130-V134 PolarHBondContact O-N 2.97Å
131S89.6Confident86.8Confident67 Ų6775.3 Ų75.347%0.46938%0.379SS..Hα-helixtrans-57.9-46.2178.7-173.80000111.8T129 V134 K135T129-S131 VanDerWaalsContact C-N 3.28Å; T129-S131 PolarHBondContact O-N 3.43Å; S131-V134 PolarHBondContact O-N 3.18Å; S131-K135 VanDerWaalsContact O-CG 3.3Å; S131-K135 WeakPolarHBondContact O-CG 3.5Å; S131-K135 PolarHBondContact O-N 3.26Å
132N91.9Very high87.9Confident64 Ų6476.8 Ų76.834%0.34238%0.383SS..Hα-helixtrans-67.8-37.2179.2-69.2-13.3000112.4I127 T129 L130 K135 G136I127-N132 WeakPolarHBondContact O-CB 3.13Å; I127-N132 PolarHBondContact O-ND2 3.23Å; T129-N132 PolarHBondContact O-N 3.5Å; T129-N132 VanDerWaalsContact OG1-CG 3.26Å; T129-N132 PolarHBondContact OG1-N 2.96Å; T129-N132 PolarHBondContact OG1-ND2 3.47Å; L130-N132 VanDerWaalsContact C-N 3.35Å; L130-N132 PolarHBondContact O-N 3Å; N132-K135 PolarHBondContact O-N 2.91Å; N132-G136 PolarHBondContact O-N 3.49Å
133A92.6Very high89.1Confident3 Ų373.5 Ų73.53%0.02536%0.362CS..Hα-helixtrans-66.3-40.8176.100000112.2P51 V54 F55 T129 L130 G136 A137P51-A133 HydrophobicContact CB-CB 3.85Å; P51-A133 WeakPolarHBondContact O-CB 3.4Å; V54-A133 HydrophobicContact CB-CB 3.95Å; V54-A133 HydrophobicContact CG1-CB 4.33Å; V54-A133 HydrophobicContact CG2-CB 3.99Å; F55-A133 HydrophobicContact CE1-CB 4.05Å; F55-A133 HydrophobicContact CE2-CB 4.34Å; F55-A133 HydrophobicContact CZ-CB 3.82Å; T129-A133 PolarHBondContact O-N 2.85Å; T129-A133 VanDerWaalsContact O-N 3.13Å; L130-A133 PolarHBondContact O-N 3.19Å; A133-G136 PolarHBondContact O-N 2.92Å; A133-A137 PolarHBondContact O-N 2.93Å
134V94Very high90.2Very high66 Ų6665.8 Ų65.840%0.433%0.328SS..Hα-helixtrans-63.6-46.1174.2172.40000110.8V54 L130 S131 G136 A137 V138V54-V134 HydrophobicContact CG1-CG2 4.16Å; V54-V134 HydrophobicContact CG2-CG2 4.23Å; L130-V134 HydrophobicContact CD1-CG2 4.43Å; L130-V134 HydrophobicContact CG-CG2 4.46Å; L130-V134 WeakPolarHBondContact O-CG2 3.4Å; L130-V134 PolarHBondContact O-N 2.97Å; S131-V134 PolarHBondContact O-N 3.18Å; V134-G136 VanDerWaalsContact C-N 3.31Å; V134-G136 PolarHBondContact O-N 3.36Å; V134-A137 PolarHBondContact O-N 3.43Å; V134-V138 HydrophobicContact CG1-CG2 4.49Å; V134-V138 WeakPolarHBondContact O-CG2 3.18Å; V134-V138 PolarHBondContact O-N 2.92Å
135K94.9Very high91.1Very high124 Ų12469.4 Ų69.454%0.53935%0.347SS..Hα-helixtrans-57.2-45.6174.1-72.7173.9-175.1179.40111.4S131 N132 A137 V138 L139S131-K135 VanDerWaalsContact O-CG 3.3Å; S131-K135 WeakPolarHBondContact O-CG 3.5Å; S131-K135 PolarHBondContact O-N 3.26Å; N132-K135 PolarHBondContact O-N 2.91Å; K135-A137 PolarHBondContact O-N 2.95Å; K135-V138 PolarHBondContact O-N 3.45Å; K135-L139 VanDerWaalsContact O-CG 3.3Å; K135-L139 WeakPolarHBondContact O-CG 3.5Å; K135-L139 PolarHBondContact O-N 3.41Å
136G95.4Very high92.1Very high14 Ų1464.8 Ų64.814%0.14434%0.341CS..Hα-helixtrans-57.1-48.9175.500000112N132 A133 V134 V138 L139 V140N132-G136 PolarHBondContact O-N 3.49Å; A133-G136 PolarHBondContact O-N 2.92Å; V134-G136 VanDerWaalsContact C-N 3.31Å; V134-G136 PolarHBondContact O-N 3.36Å; G136-V138 PolarHBondContact O-N 3.37Å; G136-L139 PolarHBondContact O-N 2.73Å; G136-V140 WeakPolarHBondContact O-CG2 3.35Å; G136-V140 PolarHBondContact O-N 2.91Å
137A96.6Very high92.8Very high3 Ų359.6 Ų59.63%0.02532%0.318CS..Hα-helixtrans-61.2-44.2177.600000112.7V54 F106 A133 V134 K135 L139 V140 W141V54-A137 HydrophobicContact CG1-CB 4.17Å; F106-A137 HydrophobicContact CE1-CB 3.98Å; F106-A137 HydrophobicContact CZ-CB 4.3Å; A133-A137 PolarHBondContact O-N 2.93Å; V134-A137 PolarHBondContact O-N 3.43Å; K135-A137 PolarHBondContact O-N 2.95Å; A137-L139 VanDerWaalsContact C-N 3.32Å; A137-L139 PolarHBondContact O-N 3.04Å; A137-V140 WeakPolarHBondContact O-CB 3.44Å; A137-V140 PolarHBondContact O-N 2.78Å; A137-W141 PolarHBondContact O-N 3.14Å
138V97.1Very high93.5Very high76 Ų7656 Ų5646%0.46130%0.299SS..Hα-helixtrans-59.6-43.9175.3171.40000111V134 K135 G136 V140 W141 L142V134-V138 HydrophobicContact CG1-CG2 4.49Å; V134-V138 WeakPolarHBondContact O-CG2 3.18Å; V134-V138 PolarHBondContact O-N 2.92Å; K135-V138 PolarHBondContact O-N 3.45Å; G136-V138 PolarHBondContact O-N 3.37Å; V138-V140 VanDerWaalsContact C-N 3.32Å; V138-V140 PolarHBondContact O-N 2.84Å; V138-W141 PolarHBondContact O-N 3.28Å; V138-L142 HydrophobicContact CG1-CD1 3.98Å; V138-L142 HydrophobicContact CG1-CG 4.36Å; V138-L142 WeakPolarHBondContact O-CG 3.5Å; V138-L142 PolarHBondContact O-N 3.01Å
139L97.2Very high93.9Very high116 Ų11658.1 Ų58.161%0.60731%0.314SS*.Hα-helixtrans-62.2-38.7176.6-71.5172.7000112.2K135 G136 A137 L142 F143K135-L139 VanDerWaalsContact O-CG 3.3Å; K135-L139 WeakPolarHBondContact O-CG 3.5Å; K135-L139 PolarHBondContact O-N 3.41Å; G136-L139 PolarHBondContact O-N 2.73Å; A137-L139 VanDerWaalsContact C-N 3.32Å; A137-L139 PolarHBondContact O-N 3.04Å; L139-L142 PolarHBondContact O-N 3.42Å; L139-F143 VanDerWaalsContact O-CB 3.23Å; L139-F143 WeakPolarHBondContact O-CB 3.39Å; L139-F143 PolarHBondContact O-N 3.5Å
140V97.6Very high94.2Very high6 Ų659.1 Ų59.14%0.03632%0.322CS..Hα-helixtrans-61.3-50174.6173.90000110.4I105 F106 F109 G136 A137 V138 L142 F143 V144I105-V140 HydrophobicContact CB-CG1 4.27Å; I105-V140 HydrophobicContact CB-CG2 4.48Å; I105-V140 HydrophobicContact CD1-CG1 4.2Å; I105-V140 HydrophobicContact CG2-CB 4.49Å; I105-V140 HydrophobicContact CG2-CG1 4.13Å; I105-V140 HydrophobicContact CG2-CG2 3.49Å; I105-V140 VanDerWaalsContact CG2-CG2 3.49Å; F106-V140 HydrophobicContact CE1-CB 4.2Å; F106-V140 HydrophobicContact CE1-CG1 4.24Å; F106-V140 HydrophobicContact CE1-CG2 4.27Å; F106-V140 HydrophobicContact CE2-CG1 3.93Å; F106-V140 HydrophobicContact CZ-CB 3.94Å; F106-V140 HydrophobicContact CZ-CG1 3.73Å; F106-V140 HydrophobicContact CZ-CG2 4.49Å; F109-V140 HydrophobicContact CD2-CG2 4.28Å; F109-V140 HydrophobicContact CE2-CG2 3.43Å; F109-V140 VanDerWaalsContact CE2-CG2 3.43Å; F109-V140 HydrophobicContact CZ-CG2 3.94Å; G136-V140 WeakPolarHBondContact O-CG2 3.35Å; G136-V140 PolarHBondContact O-N 2.91Å; A137-V140 WeakPolarHBondContact O-CB 3.44Å; A137-V140 PolarHBondContact O-N 2.78Å; V138-V140 VanDerWaalsContact C-N 3.32Å; V138-V140 PolarHBondContact O-N 2.84Å; V140-L142 VanDerWaalsContact C-N 3.35Å; V140-L142 PolarHBondContact O-N 3.33Å; V140-F143 PolarHBondContact O-N 2.9Å; V140-V144 HydrophobicContact CG1-CG1 4.43Å; V140-V144 WeakPolarHBondContact O-CG1 3.47Å; V140-V144 WeakPolarHBondContact O-CG2 3.15Å; V140-V144 PolarHBondContact O-N 3.49Å
141W97.8Very high94.4Very high48 Ų4856.2 Ų56.218%0.18231%0.306CS..Hα-helixtrans-59.8-43.2178.7-73.6116.5000112.5N58 I61 M65 N98 F106 A137 V138 V144 L145N58-W141 PolarHBondContact OD1-NE1 3.41Å; I61-W141 HydrophobicContact CG2-CZ2 4.32Å; M65-W141 HydrophobicContact SD-CH2 3.93Å; M65-W141 HydrophobicContact SD-CZ3 4.29Å; N98-W141 WeakPolarHBondContact ND2-CZ3 3.45Å; F106-W141 HydrophobicContact CE2-CZ2 4.27Å; F106-W141 AromaticContact CZ-NE1 3.96Å; A137-W141 PolarHBondContact O-N 3.14Å; V138-W141 PolarHBondContact O-N 3.28Å; W141-V144 HydrophobicContact CE3-CG2 4.05Å; W141-V144 WeakPolarHBondContact O-CG2 3.42Å; W141-L145 WeakPolarHBondContact O-CB 3.4Å; W141-L145 WeakPolarHBondContact O-CG 3.37Å; W141-L145 PolarHBondContact O-N 3.5Å
142L97.4Very high94.5Very high96 Ų9653.4 Ų53.450%0.50329%0.287SS..Hα-helixtrans-63.5-44.8175.2-68.6174.7000111.7V138 L139 V140 L145 V146V138-L142 HydrophobicContact CG1-CD1 3.98Å; V138-L142 HydrophobicContact CG1-CG 4.36Å; V138-L142 WeakPolarHBondContact O-CG 3.5Å; V138-L142 PolarHBondContact O-N 3.01Å; L139-L142 PolarHBondContact O-N 3.42Å; V140-L142 VanDerWaalsContact C-N 3.35Å; V140-L142 PolarHBondContact O-N 3.33Å; L142-L145 PolarHBondContact O-N 3.39Å; L142-V146 VanDerWaalsContact O-CG2 3.29Å; L142-V146 WeakPolarHBondContact O-CG2 3.41Å; L142-V146 PolarHBondContact O-N 3.4Å
143F95.6Very high94.5Very high85 Ų8554.2 Ų54.237%0.37329%0.291SS..Hα-helixtrans-60-47.7178.5174.1-101.2000112I105 L139 V140 L145 V146 L147 L188I105-F143 HydrophobicContact CD1-CD1 3.94Å; I105-F143 HydrophobicContact CD1-CE1 4.05Å; L139-F143 VanDerWaalsContact O-CB 3.23Å; L139-F143 WeakPolarHBondContact O-CB 3.39Å; L139-F143 PolarHBondContact O-N 3.5Å; V140-F143 PolarHBondContact O-N 2.9Å; F143-L145 VanDerWaalsContact C-N 3.34Å; F143-L145 PolarHBondContact O-N 3.34Å; F143-V146 PolarHBondContact O-N 2.89Å; F143-L147 HydrophobicContact CD1-CD1 4.35Å; F143-L147 HydrophobicContact CE1-CD1 3.67Å; F143-L147 HydrophobicContact CE2-CD1 4.24Å; F143-L147 HydrophobicContact CZ-CD1 3.61Å; F143-L147 HydrophobicContact CZ-CG 4.42Å; F143-L147 PolarHBondContact O-N 3.39Å; F143-L188 HydrophobicContact CE1-CD2 3.84Å; F143-L188 HydrophobicContact CZ-CD2 4.26Å
144V95.3Very high94.4Very high0 Ų056.2 Ų56.20%030%0.298CS..Hα-helixtrans-67.1-35.8178.7-59.80000111.9N98 R101 I105 V140 W141 L147 N148N98-V144 WeakPolarHBondContact OD1-CG2 3.27Å; R101-V144 HydrophobicContact CB-CG1 3.7Å; I105-V144 HydrophobicContact CD1-CG1 4.47Å; V140-V144 HydrophobicContact CG1-CG1 4.43Å; V140-V144 WeakPolarHBondContact O-CG1 3.47Å; V140-V144 WeakPolarHBondContact O-CG2 3.15Å; V140-V144 PolarHBondContact O-N 3.49Å; W141-V144 HydrophobicContact CE3-CG2 4.05Å; W141-V144 WeakPolarHBondContact O-CG2 3.42Å; V144-L147 PolarHBondContact O-N 3.03Å; V144-N148 VanDerWaalsContact O-CB 3.3Å; V144-N148 WeakPolarHBondContact O-CB 3.17Å; V144-N148 PolarHBondContact O-N 2.82Å; V144-N148 PolarHBondContact O-ND2 2.99Å
145L94.3Very high94.3Very high86 Ų8653.1 Ų53.145%0.4528%0.279SS..Hα-helixtrans-63.7-43.9174.6-74.2171.5000111.7W141 L142 F143 L147 N148 I149W141-L145 WeakPolarHBondContact O-CB 3.4Å; W141-L145 WeakPolarHBondContact O-CG 3.37Å; W141-L145 PolarHBondContact O-N 3.5Å; L142-L145 PolarHBondContact O-N 3.39Å; F143-L145 VanDerWaalsContact C-N 3.34Å; F143-L145 PolarHBondContact O-N 3.34Å; L145-L147 PolarHBondContact O-N 3.21Å; L145-N148 PolarHBondContact O-N 3.48Å; L145-I149 HydrophobicContact CB-CD1 4.48Å; L145-I149 WeakPolarHBondContact O-CB 3.34Å; L145-I149 VanDerWaalsContact O-CG1 3.24Å; L145-I149 WeakPolarHBondContact O-CG1 3.46Å; L145-I149 PolarHBondContact O-N 3.29Å
146V94.4Very high94.1Very high102 Ų10249.2 Ų49.262%0.61827%0.267SS*.Hα-helixtrans-59.4-34.1177.1167.70000111.8L142 F143 P150L142-V146 VanDerWaalsContact O-CG2 3.29Å; L142-V146 WeakPolarHBondContact O-CG2 3.41Å; L142-V146 PolarHBondContact O-N 3.4Å; F143-V146 PolarHBondContact O-N 2.89Å; V146-P150 WeakPolarHBondContact O-CD 3.46Å; V146-P150 VanDerWaalsContact O-CG 3.26Å; V146-P150 WeakPolarHBondContact O-CG 3.39Å
147L92.2Very high93.8Very high28 Ų2856.8 Ų56.815%0.14729%0.291CS..Hα-helixtrans-78.9-44.4174.7-64.1-177.7000112.7F143 V144 L145 P150 E151 I184F143-L147 HydrophobicContact CD1-CD1 4.35Å; F143-L147 HydrophobicContact CE1-CD1 3.67Å; F143-L147 HydrophobicContact CE2-CD1 4.24Å; F143-L147 HydrophobicContact CZ-CD1 3.61Å; F143-L147 HydrophobicContact CZ-CG 4.42Å; F143-L147 PolarHBondContact O-N 3.39Å; V144-L147 PolarHBondContact O-N 3.03Å; L145-L147 PolarHBondContact O-N 3.21Å; L147-P150 WeakPolarHBondContact O-CD 3.4Å; L147-E151 VanDerWaalsContact O-CB 3.3Å; L147-E151 WeakPolarHBondContact O-CB 3.35Å; L147-I184 HydrophobicContact CD2-CG2 4.37Å
148N91.9Very high93.4Very high11 Ų1158.6 Ų58.66%0.05930%0.3CS..Hα-helixtrans-69.7-35.9-174.8-79.4-50.8000113.3M94 N98 R101 V144 L145 G152M94-N148 HydrophobicContact SD-CB 4.49Å; N98-N148 WeakPolarHBondContact CB-ND2 3.43Å; N98-N148 PolarHBondContact OD1-ND2 3.04Å; R101-N148 PolarHBondContact NH1-OD1 3.43Å; V144-N148 VanDerWaalsContact O-CB 3.3Å; V144-N148 WeakPolarHBondContact O-CB 3.17Å; V144-N148 PolarHBondContact O-N 2.82Å; V144-N148 PolarHBondContact O-ND2 2.99Å; L145-N148 PolarHBondContact O-N 3.48Å; N148-G152 PolarHBondContact O-N 3.22Å
149I92.8Very high93Very high105 Ų10555.4 Ų55.454%0.53828%0.281SS..Hα-helixtrans-61-58-177.4-69.4166000112.6L145 E151 G152 I153L145-I149 HydrophobicContact CB-CD1 4.48Å; L145-I149 WeakPolarHBondContact O-CB 3.34Å; L145-I149 VanDerWaalsContact O-CG1 3.24Å; L145-I149 WeakPolarHBondContact O-CG1 3.46Å; L145-I149 PolarHBondContact O-N 3.29Å; I149-E151 VanDerWaalsContact C-N 3.26Å; I149-E151 PolarHBondContact O-N 3.47Å; I149-G152 PolarHBondContact O-N 2.82Å; I149-I153 HydrophobicContact CG2-CD1 4.13Å; I149-I153 WeakPolarHBondContact O-CG1 3.42Å; I149-I153 PolarHBondContact O-N 3.29Å
150P92Very high92.5Very high72 Ų7254.5 Ų54.547%0.46828%0.277SS..Hα-helixtrans-64.4-34.4-179.124.7-33.5000111.9V146 L147 I153 R154V146-P150 WeakPolarHBondContact O-CD 3.46Å; V146-P150 VanDerWaalsContact O-CG 3.26Å; V146-P150 WeakPolarHBondContact O-CG 3.39Å; L147-P150 WeakPolarHBondContact O-CD 3.4Å; P150-I153 PolarHBondContact O-N 3.4Å; P150-R154 PolarHBondContact O-N 3.45Å
151E91.3Very high91.8Very high9 Ų959 Ų594%0.04231%0.308CS..Hα-helixtrans-66.5-41.4176.2-172.7175.8-161.600112.2M94 R97 R101 L147 I149 R154 F155 T181M94-E151 HydrophobicContact SD-CG 4.49Å; R97-E151 WeakPolarHBondContact CD-OE1 3.19Å; R97-E151 IonicContact CZ-OE1 2.72Å; R97-E151 IonicContact NE-OE1 2.68Å; R97-E151 IonicContact NH1-OE1 3.64Å; R97-E151 PolarHBondContact NH1-OE1 3.32Å; R101-E151 IonicContact CZ-OE2 3.17Å; R101-E151 IonicContact NH1-OE2 2.73Å; R101-E151 PolarHBondContact NH1-OE2 3.16Å; R101-E151 IonicContact NH2-OE1 3.56Å; R101-E151 PolarHBondContact NH2-OE1 3.3Å; R101-E151 IonicContact NH2-OE2 2.68Å; R101-E151 PolarHBondContact NH2-OE2 3.22Å; L147-E151 VanDerWaalsContact O-CB 3.3Å; L147-E151 WeakPolarHBondContact O-CB 3.35Å; I149-E151 VanDerWaalsContact C-N 3.26Å; I149-E151 PolarHBondContact O-N 3.47Å; E151-R154 WeakPolarHBondContact O-CB 3.07Å; E151-R154 PolarHBondContact O-N 3.31Å; E151-F155 WeakPolarHBondContact O-CB 3.21Å; E151-F155 PolarHBondContact O-N 3.27Å; E151-T181 HydrophobicContact CB-CG2 4.44Å; E151-T181 HydrophobicContact CG-CG2 4.5Å
152G92.1Very high90.7Very high7 Ų759.2 Ų59.27%0.07232%0.315CS..Hα-helixtrans-65.3-39.2174.900000112.7M94 N148 I149 F155 S156M94-G152 VanDerWaalsContact SD-CA 3.5Å; N148-G152 PolarHBondContact O-N 3.22Å; I149-G152 PolarHBondContact O-N 2.82Å; G152-F155 PolarHBondContact O-N 3.29Å; G152-S156 WeakPolarHBondContact O-CB 3.02Å; G152-S156 PolarHBondContact O-N 3.33Å
153I92.1Very high89Confident82 Ų8262.4 Ų62.442%0.42133%0.332SS..Hα-helixtrans-62.8-45.5173.3-65.8167.3000110.3I149 P150 S156 R157I149-I153 HydrophobicContact CG2-CD1 4.13Å; I149-I153 WeakPolarHBondContact O-CG1 3.42Å; I149-I153 PolarHBondContact O-N 3.29Å; P150-I153 PolarHBondContact O-N 3.4Å; I153-S156 WeakPolarHBondContact O-CB 3.38Å; I153-S156 PolarHBondContact O-N 2.61Å; I153-R157 VanDerWaalsContact CG2-NH2 3.33Å; I153-R157 WeakPolarHBondContact O-CG 3.29Å; I153-R157 PolarHBondContact O-N 2.96Å; I153-R157 VanDerWaalsContact O-N 3.13Å
