A0A3Q0KFH8_SCHMA Loading...

F-box domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KFH8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 380 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
1M45.6Very low71.6Confident234 Ų234106.9 Ų106.9100%1.15363%0.628SS**  0129.40-75.5-174.1141.100107.5
2P55Low73Confident115 Ų115103.7 Ų103.775%0.74761%0.605SS**PPolyproline II helixtrans-58.4137.816927.1-31000107.7C4P2-C4 PolarHBondContact O-N 3.48Å
3P58.4Low74.3Confident118 Ų118105.2 Ų105.277%0.76660%0.603SS**PPolyproline II helixtrans-56130.8177.422.9-31.2000108.5S5P3-S5 PolarHBondContact O-N 3.24Å; P3-S5 VanDerWaalsContact O-N 3.12Å
4C53.1Low75.6Confident115 Ų115104.4 Ų104.478%0.77760%0.595SS**PPolyproline II helixtrans-51.4120.2174.2-56.90000108.3P2 N6P2-C4 PolarHBondContact O-N 3.48Å; C4-N6 PolarHBondContact O-N 3.46Å; C4-N6 VanDerWaalsContact O-N 3.09Å
5S69.2Low76.7Confident107 Ų10797.5 Ų97.575%0.74856%0.556SS**PPolyproline II helixtrans-53.5117.6178.4-490000109.2P3P3-S5 PolarHBondContact O-N 3.24Å; P3-S5 VanDerWaalsContact O-N 3.12Å
6N80.8Confident77.7Confident97 Ų9793.3 Ų93.352%0.51953%0.53SS..PPolyproline II helixtrans-70.8145.5-179.5-61.7-67.6000109C4 V8 D9C4-N6 PolarHBondContact O-N 3.46Å; C4-N6 VanDerWaalsContact O-N 3.09Å; N6-V8 HydrophobicContact CB-CG2 3.69Å; N6-V8 PolarHBondContact O-N 3.37Å; N6-V8 VanDerWaalsContact O-N 3.09Å; N6-D9 VanDerWaalsContact CB-OD2 3.31Å; N6-D9 WeakPolarHBondContact CB-OD2 3.48Å; N6-D9 PolarHBondContact N-OD2 3.35Å; N6-D9 PolarHBondContact ND2-OD2 3.46Å; N6-D9 WeakPolarHBondContact O-CB 3.48Å; N6-D9 PolarHBondContact O-N 3.48Å
7I83Confident78.7Confident78 Ų7893.8 Ų93.840%0.453%0.527SS..G310 helixtrans-58.8-25176.3-170163.7000112.7D9 L10 V15 F37I7-D9 VanDerWaalsContact C-N 3.26Å; I7-D9 PolarHBondContact O-N 2.94Å; I7-L10 PolarHBondContact O-N 3.47Å; I7-V15 HydrophobicContact CG1-CG2 4.34Å; I7-F37 HydrophobicContact CD1-CZ 4.07Å; I7-F37 HydrophobicContact CG1-CE1 4.46Å; I7-F37 HydrophobicContact CG1-CZ 4.45Å; I7-F37 HydrophobicContact CG2-CE1 3.94Å; I7-F37 HydrophobicContact CG2-CZ 3.87Å
8V83.1Confident79.5Confident69 Ų6993 Ų9342%0.41852%0.524SS..G310 helixtrans-73.4-16.7176-620000113.4N6 L10 F36N6-V8 HydrophobicContact CB-CG2 3.69Å; N6-V8 PolarHBondContact O-N 3.37Å; N6-V8 VanDerWaalsContact O-N 3.09Å; V8-L10 VanDerWaalsContact C-N 3.35Å; V8-F36 HydrophobicContact CB-CD1 4.22Å; V8-F36 HydrophobicContact CG1-CB 4.43Å; V8-F36 HydrophobicContact CG1-CD1 3.99Å; V8-F36 HydrophobicContact CG1-CG 4.49Å
9D84.8Confident80.3Confident106 Ų10688.5 Ų88.557%0.56750%0.499SS*.G310 helixtrans-86.9-10.1177.7-55.8-36000111.7N6 I7N6-D9 VanDerWaalsContact CB-OD2 3.31Å; N6-D9 WeakPolarHBondContact CB-OD2 3.48Å; N6-D9 PolarHBondContact N-OD2 3.35Å; N6-D9 PolarHBondContact ND2-OD2 3.46Å; N6-D9 WeakPolarHBondContact O-CB 3.48Å; N6-D9 PolarHBondContact O-N 3.48Å; I7-D9 VanDerWaalsContact C-N 3.26Å; I7-D9 PolarHBondContact O-N 2.94Å
10L86Confident80.9Confident61 Ų6189.8 Ų89.832%0.31950%0.498SS..SBendtrans-72.8142.7174.6-91.267.5000110.6I7 V8 L12 L14 V15I7-L10 PolarHBondContact O-N 3.47Å; V8-L10 VanDerWaalsContact C-N 3.35Å; L10-L12 PolarHBondContact O-N 3.05Å; L10-L14 HydrophobicContact CD2-CB 4.17Å; L10-L14 HydrophobicContact CD2-CD1 4.26Å; L10-L14 HydrophobicContact CG-CD1 4.33Å; L10-V15 HydrophobicContact CB-CG2 3.82Å