154R90.9Very high87.3Confident45 Ų4562.4 Ų62.417%0.1736%0.356CS..Hα-helixtrans-60.5-47.3176.6-174.9-173.473.9138.9-4.9111.4P150 E151 S156 R157 L158 D174 E177 S179P150-R154 PolarHBondContact O-N 3.45Å; E151-R154 WeakPolarHBondContact O-CB 3.07Å; E151-R154 PolarHBondContact O-N 3.31Å; R154-S156 VanDerWaalsContact C-N 3.31Å; R154-S156 PolarHBondContact O-N 3.34Å; R154-R157 WeakPolarHBondContact O-CB 3.48Å; R154-R157 PolarHBondContact O-N 3.5Å; R154-R157 VanDerWaalsContact O-N 3.15Å; R154-L158 PolarHBondContact O-N 3.44Å; R154-D174 IonicContact CZ-OD1 2.66Å; R154-D174 IonicContact CZ-OD2 2.79Å; R154-D174 IonicContact NE-OD1 3.9Å; R154-D174 PolarHBondContact NE-OD1 3.32Å; R154-D174 IonicContact NH1-OD1 3.95Å; R154-D174 PolarHBondContact NH2-O 3.47Å; R154-D174 IonicContact NH2-OD1 3.1Å; R154-D174 PolarHBondContact NH2-OD1 2.84Å; R154-D174 IonicContact NH2-OD2 3.31Å; R154-D174 PolarHBondContact NH2-OD2 2.88Å; R154-E177 IonicContact CZ-OE2 3.51Å; R154-E177 IonicContact NH1-OE2 2.69Å; R154-E177 PolarHBondContact NH1-OE2 2.93Å; R154-S179 PolarHBondContact NH1-OG 3.23Å; R154-S179 PolarHBondContact NH2-OG 2.93Å
155F90.9Very high86Confident0 Ų064.3 Ų64.30%037%0.37CS..Hα-helixtrans-62.9-38179.4-174.7-116.1000112.2V90 T93 M94 E151 G152 R157 L158 L159 S170 V171 D174V90-F155 HydrophobicContact CB-CD1 4.35Å; V90-F155 HydrophobicContact CG2-CD1 3.9Å; V90-F155 HydrophobicContact CG2-CE1 4.42Å; T93-F155 HydrophobicContact CG2-CD1 4.25Å; T93-F155 HydrophobicContact CG2-CE1 3.89Å; T93-F155 HydrophobicContact CG2-CZ 4.11Å; T93-F155 WeakPolarHBondContact OG1-CE1 3.17Å; M94-F155 HydrophobicContact CE-CB 4.12Å; M94-F155 HydrophobicContact CE-CD1 4.13Å; M94-F155 HydrophobicContact CE-CG 4.29Å; E151-F155 WeakPolarHBondContact O-CB 3.21Å; E151-F155 PolarHBondContact O-N 3.27Å; G152-F155 PolarHBondContact O-N 3.29Å; F155-R157 PolarHBondContact O-N 2.76Å; F155-L158 HydrophobicContact CD2-CD2 4.22Å; F155-L158 HydrophobicContact CE2-CD2 4.43Å; F155-L158 WeakPolarHBondContact O-CB 3.4Å; F155-L158 PolarHBondContact O-N 2.75Å; F155-L159 HydrophobicContact CD1-CD1 3.97Å; F155-L159 HydrophobicContact CE1-CD1 3.65Å; F155-L159 HydrophobicContact CE1-CG 4.25Å; F155-L159 HydrophobicContact CZ-CD1 4.12Å; F155-L159 HydrophobicContact CZ-CD2 4.45Å; F155-L159 HydrophobicContact CZ-CG 4.25Å; F155-L159 PolarHBondContact O-N 2.88Å; F155-S170 VanDerWaalsContact CE2-OG 3.31Å; F155-S170 WeakPolarHBondContact CE2-OG 3.48Å; F155-S170 WeakPolarHBondContact CZ-OG 3.41Å; F155-V171 HydrophobicContact CE2-CG2 4.02Å; F155-V171 HydrophobicContact CZ-CG2 3.64Å; F155-D174 HydrophobicContact CD2-CB 3.85Å; F155-D174 HydrophobicContact CE2-CB 4.13Å
156S91.1Very high85.4Confident42 Ų4262.7 Ų62.729%0.29436%0.359SS..Hα-helixtrans-60-42.8172.7-176.70000112.4G152 I153 R154 L158 L159 N160G152-S156 WeakPolarHBondContact O-CB 3.02Å; G152-S156 PolarHBondContact O-N 3.33Å; I153-S156 WeakPolarHBondContact O-CB 3.38Å; I153-S156 PolarHBondContact O-N 2.61Å; R154-S156 VanDerWaalsContact C-N 3.31Å; R154-S156 PolarHBondContact O-N 3.34Å; S156-L158 VanDerWaalsContact C-N 3.33Å; S156-L158 PolarHBondContact O-N 2.98Å; S156-L159 PolarHBondContact O-N 3.24Å; S156-N160 PolarHBondContact O-N 3.25Å; S156-N160 VanDerWaalsContact O-N 3.11Å; S156-N160 PolarHBondContact O-ND2 3.43Å
157R89.5Confident85Confident174 Ų17458 Ų5866%0.65733%0.33SS*.Hα-helixtrans-64.1-39.2174.7-64.5177.9-159.41471.3111.9I153 R154 F155 N160 S161I153-R157 VanDerWaalsContact CG2-NH2 3.33Å; I153-R157 WeakPolarHBondContact O-CG 3.29Å; I153-R157 PolarHBondContact O-N 2.96Å; I153-R157 VanDerWaalsContact O-N 3.13Å; R154-R157 WeakPolarHBondContact O-CB 3.48Å; R154-R157 PolarHBondContact O-N 3.5Å; R154-R157 VanDerWaalsContact O-N 3.15Å; F155-R157 PolarHBondContact O-N 2.76Å; R157-N160 PolarHBondContact O-N 3.19Å; R157-S161 WeakPolarHBondContact O-CB 3.34Å; R157-S161 PolarHBondContact O-N 3.08Å
158L88.3Confident84.7Confident40 Ų4056.7 Ų56.721%0.20932%0.324CS..Hα-helixtrans-60.4-48.6176.4178.967000111.2R154 F155 S156 N160 S161 T162 D174R154-L158 PolarHBondContact O-N 3.44Å; F155-L158 HydrophobicContact CD2-CD2 4.22Å; F155-L158 HydrophobicContact CE2-CD2 4.43Å; F155-L158 WeakPolarHBondContact O-CB 3.4Å; F155-L158 PolarHBondContact O-N 2.75Å; S156-L158 VanDerWaalsContact C-N 3.33Å; S156-L158 PolarHBondContact O-N 2.98Å; L158-N160 VanDerWaalsContact C-N 3.3Å; L158-N160 PolarHBondContact O-N 3.22Å; L158-S161 PolarHBondContact O-N 3.04Å; L158-S161 VanDerWaalsContact O-N 3.11Å; L158-T162 PolarHBondContact O-N 2.86Å; L158-T162 VanDerWaalsContact O-N 3.12Å; L158-T162 PolarHBondContact O-OG1 3.38Å; L158-D174 HydrophobicContact CD2-CB 3.69Å
159L88.4Confident84.3Confident9 Ų960.1 Ų60.15%0.04734%0.339CS..Hα-helixtrans-57.5-41.6176.9-78.1166.1000112.2N86 C89 V90 F155 S156 S161 T162 S170N86-L159 HydrophobicContact CB-CD1 4.38Å; C89-L159 HydrophobicContact CB-CD1 4.1Å; V90-L159 HydrophobicContact CG2-CD1 3.65Å; F155-L159 HydrophobicContact CD1-CD1 3.97Å; F155-L159 HydrophobicContact CE1-CD1 3.65Å; F155-L159 HydrophobicContact CE1-CG 4.25Å; F155-L159 HydrophobicContact CZ-CD1 4.12Å; F155-L159 HydrophobicContact CZ-CD2 4.45Å; F155-L159 HydrophobicContact CZ-CG 4.25Å; F155-L159 PolarHBondContact O-N 2.88Å; S156-L159 PolarHBondContact O-N 3.24Å; L159-S161 VanDerWaalsContact C-N 3.33Å; L159-S161 PolarHBondContact O-N 2.72Å; L159-T162 PolarHBondContact O-N 3.12Å; L159-S170 VanDerWaalsContact CD2-OG 3.26Å; L159-S170 WeakPolarHBondContact CD2-OG 3.28Å
160N86.6Confident83.8Confident98 Ų9855.2 Ų55.252%0.52431%0.314SS..Hα-helixtrans-72.1-27178.4-66.9-19.7000113N86 S156 R157 L158N86-N160 PolarHBondContact ND2-OD1 3.14Å; N86-N160 VanDerWaalsContact ND2-OD1 3.07Å; S156-N160 PolarHBondContact O-N 3.25Å; S156-N160 VanDerWaalsContact O-N 3.11Å; S156-N160 PolarHBondContact O-ND2 3.43Å; R157-N160 PolarHBondContact O-N 3.19Å; L158-N160 VanDerWaalsContact C-N 3.3Å; L158-N160 PolarHBondContact O-N 3.22Å
161S83.4Confident83.4Confident99 Ų9951.9 Ų51.969%0.69229%0.293SS*.Hα-helixtrans-80.1-22.1178.3-174.50000113.2R157 L158 L159R157-S161 WeakPolarHBondContact O-CB 3.34Å; R157-S161 PolarHBondContact O-N 3.08Å; L158-S161 PolarHBondContact O-N 3.04Å; L158-S161 VanDerWaalsContact O-N 3.11Å; L159-S161 VanDerWaalsContact C-N 3.33Å; L159-S161 PolarHBondContact O-N 2.72Å
162T74.4Confident83Confident53 Ų5353.3 Ų53.333%0.32530%0.298SS..SBendtrans-103.978.1-178.632.30000109.8L158 L159 G164 S165L158-T162 PolarHBondContact O-N 2.86Å; L158-T162 VanDerWaalsContact O-N 3.12Å; L158-T162 PolarHBondContact O-OG1 3.38Å; L159-T162 PolarHBondContact O-N 3.12Å; T162-G164 PolarHBondContact O-N 3.31Å; T162-S165 VanDerWaalsContact CB-OG 3.31Å; T162-S165 WeakPolarHBondContact CB-OG 3.41Å; T162-S165 PolarHBondContact O-N 2.9Å; T162-S165 VanDerWaalsContact O-N 3.12Å; T162-S165 PolarHBondContact OG1-OG 2.77Å
163N61.3Low82.5Confident163 Ų16356.2 Ų56.287%0.87232%0.317SS*.THydrogen-bonded Turntrans-53.3104.4175-86-10.5000110.4
164G61.1Low82.1Confident85 Ų8552.4 Ų52.488%0.87630%0.298SS*.THydrogen-bonded Turntrans974.2175.500000116.6T162T162-G164 PolarHBondContact O-N 3.31Å
165S67.3Low81.6Confident40 Ų4051.1 Ų51.128%0.2829%0.294SS..  trans-75.3139.617275.90000111.5T162T162-S165 VanDerWaalsContact CB-OG 3.31Å; T162-S165 WeakPolarHBondContact CB-OG 3.41Å; T162-S165 PolarHBondContact O-N 2.9Å; T162-S165 VanDerWaalsContact O-N 3.12Å; T162-S165 PolarHBondContact OG1-OG 2.77Å
166K81.7Confident81Confident53 Ų5355.7 Ų55.723%0.2331%0.311CS..  trans-72150.5177.7-74.5175.5-167.3163.10111.1F76 D80 F168 E169 S170F76-K166 HydrophobicContact CE2-CB 3.59Å; F76-K166 HydrophobicContact CE2-CD 3.68Å; F76-K166 HydrophobicContact CE2-CG 3.93Å; F76-K166 HydrophobicContact CZ-CB 3.75Å; F76-K166 HydrophobicContact CZ-CD 3.79Å; F76-K166 HydrophobicContact CZ-CG 4.29Å; D80-K166 WeakPolarHBondContact O-CE 3.46Å; D80-K166 PolarHBondContact O-NZ 2.84Å; D80-K166 VanDerWaalsContact O-NZ 3.07Å; D80-K166 IonicContact OD1-NZ 3.97Å; D80-K166 PolarHBondContact OD1-NZ 3.38Å; D80-K166 IonicContact OD2-NZ 3.43Å; D80-K166 PolarHBondContact OD2-NZ 2.9Å; K166-F168 PolarHBondContact O-N 3.14Å; K166-E169 HydrophobicContact CB-CB 4.27Å; K166-E169 HydrophobicContact CB-CG 4Å; K166-E169 IonicContact NZ-OE1 3.24Å; K166-E169 PolarHBondContact O-N 2.91Å; K166-S170 PolarHBondContact O-N 3.19Å
167C86.5Confident80.4Confident2 Ų258.3 Ų58.31%0.01432%0.319CS..Hα-helixtrans-48.6-57.7-175.71750000113.4W82 C89 E169 S170W82-C167 HydrophobicContact CB-CB 4.27Å; W82-C167 HydrophobicContact CD2-CB 3.47Å; W82-C167 VanDerWaalsContact CD2-CB 3.47Å; W82-C167 HydrophobicContact CE3-CB 3.77Å; W82-C167 HydrophobicContact CG-CB 3.69Å; W82-C167 HydrophobicContact CZ2-CB 4.46Å; W82-C167 HydrophobicContact CZ3-CB 4.36Å; C89-C167 WeakPolarHBondContact CA-SG 3.47Å; C89-C167 HydrophobicContact CB-CB 3.78Å; C89-C167 WeakPolarHBondContact CB-SG 3.26Å; C89-C167 WeakPolarHBondContact SG-CA 3.32Å; C89-C167 WeakPolarHBondContact SG-CB 3.43Å; C89-C167 CovalentContact SG-SG 2.02Å; C89-C167 PolarHBondContact SG-SG 3.39Å; C167-E169 PolarHBondContact O-N 2.89Å; C167-S170 PolarHBondContact O-N 2.7Å; C167-S170 PolarHBondContact O-OG 3.39Å
168F84.7Confident79.4Confident1 Ų157.9 Ų57.90%0.00432%0.322CS..Hα-helixtrans-78.4-19.8-175.7-61.6-66.7000114.1R73 F76 W82 V92 K166 V171 Y172R73-F168 HydrophobicContact CB-CE1 4.45Å; R73-F168 HydrophobicContact CB-CE2 3.97Å; R73-F168 HydrophobicContact CB-CZ 3.71Å; R73-F168 HydrophobicContact CG-CD2 4.49Å; R73-F168 HydrophobicContact CG-CE1 4.36Å; R73-F168 HydrophobicContact CG-CE2 4.03Å; R73-F168 HydrophobicContact CG-CZ 3.94Å; F76-F168 HydrophobicContact CB-CD2 3.77Å; F76-F168 HydrophobicContact CB-CE2 3.7Å; F76-F168 HydrophobicContact CD1-CB 4.23Å; F76-F168 AromaticContact CD1-CD2 3.4Å; F76-F168 HydrophobicContact CD1-CD2 3.4Å; F76-F168 HydrophobicContact CD1-CE2 4.2Å; F76-F168 HydrophobicContact CD1-CG 4.25Å; F76-F168 HydrophobicContact CD2-CD2 4.01Å; F76-F168 HydrophobicContact CE1-CB 3.94Å; F76-F168 AromaticContact CE1-CD2 3.94Å; F76-F168 HydrophobicContact CE1-CD2 3.94Å; F76-F168 HydrophobicContact CE1-CG 4.44Å; F76-F168 AromaticContact CG-CD2 3.42Å; F76-F168 HydrophobicContact CG-CD2 3.42Å; F76-F168 VanDerWaalsContact CG-CD2 3.42Å; F76-F168 AromaticContact CG-CE2 3.89Å; F76-F168 HydrophobicContact CG-CE2 3.89Å; F76-F168 HydrophobicContact CZ-CB 4.38Å; F76-F168 HydrophobicContact CZ-CD2 4.47Å; W82-F168 HydrophobicContact CE3-CE2 4.12Å; W82-F168 AromaticContact CZ3-CE2 3.79Å; W82-F168 HydrophobicContact CZ3-CE2 3.79Å; W82-F168 HydrophobicContact CZ3-CZ 4.06Å; V92-F168 HydrophobicContact CG1-CE1 4.07Å; V92-F168 HydrophobicContact CG1-CZ 3.98Å; K166-F168 PolarHBondContact O-N 3.14Å; F168-V171 HydrophobicContact CD1-CG2 4.42Å; F168-V171 WeakPolarHBondContact O-CB 3.47Å; F168-V171 PolarHBondContact O-N 3.2Å; F168-Y172 WeakPolarHBondContact O-CE1 3.48Å
169E83.2Confident78.8Confident83 Ų8356.7 Ų56.739%0.38832%0.317SS..Hα-helixtrans-68.5-39.6170.7-67.3177.1-178.300111.3K166 C167 V171 Y172 S173K166-E169 HydrophobicContact CB-CB 4.27Å; K166-E169 HydrophobicContact CB-CG 4Å; K166-E169 IonicContact NZ-OE1 3.24Å; K166-E169 PolarHBondContact O-N 2.91Å; C167-E169 PolarHBondContact O-N 2.89Å; E169-V171 PolarHBondContact O-N 3.22Å; E169-Y172 WeakPolarHBondContact O-CB 3.46Å; E169-Y172 PolarHBondContact O-N 3.01Å; E169-S173 PolarHBondContact O-N 3.11Å
170S82.4Confident78.6Confident2 Ų260.5 Ų60.51%0.01434%0.344CS..Hα-helixtrans-62.9-26.1175.877.50000112.4F155 L159 K166 C167 Y172 S173 D174F155-S170 VanDerWaalsContact CE2-OG 3.31Å; F155-S170 WeakPolarHBondContact CE2-OG 3.48Å; F155-S170 WeakPolarHBondContact CZ-OG 3.41Å; L159-S170 VanDerWaalsContact CD2-OG 3.26Å; L159-S170 WeakPolarHBondContact CD2-OG 3.28Å; K166-S170 PolarHBondContact O-N 3.19Å; C167-S170 PolarHBondContact O-N 2.7Å; C167-S170 PolarHBondContact O-OG 3.39Å; S170-Y172 VanDerWaalsContact C-N 3.3Å; S170-Y172 PolarHBondContact O-N 3.28Å; S170-S173 WeakPolarHBondContact O-CB 3.43Å; S170-S173 PolarHBondContact O-N 3.43Å; S170-D174 PolarHBondContact O-N 2.87Å
171V84.1Confident78.4Confident2 Ų257.1 Ų57.11%0.01233%0.327CS..Hα-helixtrans-63.4-37.4173.6179.80000110.9T93 F155 F168 E169 S173 D174 I175T93-V171 HydrophobicContact CG2-CG1 4.43Å; T93-V171 HydrophobicContact CG2-CG2 3.74Å; F155-V171 HydrophobicContact CE2-CG2 4.02Å; F155-V171 HydrophobicContact CZ-CG2 3.64Å; F168-V171 HydrophobicContact CD1-CG2 4.42Å; F168-V171 WeakPolarHBondContact O-CB 3.47Å; F168-V171 PolarHBondContact O-N 3.2Å; E169-V171 PolarHBondContact O-N 3.22Å; V171-S173 VanDerWaalsContact C-N 3.34Å; V171-D174 PolarHBondContact O-N 3.36Å; V171-I175 HydrophobicContact CG1-CD1 3.84Å; V171-I175 HydrophobicContact CG1-CG1 4.4Å; V171-I175 VanDerWaalsContact O-CG1 3.24Å; V171-I175 WeakPolarHBondContact O-CG1 3.39Å; V171-I175 PolarHBondContact O-N 2.84Å
172Y83.8Confident78.5Confident39 Ų3953.1 Ų53.115%0.15330%0.298CS..Hα-helixtrans-66.3-40.1177.4-50.5-29.1000111.6Y77 F168 E169 S170 I175 R176 F254 T255 I258Y77-Y172 PolarHBondContact OH-OH 3.42Å; F168-Y172 WeakPolarHBondContact O-CE1 3.48Å; E169-Y172 WeakPolarHBondContact O-CB 3.46Å; E169-Y172 PolarHBondContact O-N 3.01Å; S170-Y172 VanDerWaalsContact C-N 3.3Å; S170-Y172 PolarHBondContact O-N 3.28Å; Y172-I175 PolarHBondContact O-N 2.91Å; Y172-R176 WeakPolarHBondContact O-CB 3.43Å; Y172-R176 PolarHBondContact O-N 3.2Å; Y172-F254 HydrophobicContact CD1-CB 3.74Å; Y172-F254 HydrophobicContact CD1-CD2 4.09Å; Y172-F254 HydrophobicContact CD1-CG 4.33Å; Y172-F254 HydrophobicContact CE1-CB 3.97Å; Y172-F254 HydrophobicContact CG-CD2 4.26Å; Y172-T255 PolarHBondContact OH-OG1 3.18Å; Y172-I258 HydrophobicContact CD1-CD1 4.45Å; Y172-I258 HydrophobicContact CE1-CD1 3.83Å
173S81.6Confident79.2Confident69 Ų6955.6 Ų55.648%0.48330%0.303SS..Hα-helixtrans-62.9-44.6174.4-60.10000111.3E169 S170 V171 I175 R176 E177E169-S173 PolarHBondContact O-N 3.11Å; S170-S173 WeakPolarHBondContact O-CB 3.43Å; S170-S173 PolarHBondContact O-N 3.43Å; V171-S173 VanDerWaalsContact C-N 3.34Å; S173-I175 PolarHBondContact O-N 3.4Å; S173-R176 PolarHBondContact O-N 3.37Å; S173-E177 PolarHBondContact O-N 2.95Å
174D83.1Confident80.6Confident1 Ų151.7 Ų51.71%0.00528%0.281CS..Hα-helixtrans-64.5-38178.5-171.874.6000112.9R97 R154 F155 L158 S170 V171R97-D174 IonicContact CZ-OD2 2.95Å; R97-D174 IonicContact NH1-OD2 2.66Å; R97-D174 PolarHBondContact NH1-OD2 3.29Å; R97-D174 IonicContact NH2-OD2 3.39Å; R97-D174 PolarHBondContact NH2-OD2 3.24Å; R154-D174 IonicContact CZ-OD1 2.66Å; R154-D174 IonicContact CZ-OD2 2.79Å; R154-D174 IonicContact NE-OD1 3.9Å; R154-D174 PolarHBondContact NE-OD1 3.32Å; R154-D174 IonicContact NH1-OD1 3.95Å; R154-D174 PolarHBondContact NH2-O 3.47Å; R154-D174 IonicContact NH2-OD1 3.1Å; R154-D174 PolarHBondContact NH2-OD1 2.84Å; R154-D174 IonicContact NH2-OD2 3.31Å; R154-D174 PolarHBondContact NH2-OD2 2.88Å; F155-D174 HydrophobicContact CD2-CB 3.85Å; F155-D174 HydrophobicContact CE2-CB 4.13Å; L158-D174 HydrophobicContact CD2-CB 3.69Å; S170-D174 PolarHBondContact O-N 2.87Å; V171-D174 PolarHBondContact O-N 3.36Å
175I79.6Confident81.9Confident18 Ų1848.9 Ų48.99%0.09225%0.245CC..Hα-helixtrans-68.2-37.4175.1-69.5166.9000111.1V171 Y172 S173 E177 A245 F254V171-I175 HydrophobicContact CG1-CD1 3.84Å; V171-I175 HydrophobicContact CG1-CG1 4.4Å; V171-I175 VanDerWaalsContact O-CG1 3.24Å; V171-I175 WeakPolarHBondContact O-CG1 3.39Å; V171-I175 PolarHBondContact O-N 2.84Å; Y172-I175 PolarHBondContact O-N 2.91Å; S173-I175 PolarHBondContact O-N 3.4Å; I175-E177 VanDerWaalsContact C-N 3.34Å; I175-A245 HydrophobicContact CG2-CB 3.82Å; I175-F254 HydrophobicContact CG2-CD1 4.2Å; I175-F254 HydrophobicContact CG2-CE1 3.68Å; I175-F254 HydrophobicContact CG2-CE2 4.36Å; I175-F254 HydrophobicContact CG2-CZ 3.78Å
176R79.8Confident83Confident96 Ų9647.1 Ų47.136%0.36223%0.232SC..Hα-helixtrans-74.1-26.2-179.9-173.5174-77.3160.66.9112.6Y172 S173 T249Y172-R176 WeakPolarHBondContact O-CB 3.43Å; Y172-R176 PolarHBondContact O-N 3.2Å; S173-R176 PolarHBondContact O-N 3.37Å; R176-T249 PolarHBondContact NH2-O 3.5Å
177E77.4Confident83.6Confident98 Ų9848.2 Ų48.246%0.45824%0.244SC..SBendtrans-60.6142.7176.7-157.4-172.1-17500110.9R154 S173 I175 S179R154-E177 IonicContact CZ-OE2 3.51Å; R154-E177 IonicContact NH1-OE2 2.69Å; R154-E177 PolarHBondContact NH1-OE2 2.93Å; S173-E177 PolarHBondContact O-N 2.95Å; I175-E177 VanDerWaalsContact C-N 3.34Å; E177-S179 PolarHBondContact O-N 2.99Å
178K67.9Low83.9Confident165 Ų16549.5 Ų49.572%0.71725%0.25SS*.  trans-73.961.1178.8-61.6-164.8178.7172.60111.8
179S77.1Confident84.3Confident15 Ų1549.6 Ų49.611%0.10525%0.251CS..  trans-77.8139.9176.1-152.30000111.5R154 E177 T181 V182 Y183R154-S179 PolarHBondContact NH1-OG 3.23Å; R154-S179 PolarHBondContact NH2-OG 2.93Å; E177-S179 PolarHBondContact O-N 2.99Å; S179-T181 WeakPolarHBondContact CB-OG1 3.4Å; S179-T181 PolarHBondContact O-N 3.26Å; S179-T181 PolarHBondContact OG-N 3.45Å; S179-T181 PolarHBondContact OG-OG1 3.32Å; S179-V182 PolarHBondContact O-N 3.26Å; S179-Y183 WeakPolarHBondContact O-CD2 3.33Å
180S83.2Confident84.8Confident88 Ų8849.8 Ų49.862%0.61525%0.25SS*.Hα-helixtrans-56.5-28.4164.8-52.60000112V182 Y183 I184S180-V182 PolarHBondContact O-N 2.92Å; S180-Y183 PolarHBondContact O-N 3.15Å; S180-I184 WeakPolarHBondContact O-CD1 3.32Å; S180-I184 VanDerWaalsContact O-CG1 3.26Å; S180-I184 WeakPolarHBondContact O-CG1 3.45Å; S180-I184 PolarHBondContact O-N 3.25Å
181T83Confident85.5Confident27 Ų2754.3 Ų54.317%0.16627%0.273CS..Hα-helixtrans-64.5-38.7-179.857.90000113.1E151 S179 Y183 I184 Q185E151-T181 HydrophobicContact CB-CG2 4.44Å; E151-T181 HydrophobicContact CG-CG2 4.5Å; S179-T181 WeakPolarHBondContact CB-OG1 3.4Å; S179-T181 PolarHBondContact O-N 3.26Å; S179-T181 PolarHBondContact OG-N 3.45Å; S179-T181 PolarHBondContact OG-OG1 3.32Å; T181-Y183 VanDerWaalsContact C-N 3.34Å; T181-Y183 PolarHBondContact O-N 3Å; T181-I184 PolarHBondContact O-N 2.87Å; T181-Q185 VanDerWaalsContact O-CB 3.28Å; T181-Q185 WeakPolarHBondContact O-CB 3.39Å; T181-Q185 PolarHBondContact O-N 3.44Å
182V86Confident86.1Confident15 Ų1555 Ų559%0.09128%0.277CS..Hα-helixtrans-64.4-40.8177.6174.80000110.8S179 S180 S186 A245S179-V182 PolarHBondContact O-N 3.26Å; S180-V182 PolarHBondContact O-N 2.92Å; V182-S186 WeakPolarHBondContact O-CB 3.4Å; V182-S186 PolarHBondContact O-N 3.37Å; V182-S186 PolarHBondContact O-OG 3.38Å; V182-A245 HydrophobicContact CG1-CB 3.91Å
183Y88.8Confident86.6Confident106 Ų10654.7 Ų54.742%0.41628%0.278SS..Hα-helixtrans-68.8-42.1176.5-70.8-72.9000112.6S179 S180 T181 S186 T187 L246 R248S179-Y183 WeakPolarHBondContact O-CD2 3.33Å; S180-Y183 PolarHBondContact O-N 3.15Å; T181-Y183 VanDerWaalsContact C-N 3.34Å; T181-Y183 PolarHBondContact O-N 3Å; Y183-S186 PolarHBondContact O-N 3.17Å; Y183-T187 VanDerWaalsContact O-CB 3.25Å; Y183-T187 WeakPolarHBondContact O-CB 3.47Å; Y183-T187 PolarHBondContact O-N 2.88Å; Y183-T187 PolarHBondContact O-OG1 3.46Å; Y183-L246 HydrophobicContact CD1-CD2 3.82Å; Y183-L246 HydrophobicContact CE1-CD2 4.1Å; Y183-R248 PolarHBondContact OH-NH1 2.02Å; Y183-R248 PolarHBondContact OH-NH2 2.94Å
184I90.2Very high87.3Confident81 Ų8154.4 Ų54.442%0.41528%0.28SS..Hα-helixtrans-62.1-47.8175.9-69.3164000109.8L147 S180 T181 S186 T187 L188L147-I184 HydrophobicContact CD2-CG2 4.37Å; S180-I184 WeakPolarHBondContact O-CD1 3.32Å; S180-I184 VanDerWaalsContact O-CG1 3.26Å; S180-I184 WeakPolarHBondContact O-CG1 3.45Å; S180-I184 PolarHBondContact O-N 3.25Å; T181-I184 PolarHBondContact O-N 2.87Å; I184-S186 PolarHBondContact O-N 2.88Å; I184-T187 PolarHBondContact O-N 2.95Å; I184-L188 WeakPolarHBondContact O-CB 3.22Å; I184-L188 PolarHBondContact O-N 3.07Å
185Q89.5Confident87.9Confident26 Ų2657.2 Ų57.212%0.12130%0.297CS..Hα-helixtrans-57.9-50.3177.8-178.764.22000111.3T181 T187 L188 E189T181-Q185 VanDerWaalsContact O-CB 3.28Å; T181-Q185 WeakPolarHBondContact O-CB 3.39Å; T181-Q185 PolarHBondContact O-N 3.44Å; Q185-T187 PolarHBondContact O-N 2.99Å; Q185-L188 WeakPolarHBondContact O-CB 3.2Å; Q185-L188 PolarHBondContact O-N 2.91Å; Q185-E189 PolarHBondContact NE2-OE1 2.79Å; Q185-E189 WeakPolarHBondContact O-CG 3.42Å; Q185-E189 PolarHBondContact O-N 2.99Å
186S90.6Very high88.6Confident2 Ų256.3 Ų56.31%0.01429%0.292CS..Hα-helixtrans-66.6-42.6-176.5-52.70000111.2V182 Y183 I184 L188 E189 F190 L246V182-S186 WeakPolarHBondContact O-CB 3.4Å; V182-S186 PolarHBondContact O-N 3.37Å; V182-S186 PolarHBondContact O-OG 3.38Å; Y183-S186 PolarHBondContact O-N 3.17Å; I184-S186 PolarHBondContact O-N 2.88Å; S186-L188 VanDerWaalsContact C-N 3.31Å; S186-L188 PolarHBondContact O-N 3.16Å; S186-E189 PolarHBondContact O-N 3.15Å; S186-F190 WeakPolarHBondContact O-CD2 3.32Å; S186-F190 PolarHBondContact O-N 3.12Å; S186-L246 WeakPolarHBondContact OG-CG 3.37Å
187T92.6Very high89.3Confident77 Ų7754.8 Ų54.847%0.47229%0.293SS..Hα-helixtrans-58.5-44.2174.7-58.80000111.3Y183 I184 Q185 F190 I191Y183-T187 VanDerWaalsContact O-CB 3.25Å; Y183-T187 WeakPolarHBondContact O-CB 3.47Å; Y183-T187 PolarHBondContact O-N 2.88Å; Y183-T187 PolarHBondContact O-OG1 3.46Å; I184-T187 PolarHBondContact O-N 2.95Å; Q185-T187 PolarHBondContact O-N 2.99Å; T187-F190 PolarHBondContact O-N 2.95Å; T187-I191 HydrophobicContact CG2-CD1 3.81Å; T187-I191 HydrophobicContact CG2-CG1 4.48Å; T187-I191 VanDerWaalsContact O-CG1 3.29Å; T187-I191 WeakPolarHBondContact O-CG1 3.43Å; T187-I191 PolarHBondContact O-N 3.4Å
188L93.7Very high90.1Very high28 Ų2851.8 Ų51.815%0.14729%0.288CS..Hα-helixtrans-58-50.4175.6176.165.6000111I105 F143 I184 Q185 S186 F190 I191 L192I105-L188 HydrophobicContact CD1-CD2 4.38Å; F143-L188 HydrophobicContact CE1-CD2 3.84Å; F143-L188 HydrophobicContact CZ-CD2 4.26Å; I184-L188 WeakPolarHBondContact O-CB 3.22Å; I184-L188 PolarHBondContact O-N 3.07Å; Q185-L188 WeakPolarHBondContact O-CB 3.2Å; Q185-L188 PolarHBondContact O-N 2.91Å; S186-L188 VanDerWaalsContact C-N 3.31Å; S186-L188 PolarHBondContact O-N 3.16Å; L188-F190 VanDerWaalsContact C-N 3.34Å; L188-F190 PolarHBondContact O-N 3.42Å; L188-I191 PolarHBondContact O-N 3.22Å; L188-L192 HydrophobicContact CD1-CD1 4.05Å; L188-L192 HydrophobicContact CD1-CD2 4.49Å; L188-L192 HydrophobicContact CD1-CG 4.1Å; L188-L192 HydrophobicContact CG-CD1 3.95Å; L188-L192 HydrophobicContact CG-CG 4.37Å; L188-L192 VanDerWaalsContact O-CG 3.28Å; L188-L192 WeakPolarHBondContact O-CG 3.43Å; L188-L192 PolarHBondContact O-N 2.67Å
189E93.4Very high91.2Very high4 Ų444.2 Ų44.22%0.01926%0.256CS..Hα-helixtrans-61.4-39.1-179.8-67.6-58153.200112.7S104 Q185 S186 L192 L193 S242S104-E189 WeakPolarHBondContact CB-OE1 3.49Å; S104-E189 WeakPolarHBondContact CB-OE2 3.28Å; S104-E189 PolarHBondContact OG-OE1 3.04Å; S104-E189 PolarHBondContact OG-OE2 2.96Å; Q185-E189 PolarHBondContact NE2-OE1 2.79Å; Q185-E189 WeakPolarHBondContact O-CG 3.42Å; Q185-E189 PolarHBondContact O-N 2.99Å; S186-E189 PolarHBondContact O-N 3.15Å; E189-L192 PolarHBondContact O-N 3.37Å; E189-L193 VanDerWaalsContact O-CB 3.31Å; E189-L193 WeakPolarHBondContact O-CB 3.49Å; E189-L193 PolarHBondContact O-N 3.05Å; E189-S242 WeakPolarHBondContact CG-OG 3.35Å
190F94.1Very high91.9Very high87 Ų8745 Ų4538%0.38226%0.26SS..Hα-helixtrans-66.5-40.1174.9-77.4-66.4000112.8S186 T187 L188 L193 A194 L239 I243 L246S186-F190 WeakPolarHBondContact O-CD2 3.32Å; S186-F190 PolarHBondContact O-N 3.12Å; T187-F190 PolarHBondContact O-N 2.95Å; L188-F190 VanDerWaalsContact C-N 3.34Å; L188-F190 PolarHBondContact O-N 3.42Å; F190-L193 PolarHBondContact O-N 2.87Å; F190-A194 WeakPolarHBondContact O-CB 3.44Å; F190-A194 PolarHBondContact O-N 2.99Å; F190-L239 HydrophobicContact CD1-CD1 4.29Å; F190-L239 HydrophobicContact CE1-CD1 3.61Å; F190-L239 HydrophobicContact CZ-CD1 4.03Å; F190-I243 HydrophobicContact CZ-CG1 4.12Å; F190-L246 HydrophobicContact CE2-CD1 3.7Å; F190-L246 HydrophobicContact CZ-CD1 4.49Å
191I96Very high92.2Very high97 Ų9745 Ų4550%0.49726%0.256SS..Hα-helixtrans-63.2-47.4175.6-70.2166.8000110.1T187 L188 L193 A194 V195T187-I191 HydrophobicContact CG2-CD1 3.81Å; T187-I191 HydrophobicContact CG2-CG1 4.48Å; T187-I191 VanDerWaalsContact O-CG1 3.29Å; T187-I191 WeakPolarHBondContact O-CG1 3.43Å; T187-I191 PolarHBondContact O-N 3.4Å; L188-I191 PolarHBondContact O-N 3.22Å; I191-L193 PolarHBondContact O-N 3.42Å; I191-A194 PolarHBondContact O-N 3.42Å; I191-V195 WeakPolarHBondContact O-CG2 3.14Å; I191-V195 PolarHBondContact O-N 3.48Å
192L96.1Very high92.5Very high16 Ų1646.9 Ų46.98%0.08426%0.264CS..Hα-helixtrans-62-43.1178.5-65.9176.3000111.3S104 I105 T108 L188 E189 A194 V195 N196 F234S104-L192 WeakPolarHBondContact OG-CD1 3.47Å; I105-L192 HydrophobicContact CG1-CD1 3.82Å; T108-L192 HydrophobicContact CG2-CD2 3.92Å; L188-L192 HydrophobicContact CD1-CD1 4.05Å; L188-L192 HydrophobicContact CD1-CD2 4.49Å; L188-L192 HydrophobicContact CD1-CG 4.1Å; L188-L192 HydrophobicContact CG-CD1 3.95Å; L188-L192 HydrophobicContact CG-CG 4.37Å; L188-L192 VanDerWaalsContact O-CG 3.28Å; L188-L192 WeakPolarHBondContact O-CG 3.43Å; L188-L192 PolarHBondContact O-N 2.67Å; E189-L192 PolarHBondContact O-N 3.37Å; L192-A194 PolarHBondContact O-N 2.92Å; L192-V195 PolarHBondContact O-N 3.47Å; L192-N196 PolarHBondContact O-N 3.15Å; L192-N196 PolarHBondContact O-ND2 3.28Å; L192-F234 HydrophobicContact CB-CE1 3.76Å; L192-F234 HydrophobicContact CB-CZ 3.89Å
193L95.2Very high92.5Very high32 Ų3246.3 Ų46.317%0.16826%0.261CS..Hα-helixtrans-58.1-47.9173.6173.661000111.5E189 F190 I191 V195 N196 V197 F234 L239E189-L193 VanDerWaalsContact O-CB 3.31Å; E189-L193 WeakPolarHBondContact O-CB 3.49Å; E189-L193 PolarHBondContact O-N 3.05Å; F190-L193 PolarHBondContact O-N 2.87Å; I191-L193 PolarHBondContact O-N 3.42Å; L193-V195 VanDerWaalsContact C-N 3.29Å; L193-V195 PolarHBondContact O-N 3.28Å; L193-N196 PolarHBondContact O-N 3.23Å; L193-N196 VanDerWaalsContact O-N 3.13Å; L193-V197 HydrophobicContact CD1-CG2 3.98Å; L193-V197 HydrophobicContact CG-CG2 4.41Å; L193-V197 WeakPolarHBondContact O-CG2 3.41Å; L193-V197 PolarHBondContact O-N 3.05Å; L193-F234 HydrophobicContact CB-CD1 4.22Å; L193-F234 HydrophobicContact CD1-CB 3.86Å; L193-F234 HydrophobicContact CD1-CG 4.34Å; L193-L239 HydrophobicContact CD2-CD1 4.21Å; L193-L239 HydrophobicContact CD2-CD2 4.36Å
194A95.7Very high92.4Very high64 Ų6445.5 Ų45.553%0.52926%0.259SS..Hα-helixtrans-59.6-40.6178.600000111.9F190 I191 L192 V197 G198F190-A194 WeakPolarHBondContact O-CB 3.44Å; F190-A194 PolarHBondContact O-N 2.99Å; I191-A194 PolarHBondContact O-N 3.42Å; L192-A194 PolarHBondContact O-N 2.92Å; A194-V197 PolarHBondContact O-N 3.46Å; A194-G198 PolarHBondContact O-N 3.07Å
195V95.9Very high92.2Very high59 Ų5948 Ų4836%0.35826%0.264SS..Hα-helixtrans-61.9-46.2174172.60000111.1T108 V112 I191 L192 L193 G198 C199T108-V195 HydrophobicContact CG2-CB 4.14Å; T108-V195 HydrophobicContact CG2-CG1 3.68Å; V112-V195 HydrophobicContact CG2-CG1 3.86Å; I191-V195 WeakPolarHBondContact O-CG2 3.14Å; I191-V195 PolarHBondContact O-N 3.48Å; L192-V195 PolarHBondContact O-N 3.47Å; L193-V195 VanDerWaalsContact C-N 3.29Å; L193-V195 PolarHBondContact O-N 3.28Å; V195-G198 PolarHBondContact O-N 2.76Å; V195-C199 WeakPolarHBondContact O-CB 3.32Å; V195-C199 PolarHBondContact O-N 2.88Å; V195-C199 PolarHBondContact O-SG 3.13Å
196N94.1Very high91.9Very high0 Ų047.3 Ų47.30%026%0.261CS..Hα-helixtrans-65.3-39.6179.5-78.1-81.6000112.6T108 S111 L192 L193 C199 T200 L231 F234T108-N196 PolarHBondContact OG1-ND2 3.46Å; S111-N196 WeakPolarHBondContact CB-OD1 3.31Å; S111-N196 PolarHBondContact OG-OD1 2.96Å; L192-N196 PolarHBondContact O-N 3.15Å; L192-N196 PolarHBondContact O-ND2 3.28Å; L193-N196 PolarHBondContact O-N 3.23Å; L193-N196 VanDerWaalsContact O-N 3.13Å; N196-C199 PolarHBondContact O-N 3.39Å; N196-T200 WeakPolarHBondContact O-CB 3.43Å; N196-T200 PolarHBondContact O-N 3.26Å; N196-T200 PolarHBondContact O-OG1 3.32Å; N196-L231 HydrophobicContact CB-CD2 4.37Å; N196-F234 HydrophobicContact CB-CD2 4.45Å; N196-F234 HydrophobicContact CB-CE2 4.43Å; N196-F234 WeakPolarHBondContact ND2-CE2 3.35Å; N196-F234 WeakPolarHBondContact ND2-CZ 3.41Å
197V94.5Very high91.3Very high64 Ų6447.8 Ų47.839%0.38826%0.264SS..Hα-helixtrans-62.4-48.6173.2171.30000110.2L193 A194 C199 T200 V201 L231L193-V197 HydrophobicContact CD1-CG2 3.98Å; L193-V197 HydrophobicContact CG-CG2 4.41Å; L193-V197 WeakPolarHBondContact O-CG2 3.41Å; L193-V197 PolarHBondContact O-N 3.05Å; A194-V197 PolarHBondContact O-N 3.46Å; V197-C199 VanDerWaalsContact C-N 3.34Å; V197-C199 PolarHBondContact O-N 2.78Å; V197-T200 WeakPolarHBondContact O-CB 3.13Å; V197-T200 PolarHBondContact O-N 3.47Å; V197-T200 VanDerWaalsContact O-N 3.12Å; V197-V201 HydrophobicContact CG1-CG2 4.41Å; V197-V201 WeakPolarHBondContact O-CG2 3.48Å; V197-V201 PolarHBondContact O-N 3.17Å; V197-L231 HydrophobicContact CG2-CD2 3.75Å
198G93.8Very high90.7Very high34 Ų3452.8 Ų52.835%0.35127%0.274SS..Hα-helixtrans-57.9-44.5176.200000112.5A194 V195 T200 V201 M202A194-G198 PolarHBondContact O-N 3.07Å; V195-G198 PolarHBondContact O-N 2.76Å; G198-T200 VanDerWaalsContact C-N 3.32Å; G198-T200 PolarHBondContact O-N 2.84Å; G198-V201 PolarHBondContact O-N 2.89Å; G198-M202 WeakPolarHBondContact O-CB 3.34Å; G198-M202 VanDerWaalsContact O-CG 3.22Å; G198-M202 WeakPolarHBondContact O-CG 3.48Å; G198-M202 PolarHBondContact O-N 3.11Å