11P88.7Confident81.5Confident76 Ų7695.4 Ų95.449%0.49451%0.514SS..  trans-49.6137.6168.3-28.233.4000112.3Q13 L14 V15P11-Q13 PolarHBondContact O-N 3.47Å; P11-L14 HydrophobicContact CB-CG 4.46Å; P11-L14 HydrophobicContact CG-CD1 4.38Å; P11-L14 PolarHBondContact O-N 3.22Å; P11-V15 PolarHBondContact O-N 2.98Å
12L88.7Confident84Confident68 Ų6887.3 Ų87.336%0.35648%0.475SS..Hα-helixtrans-45.7-40.2-179.2-17285.8000112.4L10 L14 V15 E16 F36 V39 V40L10-L12 PolarHBondContact O-N 3.05Å; L12-L14 PolarHBondContact O-N 3.41Å; L12-V15 PolarHBondContact O-N 3.32Å; L12-E16 WeakPolarHBondContact O-CB 3.47Å; L12-E16 PolarHBondContact O-N 3.34Å; L12-F36 HydrophobicContact CD1-CE2 3.98Å; L12-F36 HydrophobicContact CD1-CZ 4.42Å; L12-V39 HydrophobicContact CD1-CG1 4.34Å; L12-V40 HydrophobicContact CD1-CB 4.45Å; L12-V40 HydrophobicContact CD1-CG2 3.34Å; L12-V40 HydrophobicContact CG-CG2 4.17Å
13Q90.2Very high86Confident124 Ų12483.8 Ų83.858%0.57945%0.452SS*.Hα-helixtrans-64.1-38.2-178.6-61.882.6-8.300112.2P11 E16 Q17P11-Q13 PolarHBondContact O-N 3.47Å; Q13-E16 PolarHBondContact O-N 3.39Å; Q13-Q17 WeakPolarHBondContact O-CG 3.44Å; Q13-Q17 PolarHBondContact O-N 3.34Å
14L92.2Very high87.9Confident93 Ų9379.9 Ų79.949%0.48742%0.423SS..Hα-helixtrans-68.3-43.2178.8-65.9-175.1000110.6L10 P11 L12 E16 Q17 V18L10-L14 HydrophobicContact CD2-CB 4.17Å; L10-L14 HydrophobicContact CD2-CD1 4.26Å; L10-L14 HydrophobicContact CG-CD1 4.33Å; P11-L14 HydrophobicContact CB-CG 4.46Å; P11-L14 HydrophobicContact CG-CD1 4.38Å; P11-L14 PolarHBondContact O-N 3.22Å; L12-L14 PolarHBondContact O-N 3.41Å; L14-E16 VanDerWaalsContact C-N 3.33Å; L14-E16 PolarHBondContact O-N 3.28Å; L14-Q17 PolarHBondContact O-N 3.36Å; L14-Q17 VanDerWaalsContact O-N 3.14Å; L14-V18 WeakPolarHBondContact O-CG2 3.46Å; L14-V18 PolarHBondContact O-N 3.11Å
15V92.2Very high90.1Very high1 Ų176.3 Ų76.31%0.00640%0.395CS..Hα-helixtrans-65.8-39.1176.8-174.20000110.7I7 L10 P11 L12 Q17 V18 F19 F36 V40I7-V15 HydrophobicContact CG1-CG2 4.34Å; L10-V15 HydrophobicContact CB-CG2 3.82Å; P11-V15 PolarHBondContact O-N 2.98Å; L12-V15 PolarHBondContact O-N 3.32Å; V15-Q17 VanDerWaalsContact C-N 3.31Å; V15-Q17 PolarHBondContact O-N 3.36Å; V15-V18 PolarHBondContact O-N 3.5Å; V15-F19 HydrophobicContact CG1-CD1 4.36Å; V15-F19 HydrophobicContact CG1-CD2 4.3Å; V15-F19 HydrophobicContact CG1-CE1 3.91Å; V15-F19 HydrophobicContact CG1-CE2 3.84Å; V15-F19 HydrophobicContact CG1-CZ 3.61Å; V15-F19 WeakPolarHBondContact O-CG 3.39Å; V15-F19 PolarHBondContact O-N 3.37Å; V15-F36 HydrophobicContact CB-CE1 4.34Å; V15-F36 HydrophobicContact CG1-CE1 4.28Å; V15-F36 HydrophobicContact CG2-CE1 3.91Å; V15-F36 HydrophobicContact CG2-CZ 4.16Å; V15-V40 HydrophobicContact CB-CG2 4.45Å; V15-V40 HydrophobicContact CG1-CG1 4.29Å; V15-V40 HydrophobicContact CG1-CG2 4.25Å