199C92.3Very high89.8Confident6 Ų657.6 Ų57.64%0.04130%0.295CS..Hα-helixtrans-58.4-45.4174.6-67.50000111.5L115 V195 N196 V197 M202 V203 F227L115-C199 HydrophobicContact CB-CB 4.31Å; L115-C199 HydrophobicContact CD2-CB 4.2Å; V195-C199 WeakPolarHBondContact O-CB 3.32Å; V195-C199 PolarHBondContact O-N 2.88Å; V195-C199 PolarHBondContact O-SG 3.13Å; N196-C199 PolarHBondContact O-N 3.39Å; V197-C199 VanDerWaalsContact C-N 3.34Å; V197-C199 PolarHBondContact O-N 2.78Å; C199-M202 PolarHBondContact O-N 2.76Å; C199-V203 WeakPolarHBondContact O-CB 3.47Å; C199-V203 WeakPolarHBondContact O-CG2 3.25Å; C199-V203 PolarHBondContact O-N 2.96Å; C199-F227 HydrophobicContact CB-CD1 4.38Å; C199-F227 HydrophobicContact CB-CE1 3.94Å
200T90.8Very high88.5Confident31 Ų3164 Ų6419%0.1933%0.325CS..Hα-helixtrans-63.4-46.7-179-570000111.6N196 V197 G198 V203 F204 F227 L231N196-T200 WeakPolarHBondContact O-CB 3.43Å; N196-T200 PolarHBondContact O-N 3.26Å; N196-T200 PolarHBondContact O-OG1 3.32Å; V197-T200 WeakPolarHBondContact O-CB 3.13Å; V197-T200 PolarHBondContact O-N 3.47Å; V197-T200 VanDerWaalsContact O-N 3.12Å; G198-T200 VanDerWaalsContact C-N 3.32Å; G198-T200 PolarHBondContact O-N 2.84Å; T200-V203 PolarHBondContact O-N 3.29Å; T200-F204 VanDerWaalsContact O-CB 3.28Å; T200-F204 WeakPolarHBondContact O-CB 3.16Å; T200-F204 PolarHBondContact O-N 3.44Å; T200-F227 HydrophobicContact CG2-CB 4.03Å; T200-L231 HydrophobicContact CG2-CD1 3.84Å
201V91.1Very high87.1Confident88 Ų8863.1 Ų63.153%0.53332%0.324SS..Hα-helixtrans-61.1-47177.9172.30000110.9V197 G198 V203 F204 W205V197-V201 HydrophobicContact CG1-CG2 4.41Å; V197-V201 WeakPolarHBondContact O-CG2 3.48Å; V197-V201 PolarHBondContact O-N 3.17Å; G198-V201 PolarHBondContact O-N 2.89Å; V201-V203 PolarHBondContact O-N 2.84Å; V201-F204 PolarHBondContact O-N 2.9Å; V201-W205 WeakPolarHBondContact O-CB 3.45Å; V201-W205 PolarHBondContact O-N 3.35Å
202M88.8Confident84.9Confident68 Ų6862.4 Ų62.434%0.33533%0.327SS..Hα-helixtrans-64.2-42.1-179.4-71.2-65.3-7100112.5L115 G198 C199 T206L115-M202 HydrophobicContact CD1-CB 3.69Å; G198-M202 WeakPolarHBondContact O-CB 3.34Å; G198-M202 VanDerWaalsContact O-CG 3.22Å; G198-M202 WeakPolarHBondContact O-CG 3.48Å; G198-M202 PolarHBondContact O-N 3.11Å; C199-M202 PolarHBondContact O-N 2.76Å; M202-T206 WeakPolarHBondContact O-CB 3.29Å; M202-T206 PolarHBondContact O-N 3.3Å; M202-T206 PolarHBondContact O-OG1 2.94Å
203V85.9Confident82.9Confident2 Ų270.9 Ų70.91%0.01237%0.366CS..Hα-helixtrans-65.1-47.4175169.10000110.6L115 V118 V119 C199 T200 V201 W205 T206 L207 V223 F227L115-V203 HydrophobicContact CB-CG2 4.24Å; L115-V203 HydrophobicContact CD1-CG2 3.52Å; L115-V203 HydrophobicContact CG-CG2 4.49Å; V118-V203 HydrophobicContact CG1-CG1 4.34Å; V119-V203 HydrophobicContact CG2-CG2 4.24Å; C199-V203 WeakPolarHBondContact O-CB 3.47Å; C199-V203 WeakPolarHBondContact O-CG2 3.25Å; C199-V203 PolarHBondContact O-N 2.96Å; T200-V203 PolarHBondContact O-N 3.29Å; V201-V203 PolarHBondContact O-N 2.84Å; V203-W205 VanDerWaalsContact C-N 3.33Å; V203-W205 PolarHBondContact O-N 3.08Å; V203-T206 PolarHBondContact O-N 3.32Å; V203-L207 HydrophobicContact CG1-CD1 3.64Å; V203-L207 HydrophobicContact CG1-CG 3.93Å; V203-L207 WeakPolarHBondContact O-CB 3.3Å; V203-L207 VanDerWaalsContact O-CG 3.25Å; V203-L207 WeakPolarHBondContact O-CG 3.23Å; V203-L207 PolarHBondContact O-N 3.46Å; V203-V223 HydrophobicContact CG1-CG1 4.06Å; V203-F227 HydrophobicContact CB-CD2 4.39Å; V203-F227 HydrophobicContact CB-CE2 4.06Å; V203-F227 HydrophobicContact CB-CZ 4.27Å; V203-F227 HydrophobicContact CG1-CD2 4.07Å; V203-F227 HydrophobicContact CG1-CE2 3.78Å; V203-F227 HydrophobicContact CG1-CZ 4.46Å; V203-F227 HydrophobicContact CG2-CD2 4.47Å; V203-F227 HydrophobicContact CG2-CE1 4.16Å; V203-F227 HydrophobicContact CG2-CE2 3.7Å; V203-F227 HydrophobicContact CG2-CZ 3.52Å
204F86.1Confident80.6Confident89 Ų8974.5 Ų74.539%0.3939%0.394SS..Hα-helixtrans-56.8-47.5178.7177.1-97.9000111.8T200 V201 T206 L207 R208 M224T200-F204 VanDerWaalsContact O-CB 3.28Å; T200-F204 WeakPolarHBondContact O-CB 3.16Å; T200-F204 PolarHBondContact O-N 3.44Å; V201-F204 PolarHBondContact O-N 2.9Å; F204-T206 PolarHBondContact O-N 3.29Å; F204-L207 PolarHBondContact O-N 3.43Å; F204-R208 HydrophobicContact CD1-CG 4.39Å; F204-R208 HydrophobicContact CE1-CG 4.13Å; F204-R208 HydrophobicContact CE2-CG 4.35Å; F204-R208 HydrophobicContact CZ-CG 4.14Å; F204-R208 WeakPolarHBondContact O-CB 3.28Å; F204-R208 VanDerWaalsContact O-CG 3.25Å; F204-R208 WeakPolarHBondContact O-CG 3.24Å; F204-R208 PolarHBondContact O-N 2.78Å; F204-M224 HydrophobicContact CD2-SD 3.79Å; F204-M224 HydrophobicContact CE2-SD 4.4Å
205W86.4Confident78.5Confident134 Ų13472.7 Ų72.751%0.50838%0.38SS..Hα-helixtrans-60.8-46.1177-17462.9000111.6V201 V203 L207 R208 H209V201-W205 WeakPolarHBondContact O-CB 3.45Å; V201-W205 PolarHBondContact O-N 3.35Å; V203-W205 VanDerWaalsContact C-N 3.33Å; V203-W205 PolarHBondContact O-N 3.08Å; W205-L207 PolarHBondContact O-N 3.5Å; W205-R208 PolarHBondContact O-N 3.39Å; W205-H209 AromaticContact CD1-CD2 3.18Å; W205-H209 AromaticContact CD1-NE2 3.49Å; W205-H209 AromaticContact CG-CD2 3.98Å; W205-H209 AromaticContact NE1-CD2 3.17Å; W205-H209 PolarHBondContact NE1-CD2 2.87Å; W205-H209 AromaticContact NE1-NE2 3.37Å; W205-H209 PolarHBondContact NE1-NE2 3.2Å; W205-H209 PolarHBondContact O-CD2 3.07Å; W205-H209 VanDerWaalsContact O-CD2 3.31Å; W205-H209 PolarHBondContact O-N 3.42Å
206T82.4Confident76.6Confident11 Ų1175.8 Ų75.87%0.06739%0.389CS..Hα-helixtrans-63.3-43.5178.5-56.70000112.3V119 M202 V203 F204 R208 H209 H210V119-T206 HydrophobicContact CB-CG2 4.49Å; V119-T206 HydrophobicContact CG1-CG2 4.37Å; V119-T206 HydrophobicContact CG2-CG2 4.08Å; V119-T206 WeakPolarHBondContact CG2-OG1 3.43Å; M202-T206 WeakPolarHBondContact O-CB 3.29Å; M202-T206 PolarHBondContact O-N 3.3Å; M202-T206 PolarHBondContact O-OG1 2.94Å; V203-T206 PolarHBondContact O-N 3.32Å; F204-T206 PolarHBondContact O-N 3.29Å; T206-R208 VanDerWaalsContact C-N 3.3Å; T206-R208 PolarHBondContact O-N 2.89Å; T206-H209 PolarHBondContact O-N 3.22Å; T206-H210 HydrophobicContact CG2-CB 4.25Å; T206-H210 WeakPolarHBondContact O-CB 3.38Å; T206-H210 PolarHBondContact O-N 3.41Å
207L78.7Confident74.9Confident13 Ų1380.6 Ų80.67%0.06842%0.418CS..Hα-helixtrans-65.2-33.2178.9-70.8179.9000112.4V118 V203 F204 W205 L211 V223 M224V118-L207 HydrophobicContact CG1-CD2 4.09Å; V203-L207 HydrophobicContact CG1-CD1 3.64Å; V203-L207 HydrophobicContact CG1-CG 3.93Å; V203-L207 WeakPolarHBondContact O-CB 3.3Å; V203-L207 VanDerWaalsContact O-CG 3.25Å; V203-L207 WeakPolarHBondContact O-CG 3.23Å; V203-L207 PolarHBondContact O-N 3.46Å; F204-L207 PolarHBondContact O-N 3.43Å; W205-L207 PolarHBondContact O-N 3.5Å; L207-L211 HydrophobicContact CD2-CD1 3.34Å; L207-V223 HydrophobicContact CD1-CG1 4.32Å; L207-M224 HydrophobicContact CD1-CG 3.7Å; L207-M224 HydrophobicContact CD1-SD 4.34Å
208R79.5Confident73.1Confident181 Ų18182.8 Ų82.868%0.68343%0.427SS*.Hα-helixtrans-74.2-43.5177-75.1-104.9-170.9172.30.5112.5F204 W205 T206F204-R208 HydrophobicContact CD1-CG 4.39Å; F204-R208 HydrophobicContact CE1-CG 4.13Å; F204-R208 HydrophobicContact CE2-CG 4.35Å; F204-R208 HydrophobicContact CZ-CG 4.14Å; F204-R208 WeakPolarHBondContact O-CB 3.28Å; F204-R208 VanDerWaalsContact O-CG 3.25Å; F204-R208 WeakPolarHBondContact O-CG 3.24Å; F204-R208 PolarHBondContact O-N 2.78Å; W205-R208 PolarHBondContact O-N 3.39Å; T206-R208 VanDerWaalsContact C-N 3.3Å; T206-R208 PolarHBondContact O-N 2.89Å
209H74.6Confident71.7Confident130 Ų13083.2 Ų83.260%0.60242%0.424SS*.Hα-helixtrans-98.5-31.1-169.6-72.2-80.1000115.3W205 T206W205-H209 AromaticContact CD1-CD2 3.18Å; W205-H209 AromaticContact CD1-NE2 3.49Å; W205-H209 AromaticContact CG-CD2 3.98Å; W205-H209 AromaticContact NE1-CD2 3.17Å; W205-H209 PolarHBondContact NE1-CD2 2.87Å; W205-H209 AromaticContact NE1-NE2 3.37Å; W205-H209 PolarHBondContact NE1-NE2 3.2Å; W205-H209 PolarHBondContact O-CD2 3.07Å; W205-H209 VanDerWaalsContact O-CD2 3.31Å; W205-H209 PolarHBondContact O-N 3.42Å; T206-H209 PolarHBondContact O-N 3.22Å
210H67.4Low70.6Confident138 Ų13885 Ų8564%0.63943%0.432SS*.THydrogen-bonded Turntrans-105.7-21-172.2-70.5-64.9000114.4T206T206-H210 HydrophobicContact CG2-CB 4.25Å; T206-H210 WeakPolarHBondContact O-CB 3.38Å; T206-H210 PolarHBondContact O-N 3.41Å
211L63.4Low69.7Low69 Ų6986.8 Ų86.836%0.36144%0.442SS..SBendtrans-99.898.4176.2-81.2142.6000109.3L207 A215 K220L207-L211 HydrophobicContact CD2-CD1 3.34Å; L211-A215 HydrophobicContact CB-CB 4.42Å; L211-A215 HydrophobicContact CD2-CB 3.88Å; L211-K220 PolarHBondContact O-NZ 3.33Å
212S51.2Low68.7Low81 Ų8184.1 Ų84.157%0.56643%0.425SS*.  trans-34.2148.6169.7151.10000113.2S214 A215 K220S212-S214 PolarHBondContact O-N 3.21Å; S212-S214 VanDerWaalsContact OG-CB 3.32Å; S212-S214 WeakPolarHBondContact OG-CB 3.48Å; S212-S214 PolarHBondContact OG-N 3.43Å; S212-S214 VanDerWaalsContact OG-N 3.08Å; S212-A215 PolarHBondContact O-N 2.95Å; S212-K220 PolarHBondContact O-NZ 2.99Å
213E53.1Low68.2Low194 Ų19482.2 Ų82.291%0.90742%0.417SS*.THydrogen-bonded Turntrans-50.5-19172.2-71.2-162.3142.200113.6
214S46.8Very low68Low108 Ų10886 Ų8676%0.75544%0.436SS*.THydrogen-bonded Turntrans-75.6-17178.2-169.40000114.7S212 K216S212-S214 PolarHBondContact O-N 3.21Å; S212-S214 VanDerWaalsContact OG-CB 3.32Å; S212-S214 WeakPolarHBondContact OG-CB 3.48Å; S212-S214 PolarHBondContact OG-N 3.43Å; S212-S214 VanDerWaalsContact OG-N 3.08Å; S214-K216 PolarHBondContact O-N 2.73Å; S214-K216 VanDerWaalsContact O-N 3.15Å
215A51.9Low67.8Low27 Ų2783.8 Ų83.822%0.22343%0.429CS..SBendtrans-75.3106.1176.100000110.4L211 S212 V217 K220L211-A215 HydrophobicContact CB-CB 4.42Å; L211-A215 HydrophobicContact CD2-CB 3.88Å; S212-A215 PolarHBondContact O-N 2.95Å; A215-V217 PolarHBondContact O-N 2.91Å; A215-V217 VanDerWaalsContact O-N 3.14Å; A215-K220 WeakPolarHBondContact O-CE 3.39Å
216K56.1Low67.8Low124 Ų12477.5 Ų77.554%0.53941%0.406SS..  trans-19.3107.8176-85.5177.5175.4174.30113.3S214 N218 S219S214-K216 PolarHBondContact O-N 2.73Å; S214-K216 VanDerWaalsContact O-N 3.15Å; K216-N218 PolarHBondContact O-N 2.86Å; K216-S219 PolarHBondContact O-N 3.25Å; K216-S219 PolarHBondContact O-OG 3.31Å
217V59Low68.1Low101 Ų10177.1 Ų77.161%0.61240%0.403SS*.Hα-helixtrans-43.7-39.7178178.50000112.5A215 S219 K220 V221A215-V217 PolarHBondContact O-N 2.91Å; A215-V217 VanDerWaalsContact O-N 3.14Å; V217-S219 VanDerWaalsContact C-N 3.32Å; V217-S219 PolarHBondContact O-N 3.31Å; V217-K220 PolarHBondContact O-N 2.95Å; V217-V221 HydrophobicContact CG1-CG2 4.33Å; V217-V221 WeakPolarHBondContact O-CG2 3.45Å; V217-V221 PolarHBondContact O-N 3.42Å; V217-V221 VanDerWaalsContact O-N 3.09Å
218N56.5Low68.5Low110 Ų11079 Ų7959%0.58842%0.42SS*.Hα-helixtrans-65.2-21.7178.9-71.99.6000115.6K216 N222 K281K216-N218 PolarHBondContact O-N 2.86Å; N218-N222 PolarHBondContact O-OD1 2.95Å; N218-K281 PolarHBondContact O-NZ 3.43Å
219S64.1Low69Low42 Ų4272.2 Ų72.229%0.29440%0.397SS..Hα-helixtrans-83-32.8173.362.30000111.8K216 V217 V223K216-S219 PolarHBondContact O-N 3.25Å; K216-S219 PolarHBondContact O-OG 3.31Å; V217-S219 VanDerWaalsContact C-N 3.32Å; V217-S219 PolarHBondContact O-N 3.31Å; S219-V223 WeakPolarHBondContact O-CG2 3.45Å; S219-V223 PolarHBondContact O-N 3.47Å
220K69.6Low69.7Low45 Ų4566.1 Ų66.120%0.19637%0.369CS..Hα-helixtrans-65.1-44174.3-60.9-173.1-177.3-174.90111.1L211 S212 A215 V217 V223 M224L211-K220 PolarHBondContact O-NZ 3.33Å; S212-K220 PolarHBondContact O-NZ 2.99Å; A215-K220 WeakPolarHBondContact O-CE 3.39Å; V217-K220 PolarHBondContact O-N 2.95Å; K220-V223 PolarHBondContact O-N 3.28Å; K220-M224 WeakPolarHBondContact O-CG 3.38Å; K220-M224 PolarHBondContact O-N 3.2Å
221V70.4Confident70.9Confident68 Ų6861.7 Ų61.741%0.41235%0.35SS..Hα-helixtrans-61.9-49.5178.31760000111.4V217 V223 M224 V225V217-V221 HydrophobicContact CG1-CG2 4.33Å; V217-V221 WeakPolarHBondContact O-CG2 3.45Å; V217-V221 PolarHBondContact O-N 3.42Å; V217-V221 VanDerWaalsContact O-N 3.09Å; V221-V223 VanDerWaalsContact C-N 3.26Å; V221-V223 PolarHBondContact O-N 3.25Å; V221-M224 PolarHBondContact O-N 3.23Å; V221-M224 VanDerWaalsContact O-N 3.12Å; V221-V225 HydrophobicContact CG1-CG2 4.2Å; V221-V225 VanDerWaalsContact O-CG2 3.32Å; V221-V225 WeakPolarHBondContact O-CG2 3.35Å; V221-V225 PolarHBondContact O-N 3.43Å
222N70.9Confident72.2Confident32 Ų3262 Ų6217%0.17136%0.355CS..Hα-helixtrans-59.9-36.3-179.7-69.79.8000112.4N218 D277N218-N222 PolarHBondContact O-OD1 2.95Å; N222-D277 PolarHBondContact ND2-OD2 3.34Å
223V77.2Confident74Confident28 Ų2858.2 Ų58.217%0.1733%0.328CS..Hα-helixtrans-68.4-46176173.80000110.9V118 V203 L207 S219 K220 V221 V225 I226 F227V118-V223 HydrophobicContact CG2-CG1 4.06Å; V203-V223 HydrophobicContact CG1-CG1 4.06Å; L207-V223 HydrophobicContact CD1-CG1 4.32Å; S219-V223 WeakPolarHBondContact O-CG2 3.45Å; S219-V223 PolarHBondContact O-N 3.47Å; K220-V223 PolarHBondContact O-N 3.28Å; V221-V223 VanDerWaalsContact C-N 3.26Å; V221-V223 PolarHBondContact O-N 3.25Å; V223-V225 VanDerWaalsContact C-N 3.31Å; V223-V225 PolarHBondContact O-N 2.94Å; V223-I226 PolarHBondContact O-N 3.24Å; V223-F227 HydrophobicContact CG1-CD2 4.28Å; V223-F227 HydrophobicContact CG1-CE2 3.92Å; V223-F227 VanDerWaalsContact O-CD2 3.26Å; V223-F227 WeakPolarHBondContact O-CD2 3.47Å
224M82.1Confident75.9Confident81 Ų8149.1 Ų49.140%0.39929%0.285SS..Hα-helixtrans-66-32.5179.2-67.2-149.1-53.300113F204 L207 K220 V221 I226 F227 A228F204-M224 HydrophobicContact CD2-SD 3.79Å; F204-M224 HydrophobicContact CE2-SD 4.4Å; L207-M224 HydrophobicContact CD1-CG 3.7Å; L207-M224 HydrophobicContact CD1-SD 4.34Å; K220-M224 WeakPolarHBondContact O-CG 3.38Å; K220-M224 PolarHBondContact O-N 3.2Å; V221-M224 PolarHBondContact O-N 3.23Å; V221-M224 VanDerWaalsContact O-N 3.12Å; M224-I226 VanDerWaalsContact C-N 3.29Å; M224-I226 PolarHBondContact O-N 3.18Å; M224-F227 PolarHBondContact O-N 3.47Å; M224-A228 WeakPolarHBondContact O-CB 3.11Å; M224-A228 PolarHBondContact O-N 2.97Å