16E93.2Very high91.4Very high30 Ų3075.6 Ų75.614%0.1438%0.379CS..Hα-helixtrans-58.7-40.6171.5-171178.9156.600111.7L12 Q13 L14 K20 V40 I44 K47L12-E16 WeakPolarHBondContact O-CB 3.47Å; L12-E16 PolarHBondContact O-N 3.34Å; Q13-E16 PolarHBondContact O-N 3.39Å; L14-E16 VanDerWaalsContact C-N 3.33Å; L14-E16 PolarHBondContact O-N 3.28Å; E16-K20 WeakPolarHBondContact O-CG 3.49Å; E16-K20 PolarHBondContact O-N 3.42Å; E16-V40 HydrophobicContact CB-CG1 4.24Å; E16-I44 HydrophobicContact CG-CD1 4.13Å; E16-I44 HydrophobicContact CG-CG1 3.8Å; E16-K47 IonicContact OE1-NZ 2.88Å; E16-K47 PolarHBondContact OE1-NZ 2.94Å; E16-K47 IonicContact OE2-NZ 2.9Å; E16-K47 PolarHBondContact OE2-NZ 2.88Å
17Q93.5Very high92.2Very high102 Ų10271 Ų7148%0.47736%0.355SS..Hα-helixtrans-67.7-39.5176-65.1-58.6-21.600112.7Q13 L14 V15 K20Q13-Q17 WeakPolarHBondContact O-CG 3.44Å; Q13-Q17 PolarHBondContact O-N 3.34Å; L14-Q17 PolarHBondContact O-N 3.36Å; L14-Q17 VanDerWaalsContact O-N 3.14Å; V15-Q17 VanDerWaalsContact C-N 3.31Å; V15-Q17 PolarHBondContact O-N 3.36Å; Q17-K20 VanDerWaalsContact CD-NZ 3.34Å; Q17-K20 VanDerWaalsContact NE2-NZ 3.11Å; Q17-K20 PolarHBondContact O-N 3.46Å
18V93.8Very high92.9Very high80 Ų8068.3 Ų68.349%0.48534%0.343SS..Hα-helixtrans-62.1-45.4176.1174.60000110.3L14 V15 K20 Y21L14-V18 WeakPolarHBondContact O-CG2 3.46Å; L14-V18 PolarHBondContact O-N 3.11Å; V15-V18 PolarHBondContact O-N 3.5Å; V18-K20 PolarHBondContact O-N 3.17Å; V18-Y21 PolarHBondContact O-N 3.19Å
19F94.6Very high93.5Very high8 Ų869.2 Ų69.24%0.03534%0.341CS..Hα-helixtrans-70.7-14.3-177.9-712.1000114V15 Y21 L22 V27 L30 F37 V40 C41 I44V15-F19 HydrophobicContact CG1-CD1 4.36Å; V15-F19 HydrophobicContact CG1-CD2 4.3Å; V15-F19 HydrophobicContact CG1-CE1 3.91Å; V15-F19 HydrophobicContact CG1-CE2 3.84Å; V15-F19 HydrophobicContact CG1-CZ 3.61Å; V15-F19 WeakPolarHBondContact O-CG 3.39Å; V15-F19 PolarHBondContact O-N 3.37Å; F19-Y21 PolarHBondContact O-N 3.14Å; F19-L22 HydrophobicContact CD1-CD1 4.08Å; F19-L22 HydrophobicContact CG-CD1 4.43Å; F19-L22 WeakPolarHBondContact O-CB 3.4Å; F19-L22 PolarHBondContact O-N 3.21Å; F19-L22 VanDerWaalsContact O-N 3.13Å; F19-V27 HydrophobicContact CB-CG2 4.47Å; F19-L30 HydrophobicContact CD1-CD1 4.19Å; F19-L30 HydrophobicContact CD2-CD1 4.39Å; F19-L30 HydrophobicContact CE1-CD1 4.01Å; F19-L30 HydrophobicContact CE2-CD1 4.21Å; F19-L30 HydrophobicContact CG-CD1 4.4Å; F19-L30 HydrophobicContact CZ-CD1 4.04Å; F19-F37 HydrophobicContact CE1-CE2 4.29Å; F19-F37 HydrophobicContact CE1-CZ 4.46Å; F19-F37 HydrophobicContact CE2-CB 4.47Å; F19-F37 HydrophobicContact CE2-CD1 4.43Å; F19-F37 HydrophobicContact CE2-CD2 4.06Å; F19-F37 HydrophobicContact CE2-CE2 4.48Å; F19-F37 HydrophobicContact CE2-CG 4.07Å; F19-F37 HydrophobicContact CZ-CD1 4.06Å; F19-F37 AromaticContact CZ-CD2 3.56Å; F19-F37 HydrophobicContact CZ-CD2 3.56Å; F19-F37 HydrophobicContact CZ-CE1 4.03Å; F19-F37 AromaticContact CZ-CE2 3.55Å; F19-F37 HydrophobicContact CZ-CE2 3.55Å; F19-F37 AromaticContact CZ-CG 3.86Å; F19-F37 HydrophobicContact CZ-CG 3.86Å; F19-F37 AromaticContact CZ-CZ 3.8Å; F19-F37 HydrophobicContact CZ-CZ 3.8Å; F19-V40 HydrophobicContact CD2-CB 4.42Å; F19-V40 HydrophobicContact CD2-CG1 3.68Å; F19-V40 HydrophobicContact CE2-CB 4.32Å; F19-V40 HydrophobicContact CE2-CG1 4.01Å; F19-C41 VanDerWaalsContact CE2-SG 3.56Å; F19-I44 HydrophobicContact CB-CD1 3.39Å; F19-I44 HydrophobicContact CD2-CD1 4.03Å; F19-I44 HydrophobicContact CG-CD1 4.24Å