225V83.4Confident77.9Confident42 Ų4246.9 Ų46.926%0.25527%0.27SS..Hα-helixtrans-59.5-39.5175.2168.50000111.2V221 V223 F227 A228 L229 F274V221-V225 HydrophobicContact CG1-CG2 4.2Å; V221-V225 VanDerWaalsContact O-CG2 3.32Å; V221-V225 WeakPolarHBondContact O-CG2 3.35Å; V221-V225 PolarHBondContact O-N 3.43Å; V223-V225 VanDerWaalsContact C-N 3.31Å; V223-V225 PolarHBondContact O-N 2.94Å; V225-F227 PolarHBondContact O-N 3.06Å; V225-A228 PolarHBondContact O-N 2.63Å; V225-L229 HydrophobicContact CG1-CD1 3.84Å; V225-L229 HydrophobicContact CG1-CG 4.14Å; V225-L229 WeakPolarHBondContact O-CB 3.39Å; V225-L229 VanDerWaalsContact O-CG 3.25Å; V225-L229 WeakPolarHBondContact O-CG 3.49Å; V225-L229 PolarHBondContact O-N 3.3Å; V225-F274 HydrophobicContact CG1-CD1 4.12Å; V225-F274 HydrophobicContact CG1-CD2 3.85Å; V225-F274 HydrophobicContact CG1-CE1 4.11Å; V225-F274 HydrophobicContact CG1-CE2 3.86Å; V225-F274 HydrophobicContact CG1-CG 4Å; V225-F274 HydrophobicContact CG1-CZ 3.99Å
226I84.4Confident79.8Confident2 Ų248.6 Ų48.61%0.0128%0.277CS..Hα-helixtrans-61.5-47.4177.7-61.5165.2000110.8V223 M224 L229 N230 F274 A278V223-I226 PolarHBondContact O-N 3.24Å; M224-I226 VanDerWaalsContact C-N 3.29Å; M224-I226 PolarHBondContact O-N 3.18Å; I226-L229 PolarHBondContact O-N 3.42Å; I226-N230 PolarHBondContact O-N 3.17Å; I226-N230 PolarHBondContact O-ND2 3.49Å; I226-N230 PolarHBondContact O-OD1 2.9Å; I226-F274 HydrophobicContact CD1-CB 4.41Å; I226-F274 HydrophobicContact CG1-CB 3.77Å; I226-A278 HydrophobicContact CD1-CB 4.31Å
227F88.9Confident81.5Confident3 Ų342.7 Ų42.71%0.01325%0.252CS..Hα-helixtrans-66.4-38.9178.3-70.6-78.2000112.1R114 C199 T200 V203 V223 M224 V225 N230 L231R114-F227 HydrophobicContact CB-CE2 4.21Å; R114-F227 HydrophobicContact CB-CZ 3.69Å; C199-F227 HydrophobicContact CB-CD1 4.38Å; C199-F227 HydrophobicContact CB-CE1 3.94Å; T200-F227 HydrophobicContact CG2-CB 4.03Å; V203-F227 HydrophobicContact CB-CD2 4.39Å; V203-F227 HydrophobicContact CB-CE2 4.06Å; V203-F227 HydrophobicContact CB-CZ 4.27Å; V203-F227 HydrophobicContact CG1-CD2 4.07Å; V203-F227 HydrophobicContact CG1-CE2 3.78Å; V203-F227 HydrophobicContact CG1-CZ 4.46Å; V203-F227 HydrophobicContact CG2-CD2 4.47Å; V203-F227 HydrophobicContact CG2-CE1 4.16Å; V203-F227 HydrophobicContact CG2-CE2 3.7Å; V203-F227 HydrophobicContact CG2-CZ 3.52Å; V223-F227 HydrophobicContact CG1-CD2 4.28Å; V223-F227 HydrophobicContact CG1-CE2 3.92Å; V223-F227 VanDerWaalsContact O-CD2 3.26Å; V223-F227 WeakPolarHBondContact O-CD2 3.47Å; M224-F227 PolarHBondContact O-N 3.47Å; V225-F227 PolarHBondContact O-N 3.06Å; F227-N230 PolarHBondContact O-N 2.98Å; F227-L231 WeakPolarHBondContact O-CG 3.4Å; F227-L231 PolarHBondContact O-N 2.98Å
228A88.7Confident83.1Confident52 Ų5238 Ų3843%0.4322%0.223SC..Hα-helixtrans-62.8-45.4174.900000111.9M224 V225 N230 L231 V232M224-A228 WeakPolarHBondContact O-CB 3.11Å; M224-A228 PolarHBondContact O-N 2.97Å; V225-A228 PolarHBondContact O-N 2.63Å; A228-N230 VanDerWaalsContact C-N 3.33Å; A228-N230 PolarHBondContact O-N 3.36Å; A228-L231 PolarHBondContact O-N 2.86Å; A228-V232 WeakPolarHBondContact O-CG2 3.41Å; A228-V232 PolarHBondContact O-N 3.35Å
229L88.9Confident84.8Confident39 Ų3934.5 Ų34.520%0.20420%0.204CC..Hα-helixtrans-59.9-43.5175.6-73.6173000111.4V225 I226 L231 V232 M233 L270 F274V225-L229 HydrophobicContact CG1-CD1 3.84Å; V225-L229 HydrophobicContact CG1-CG 4.14Å; V225-L229 WeakPolarHBondContact O-CB 3.39Å; V225-L229 VanDerWaalsContact O-CG 3.25Å; V225-L229 WeakPolarHBondContact O-CG 3.49Å; V225-L229 PolarHBondContact O-N 3.3Å; I226-L229 PolarHBondContact O-N 3.42Å; L229-L231 PolarHBondContact O-N 2.94Å; L229-V232 PolarHBondContact O-N 3.47Å; L229-M233 WeakPolarHBondContact O-CB 3.49Å; L229-M233 VanDerWaalsContact O-CG 3.26Å; L229-M233 WeakPolarHBondContact O-CG 3.41Å; L229-M233 PolarHBondContact O-N 2.88Å; L229-L270 HydrophobicContact CD1-CB 4.19Å; L229-F274 HydrophobicContact CD1-CD2 3.57Å; L229-F274 HydrophobicContact CD1-CE2 3.96Å
230N89.4Confident86.1Confident2 Ų233.9 Ų33.91%0.01120%0.199CC..Hα-helixtrans-62.9-42.1177.2-67.1-10.2000111.6I107 S111 I226 F227 A228 M233 F234I107-N230 HydrophobicContact CG2-CB 3.97Å; S111-N230 PolarHBondContact OG-ND2 3.36Å; I226-N230 PolarHBondContact O-N 3.17Å; I226-N230 PolarHBondContact O-ND2 3.49Å; I226-N230 PolarHBondContact O-OD1 2.9Å; F227-N230 PolarHBondContact O-N 2.98Å; A228-N230 VanDerWaalsContact C-N 3.33Å; A228-N230 PolarHBondContact O-N 3.36Å; N230-M233 WeakPolarHBondContact O-CB 3.43Å; N230-M233 PolarHBondContact O-N 2.8Å; N230-F234 WeakPolarHBondContact O-CD2 3.41Å; N230-F234 PolarHBondContact O-N 2.9Å
231L91.8Very high87.1Confident45 Ų4532.7 Ų32.724%0.23620%0.195CC..Hα-helixtrans-63.9-42.5174.9-70.1179.1000112.1N196 V197 T200 F227 A228 L229 M233 F234 S235N196-L231 HydrophobicContact CB-CD2 4.37Å; V197-L231 HydrophobicContact CG2-CD2 3.75Å; T200-L231 HydrophobicContact CG2-CD1 3.84Å; F227-L231 WeakPolarHBondContact O-CG 3.4Å; F227-L231 PolarHBondContact O-N 2.98Å; A228-L231 PolarHBondContact O-N 2.86Å; L229-L231 PolarHBondContact O-N 2.94Å; L231-M233 VanDerWaalsContact C-N 3.31Å; L231-M233 PolarHBondContact O-N 3.03Å; L231-F234 PolarHBondContact O-N 2.86Å; L231-S235 WeakPolarHBondContact O-CB 3.31Å; L231-S235 PolarHBondContact O-N 3.1Å; L231-S235 PolarHBondContact O-OG 3.36Å; L231-S235 VanDerWaalsContact O-OG 3.1Å
232V90.8Very high88Confident75 Ų7529.7 Ų29.746%0.45518%0.177SC..Hα-helixtrans-59.7-43.4174.9170.20000110.8A228 L229 F234 S235 V236A228-V232 WeakPolarHBondContact O-CG2 3.41Å; A228-V232 PolarHBondContact O-N 3.35Å; L229-V232 PolarHBondContact O-N 3.47Å; V232-F234 PolarHBondContact O-N 2.88Å; V232-S235 PolarHBondContact O-N 3.28Å; V232-V236 HydrophobicContact CG1-CG2 4.13Å; V232-V236 VanDerWaalsContact O-CB 3.3Å; V232-V236 WeakPolarHBondContact O-CB 3.2Å; V232-V236 WeakPolarHBondContact O-CG2 3.48Å; V232-V236 PolarHBondContact O-N 3.34Å
233M90.5Very high88.9Confident2 Ų231.2 Ų31.21%0.0119%0.185CC..Hα-helixtrans-57.1-48.7175.6-75.9-74.5-78.500112.1I107 L229 N230 L231 C237 F238 N264 L267 D268I107-M233 HydrophobicContact CD1-CE 3.57Å; L229-M233 WeakPolarHBondContact O-CB 3.49Å; L229-M233 VanDerWaalsContact O-CG 3.26Å; L229-M233 WeakPolarHBondContact O-CG 3.41Å; L229-M233 PolarHBondContact O-N 2.88Å; N230-M233 WeakPolarHBondContact O-CB 3.43Å; N230-M233 PolarHBondContact O-N 2.8Å; L231-M233 VanDerWaalsContact C-N 3.31Å; L231-M233 PolarHBondContact O-N 3.03Å; M233-C237 WeakPolarHBondContact O-CA 3.38Å; M233-C237 WeakPolarHBondContact O-CB 3.39Å; M233-C237 PolarHBondContact O-N 3.12Å; M233-F238 HydrophobicContact CE-CZ 4.47Å; M233-F238 PolarHBondContact O-N 2.68Å; M233-N264 HydrophobicContact CE-CB 3.57Å; M233-N264 WeakPolarHBondContact CE-O 3.26Å; M233-N264 HydrophobicContact SD-CB 4.32Å; M233-L267 HydrophobicContact CE-CB 4.3Å; M233-L267 HydrophobicContact CG-CB 4.44Å; M233-L267 HydrophobicContact SD-CB 3.31Å; M233-L267 WeakPolarHBondContact SD-CB 3.41Å; M233-L267 HydrophobicContact SD-CD1 3.51Å; M233-L267 VanDerWaalsContact SD-CD1 3.51Å; M233-L267 HydrophobicContact SD-CG 4.03Å; M233-D268 WeakPolarHBondContact CE-OD1 3.44Å
234F91.6Very high89.5Confident3 Ų331.2 Ų31.21%0.01319%0.185CC..Iπ-helixtrans-64.9-46.6176.6-85.6-83.8000112.7I107 T108 L192 L193 N196 N230 L231 V232 F238 L239I107-F234 HydrophobicContact CB-CE2 4.48Å; I107-F234 HydrophobicContact CG2-CE2 3.92Å; T108-F234 WeakPolarHBondContact OG1-CZ 3.3Å; L192-F234 HydrophobicContact CB-CE1 3.76Å; L192-F234 HydrophobicContact CB-CZ 3.89Å; L193-F234 HydrophobicContact CB-CD1 4.22Å; L193-F234 HydrophobicContact CD1-CB 3.86Å; L193-F234 HydrophobicContact CD1-CG 4.34Å; N196-F234 HydrophobicContact CB-CD2 4.45Å; N196-F234 HydrophobicContact CB-CE2 4.43Å; N196-F234 WeakPolarHBondContact ND2-CE2 3.35Å; N196-F234 WeakPolarHBondContact ND2-CZ 3.41Å; N230-F234 WeakPolarHBondContact O-CD2 3.41Å; N230-F234 PolarHBondContact O-N 2.9Å; L231-F234 PolarHBondContact O-N 2.86Å; V232-F234 PolarHBondContact O-N 2.88Å; F234-F238 HydrophobicContact CD1-CB 4.35Å; F234-F238 AromaticContact CD1-CD2 3.87Å; F234-F238 HydrophobicContact CD1-CD2 3.87Å; F234-F238 HydrophobicContact CE1-CD2 4.07Å; F234-F238 HydrophobicContact CG-CD2 4.12Å; F234-F238 HydrophobicContact CZ-CD2 4.47Å; F234-F238 PolarHBondContact O-N 2.92Å; F234-L239 WeakPolarHBondContact O-CB 3.47Å; F234-L239 PolarHBondContact O-N 3.37Å
235S90Very high89.7Confident62 Ų6227.8 Ų27.843%0.43417%0.169SC..Iπ-helixtrans-68.5-36.2-176.1-63.20000113.4L231 V232 P240L231-S235 WeakPolarHBondContact O-CB 3.31Å; L231-S235 PolarHBondContact O-N 3.1Å; L231-S235 PolarHBondContact O-OG 3.36Å; L231-S235 VanDerWaalsContact O-OG 3.1Å; V232-S235 PolarHBondContact O-N 3.28Å; S235-P240 WeakPolarHBondContact O-CD 3.06Å
236V90.4Very high89.8Confident62 Ų6228.4 Ų28.438%0.37617%0.171SC..Iπ-helixtrans-95.7-40.9-175.1179.80000111.9V232 P240 L260V232-V236 HydrophobicContact CG1-CG2 4.13Å; V232-V236 VanDerWaalsContact O-CB 3.3Å; V232-V236 WeakPolarHBondContact O-CB 3.2Å; V232-V236 WeakPolarHBondContact O-CG2 3.48Å; V232-V236 PolarHBondContact O-N 3.34Å; V236-P240 WeakPolarHBondContact O-CG 3.2Å; V236-L260 HydrophobicContact CG1-CD2 4.09Å; V236-L260 WeakPolarHBondContact O-CB 3.45Å
237C92.4Very high89.9Confident0 Ų033.8 Ų33.80%020%0.198CC..Iπ-helixtrans-94.4-48.6-171.5-51.80000112.5M233 L260 A261 N264M233-C237 WeakPolarHBondContact O-CA 3.38Å; M233-C237 WeakPolarHBondContact O-CB 3.39Å; M233-C237 PolarHBondContact O-N 3.12Å; C237-L260 WeakPolarHBondContact CA-O 3.42Å; C237-L260 WeakPolarHBondContact CB-O 3.35Å; C237-A261 WeakPolarHBondContact O-CA 3.35Å; C237-A261 WeakPolarHBondContact O-CB 3.34Å; C237-A261 PolarHBondContact O-N 3.4Å; C237-N264 HydrophobicContact CB-CB 3.87Å
238F92.8Very high89.3Confident2 Ų236.3 Ų36.31%0.00921%0.208CC..Iπ-helixtrans-93.9-42.4-170.2-55.2-52.4000113.7I100 I107 M233 F234 L241 S242 N264I100-F238 HydrophobicContact CG2-CD1 4.03Å; I100-F238 HydrophobicContact CG2-CE1 4.45Å; I107-F238 HydrophobicContact CD1-CE2 3.78Å; I107-F238 HydrophobicContact CD1-CZ 3.99Å; M233-F238 HydrophobicContact CE-CZ 4.47Å; M233-F238 PolarHBondContact O-N 2.68Å; F234-F238 HydrophobicContact CD1-CB 4.35Å; F234-F238 AromaticContact CD1-CD2 3.87Å; F234-F238 HydrophobicContact CD1-CD2 3.87Å; F234-F238 HydrophobicContact CE1-CD2 4.07Å; F234-F238 HydrophobicContact CG-CD2 4.12Å; F234-F238 HydrophobicContact CZ-CD2 4.47Å; F234-F238 PolarHBondContact O-N 2.92Å; F238-L241 PolarHBondContact O-N 3.38Å; F238-S242 PolarHBondContact O-N 2.88Å; F238-S242 PolarHBondContact O-OG 3.36Å; F238-N264 HydrophobicContact CE1-CB 4.03Å; F238-N264 HydrophobicContact CZ-CB 3.89Å
239L91.6Very high88.2Confident37 Ų3736.1 Ų36.119%0.19420%0.201CC..Hα-helixtrans-64.8-42.8-173.6-173.365.8000113.7F190 L193 F234 L241 S242 I243F190-L239 HydrophobicContact CD1-CD1 4.29Å; F190-L239 HydrophobicContact CE1-CD1 3.61Å; F190-L239 HydrophobicContact CZ-CD1 4.03Å; L193-L239 HydrophobicContact CD2-CD1 4.21Å; L193-L239 HydrophobicContact CD2-CD2 4.36Å; F234-L239 WeakPolarHBondContact O-CB 3.47Å; F234-L239 PolarHBondContact O-N 3.37Å; L239-L241 VanDerWaalsContact C-N 3.3Å; L239-L241 PolarHBondContact O-N 3.26Å; L239-S242 PolarHBondContact O-N 2.91Å; L239-I243 HydrophobicContact CD1-CD1 3.81Å; L239-I243 HydrophobicContact CD1-CG1 3.96Å; L239-I243 HydrophobicContact CD2-CD1 4.15Å; L239-I243 HydrophobicContact CG-CD1 3.62Å; L239-I243 HydrophobicContact CG-CG1 4.15Å; L239-I243 WeakPolarHBondContact O-CG1 3.13Å; L239-I243 PolarHBondContact O-N 3.47Å
240P92.3Very high86.9Confident29 Ų2943.5 Ų43.519%0.18823%0.232CC..Hα-helixtrans-62.1-38.2-178.9-2638.3000112.6S235 V236 T244 V257 L260S235-P240 WeakPolarHBondContact O-CD 3.06Å; V236-P240 WeakPolarHBondContact O-CG 3.2Å; P240-T244 VanDerWaalsContact O-CB 3.3Å; P240-T244 WeakPolarHBondContact O-CB 3.17Å; P240-T244 PolarHBondContact O-N 2.84Å; P240-T244 PolarHBondContact O-OG1 3.42Å; P240-V257 HydrophobicContact CB-CB 4.47Å; P240-V257 HydrophobicContact CB-CG1 3.98Å; P240-L260 HydrophobicContact CB-CD1 4.24Å; P240-L260 HydrophobicContact CG-CD1 4.3Å
241L90.4Very high85.6Confident20 Ų2046.9 Ų46.911%0.10527%0.267CS..Hα-helixtrans-65.6-48.2177179.963000111.1F96 I100 F238 L239 T244 A245 V257 I258 A261F96-L241 HydrophobicContact CZ-CD2 4.36Å; I100-L241 HydrophobicContact CD1-CD2 3.42Å; I100-L241 VanDerWaalsContact CD1-CD2 3.42Å; F238-L241 PolarHBondContact O-N 3.38Å; L239-L241 VanDerWaalsContact C-N 3.3Å; L239-L241 PolarHBondContact O-N 3.26Å; L241-T244 PolarHBondContact O-N 2.94Å; L241-A245 VanDerWaalsContact O-CB 3.25Å; L241-A245 WeakPolarHBondContact O-CB 3.4Å; L241-A245 PolarHBondContact O-N 3.46Å; L241-V257 HydrophobicContact CB-CB 4.47Å; L241-V257 HydrophobicContact CD1-CB 4.47Å; L241-V257 HydrophobicContact CD1-CG2 3.84Å; L241-I258 HydrophobicContact CD1-CG1 4.22Å; L241-A261 HydrophobicContact CB-CB 4.5Å; L241-A261 HydrophobicContact CD2-CB 3.96Å
242S90.1Very high84.4Confident6 Ų647.3 Ų47.34%0.04227%0.274CS..Hα-helixtrans-62.3-44.5179.3-640000112.7E189 F238 L239 A245 L246E189-S242 WeakPolarHBondContact CG-OG 3.35Å; F238-S242 PolarHBondContact O-N 2.88Å; F238-S242 PolarHBondContact O-OG 3.36Å; L239-S242 PolarHBondContact O-N 2.91Å; S242-A245 PolarHBondContact O-N 3.47Å; S242-L246 WeakPolarHBondContact O-CG 3.11Å; S242-L246 PolarHBondContact O-N 3.3Å
243I89.8Confident83.9Confident64 Ų6446.8 Ų46.833%0.32827%0.269SS..Hα-helixtrans-63.3-47.5177.4-69177.2000110.6F190 L239 A245 L246 I247F190-I243 HydrophobicContact CZ-CG1 4.12Å; L239-I243 HydrophobicContact CD1-CD1 3.81Å; L239-I243 HydrophobicContact CD1-CG1 3.96Å; L239-I243 HydrophobicContact CD2-CD1 4.15Å; L239-I243 HydrophobicContact CG-CD1 3.62Å; L239-I243 HydrophobicContact CG-CG1 4.15Å; L239-I243 WeakPolarHBondContact O-CG1 3.13Å; L239-I243 PolarHBondContact O-N 3.47Å; I243-A245 VanDerWaalsContact C-N 3.33Å; I243-A245 PolarHBondContact O-N 3.38Å; I243-L246 PolarHBondContact O-N 3.16Å; I243-I247 HydrophobicContact CG2-CD1 3.49Å; I243-I247 VanDerWaalsContact CG2-CD1 3.49Å; I243-I247 HydrophobicContact CG2-CG1 4.27Å; I243-I247 WeakPolarHBondContact O-CG1 3.36Å; I243-I247 PolarHBondContact O-N 2.97Å
244T88.3Confident83.7Confident27 Ų2746.7 Ų46.717%0.16627%0.268CS..Hα-helixtrans-65.6-39.3-177.6-51.40000111.1P240 L241 L246 R248 F254P240-T244 VanDerWaalsContact O-CB 3.3Å; P240-T244 WeakPolarHBondContact O-CB 3.17Å; P240-T244 PolarHBondContact O-N 2.84Å; P240-T244 PolarHBondContact O-OG1 3.42Å; L241-T244 PolarHBondContact O-N 2.94Å; T244-L246 VanDerWaalsContact C-N 3.35Å; T244-L246 PolarHBondContact O-N 3.23Å; T244-R248 PolarHBondContact O-N 3.47Å; T244-R248 VanDerWaalsContact O-N 3.08Å; T244-F254 HydrophobicContact CG2-CD1 3.81Å; T244-F254 HydrophobicContact CG2-CE1 3.52Å; T244-F254 HydrophobicContact CG2-CZ 4.39Å
245A86.6Confident83.5Confident10 Ų1046.7 Ų46.78%0.08327%0.268CS..Hα-helixtrans-62.9-39174.600000112.3I175 V182 L241 S242 I243 R248I175-A245 HydrophobicContact CG2-CB 3.82Å; V182-A245 HydrophobicContact CG1-CB 3.91Å; L241-A245 VanDerWaalsContact O-CB 3.25Å; L241-A245 WeakPolarHBondContact O-CB 3.4Å; L241-A245 PolarHBondContact O-N 3.46Å; S242-A245 PolarHBondContact O-N 3.47Å; I243-A245 VanDerWaalsContact C-N 3.33Å; I243-A245 PolarHBondContact O-N 3.38Å; A245-R248 WeakPolarHBondContact O-CG 2.97Å