20K91.4Very high94Very high113 Ų11366.1 Ų66.149%0.49133%0.325SS..THydrogen-bonded Turntrans-67-17.9172.4-76.6174.4-171.41740114E16 Q17 V18E16-K20 WeakPolarHBondContact O-CG 3.49Å; E16-K20 PolarHBondContact O-N 3.42Å; Q17-K20 VanDerWaalsContact CD-NZ 3.34Å; Q17-K20 VanDerWaalsContact NE2-NZ 3.11Å; Q17-K20 PolarHBondContact O-N 3.46Å; V18-K20 PolarHBondContact O-N 3.17Å
21Y95.1Very high94.4Very high209 Ų20964.2 Ų64.282%0.8231%0.313SS*.THydrogen-bonded Turntrans-81-6.5174.1-67.1-78.6000113.1V18 F19V18-Y21 PolarHBondContact O-N 3.19Å; F19-Y21 PolarHBondContact O-N 3.14Å
22L97Very high94.5Very high64 Ų6465.9 Ų65.934%0.33531%0.314SS..SBendtrans-96.2151.5176.6-55.4176.3000110.2F19 E26 V27 L30F19-L22 HydrophobicContact CD1-CD1 4.08Å; F19-L22 HydrophobicContact CG-CD1 4.43Å; F19-L22 WeakPolarHBondContact O-CB 3.4Å; F19-L22 PolarHBondContact O-N 3.21Å; F19-L22 VanDerWaalsContact O-N 3.13Å; L22-E26 HydrophobicContact CB-CB 4.04Å; L22-V27 HydrophobicContact CB-CG2 3.99Å; L22-L30 HydrophobicContact CD1-CD1 3.3Å
23S97.7Very high94.7Very high40 Ų4066.5 Ų66.528%0.2832%0.321SS..  trans-63.3156.7168.5630000111.2E25 E26 V27S23-E25 PolarHBondContact O-N 3.45Å; S23-E26 WeakPolarHBondContact CB-OE2 3.36Å; S23-E26 PolarHBondContact N-OE2 3.31Å; S23-E26 PolarHBondContact O-N 3.04Å; S23-E26 VanDerWaalsContact O-N 3.16Å; S23-E26 WeakPolarHBondContact OG-CB 3.33Å; S23-E26 VanDerWaalsContact OG-CD 3.24Å; S23-E26 WeakPolarHBondContact OG-CG 3.32Å; S23-E26 PolarHBondContact OG-N 2.98Å; S23-E26 PolarHBondContact OG-OE2 3.2Å; S23-V27 WeakPolarHBondContact O-CG2 3.33Å; S23-V27 PolarHBondContact O-N 3.04Å
24Y98.3Very high94.7Very high36 Ų3663 Ų6314%0.14131%0.309CS..Hα-helixtrans-64.1-30.7176.9-70.9-71.1000111.8V27 S28 I44 L45 G48 I52 G114 L117 D118Y24-V27 PolarHBondContact O-N 3.46Å; Y24-S28 WeakPolarHBondContact O-CB 3.35Å; Y24-S28 PolarHBondContact O-N 3.16Å; Y24-I44 HydrophobicContact CD1-CG2 4.39Å; Y24-I44 HydrophobicContact CE1-CG2 4.11Å; Y24-L45 HydrophobicContact CD1-CD2 3.98Å; Y24-G48 VanDerWaalsContact OH-CA 3.26Å; Y24-G48 WeakPolarHBondContact OH-CA 3.26Å; Y24-I52 HydrophobicContact CE2-CD1 4.01Å; Y24-G114 VanDerWaalsContact CB-O 3.29Å; Y24-G114 WeakPolarHBondContact CB-O 3.37Å; Y24-G114 WeakPolarHBondContact O-CA 3.37Å; Y24-L117 HydrophobicContact CD1-CB 4.49Å; Y24-L117 HydrophobicContact CD1-CD1 3.73Å; Y24-L117 HydrophobicContact CD2-CB 3.5Å; Y24-L117 VanDerWaalsContact CD2-CB 3.5Å; Y24-L117 HydrophobicContact CD2-CD1 4.2Å; Y24-L117 HydrophobicContact CD2-CG 4.5Å; Y24-L117 HydrophobicContact CE1-CD1 4.07Å; Y24-L117 HydrophobicContact CE2-CB 4.09Å; Y24-L117 HydrophobicContact CG-CB 3.72Å; Y24-L117 HydrophobicContact CG-CD1 3.79Å; Y24-L117 HydrophobicContact CG-CG 4.37Å; Y24-D118 WeakPolarHBondContact CD2-OD1 3.37Å; Y24-D118 PolarHBondContact N-OD1 3.48Å; Y24-D118 PolarHBondContact N-OD2 3.44Å
25E97.8Very high94.7Very high41 Ų4167.2 Ų67.219%0.19232%0.319CS..Hα-helixtrans-58.1-49.9170.9-172.3-175.4163.500111.3S23 S28 K29 K115 D118S23-E25 PolarHBondContact O-N 3.45Å; E25-S28 WeakPolarHBondContact O-CB 3.45Å; E25-S28 PolarHBondContact O-N 3.11Å; E25-K29 WeakPolarHBondContact O-CG 3.42Å; E25-K29 PolarHBondContact O-N 3.15Å; E25-K29 VanDerWaalsContact O-N 3.09Å; E25-K29 WeakPolarHBondContact OE1-CE 3.31Å; E25-K29 IonicContact OE1-NZ 2.71Å; E25-K29 PolarHBondContact OE1-NZ 3.26Å; E25-K115 HydrophobicContact CB-CB 4.4Å; E25-K115 HydrophobicContact CG-CB 4.3Å; E25-K115 VanDerWaalsContact OE2-CD 3.28Å; E25-K115 WeakPolarHBondContact OE2-CD 3.4Å; E25-K115 WeakPolarHBondContact OE2-CE 3.42Å; E25-K115 IonicContact OE2-NZ 3.54Å; E25-K115 PolarHBondContact OE2-NZ 3.41Å; E25-D118 VanDerWaalsContact CB-OD2 3.3Å; E25-D118 WeakPolarHBondContact CB-OD2 3.32Å; E25-D118 PolarHBondContact N-OD2 3.21Å
26E97.7Very high94.6Very high91 Ų9169.8 Ų69.843%0.42533%0.33SS..Hα-helixtrans-63.6-44.6176.8-72.1163.6133.700111.7L22 S23 S28 K29 L30L22-E26 HydrophobicContact CB-CB 4.04Å; S23-E26 WeakPolarHBondContact CB-OE2 3.36Å; S23-E26 PolarHBondContact N-OE2 3.31Å; S23-E26 PolarHBondContact O-N 3.04Å; S23-E26 VanDerWaalsContact O-N 3.16Å; S23-E26 WeakPolarHBondContact OG-CB 3.33Å; S23-E26 VanDerWaalsContact OG-CD 3.24Å; S23-E26 WeakPolarHBondContact OG-CG 3.32Å; S23-E26 PolarHBondContact OG-N 2.98Å; S23-E26 PolarHBondContact OG-OE2 3.2Å; E26-S28 PolarHBondContact O-N 2.97Å; E26-K29 PolarHBondContact O-N 3.49Å; E26-K29 VanDerWaalsContact O-N 3.09Å; E26-L30 WeakPolarHBondContact O-CG 3.44Å; E26-L30 PolarHBondContact O-N 3.33Å
27V97.8Very high94.7Very high1 Ų169.5 Ų69.51%0.00633%0.328CS..Hα-helixtrans-58.7-37.8175173.30000111.1F19 L22 S23 Y24 L30 C41 I44 L45F19-V27 HydrophobicContact CB-CG2 4.47Å; L22-V27 HydrophobicContact CB-CG2 3.99Å; S23-V27 WeakPolarHBondContact O-CG2 3.33Å; S23-V27 PolarHBondContact O-N 3.04Å; Y24-V27 PolarHBondContact O-N 3.46Å; V27-L30 PolarHBondContact O-N 3.21Å; V27-C41 HydrophobicContact CG1-CB 3.67Å; V27-C41 WeakPolarHBondContact O-CB 3.49Å; V27-C41 PolarHBondContact O-SG 3.08Å; V27-C41 VanDerWaalsContact O-SG 3.41Å; V27-I44 HydrophobicContact CG1-CB 4.02Å; V27-I44 HydrophobicContact CG1-CD1 4.34Å; V27-I44 HydrophobicContact CG1-CG2 3.94Å; V27-I44 HydrophobicContact CG2-CG2 4.38Å; V27-L45 HydrophobicContact CG1-CD1 4.4Å; V27-L45 HydrophobicContact CG1-CD2 4.39Å; V27-L45 HydrophobicContact CG1-CG 4.03Å
28S97Very high94.7Very high21 Ų2165.7 Ų65.715%0.14731%0.311CS..Hα-helixtrans-64.5-42.6175.3-176.20000112.2Y24 E25 E26 R31 F112Y24-S28 WeakPolarHBondContact O-CB 3.35Å; Y24-S28 PolarHBondContact O-N 3.16Å; E25-S28 WeakPolarHBondContact O-CB 3.45Å; E25-S28 PolarHBondContact O-N 3.11Å; E26-S28 PolarHBondContact O-N 2.97Å; S28-R31 WeakPolarHBondContact O-CB 3.42Å; S28-R31 WeakPolarHBondContact O-CG 3.28Å; S28-R31 PolarHBondContact O-N 3.35Å; S28-F112 PolarHBondContact OG-O 3.27Å
29K95.9Very high94.6Very high88 Ų8866.2 Ų66.238%0.38331%0.314SS..Hα-helixtrans-67.4-36.6177.9-67.1174.1-172.6174.20112E25 E26 R31 E32 L375E25-K29 WeakPolarHBondContact O-CG 3.42Å; E25-K29 PolarHBondContact O-N 3.15Å; E25-K29 VanDerWaalsContact O-N 3.09Å; E25-K29 WeakPolarHBondContact OE1-CE 3.31Å; E25-K29 IonicContact OE1-NZ 2.71Å; E25-K29 PolarHBondContact OE1-NZ 3.26Å; E26-K29 PolarHBondContact O-N 3.49Å; E26-K29 VanDerWaalsContact O-N 3.09Å; K29-R31 PolarHBondContact O-N 3.16Å; K29-R31 VanDerWaalsContact O-N 3.08Å; K29-E32 PolarHBondContact O-N 2.96Å; K29-L375 HydrophobicContact CD-CD2 4.39Å; K29-L375 HydrophobicContact CG-CD2 4.49Å