246L86.6Confident83.6Confident54 Ų5446.4 Ų46.428%0.28327%0.265SS..Hα-helixtrans-70-43.6176.7-77.8177.9000113.7Y183 S186 F190 S242 I243 T244 R248Y183-L246 HydrophobicContact CD1-CD2 3.82Å; Y183-L246 HydrophobicContact CE1-CD2 4.1Å; S186-L246 WeakPolarHBondContact OG-CG 3.37Å; F190-L246 HydrophobicContact CE2-CD1 3.7Å; F190-L246 HydrophobicContact CZ-CD1 4.49Å; S242-L246 WeakPolarHBondContact O-CG 3.11Å; S242-L246 PolarHBondContact O-N 3.3Å; I243-L246 PolarHBondContact O-N 3.16Å; T244-L246 VanDerWaalsContact C-N 3.35Å; T244-L246 PolarHBondContact O-N 3.23Å; L246-R248 PolarHBondContact O-N 3.17Å
247I86.1Confident83.6Confident115 Ų11544.4 Ų44.459%0.5925%0.253SS*.Hα-helixtrans-74.2-19.6-177-63.2174.1000111.1I243 T249I243-I247 HydrophobicContact CG2-CD1 3.49Å; I243-I247 VanDerWaalsContact CG2-CD1 3.49Å; I243-I247 HydrophobicContact CG2-CG1 4.27Å; I243-I247 WeakPolarHBondContact O-CG1 3.36Å; I243-I247 PolarHBondContact O-N 2.97Å; I247-T249 HydrophobicContact CG2-CG2 4.11Å; I247-T249 PolarHBondContact O-N 3.37Å
248R75.4Confident83.6Confident56 Ų5644.4 Ų44.421%0.21125%0.253CS..THydrogen-bonded Turntrans54.950.7174.9-57.9173175.5141.41.9112.2Y183 T244 A245 L246 K250Y183-R248 PolarHBondContact OH-NH1 2.02Å; Y183-R248 PolarHBondContact OH-NH2 2.94Å; T244-R248 PolarHBondContact O-N 3.47Å; T244-R248 VanDerWaalsContact O-N 3.08Å; A245-R248 WeakPolarHBondContact O-CG 2.97Å; L246-R248 PolarHBondContact O-N 3.17Å; R248-K250 PolarHBondContact O-N 2.85Å
249T67.1Low83.6Confident48 Ų4844.9 Ų44.929%0.29426%0.256SS..  trans-54110.518045.20000110.2R176 I247 S252R176-T249 PolarHBondContact NH2-O 3.5Å; I247-T249 HydrophobicContact CG2-CG2 4.11Å; I247-T249 PolarHBondContact O-N 3.37Å; T249-S252 PolarHBondContact O-N 2.8Å; T249-S252 WeakPolarHBondContact OG1-CB 3.42Å
250K61.8Low83.7Confident195 Ų19546.4 Ų46.485%0.84826%0.264SS*.THydrogen-bonded Turntrans-68.3132.8176.5-76-173177.5-178.70108.5R248 S252R248-K250 PolarHBondContact O-N 2.85Å; K250-S252 VanDerWaalsContact C-N 3.25Å; K250-S252 PolarHBondContact O-N 2.98Å
251G60.8Low83.7Confident73 Ų7345 Ų4575%0.75326%0.255SS*.THydrogen-bonded Turntrans75.2-1.5-177.700000116.3
252S67.1Low83.9Confident53 Ų5344 Ų4437%0.37125%0.25SS..  trans-81.2134.5-179.7-159.40000112.1T249 K250T249-S252 PolarHBondContact O-N 2.8Å; T249-S252 WeakPolarHBondContact OG1-CB 3.42Å; K250-S252 VanDerWaalsContact C-N 3.25Å; K250-S252 PolarHBondContact O-N 2.98Å
253D79.6Confident84Confident65 Ų6545.9 Ų45.935%0.34826%0.261SS..  trans-68.6125.9163.9-178.210.8000109.1Y20 T255Y20-D253 WeakPolarHBondContact CE2-OD2 3.28Å; Y20-D253 PolarHBondContact OH-OD2 3.49Å; D253-T255 WeakPolarHBondContact OD1-CB 3.31Å; D253-T255 PolarHBondContact OD1-N 3.49Å; D253-T255 PolarHBondContact OD1-OG1 3Å; D253-T255 PolarHBondContact OD2-OG1 3.16Å
254F86.5Confident84.1Confident0 Ų042.8 Ų42.80%025%0.245CC..  trans-88-7.2176-73.2-90000112.1Y172 I175 T244 P256 V257 I258Y172-F254 HydrophobicContact CD1-CB 3.74Å; Y172-F254 HydrophobicContact CD1-CD2 4.09Å; Y172-F254 HydrophobicContact CD1-CG 4.33Å; Y172-F254 HydrophobicContact CE1-CB 3.97Å; Y172-F254 HydrophobicContact CG-CD2 4.26Å; I175-F254 HydrophobicContact CG2-CD1 4.2Å; I175-F254 HydrophobicContact CG2-CE1 3.68Å; I175-F254 HydrophobicContact CG2-CE2 4.36Å; I175-F254 HydrophobicContact CG2-CZ 3.78Å; T244-F254 HydrophobicContact CG2-CD1 3.81Å; T244-F254 HydrophobicContact CG2-CE1 3.52Å; T244-F254 HydrophobicContact CG2-CZ 4.39Å; F254-P256 VanDerWaalsContact C-CD 3.45Å; F254-V257 HydrophobicContact CB-CG2 4.25Å; F254-V257 HydrophobicContact CD1-CG2 4.1Å; F254-V257 WeakPolarHBondContact O-CG2 3.42Å; F254-V257 PolarHBondContact O-N 2.78Å; F254-I258 HydrophobicContact CB-CD1 4.05Å; F254-I258 WeakPolarHBondContact O-CB 2.98Å; F254-I258 VanDerWaalsContact O-CG1 3.3Å; F254-I258 WeakPolarHBondContact O-CG1 3.47Å; F254-I258 PolarHBondContact O-N 2.69Å
255T88.8Confident84.1Confident2 Ų241.6 Ų41.61%0.01224%0.238CC..Hα-helixtrans-54.6-42.2-178.7-47.50000113.5Y20 F24 Y77 Y172 D253 V257 I258 C259Y20-T255 HydrophobicContact CD1-CG2 3.55Å; Y20-T255 HydrophobicContact CD2-CG2 3.41Å; Y20-T255 VanDerWaalsContact CD2-CG2 3.41Å; Y20-T255 HydrophobicContact CE1-CG2 3.72Å; Y20-T255 HydrophobicContact CE2-CG2 3.56Å; Y20-T255 HydrophobicContact CG-CG2 3.39Å; F24-T255 HydrophobicContact CE2-CG2 4.22Å; Y77-T255 HydrophobicContact CE1-CG2 4.01Å; Y77-T255 HydrophobicContact CE2-CG2 4.26Å; Y77-T255 WeakPolarHBondContact OH-CG2 3.43Å; Y77-T255 PolarHBondContact OH-OG1 2.9Å; Y77-T255 VanDerWaalsContact OH-OG1 3.12Å; Y172-T255 PolarHBondContact OH-OG1 3.18Å; D253-T255 WeakPolarHBondContact OD1-CB 3.31Å; D253-T255 PolarHBondContact OD1-N 3.49Å; D253-T255 PolarHBondContact OD1-OG1 3Å; D253-T255 PolarHBondContact OD2-OG1 3.16Å; T255-V257 PolarHBondContact O-N 3.25Å; T255-I258 PolarHBondContact O-N 3.24Å; T255-C259 PolarHBondContact O-N 3Å; T255-C259 PolarHBondContact O-SG 3.35Å
256P90.4Very high84.3Confident57 Ų5742.5 Ų42.537%0.3724%0.243SC..Hα-helixtrans-59.3-46.5178.1-25.134.5000113Y20 F254 I258 C259 L260Y20-P256 HydrophobicContact CE1-CG 4.42Å; Y20-P256 WeakPolarHBondContact OH-CD 3.48Å; Y20-P256 WeakPolarHBondContact OH-CG 3.44Å; F254-P256 VanDerWaalsContact C-CD 3.45Å; P256-I258 VanDerWaalsContact C-N 3.32Å; P256-I258 PolarHBondContact O-N 2.87Å; P256-C259 WeakPolarHBondContact O-CB 3.3Å; P256-C259 PolarHBondContact O-N 3.41Å; P256-L260 WeakPolarHBondContact O-CG 3.29Å; P256-L260 PolarHBondContact O-N 3.3Å
257V91.3Very high84.3Confident19 Ų1942.1 Ų42.112%0.11524%0.241CC..Hα-helixtrans-72.5-28.4179.6-64.30000112.2P240 L241 F254 T255 A261P240-V257 HydrophobicContact CB-CB 4.47Å; P240-V257 HydrophobicContact CB-CG1 3.98Å; L241-V257 HydrophobicContact CB-CB 4.47Å; L241-V257 HydrophobicContact CD1-CB 4.47Å; L241-V257 HydrophobicContact CD1-CG2 3.84Å; F254-V257 HydrophobicContact CB-CG2 4.25Å; F254-V257 HydrophobicContact CD1-CG2 4.1Å; F254-V257 WeakPolarHBondContact O-CG2 3.42Å; F254-V257 PolarHBondContact O-N 2.78Å; T255-V257 PolarHBondContact O-N 3.25Å; V257-A261 WeakPolarHBondContact O-CB 3.3Å; V257-A261 PolarHBondContact O-N 3.46Å
258I92.1Very high84.4Confident1 Ų136.7 Ų36.71%0.00521%0.213CC..Hα-helixtrans-68.7-39.7170.8-71.2169.4000110.9F24 F96 Y172 L241 F254 T255 P256 A261 T262F24-I258 HydrophobicContact CE1-CG2 4.44Å; F24-I258 HydrophobicContact CZ-CG2 4.04Å; F96-I258 HydrophobicContact CE1-CG1 4.41Å; F96-I258 HydrophobicContact CE1-CG2 4.37Å; F96-I258 HydrophobicContact CE2-CG2 4.01Å; F96-I258 HydrophobicContact CZ-CB 4.26Å; F96-I258 HydrophobicContact CZ-CG1 4.15Å; F96-I258 HydrophobicContact CZ-CG2 3.7Å; Y172-I258 HydrophobicContact CD1-CD1 4.45Å; Y172-I258 HydrophobicContact CE1-CD1 3.83Å; L241-I258 HydrophobicContact CD1-CG1 4.22Å; F254-I258 HydrophobicContact CB-CD1 4.05Å; F254-I258 WeakPolarHBondContact O-CB 2.98Å; F254-I258 VanDerWaalsContact O-CG1 3.3Å; F254-I258 WeakPolarHBondContact O-CG1 3.47Å; F254-I258 PolarHBondContact O-N 2.69Å; T255-I258 PolarHBondContact O-N 3.24Å; P256-I258 VanDerWaalsContact C-N 3.32Å; P256-I258 PolarHBondContact O-N 2.87Å; I258-A261 PolarHBondContact O-N 2.75Å; I258-T262 WeakPolarHBondContact O-CB 3.48Å; I258-T262 PolarHBondContact O-N 3.4Å; I258-T262 PolarHBondContact O-OG1 2.95Å
259C92.4Very high84.8Confident12 Ų1234.7 Ų34.78%0.08121%0.208CC..Hα-helixtrans-60.4-51.1173.5-68.80000110V23 F24 T255 P256 A261 T262 V263V23-C259 HydrophobicContact CG1-CB 4.15Å; F24-C259 HydrophobicContact CZ-CB 4.44Å; F24-C259 WeakPolarHBondContact CZ-SG 3.35Å; T255-C259 PolarHBondContact O-N 3Å; T255-C259 PolarHBondContact O-SG 3.35Å; P256-C259 WeakPolarHBondContact O-CB 3.3Å; P256-C259 PolarHBondContact O-N 3.41Å; C259-A261 VanDerWaalsContact C-N 3.31Å; C259-A261 PolarHBondContact O-N 3.46Å; C259-T262 WeakPolarHBondContact O-CA 3.37Å; C259-T262 WeakPolarHBondContact O-CB 3.5Å; C259-T262 PolarHBondContact O-N 3.03Å; C259-V263 WeakPolarHBondContact O-CG2 3.45Å; C259-V263 PolarHBondContact O-N 3.4Å
260L93.4Very high85.4Confident68 Ų6836.1 Ų36.136%0.35621%0.213SC..Hα-helixtrans-55.4-45.7175.8-71.7176.8000111.9V236 C237 P240 P256 T262 V263V236-L260 HydrophobicContact CG1-CD2 4.09Å; V236-L260 WeakPolarHBondContact O-CB 3.45Å; C237-L260 WeakPolarHBondContact CA-O 3.42Å; C237-L260 WeakPolarHBondContact CB-O 3.35Å; P240-L260 HydrophobicContact CB-CD1 4.24Å; P240-L260 HydrophobicContact CG-CD1 4.3Å; P256-L260 WeakPolarHBondContact O-CG 3.29Å; P256-L260 PolarHBondContact O-N 3.3Å; L260-T262 VanDerWaalsContact C-N 3.28Å; L260-T262 PolarHBondContact O-N 2.92Å; L260-V263 WeakPolarHBondContact O-CB 3.38Å; L260-V263 PolarHBondContact O-N 3.08Å
261A93.6Very high86.1Confident0 Ų027 Ų270%017%0.174CC..Hα-helixtrans-60.1-39.317500000112.1F96 I100 C237 L241 V257 I258 C259 V263 N264F96-A261 HydrophobicContact CE2-CB 4.48Å; F96-A261 HydrophobicContact CZ-CB 4.3Å; I100-A261 HydrophobicContact CD1-CB 4.08Å; I100-A261 HydrophobicContact CG1-CB 4.37Å; C237-A261 WeakPolarHBondContact O-CA 3.35Å; C237-A261 WeakPolarHBondContact O-CB 3.34Å; C237-A261 PolarHBondContact O-N 3.4Å; L241-A261 HydrophobicContact CB-CB 4.5Å; L241-A261 HydrophobicContact CD2-CB 3.96Å; V257-A261 WeakPolarHBondContact O-CB 3.3Å; V257-A261 PolarHBondContact O-N 3.46Å; I258-A261 PolarHBondContact O-N 2.75Å; C259-A261 VanDerWaalsContact C-N 3.31Å; C259-A261 PolarHBondContact O-N 3.46Å; A261-V263 VanDerWaalsContact C-N 3.33Å; A261-V263 PolarHBondContact O-N 3.42Å; A261-N264 WeakPolarHBondContact O-CB 3.02Å; A261-N264 PolarHBondContact O-N 2.95Å; A261-N264 PolarHBondContact O-ND2 3.22Å
262T93.3Very high87.1Confident0 Ų023.7 Ų23.70%014%0.139CC..Hα-helixtrans-73.4-23.1-178.4-50.20000112.8F24 I27 L66 L70 I258 C259 L260 N264 C265F24-T262 HydrophobicContact CD1-CG2 4.13Å; F24-T262 HydrophobicContact CE1-CG2 4.12Å; I27-T262 HydrophobicContact CD1-CG2 4.01Å; I27-T262 HydrophobicContact CG2-CG2 3.93Å; L66-T262 HydrophobicContact CD2-CG2 4.19Å; L70-T262 HydrophobicContact CD1-CG2 4.2Å; L70-T262 HydrophobicContact CD2-CG2 3.7Å; I258-T262 WeakPolarHBondContact O-CB 3.48Å; I258-T262 PolarHBondContact O-N 3.4Å; I258-T262 PolarHBondContact O-OG1 2.95Å; C259-T262 WeakPolarHBondContact O-CA 3.37Å; C259-T262 WeakPolarHBondContact O-CB 3.5Å; C259-T262 PolarHBondContact O-N 3.03Å; L260-T262 VanDerWaalsContact C-N 3.28Å; L260-T262 PolarHBondContact O-N 2.92Å; T262-N264 PolarHBondContact O-N 2.76Å; T262-N264 VanDerWaalsContact O-N 3.15Å; T262-C265 PolarHBondContact O-N 3.49Å
263V92.3Very high87.8Confident44 Ų4428.4 Ų28.427%0.26715%0.149SC..THydrogen-bonded Turntrans-61.5-20.8175.1170.10000112.1I27 C259 L260 A261 C265 C266 L267I27-V263 HydrophobicContact CD1-CG2 3.94Å; I27-V263 HydrophobicContact CG1-CG2 4.39Å; C259-V263 WeakPolarHBondContact O-CG2 3.45Å; C259-V263 PolarHBondContact O-N 3.4Å; L260-V263 WeakPolarHBondContact O-CB 3.38Å; L260-V263 PolarHBondContact O-N 3.08Å; A261-V263 VanDerWaalsContact C-N 3.33Å; A261-V263 PolarHBondContact O-N 3.42Å; V263-C265 PolarHBondContact O-N 3.23Å; V263-C265 VanDerWaalsContact O-N 3.15Å; V263-C266 PolarHBondContact O-N 2.8Å; V263-L267 HydrophobicContact CG1-CD1 3.96Å; V263-L267 HydrophobicContact CG1-CG 4.18Å
264N92.1Very high87.7Confident0 Ų027.7 Ų27.70%014%0.143CC..Hα-helixtrans-47.5-45.8176.590.273.1000112D63 N99 M233 C237 F238 A261 T262 C266 L267 D268D63-N264 PolarHBondContact OD1-OD1 2.92Å; N99-N264 PolarHBondContact OD1-ND2 3.43Å; M233-N264 HydrophobicContact CE-CB 3.57Å; M233-N264 WeakPolarHBondContact CE-O 3.26Å; M233-N264 HydrophobicContact SD-CB 4.32Å; C237-N264 HydrophobicContact CB-CB 3.87Å; F238-N264 HydrophobicContact CE1-CB 4.03Å; F238-N264 HydrophobicContact CZ-CB 3.89Å; A261-N264 WeakPolarHBondContact O-CB 3.02Å; A261-N264 PolarHBondContact O-N 2.95Å; A261-N264 PolarHBondContact O-ND2 3.22Å; T262-N264 PolarHBondContact O-N 2.76Å; T262-N264 VanDerWaalsContact O-N 3.15Å; N264-C266 PolarHBondContact O-N 3Å; N264-L267 PolarHBondContact O-N 2.68Å; N264-D268 PolarHBondContact O-N 3.07Å; N264-D268 VanDerWaalsContact O-N 3.14Å; N264-D268 PolarHBondContact OD1-OD2 2.58Å
265C89.9Confident87.1Confident2 Ų227.7 Ų27.71%0.01414%0.144CC..Hα-helixtrans-61.9-23.4-177.9-60.10000114.3N35 D63 T262 V263 P269N35-C265 PolarHBondContact ND2-O 3.25Å; D63-C265 HydrophobicContact CB-CB 4.04Å; D63-C265 PolarHBondContact OD1-SG 3.24Å; T262-C265 PolarHBondContact O-N 3.49Å; V263-C265 PolarHBondContact O-N 3.23Å; V263-C265 VanDerWaalsContact O-N 3.15Å; C265-P269 WeakPolarHBondContact O-CD 3.17Å
266C89.2Confident86.3Confident29 Ų2928.8 Ų28.820%0.19615%0.149CC..Hα-helixtrans-84.9-21.6177-67.30000112.8V263 N264V263-C266 PolarHBondContact O-N 2.8Å; N264-C266 PolarHBondContact O-N 3Å
267L87.7Confident85.4Confident46 Ų4628.8 Ų28.824%0.24115%0.146CC..Hα-helixtrans-94.3-26.1-175.4-66.2176.8000112.1M233 V263 N264 L270M233-L267 HydrophobicContact CE-CB 4.3Å; M233-L267 HydrophobicContact CG-CB 4.44Å; M233-L267 HydrophobicContact SD-CB 3.31Å; M233-L267 WeakPolarHBondContact SD-CB 3.41Å; M233-L267 HydrophobicContact SD-CD1 3.51Å; M233-L267 VanDerWaalsContact SD-CD1 3.51Å; M233-L267 HydrophobicContact SD-CG 4.03Å; V263-L267 HydrophobicContact CG1-CD1 3.96Å; V263-L267 HydrophobicContact CG1-CG 4.18Å; N264-L267 PolarHBondContact O-N 2.68Å; L267-L270 HydrophobicContact CD2-CD1 4.17Å; L267-L270 VanDerWaalsContact O-CB 3.3Å; L267-L270 WeakPolarHBondContact O-CB 3.33Å; L267-L270 PolarHBondContact O-N 2.96Å
268D87.2Confident84.1Confident0 Ų028.8 Ų28.80%015%0.148CC..Hα-helixtrans-56.7-37.4176.7-67.8-47000114.9L59 M233 N264 L270 C271 Y272L59-D268 HydrophobicContact CD2-CB 4.17Å; L59-D268 HydrophobicContact CG-CB 4.4Å; M233-D268 WeakPolarHBondContact CE-OD1 3.44Å; N264-D268 PolarHBondContact O-N 3.07Å; N264-D268 VanDerWaalsContact O-N 3.14Å; N264-D268 PolarHBondContact OD1-OD2 2.58Å; D268-L270 PolarHBondContact O-N 2.86Å; D268-C271 WeakPolarHBondContact O-CA 3.01Å; D268-C271 VanDerWaalsContact O-CB 3.25Å; D268-C271 WeakPolarHBondContact O-CB 3.45Å; D268-C271 PolarHBondContact O-N 2.8Å; D268-Y272 HydrophobicContact CB-CE2 4.23Å; D268-Y272 WeakPolarHBondContact O-CD2 3.36Å; D268-Y272 PolarHBondContact O-N 3.12Å
269P83.9Confident82.7Confident15 Ų1531.6 Ų31.610%0.09716%0.16CC..Hα-helixtrans-54.2-33.5170.7-29.136.5000115.1L34 C265 Y272 Y273L34-P269 HydrophobicContact CB-CB 4.06Å; L34-P269 HydrophobicContact CB-CG 3.57Å; L34-P269 HydrophobicContact CD1-CG 4.33Å; C265-P269 WeakPolarHBondContact O-CD 3.17Å; P269-Y272 VanDerWaalsContact CA-CD2 3.47Å; P269-Y272 HydrophobicContact CB-CD2 4.44Å; P269-Y272 PolarHBondContact O-N 2.85Å; P269-Y273 PolarHBondContact O-N 2.94Å