30L95.2Very high94.6Very high42 Ų4266 Ų6622%0.2231%0.314CS..Hα-helixtrans-62.4-16.4178-77-179.3000114.4F19 L22 E26 V27 E32 T33 F37F19-L30 HydrophobicContact CD1-CD1 4.19Å; F19-L30 HydrophobicContact CD2-CD1 4.39Å; F19-L30 HydrophobicContact CE1-CD1 4.01Å; F19-L30 HydrophobicContact CE2-CD1 4.21Å; F19-L30 HydrophobicContact CG-CD1 4.4Å; F19-L30 HydrophobicContact CZ-CD1 4.04Å; L22-L30 HydrophobicContact CD1-CD1 3.3Å; E26-L30 WeakPolarHBondContact O-CG 3.44Å; E26-L30 PolarHBondContact O-N 3.33Å; V27-L30 PolarHBondContact O-N 3.21Å; L30-E32 PolarHBondContact O-N 2.84Å; L30-T33 HydrophobicContact CD2-CG2 4.13Å; L30-T33 PolarHBondContact O-N 3.32Å; L30-T33 PolarHBondContact O-OG1 3.35Å; L30-F37 HydrophobicContact CB-CD2 4.44Å; L30-F37 HydrophobicContact CD2-CD2 4.4Å; L30-F37 HydrophobicContact CD2-CE2 4.49Å
31R94.9Very high94.8Very high20 Ų2060.6 Ų60.68%0.07529%0.291CS..THydrogen-bonded Turntrans-62.3-21.8176.4-68.5177.659.1-124.3-15.6113.5S28 K29 T33 D38 C41 C110S28-R31 WeakPolarHBondContact O-CB 3.42Å; S28-R31 WeakPolarHBondContact O-CG 3.28Å; S28-R31 PolarHBondContact O-N 3.35Å; K29-R31 PolarHBondContact O-N 3.16Å; K29-R31 VanDerWaalsContact O-N 3.08Å; R31-T33 VanDerWaalsContact C-N 3.34Å; R31-D38 IonicContact CZ-OD1 2.71Å; R31-D38 IonicContact NE-OD1 3.47Å; R31-D38 PolarHBondContact NE-OD1 3.47Å; R31-D38 IonicContact NH2-OD1 3.64Å; R31-D38 PolarHBondContact NH2-OD1 2.87Å; R31-C41 HydrophobicContact CG-CB 3.35Å; R31-C110 PolarHBondContact NH1-SG 3.22Å; R31-C110 PolarHBondContact NH2-SG 3.07Å; R31-C110 VanDerWaalsContact NH2-SG 3.41Å
32E90.8Very high94.8Very high111 Ų11154 Ų5452%0.51926%0.264SS..THydrogen-bonded Turntrans-84.2-10.3-175.9-50.6-165.8158.100112.9K29 L30K29-E32 PolarHBondContact O-N 2.96Å; L30-E32 PolarHBondContact O-N 2.84Å
33T91.8Very high94.7Very high82 Ų8252.2 Ų52.250%0.50326%0.261SS..THydrogen-bonded Turntrans-76-49-17363.90000112.8L30 R31 F37L30-T33 HydrophobicContact CD2-CG2 4.13Å; L30-T33 PolarHBondContact O-N 3.32Å; L30-T33 PolarHBondContact O-OG1 3.35Å; R31-T33 VanDerWaalsContact C-N 3.34Å; T33-F37 HydrophobicContact CG2-CD2 4.4Å; T33-F37 WeakPolarHBondContact OG1-CB 3.38Å; T33-F37 WeakPolarHBondContact OG1-CD2 3.46Å; T33-F37 WeakPolarHBondContact OG1-CG 3.38Å
34C91.8Very high94.7Very high49 Ų4951 Ų5133%0.33125%0.251SS..  trans-160.5163.5178.675.40000112.1F36 F37 D38C34-F36 VanDerWaalsContact C-N 3.27Å; C34-F36 PolarHBondContact O-N 3.04Å; C34-F37 PolarHBondContact O-N 3.28Å; C34-F37 VanDerWaalsContact SG-CD1 3.51Å; C34-F37 PolarHBondContact SG-N 3.42Å; C34-F37 VanDerWaalsContact SG-N 3.38Å; C34-D38 PolarHBondContact O-N 3.25Å
35R90.7Very high94.7Very high183 Ų18349.3 Ų49.369%0.69124%0.244SC*.Hα-helixtrans-58.3-37.6-179.7-67.1-177.2178-179.20.3112.9D38 V39R35-D38 PolarHBondContact O-N 2.94Å; R35-V39 WeakPolarHBondContact O-CG2 3.48Å; R35-V39 PolarHBondContact O-N 2.68Å; R35-V39 VanDerWaalsContact O-N 3.13Å