270L80.1Confident81.2Confident77 Ų7736.1 Ų36.140%0.40318%0.176SC..Hα-helixtrans-67.9-41.4174.5-60.1172.9000110.5L229 L267 D268 Y272 Y273 F274L229-L270 HydrophobicContact CD1-CB 4.19Å; L267-L270 HydrophobicContact CD2-CD1 4.17Å; L267-L270 VanDerWaalsContact O-CB 3.3Å; L267-L270 WeakPolarHBondContact O-CB 3.33Å; L267-L270 PolarHBondContact O-N 2.96Å; D268-L270 PolarHBondContact O-N 2.86Å; L270-Y272 VanDerWaalsContact C-N 3.28Å; L270-Y272 PolarHBondContact O-N 3.48Å; L270-Y273 PolarHBondContact O-N 3.28Å; L270-F274 WeakPolarHBondContact O-CD2 3.3Å; L270-F274 PolarHBondContact O-N 3.18Å; L270-F274 VanDerWaalsContact O-N 3.07Å
271C77.1Confident79.8Confident3 Ų335.3 Ų35.32%0.0217%0.169CC..Hα-helixtrans-59.7-39.2175.4-65.70000111.6D268 S275D268-C271 WeakPolarHBondContact O-CA 3.01Å; D268-C271 VanDerWaalsContact O-CB 3.25Å; D268-C271 WeakPolarHBondContact O-CB 3.45Å; D268-C271 PolarHBondContact O-N 2.8Å; C271-S275 WeakPolarHBondContact O-CB 3.4Å; C271-S275 PolarHBondContact O-N 3.32Å; C271-S275 PolarHBondContact O-OG 3.34Å
272Y81.9Confident78.4Confident4 Ų439.5 Ų39.52%0.01619%0.187CC..Hα-helixtrans-64.4-49.4174.7-51.9-36.4000111.9S38 M56 L59 A60 D63 D268 P269 L270 F274 S275 L276S38-Y272 VanDerWaalsContact CB-CD2 3.49Å; M56-Y272 HydrophobicContact CB-CD1 3.73Å; M56-Y272 HydrophobicContact CB-CE1 3.79Å; M56-Y272 HydrophobicContact CG-CD1 3.71Å; M56-Y272 HydrophobicContact CG-CE1 4.04Å; M56-Y272 HydrophobicContact SD-CD1 3.9Å; L59-Y272 HydrophobicContact CB-CE1 4.31Å; L59-Y272 WeakPolarHBondContact CB-OH 3.36Å; L59-Y272 HydrophobicContact CD2-CE1 3.87Å; L59-Y272 HydrophobicContact CG-CE1 4.31Å; L59-Y272 WeakPolarHBondContact CG-OH 2.98Å; A60-Y272 WeakPolarHBondContact CA-OH 3.2Å; A60-Y272 HydrophobicContact CB-CE2 4.26Å; A60-Y272 PolarHBondContact N-OH 3.03Å; D63-Y272 PolarHBondContact OD2-OH 2.68Å; D268-Y272 HydrophobicContact CB-CE2 4.23Å; D268-Y272 WeakPolarHBondContact O-CD2 3.36Å; D268-Y272 PolarHBondContact O-N 3.12Å; P269-Y272 VanDerWaalsContact CA-CD2 3.47Å; P269-Y272 HydrophobicContact CB-CD2 4.44Å; P269-Y272 PolarHBondContact O-N 2.85Å; L270-Y272 VanDerWaalsContact C-N 3.28Å; L270-Y272 PolarHBondContact O-N 3.48Å; Y272-F274 PolarHBondContact O-N 3.5Å; Y272-S275 PolarHBondContact O-N 3.05Å; Y272-L276 WeakPolarHBondContact O-CB 3.48Å; Y272-L276 VanDerWaalsContact O-CG 3.25Å; Y272-L276 WeakPolarHBondContact O-CG 3.4Å; Y272-L276 PolarHBondContact O-N 3.33Å
273Y80.4Confident77Confident152 Ų15243.3 Ų43.360%0.59620%0.204SC*.Hα-helixtrans-57-53.8-178.6174.8-99.9000111.8P269 L270 S275 L276 D277P269-Y273 PolarHBondContact O-N 2.94Å; L270-Y273 PolarHBondContact O-N 3.28Å; Y273-S275 VanDerWaalsContact C-N 3.33Å; Y273-S275 PolarHBondContact O-N 3.34Å; Y273-L276 PolarHBondContact O-N 3.26Å; Y273-D277 WeakPolarHBondContact O-CB 3.3Å; Y273-D277 PolarHBondContact O-N 3.38Å
274F77.4Confident75.5Confident50 Ų5043.8 Ų43.822%0.21921%0.209CC..Hα-helixtrans-67.4-34.8-179.6-72.1-67.7000112.4V225 I226 L229 L270 Y272 A278V225-F274 HydrophobicContact CG1-CD1 4.12Å; V225-F274 HydrophobicContact CG1-CD2 3.85Å; V225-F274 HydrophobicContact CG1-CE1 4.11Å; V225-F274 HydrophobicContact CG1-CE2 3.86Å; V225-F274 HydrophobicContact CG1-CG 4Å; V225-F274 HydrophobicContact CG1-CZ 3.99Å; I226-F274 HydrophobicContact CD1-CB 4.41Å; I226-F274 HydrophobicContact CG1-CB 3.77Å; L229-F274 HydrophobicContact CD1-CD2 3.57Å; L229-F274 HydrophobicContact CD1-CE2 3.96Å; L270-F274 WeakPolarHBondContact O-CD2 3.3Å; L270-F274 PolarHBondContact O-N 3.18Å; L270-F274 VanDerWaalsContact O-N 3.07Å; Y272-F274 PolarHBondContact O-N 3.5Å; F274-A278 VanDerWaalsContact O-CB 3.27Å; F274-A278 WeakPolarHBondContact O-CB 3.37Å; F274-A278 PolarHBondContact O-N 2.97Å
275S74.6Confident74.3Confident1 Ų146.7 Ų46.71%0.00723%0.225CC..Hα-helixtrans-62.9-44.6174.3-85.90000112.8R114 C271 Y272 Y273 F279R114-S275 PolarHBondContact NH2-O 2.91Å; R114-S275 PolarHBondContact NH2-OG 2.91Å; C271-S275 WeakPolarHBondContact O-CB 3.4Å; C271-S275 PolarHBondContact O-N 3.32Å; C271-S275 PolarHBondContact O-OG 3.34Å; Y272-S275 PolarHBondContact O-N 3.05Å; Y273-S275 VanDerWaalsContact C-N 3.33Å; Y273-S275 PolarHBondContact O-N 3.34Å; S275-F279 WeakPolarHBondContact O-CB 3.34Å; S275-F279 PolarHBondContact O-N 2.68Å; S275-F279 VanDerWaalsContact O-N 3.12Å
276L71.9Confident73.2Confident24 Ų2452.1 Ų52.113%0.12625%0.25CC..Hα-helixtrans-71.6-45.7-179.1-70168.6000110.5L42 M56 Y272 Y273 A278 F279 W280L42-L276 HydrophobicContact CD2-CD1 4.07Å; L42-L276 HydrophobicContact CD2-CD2 4.16Å; M56-L276 HydrophobicContact CE-CD2 3.92Å; M56-L276 HydrophobicContact CE-CG 4.32Å; Y272-L276 WeakPolarHBondContact O-CB 3.48Å; Y272-L276 VanDerWaalsContact O-CG 3.25Å; Y272-L276 WeakPolarHBondContact O-CG 3.4Å; Y272-L276 PolarHBondContact O-N 3.33Å; Y273-L276 PolarHBondContact O-N 3.26Å; L276-A278 PolarHBondContact O-N 3.38Å; L276-F279 WeakPolarHBondContact O-CB 3.09Å; L276-F279 PolarHBondContact O-N 3Å; L276-F279 VanDerWaalsContact O-N 3.1Å; L276-W280 PolarHBondContact O-N 2.95Å
277D71.4Confident72.1Confident58 Ų5854.8 Ų54.831%0.3126%0.262SS..Hα-helixtrans-56.3-48.9176.7179.165.1000111.7N222 Y273 F279 W280 K281N222-D277 PolarHBondContact ND2-OD2 3.34Å; Y273-D277 WeakPolarHBondContact O-CB 3.3Å; Y273-D277 PolarHBondContact O-N 3.38Å; D277-F279 VanDerWaalsContact C-N 3.28Å; D277-F279 PolarHBondContact O-N 2.65Å; D277-W280 PolarHBondContact O-N 2.66Å; D277-K281 VanDerWaalsContact O-CB 3.28Å; D277-K281 WeakPolarHBondContact O-CB 3.37Å; D277-K281 PolarHBondContact O-N 3.43Å
278A63.9Low71.3Confident18 Ų1860.1 Ų60.115%0.14928%0.279CS..Hα-helixtrans-60.4-38.4177.200000112.4I226 F274 L276 K282I226-A278 HydrophobicContact CD1-CB 4.31Å; F274-A278 VanDerWaalsContact O-CB 3.27Å; F274-A278 WeakPolarHBondContact O-CB 3.37Å; F274-A278 PolarHBondContact O-N 2.97Å; L276-A278 PolarHBondContact O-N 3.38Å; A278-K282 WeakPolarHBondContact O-CB 3.46Å; A278-K282 PolarHBondContact O-N 2.91Å; A278-K282 VanDerWaalsContact O-N 3.13Å
279F63.5Low70.7Confident61 Ų6164 Ų6427%0.26830%0.299SS..Hα-helixtrans-67.1-46.4176.7178.2-94.2000112.2S275 L276 D277 K282 K283S275-F279 WeakPolarHBondContact O-CB 3.34Å; S275-F279 PolarHBondContact O-N 2.68Å; S275-F279 VanDerWaalsContact O-N 3.12Å; L276-F279 WeakPolarHBondContact O-CB 3.09Å; L276-F279 PolarHBondContact O-N 3Å; L276-F279 VanDerWaalsContact O-N 3.1Å; D277-F279 VanDerWaalsContact C-N 3.28Å; D277-F279 PolarHBondContact O-N 2.65Å; F279-K282 PolarHBondContact O-N 3.49Å; F279-K283 HydrophobicContact CE1-CD 4.38Å; F279-K283 WeakPolarHBondContact O-CB 3.26Å; F279-K283 PolarHBondContact O-N 2.73Å
280W60.6Low70.3Confident107 Ų10769.7 Ų69.741%0.40532%0.323SS..Hα-helixtrans-66.4-40.8179.9-77.4110000112.3H46 L276 D277 K282 K283 S284H46-W280 AromaticContact CE1-CE2 3.56Å; H46-W280 AromaticContact CE1-CZ2 3.63Å; H46-W280 AromaticContact CE1-NE1 2.95Å; H46-W280 PolarHBondContact CE1-NE1 3.49Å; H46-W280 AromaticContact ND1-CE2 3.55Å; H46-W280 AromaticContact ND1-CZ2 3.33Å; H46-W280 VanDerWaalsContact ND1-CZ2 3.33Å; H46-W280 WeakPolarHBondContact ND1-CZ2 3.05Å; H46-W280 AromaticContact ND1-NE1 3.23Å; H46-W280 PolarHBondContact ND1-NE1 3.27Å; L276-W280 PolarHBondContact O-N 2.95Å; D277-W280 PolarHBondContact O-N 2.66Å; W280-K282 PolarHBondContact O-N 2.73Å; W280-K283 HydrophobicContact CE3-CD 4.44Å; W280-K283 HydrophobicContact CZ3-CD 4.34Å; W280-K283 PolarHBondContact O-N 2.96Å; W280-S284 WeakPolarHBondContact O-CB 3.25Å; W280-S284 PolarHBondContact O-N 3.48Å; W280-S284 PolarHBondContact O-OG 3.47Å
281K64.1Low70.5Confident50 Ų5074.7 Ų74.722%0.21734%0.336CS..Hα-helixtrans-58.8-48.7174.4-165.2172.3-173.8171.80110.9N218 D277 K283 S284 D285N218-K281 PolarHBondContact O-NZ 3.43Å; D277-K281 VanDerWaalsContact O-CB 3.28Å; D277-K281 WeakPolarHBondContact O-CB 3.37Å; D277-K281 PolarHBondContact O-N 3.43Å; K281-K283 PolarHBondContact O-N 2.91Å; K281-S284 PolarHBondContact O-N 3.07Å; K281-S284 PolarHBondContact O-OG 3.34Å; K281-D285 PolarHBondContact O-N 3.4Å
282K63.9Low70.8Confident88 Ų8876.8 Ų76.838%0.38335%0.354SS..Hα-helixtrans-59.7-47.9176.2-177.3173.8178.3173.80112.5A278 F279 W280 S284 D285 E286A278-K282 WeakPolarHBondContact O-CB 3.46Å; A278-K282 PolarHBondContact O-N 2.91Å; A278-K282 VanDerWaalsContact O-N 3.13Å; F279-K282 PolarHBondContact O-N 3.49Å; W280-K282 PolarHBondContact O-N 2.73Å; K282-S284 VanDerWaalsContact C-N 3.28Å; K282-S284 PolarHBondContact O-N 3.11Å; K282-D285 PolarHBondContact O-N 2.98Å; K282-E286 WeakPolarHBondContact CE-OE1 3.18Å; K282-E286 PolarHBondContact O-N 3.48Å
283K63.3Low71.1Confident81 Ų8181.6 Ų81.635%0.35238%0.375SS..Hα-helixtrans-61-38.9178-175.4176.1179.3179.50111.8F279 W280 K281 L287F279-K283 HydrophobicContact CE1-CD 4.38Å; F279-K283 WeakPolarHBondContact O-CB 3.26Å; F279-K283 PolarHBondContact O-N 2.73Å; W280-K283 HydrophobicContact CE3-CD 4.44Å; W280-K283 HydrophobicContact CZ3-CD 4.34Å; W280-K283 PolarHBondContact O-N 2.96Å; K281-K283 PolarHBondContact O-N 2.91Å; K283-L287 HydrophobicContact CG-CD1 4.13Å; K283-L287 WeakPolarHBondContact O-CB 3.31Å; K283-L287 VanDerWaalsContact O-CG 3.31Å; K283-L287 WeakPolarHBondContact O-CG 3.24Å; K283-L287 PolarHBondContact O-N 3.5Å
284S61.4Low71.4Confident53 Ų5381.4 Ų81.437%0.37138%0.377SS..Hα-helixtrans-65.1-40.8176.778.80000111.9W280 K281 K282 L287 R288W280-S284 WeakPolarHBondContact O-CB 3.25Å; W280-S284 PolarHBondContact O-N 3.48Å; W280-S284 PolarHBondContact O-OG 3.47Å; K281-S284 PolarHBondContact O-N 3.07Å; K281-S284 PolarHBondContact O-OG 3.34Å; K282-S284 VanDerWaalsContact C-N 3.28Å; K282-S284 PolarHBondContact O-N 3.11Å; S284-L287 PolarHBondContact O-N 3.37Å; S284-R288 WeakPolarHBondContact O-CB 3.36Å; S284-R288 VanDerWaalsContact O-CG 3.25Å; S284-R288 WeakPolarHBondContact O-CG 3.39Å; S284-R288 PolarHBondContact O-N 3.2Å
285D66.6Low71.8Confident61 Ų6186.2 Ų86.233%0.32640%0.395SS..Hα-helixtrans-69.1-41177.9-72.3-26.6000111.5K281 K282 R288 D289K281-D285 PolarHBondContact O-N 3.4Å; K282-D285 PolarHBondContact O-N 2.98Å; D285-R288 WeakPolarHBondContact O-CB 3.37Å; D285-R288 PolarHBondContact O-N 3.03Å; D285-R288 IonicContact OD1-NH1 3.88Å; D285-D289 PolarHBondContact O-N 3.43Å
286E66.8Low72.5Confident117 Ų11790.4 Ų90.455%0.54742%0.416SS..Hα-helixtrans-62.1-42.7173.9-75.3177.2-174.300112.2K282 R288 D289 F290K282-E286 WeakPolarHBondContact CE-OE1 3.18Å; K282-E286 PolarHBondContact O-N 3.48Å; E286-R288 VanDerWaalsContact C-N 3.32Å; E286-R288 PolarHBondContact O-N 3.43Å; E286-D289 PolarHBondContact O-N 3.37Å; E286-F290 WeakPolarHBondContact O-CB 3.25Å; E286-F290 PolarHBondContact O-N 2.84Å
287L65.5Low73.4Confident85 Ų8597.1 Ų97.145%0.44544%0.44SS..Hα-helixtrans-64.4-37.7175.5-77.7166.8000111.9K283 S284 R291K283-L287 HydrophobicContact CG-CD1 4.13Å; K283-L287 WeakPolarHBondContact O-CB 3.31Å; K283-L287 VanDerWaalsContact O-CG 3.31Å; K283-L287 WeakPolarHBondContact O-CG 3.24Å; K283-L287 PolarHBondContact O-N 3.5Å; S284-L287 PolarHBondContact O-N 3.37Å; L287-R291 WeakPolarHBondContact O-CB 3.5Å; L287-R291 VanDerWaalsContact O-CG 3.28Å; L287-R291 WeakPolarHBondContact O-CG 3.47Å; L287-R291 PolarHBondContact O-N 2.79Å
288R70.8Confident74.3Confident158 Ų158101.1 Ų101.160%0.59645%0.454SS*.Hα-helixtrans-65.5-46.8175.2-75.7173.567.8-178.47111.6S284 D285 E286 R291 A292S284-R288 WeakPolarHBondContact O-CB 3.36Å; S284-R288 VanDerWaalsContact O-CG 3.25Å; S284-R288 WeakPolarHBondContact O-CG 3.39Å; S284-R288 PolarHBondContact O-N 3.2Å; D285-R288 WeakPolarHBondContact O-CB 3.37Å; D285-R288 PolarHBondContact O-N 3.03Å; D285-R288 IonicContact OD1-NH1 3.88Å; E286-R288 VanDerWaalsContact C-N 3.32Å; E286-R288 PolarHBondContact O-N 3.43Å; R288-R291 PolarHBondContact O-N 3.31Å; R288-A292 WeakPolarHBondContact O-CB 3.28Å; R288-A292 PolarHBondContact O-N 3.47Å
289D75.6Confident75.5Confident80 Ų80104.4 Ų104.443%0.42847%0.469SS..Hα-helixtrans-61.6-43.6176.7178.260.3000111.6D285 E286 R291 A292 K293D285-D289 PolarHBondContact O-N 3.43Å; E286-D289 PolarHBondContact O-N 3.37Å; D289-R291 PolarHBondContact O-N 3.45Å; D289-A292 PolarHBondContact O-N 3.29Å; D289-K293 WeakPolarHBondContact O-CB 3.32Å; D289-K293 WeakPolarHBondContact O-CG 3.49Å; D289-K293 PolarHBondContact O-N 3.48Å; D289-K293 WeakPolarHBondContact OD1-CE 3.14Å; D289-K293 IonicContact OD1-NZ 2.76Å; D289-K293 WeakPolarHBondContact OD2-CE 3.26Å; D289-K293 IonicContact OD2-NZ 3.61Å; D289-K293 PolarHBondContact OD2-NZ 3.37Å
290F76.4Confident76.8Confident135 Ų135107.1 Ų107.159%0.59248%0.483SS*.Hα-helixtrans-61.1-44.7175.7-176.7-98.2000112.3E286 K293 K294E286-F290 WeakPolarHBondContact O-CB 3.25Å; E286-F290 PolarHBondContact O-N 2.84Å; F290-K293 PolarHBondContact O-N 2.85Å; F290-K294 WeakPolarHBondContact O-CB 3.27Å; F290-K294 PolarHBondContact O-N 3.45Å
291R82.8Confident78.3Confident182 Ų182108.1 Ų108.169%0.68749%0.492SS*.Hα-helixtrans-62.8-43.3175.3-74.8178.5-169.2-175.13.9111.6L287 R288 D289 K294 Y295L287-R291 WeakPolarHBondContact O-CB 3.5Å; L287-R291 VanDerWaalsContact O-CG 3.28Å; L287-R291 WeakPolarHBondContact O-CG 3.47Å; L287-R291 PolarHBondContact O-N 2.79Å; R288-R291 PolarHBondContact O-N 3.31Å; D289-R291 PolarHBondContact O-N 3.45Å; R291-K294 PolarHBondContact O-N 3.3Å; R291-Y295 WeakPolarHBondContact O-CB 3.23Å; R291-Y295 PolarHBondContact O-N 3.19Å
292A83.6Confident79.5Confident47 Ų47109.9 Ų109.939%0.38851%0.507SS..Hα-helixtrans-61-47.3176.600000111.5R288 D289 K294 Y295 I296R288-A292 WeakPolarHBondContact O-CB 3.28Å; R288-A292 PolarHBondContact O-N 3.47Å; D289-A292 PolarHBondContact O-N 3.29Å; A292-K294 VanDerWaalsContact C-N 3.34Å; A292-K294 PolarHBondContact O-N 3.48Å; A292-Y295 PolarHBondContact O-N 2.97Å; A292-I296 WeakPolarHBondContact O-CG1 3.46Å; A292-I296 PolarHBondContact O-N 2.79Å
293K87.7Confident80.7Confident105 Ų105113.3 Ų113.346%0.45752%0.519SS..Hα-helixtrans-60.4-41.2175.5-76.1172.2177.3163.40112.4D289 F290 Y295 I296 R297D289-K293 WeakPolarHBondContact O-CB 3.32Å; D289-K293 WeakPolarHBondContact O-CG 3.49Å; D289-K293 PolarHBondContact O-N 3.48Å; D289-K293 WeakPolarHBondContact OD1-CE 3.14Å; D289-K293 IonicContact OD1-NZ 2.76Å; D289-K293 WeakPolarHBondContact OD2-CE 3.26Å; D289-K293 IonicContact OD2-NZ 3.61Å; D289-K293 PolarHBondContact OD2-NZ 3.37Å; F290-K293 PolarHBondContact O-N 2.85Å; K293-Y295 VanDerWaalsContact C-N 3.35Å; K293-I296 PolarHBondContact O-N 3.15Å; K293-R297 WeakPolarHBondContact O-CG 3.47Å; K293-R297 PolarHBondContact O-N 2.99Å
294K88.6Confident82.1Confident148 Ų148116.9 Ų116.964%0.64353%0.534SS*.Hα-helixtrans-63.2-41.4175.7-171.7176.7-178.7178.40111.5F290 R291 A292 K298F290-K294 WeakPolarHBondContact O-CB 3.27Å; F290-K294 PolarHBondContact O-N 3.45Å; R291-K294 PolarHBondContact O-N 3.3Å; A292-K294 VanDerWaalsContact C-N 3.34Å; A292-K294 PolarHBondContact O-N 3.48Å; K294-K298 PolarHBondContact O-N 3.38Å
295Y85.6Confident83.5Confident151 Ų151118.4 Ų118.459%0.59254%0.541SS*.Hα-helixtrans-66.4-45176.9-171.7-104.8000112.2R291 A292 K293 R297 K298 L299R291-Y295 WeakPolarHBondContact O-CB 3.23Å; R291-Y295 PolarHBondContact O-N 3.19Å; A292-Y295 PolarHBondContact O-N 2.97Å; K293-Y295 VanDerWaalsContact C-N 3.35Å; Y295-R297 PolarHBondContact O-N 2.73Å; Y295-K298 PolarHBondContact O-N 3.33Å; Y295-L299 HydrophobicContact CD1-CD1 3.77Å; Y295-L299 HydrophobicContact CD1-CG 4.32Å; Y295-L299 HydrophobicContact CE1-CD1 3.4Å; Y295-L299 VanDerWaalsContact CE1-CD1 3.4Å; Y295-L299 HydrophobicContact CE1-CG 4.01Å; Y295-L299 PolarHBondContact O-N 2.76Å
296I89.3Confident84.6Confident90 Ų90121 Ų12146%0.46255%0.551SS.*Hα-helixtrans-60.7-43.9177-69.3168.5000111.3A292 K293 K298 L299 Q300A292-I296 WeakPolarHBondContact O-CG1 3.46Å; A292-I296 PolarHBondContact O-N 2.79Å; K293-I296 PolarHBondContact O-N 3.15Å; I296-K298 VanDerWaalsContact C-N 3.31Å; I296-K298 PolarHBondContact O-N 3.13Å; I296-L299 PolarHBondContact O-N 3.21Å; I296-Q300 HydrophobicContact CG2-CG 4.36Å; I296-Q300 WeakPolarHBondContact O-CG 3.37Å; I296-Q300 PolarHBondContact O-N 3.03Å
297R89.8Confident85.7Confident165 Ų165121.2 Ų121.262%0.62355%0.55SS**Hα-helixtrans-58.6-43.7175.6-74.8-178.7-166.3175.12.7111.9K293 Y295 L299 Q300 E301K293-R297 WeakPolarHBondContact O-CG 3.47Å; K293-R297 PolarHBondContact O-N 2.99Å; Y295-R297 PolarHBondContact O-N 2.73Å; R297-L299 VanDerWaalsContact C-N 3.35Å; R297-L299 PolarHBondContact O-N 3.45Å; R297-Q300 PolarHBondContact O-N 3.46Å; R297-E301 WeakPolarHBondContact O-CG 3.37Å; R297-E301 PolarHBondContact O-N 3.02Å
298K91.5Very high86.9Confident141 Ų141120.8 Ų120.861%0.61355%0.551SS**Hα-helixtrans-63.6-39.8177.8-166.7176.3-177.6-177.40112.1K294 Y295 I296 T302K294-K298 PolarHBondContact O-N 3.38Å; Y295-K298 PolarHBondContact O-N 3.33Å; I296-K298 VanDerWaalsContact C-N 3.31Å; I296-K298 PolarHBondContact O-N 3.13Å; K298-T302 PolarHBondContact O-N 3.45Å; K298-T302 PolarHBondContact O-OG1 3.4Å
299L89.3Confident87.8Confident88 Ų88117.7 Ų117.746%0.46155%0.546SS..Hα-helixtrans-64.5-42.2173.6-76.1175.3000112.1Y295 I296 R297 T302 Y303Y295-L299 HydrophobicContact CD1-CD1 3.77Å; Y295-L299 HydrophobicContact CD1-CG 4.32Å; Y295-L299 HydrophobicContact CE1-CD1 3.4Å; Y295-L299 VanDerWaalsContact CE1-CD1 3.4Å; Y295-L299 HydrophobicContact CE1-CG 4.01Å; Y295-L299 PolarHBondContact O-N 2.76Å; I296-L299 PolarHBondContact O-N 3.21Å; R297-L299 VanDerWaalsContact C-N 3.35Å; R297-L299 PolarHBondContact O-N 3.45Å; L299-T302 PolarHBondContact O-N 3.07Å; L299-Y303 WeakPolarHBondContact O-CB 3.31Å; L299-Y303 PolarHBondContact O-N 3.38Å
300Q90.3Very high88.4Confident118 Ų118119.5 Ų119.555%0.55155%0.552SS**Hα-helixtrans-64.2-39.9177.3-74.7177.8-37.400112.4I296 R297 K304I296-Q300 HydrophobicContact CG2-CG 4.36Å; I296-Q300 WeakPolarHBondContact O-CG 3.37Å; I296-Q300 PolarHBondContact O-N 3.03Å; R297-Q300 PolarHBondContact O-N 3.46Å; Q300-K304 WeakPolarHBondContact O-CB 3.35Å; Q300-K304 PolarHBondContact O-N 3.45Å
301E91.3Very high88.9Confident128 Ų128117.4 Ų117.460%0.59855%0.551SS**Hα-helixtrans-61.8-49.4173-75.5169.1-176.400111R297 Y303 K304 T305R297-E301 WeakPolarHBondContact O-CG 3.37Å; R297-E301 PolarHBondContact O-N 3.02Å; E301-Y303 PolarHBondContact O-N 3.04Å; E301-K304 WeakPolarHBondContact O-CB 3.37Å; E301-K304 PolarHBondContact O-N 3.43Å; E301-T305 PolarHBondContact O-N 3.02Å; E301-T305 PolarHBondContact O-OG1 3.47Å; E301-T305 VanDerWaalsContact O-OG1 3.07Å
302T89.9Confident89.2Confident86 Ų86114 Ų11453%0.52854%0.542SS..Hα-helixtrans-60.5-44.3179.1-51.20000111.8K298 L299 T305 H306K298-T302 PolarHBondContact O-N 3.45Å; K298-T302 PolarHBondContact O-OG1 3.4Å; L299-T302 PolarHBondContact O-N 3.07Å; T302-T305 PolarHBondContact O-N 3.44Å; T302-H306 PolarHBondContact O-N 2.66Å
303Y89.2Confident89.3Confident161 Ų161114.2 Ų114.263%0.63154%0.544SS*.Hα-helixtrans-63.5-41.8177.6179.1-102000112.2L299 E301 H306 K307L299-Y303 WeakPolarHBondContact O-CB 3.31Å; L299-Y303 PolarHBondContact O-N 3.38Å; E301-Y303 PolarHBondContact O-N 3.04Å; Y303-H306 PolarHBondContact O-N 3.44Å; Y303-K307 WeakPolarHBondContact O-CB 3.47Å; Y303-K307 PolarHBondContact O-N 3.49Å
304K91.6Very high89.2Confident155 Ų155115.5 Ų115.567%0.67455%0.552SS**Hα-helixtrans-58.5-48.9173.8-89.5-175.9174.9-177.30111.3Q300 E301 H306 K307 T308Q300-K304 WeakPolarHBondContact O-CB 3.35Å; Q300-K304 PolarHBondContact O-N 3.45Å; E301-K304 WeakPolarHBondContact O-CB 3.37Å; E301-K304 PolarHBondContact O-N 3.43Å; K304-H306 VanDerWaalsContact C-N 3.32Å; K304-H306 PolarHBondContact O-N 3.49Å; K304-K307 PolarHBondContact O-N 3.2Å; K304-T308 PolarHBondContact O-N 3.02Å; K304-T308 PolarHBondContact O-OG1 2.94Å; K304-T308 VanDerWaalsContact O-OG1 3.06Å
305T90.5Very high89Confident86 Ų86111.5 Ų111.553%0.52855%0.546SS..Hα-helixtrans-59-43.5178.2-50.40000111.7E301 T302 K307 T308 L309E301-T305 PolarHBondContact O-N 3.02Å; E301-T305 PolarHBondContact O-OG1 3.47Å; E301-T305 VanDerWaalsContact O-OG1 3.07Å; T302-T305 PolarHBondContact O-N 3.44Å; T305-K307 PolarHBondContact O-N 3.24Å; T305-T308 PolarHBondContact O-N 3.01Å; T305-L309 HydrophobicContact CG2-CD1 4.31Å; T305-L309 WeakPolarHBondContact O-CG 3.39Å; T305-L309 PolarHBondContact O-N 3.12Å
306H89.9Confident89Confident116 Ų116110.6 Ų110.654%0.53755%0.551SS.*Hα-helixtrans-65-39.6179.6-150.562.9000112.5T302 Y303 K304 L309 Q310T302-H306 PolarHBondContact O-N 2.66Å; Y303-H306 PolarHBondContact O-N 3.44Å; K304-H306 VanDerWaalsContact C-N 3.32Å; K304-H306 PolarHBondContact O-N 3.49Å; H306-L309 PolarHBondContact O-N 2.91Å; H306-Q310 PolarHBondContact O-N 3.08Å
307K90.3Very high88.8Confident121 Ų121109.9 Ų109.953%0.52655%0.551SS.*Hα-helixtrans-64.8-39.3176-167.7176.9-178.3-179.50112.1Y303 K304 T305 Q310 T311Y303-K307 WeakPolarHBondContact O-CB 3.47Å; Y303-K307 PolarHBondContact O-N 3.49Å; K304-K307 PolarHBondContact O-N 3.2Å; T305-K307 PolarHBondContact O-N 3.24Å; K307-Q310 PolarHBondContact O-N 3.02Å; K307-T311 PolarHBondContact O-N 3.3Å; K307-T311 VanDerWaalsContact O-N 3.13Å; K307-T311 PolarHBondContact O-OG1 3.47Å
308T90.1Very high88.5Confident75 Ų75106.8 Ų106.846%0.4655%0.547SS..Hα-helixtrans-62.7-48.2175.1-51.30000111.1K304 T305 Q310 T311 E312K304-T308 PolarHBondContact O-N 3.02Å; K304-T308 PolarHBondContact O-OG1 2.94Å; K304-T308 VanDerWaalsContact O-OG1 3.06Å; T305-T308 PolarHBondContact O-N 3.01Å; T308-Q310 VanDerWaalsContact C-N 3.35Å; T308-Q310 PolarHBondContact O-N 2.94Å; T308-T311 WeakPolarHBondContact O-CB 3.48Å; T308-T311 PolarHBondContact O-N 3.23Å; T308-E312 PolarHBondContact O-N 3.02Å
309L90.1Very high87.9Confident94 Ų94101.9 Ų101.949%0.49254%0.536SS..Hα-helixtrans-59.5-41.4177.9-72.3168000112.7T305 H306 T311 E312 A313T305-L309 HydrophobicContact CG2-CD1 4.31Å; T305-L309 WeakPolarHBondContact O-CG 3.39Å; T305-L309 PolarHBondContact O-N 3.12Å; H306-L309 PolarHBondContact O-N 2.91Å; L309-T311 VanDerWaalsContact C-N 3.31Å; L309-T311 PolarHBondContact O-N 3.47Å; L309-E312 PolarHBondContact O-N 3.12Å; L309-A313 WeakPolarHBondContact O-CB 3.43Å; L309-A313 PolarHBondContact O-N 3.01Å
310Q87.8Confident87.4Confident117 Ų117104.9 Ų104.955%0.54754%0.542SS..Hα-helixtrans-61.2-40.3174.1-82.2-176-30.700112.2H306 K307 T308 A313 Q314H306-Q310 PolarHBondContact O-N 3.08Å; K307-Q310 PolarHBondContact O-N 3.02Å; T308-Q310 VanDerWaalsContact C-N 3.35Å; T308-Q310 PolarHBondContact O-N 2.94Å; Q310-A313 PolarHBondContact O-N 3.11Å; Q310-Q314 WeakPolarHBondContact O-CB 3.19Å; Q310-Q314 PolarHBondContact O-N 2.74Å
311T88.3Confident86.5Confident92 Ų92106 Ų10656%0.56455%0.545SS*.Hα-helixtrans-67.8-41.9-179.5-45.30000111.2K307 T308 L309 Q314 A315K307-T311 PolarHBondContact O-N 3.3Å; K307-T311 VanDerWaalsContact O-N 3.13Å; K307-T311 PolarHBondContact O-OG1 3.47Å; T308-T311 WeakPolarHBondContact O-CB 3.48Å; T308-T311 PolarHBondContact O-N 3.23Å; L309-T311 VanDerWaalsContact C-N 3.31Å; L309-T311 PolarHBondContact O-N 3.47Å; T311-Q314 PolarHBondContact O-N 2.69Å; T311-A315 PolarHBondContact O-N 3.06Å
312E89.3Confident85.5Confident110 Ų110103.8 Ų103.851%0.51454%0.544SS..Hα-helixtrans-64-44174.8-71.3176172.800111.9T308 L309 Q314 A315 L316T308-E312 PolarHBondContact O-N 3.02Å; L309-E312 PolarHBondContact O-N 3.12Å; E312-Q314 PolarHBondContact O-N 2.91Å; E312-A315 PolarHBondContact O-N 2.94Å; E312-L316 WeakPolarHBondContact O-CG 3.46Å; E312-L316 PolarHBondContact O-N 2.99Å
313A85.3Confident84.6Confident51 Ų51109.5 Ų109.542%0.42156%0.556SS.*Hα-helixtrans-60.9-43.517600000111.9L309 Q310 A315 L316 V317L309-A313 WeakPolarHBondContact O-CB 3.43Å; L309-A313 PolarHBondContact O-N 3.01Å; Q310-A313 PolarHBondContact O-N 3.11Å; A313-A315 VanDerWaalsContact C-N 3.33Å; A313-A315 PolarHBondContact O-N 3.35Å; A313-L316 PolarHBondContact O-N 3.35Å; A313-V317 WeakPolarHBondContact O-CG2 3.34Å; A313-V317 PolarHBondContact O-N 3.34Å
314Q86.3Confident83.3Confident133 Ų133106.2 Ų106.262%0.62155%0.549SS*.Hα-helixtrans-62.2-40.6176.8-152.798.212.600111.8Q310 T311 E312 V317 N318Q310-Q314 WeakPolarHBondContact O-CB 3.19Å; Q310-Q314 PolarHBondContact O-N 2.74Å; T311-Q314 PolarHBondContact O-N 2.69Å; E312-Q314 PolarHBondContact O-N 2.91Å; Q314-V317 PolarHBondContact O-N 3.44Å; Q314-N318 WeakPolarHBondContact O-CB 3.48Å; Q314-N318 VanDerWaalsContact O-CG 3.25Å; Q314-N318 PolarHBondContact O-N 2.75Å; Q314-N318 PolarHBondContact O-ND2 3.14Å
315A84.4Confident81.7Confident64 Ų64103.4 Ų103.453%0.52955%0.549SS..Hα-helixtrans-65.4-40.4177.500000112.2T311 E312 A313 N318 G319T311-A315 PolarHBondContact O-N 3.06Å; E312-A315 PolarHBondContact O-N 2.94Å; A313-A315 VanDerWaalsContact C-N 3.33Å; A313-A315 PolarHBondContact O-N 3.35Å; A315-N318 PolarHBondContact O-N 2.93Å; A315-G319 PolarHBondContact O-N 2.74Å
316L85.6Confident80.1Confident131 Ų131103.3 Ų103.369%0.68656%0.557SS**Hα-helixtrans-63.4-44.4175.2-74.7169000112E312 A313 G319 Y320E312-L316 WeakPolarHBondContact O-CG 3.46Å; E312-L316 PolarHBondContact O-N 2.99Å; A313-L316 PolarHBondContact O-N 3.35Å; L316-G319 PolarHBondContact O-N 2.92Å; L316-Y320 PolarHBondContact O-N 3.43Å
317V84.2Confident78.3Confident76 Ų76109.9 Ų109.946%0.46159%0.585SS.*Hα-helixtrans-61-48.5176.71720000110.6A313 Q314 G319 Y320 F321A313-V317 WeakPolarHBondContact O-CG2 3.34Å; A313-V317 PolarHBondContact O-N 3.34Å; Q314-V317 PolarHBondContact O-N 3.44Å; V317-G319 VanDerWaalsContact C-N 3.33Å; V317-G319 PolarHBondContact O-N 2.85Å; V317-Y320 PolarHBondContact O-N 3.44Å; V317-F321 HydrophobicContact CG1-CD2 3.84Å; V317-F321 HydrophobicContact CG1-CE2 3.82Å; V317-F321 VanDerWaalsContact O-CD2 3.32Å; V317-F321 WeakPolarHBondContact O-CD2 3.22Å; V317-F321 PolarHBondContact O-N 3.11Å; V317-F321 VanDerWaalsContact O-N 3.09Å
318N82.9Confident77.7Confident100 Ų100109.4 Ų109.454%0.53559%0.588SS.*Hα-helixtrans-62.1-39.2178.3-69.9-13.1000112.4Q314 A315 S322Q314-N318 WeakPolarHBondContact O-CB 3.48Å; Q314-N318 VanDerWaalsContact O-CG 3.25Å; Q314-N318 PolarHBondContact O-N 2.75Å; Q314-N318 PolarHBondContact O-ND2 3.14Å; A315-N318 PolarHBondContact O-N 2.93Å; N318-S322 WeakPolarHBondContact O-CB 3.08Å; N318-S322 PolarHBondContact O-N 3.43Å
319G80.2Confident77Confident38 Ų38111.2 Ų111.239%0.39259%0.594SS.*Hα-helixtrans-65.9-37.217600000113.5A315 L316 V317 R323A315-G319 PolarHBondContact O-N 2.74Å; L316-G319 PolarHBondContact O-N 2.92Å; V317-G319 VanDerWaalsContact C-N 3.33Å; V317-G319 PolarHBondContact O-N 2.85Å; G319-R323 PolarHBondContact O-N 3.34Å; G319-R323 VanDerWaalsContact O-N 3.15Å
320Y77.1Confident76.3Confident151 Ų151112.1 Ų112.159%0.59260%0.6SS**Hα-helixtrans-64.8-47.4175-176.8-96.8000111.7L316 V317 S322 R323 N324L316-Y320 PolarHBondContact O-N 3.43Å; V317-Y320 PolarHBondContact O-N 3.44Å; Y320-S322 PolarHBondContact O-N 3.37Å; Y320-R323 PolarHBondContact O-N 2.94Å; Y320-N324 WeakPolarHBondContact CE1-ND2 3.34Å; Y320-N324 PolarHBondContact O-N 3.45Å; Y320-N324 VanDerWaalsContact O-N 3.14Å; Y320-N324 PolarHBondContact OH-ND2 3.37Å
321F72.1Confident75.6Confident141 Ų141111.8 Ų111.862%0.61860%0.603SS**Hα-helixtrans-63.2-41.2176.8-83.1-74.2000112.5V317 R323 N324 S325V317-F321 HydrophobicContact CG1-CD2 3.84Å; V317-F321 HydrophobicContact CG1-CE2 3.82Å; V317-F321 VanDerWaalsContact O-CD2 3.32Å; V317-F321 WeakPolarHBondContact O-CD2 3.22Å; V317-F321 PolarHBondContact O-N 3.11Å; V317-F321 VanDerWaalsContact O-N 3.09Å; F321-R323 VanDerWaalsContact C-N 3.3Å; F321-R323 PolarHBondContact O-N 3.3Å; F321-N324 PolarHBondContact O-N 3.06Å; F321-S325 WeakPolarHBondContact O-CB 3.45Å; F321-S325 PolarHBondContact O-N 3.49Å; F321-S325 PolarHBondContact O-OG 3.49Å; F321-S325 VanDerWaalsContact O-OG 3.11Å
322S70.3Confident74.8Confident82 Ų82113.1 Ų113.157%0.57361%0.606SS**Hα-helixtrans-64.3-30.5176.9-178.20000113.7N318 Y320 S325N318-S322 WeakPolarHBondContact O-CB 3.08Å; N318-S322 PolarHBondContact O-N 3.43Å; Y320-S322 PolarHBondContact O-N 3.37Å; S322-S325 PolarHBondContact O-OG 2.99Å
323R70.2Confident73.8Confident206 Ų206113.3 Ų113.378%0.77761%0.612SS**Hα-helixtrans-75.7-36.6175.3-90.4-175.8177179.7-0.1112.5G319 Y320 F321G319-R323 PolarHBondContact O-N 3.34Å; G319-R323 VanDerWaalsContact O-N 3.15Å; Y320-R323 PolarHBondContact O-N 2.94Å; F321-R323 VanDerWaalsContact C-N 3.3Å; F321-R323 PolarHBondContact O-N 3.3Å
324N62.6Low73Confident91 Ų91117.7 Ų117.749%0.48763%0.625SS.*Hα-helixtrans-82.6-15.3-178.8-77.4-5.1000113.9Y320 F321 A326Y320-N324 WeakPolarHBondContact CE1-ND2 3.34Å; Y320-N324 PolarHBondContact O-N 3.45Å; Y320-N324 VanDerWaalsContact O-N 3.14Å; Y320-N324 PolarHBondContact OH-ND2 3.37Å; F321-N324 PolarHBondContact O-N 3.06Å; N324-A326 VanDerWaalsContact C-N 3.35Å
325S59Low72Confident96 Ų96116.5 Ų116.567%0.67163%0.626SS**THydrogen-bonded Turntrans-86.8-1.6173.3600000114.3F321 S322F321-S325 WeakPolarHBondContact O-CB 3.45Å; F321-S325 PolarHBondContact O-N 3.49Å; F321-S325 PolarHBondContact O-OG 3.49Å; F321-S325 VanDerWaalsContact O-OG 3.11Å; S322-S325 PolarHBondContact O-OG 2.99Å
326A56.5Low71Confident84 Ų84120.9 Ų120.969%0.69463%0.634SS**THydrogen-bonded Turntrans-100.39-179.900000113.4N324N324-A326 VanDerWaalsContact C-N 3.35Å
327F50.8Low69.6Low255 Ų255120 Ų120100%1.11863%0.629SS**  trans-112.10171.8-100.9-84.7000110.2

Retrieved 327 of 327 residues in 103 ms (Link to these results)

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