36F91.7Very high94.6Very high54 Ų5448.5 Ų48.524%0.23724%0.242CC..Hα-helixtrans-65.4-44.1178.3178.4-109.2000111.5V8 L12 V15 C34 V39 V40V8-F36 HydrophobicContact CB-CD1 4.22Å; V8-F36 HydrophobicContact CG1-CB 4.43Å; V8-F36 HydrophobicContact CG1-CD1 3.99Å; V8-F36 HydrophobicContact CG1-CG 4.49Å; L12-F36 HydrophobicContact CD1-CE2 3.98Å; L12-F36 HydrophobicContact CD1-CZ 4.42Å; V15-F36 HydrophobicContact CB-CE1 4.34Å; V15-F36 HydrophobicContact CG1-CE1 4.28Å; V15-F36 HydrophobicContact CG2-CE1 3.91Å; V15-F36 HydrophobicContact CG2-CZ 4.16Å; C34-F36 VanDerWaalsContact C-N 3.27Å; C34-F36 PolarHBondContact O-N 3.04Å; F36-V39 PolarHBondContact O-N 3.1Å; F36-V40 HydrophobicContact CE1-CG2 4.37Å; F36-V40 HydrophobicContact CZ-CG2 4.32Å; F36-V40 WeakPolarHBondContact O-CG2 3.29Å; F36-V40 PolarHBondContact O-N 3.48Å; F36-V40 VanDerWaalsContact O-N 3.13Å
37F93.8Very high94.6Very high24 Ų2449.2 Ų49.211%0.10524%0.243CC..Hα-helixtrans-66.8-38.5176.7-79.427.6000111.4I7 F19 L30 T33 C34 V39 V40 C41I7-F37 HydrophobicContact CD1-CZ 4.07Å; I7-F37 HydrophobicContact CG1-CE1 4.46Å; I7-F37 HydrophobicContact CG1-CZ 4.45Å; I7-F37 HydrophobicContact CG2-CE1 3.94Å; I7-F37 HydrophobicContact CG2-CZ 3.87Å; F19-F37 HydrophobicContact CE1-CE2 4.29Å; F19-F37 HydrophobicContact CE1-CZ 4.46Å; F19-F37 HydrophobicContact CE2-CB 4.47Å; F19-F37 HydrophobicContact CE2-CD1 4.43Å; F19-F37 HydrophobicContact CE2-CD2 4.06Å; F19-F37 HydrophobicContact CE2-CE2 4.48Å; F19-F37 HydrophobicContact CE2-CG 4.07Å; F19-F37 HydrophobicContact CZ-CD1 4.06Å; F19-F37 AromaticContact CZ-CD2 3.56Å; F19-F37 HydrophobicContact CZ-CD2 3.56Å; F19-F37 HydrophobicContact CZ-CE1 4.03Å; F19-F37 AromaticContact CZ-CE2 3.55Å; F19-F37 HydrophobicContact CZ-CE2 3.55Å; F19-F37 AromaticContact CZ-CG 3.86Å; F19-F37 HydrophobicContact CZ-CG 3.86Å; F19-F37 AromaticContact CZ-CZ 3.8Å; F19-F37 HydrophobicContact CZ-CZ 3.8Å; L30-F37 HydrophobicContact CB-CD2 4.44Å; L30-F37 HydrophobicContact CD2-CD2 4.4Å; L30-F37 HydrophobicContact CD2-CE2 4.49Å; T33-F37 HydrophobicContact CG2-CD2 4.4Å; T33-F37 WeakPolarHBondContact OG1-CB 3.38Å; T33-F37 WeakPolarHBondContact OG1-CD2 3.46Å; T33-F37 WeakPolarHBondContact OG1-CG 3.38Å; C34-F37 PolarHBondContact O-N 3.28Å; C34-F37 VanDerWaalsContact SG-CD1 3.51Å; C34-F37 PolarHBondContact SG-N 3.42Å; C34-F37 VanDerWaalsContact SG-N 3.38Å; F37-V39 VanDerWaalsContact C-N 3.33Å; F37-V39 PolarHBondContact O-N 3.01Å; F37-V40 PolarHBondContact O-N 2.94Å; F37-C41 WeakPolarHBondContact O-CB 3.48Å; F37-C41 PolarHBondContact O-N 2.76Å; F37-C41 PolarHBondContact O-SG 2.95Å
38D93.6Very high94.6Very high22 Ų2249.2 Ų49.212%0.11824%0.244CC..Hα-helixtrans-56.7-47.3173.9-174.838.6000110.7R31 C34 R35 V40 C41 R42R31-D38 IonicContact CZ-OD1 2.71Å; R31-D38 IonicContact NE-OD1 3.47Å; R31-D38 PolarHBondContact NE-OD1 3.47Å; R31-D38 IonicContact NH2-OD1 3.64Å; R31-D38 PolarHBondContact NH2-OD1 2.87Å; C34-D38 PolarHBondContact O-N 3.25Å; R35-D38 PolarHBondContact O-N 2.94Å; D38-V40 PolarHBondContact O-N 3.32Å; D38-C41 PolarHBondContact O-N 2.89Å; D38-R42 VanDerWaalsContact O-CB 3.29Å; D38-R42 WeakPolarHBondContact O-CB 3.47Å; D38-R42 WeakPolarHBondContact O-CG 3.48Å; D38-R42 PolarHBondContact O-N 3.46Å; D38-R42 IonicContact OD1-CZ 3.05Å; D38-R42 IonicContact OD1-NE 2.9Å; D38-R42 PolarHBondContact OD1-NE 3.39Å; D38-R42 IonicContact OD1-NH2 2.69Å; D38-R42 IonicContact OD2-CZ 2.75Å; D38-R42 IonicContact OD2-NE 3.74Å; D38-R42 PolarHBondContact OD2-NE 2.88Å; D38-R42 IonicContact OD2-NH2 3.76Å; D38-R42 PolarHBondContact OD2-NH2 3.25Å
39V92.8Very high94.6Very high91 Ų9148.3 Ų48.355%0.55224%0.237SC*.Hα-helixtrans-58.9-48.1177.1173.60000112L12 R35 F36 F37 G43L12-V39 HydrophobicContact CD1-CG1 4.34Å; R35-V39 WeakPolarHBondContact O-CG2 3.48Å; R35-V39 PolarHBondContact O-N 2.68Å; R35-V39 VanDerWaalsContact O-N 3.13Å; F36-V39 PolarHBondContact O-N 3.1Å; F37-V39 VanDerWaalsContact C-N 3.33Å; F37-V39 PolarHBondContact O-N 3.01Å; V39-G43 PolarHBondContact O-N 3.01Å
40V94.2Very high94.7Very high4 Ų447.9 Ų47.92%0.02424%0.235CC..Hα-helixtrans-61-53.2178.7177.90000110.9L12 V15 E16 F19 F36 F37 D38 R42 G43 I44L12-V40 HydrophobicContact CD1-CB 4.45Å; L12-V40 HydrophobicContact CD1-CG2 3.34Å; L12-V40 HydrophobicContact CG-CG2 4.17Å; V15-V40 HydrophobicContact CB-CG2 4.45Å; V15-V40 HydrophobicContact CG1-CG1 4.29Å; V15-V40 HydrophobicContact CG1-CG2 4.25Å; E16-V40 HydrophobicContact CB-CG1 4.24Å; F19-V40 HydrophobicContact CD2-CB 4.42Å; F19-V40 HydrophobicContact CD2-CG1 3.68Å; F19-V40 HydrophobicContact CE2-CB 4.32Å; F19-V40 HydrophobicContact CE2-CG1 4.01Å; F36-V40 HydrophobicContact CE1-CG2 4.37Å; F36-V40 HydrophobicContact CZ-CG2 4.32Å; F36-V40 WeakPolarHBondContact O-CG2 3.29Å; F36-V40 PolarHBondContact O-N 3.48Å; F36-V40 VanDerWaalsContact O-N 3.13Å; F37-V40 PolarHBondContact O-N 2.94Å; D38-V40 PolarHBondContact O-N 3.32Å; V40-R42 PolarHBondContact O-N 2.84Å; V40-G43 WeakPolarHBondContact O-CA 3.26Å; V40-G43 PolarHBondContact O-N 3.37Å; V40-G43 VanDerWaalsContact O-N 3.09Å; V40-I44 HydrophobicContact CG1-CD1 3.89Å; V40-I44 WeakPolarHBondContact O-CG1 3.4Å; V40-I44 PolarHBondContact O-N 3.44Å
41C96.3Very high94.8Very high0 Ų049 Ų490%024%0.244CC..Hα-helixtrans-66.6-37.4-173.7-66.30000112.2F19 V27 R31 F37 D38 G43 I44 L45F19-C41 VanDerWaalsContact CE2-SG 3.56Å; V27-C41 HydrophobicContact CG1-CB 3.67Å; V27-C41 WeakPolarHBondContact O-CB 3.49Å; V27-C41 PolarHBondContact O-SG 3.08Å; V27-C41 VanDerWaalsContact O-SG 3.41Å; R31-C41 HydrophobicContact CG-CB 3.35Å; F37-C41 WeakPolarHBondContact O-CB 3.48Å; F37-C41 PolarHBondContact O-N 2.76Å; F37-C41 PolarHBondContact O-SG 2.95Å; D38-C41 PolarHBondContact O-N 2.89Å; C41-G43 VanDerWaalsContact C-N 3.28Å; C41-G43 PolarHBondContact O-N 3.35Å; C41-I44 PolarHBondContact O-N 3.39Å; C41-L45 WeakPolarHBondContact O-CB 3.12Å; C41-L45 WeakPolarHBondContact O-CG 3.43Å; C41-L45 PolarHBondContact O-N 2.89Å
42R95.1Very high95Very high71 Ų7148 Ų4827%0.26824%0.24SC..Hα-helixtrans-57-44.3171-73.6-179.9-176.6-162.66.2111.4D38 V40 N46 C110D38-R42 VanDerWaalsContact O-CB 3.29Å; D38-R42 WeakPolarHBondContact O-CB 3.47Å; D38-R42 WeakPolarHBondContact O-CG 3.48Å; D38-R42 PolarHBondContact O-N 3.46Å; D38-R42 IonicContact OD1-CZ 3.05Å; D38-R42 IonicContact OD1-NE 2.9Å; D38-R42 PolarHBondContact OD1-NE 3.39Å; D38-R42 IonicContact OD1-NH2 2.69Å; D38-R42 IonicContact OD2-CZ 2.75Å; D38-R42 IonicContact OD2-NE 3.74Å; D38-R42 PolarHBondContact OD2-NE 2.88Å; D38-R42 IonicContact OD2-NH2 3.76Å; D38-R42 PolarHBondContact OD2-NH2 3.25Å; V40-R42 PolarHBondContact O-N 2.84Å; R42-N46 VanDerWaalsContact O-CB 3.31Å; R42-N46 WeakPolarHBondContact O-CB 3.4Å; R42-N46 PolarHBondContact O-N 2.76Å; R42-C110 HydrophobicContact CB-CB 3.99Å; R42-C110 HydrophobicContact CG-CB 3.5Å; R42-C110 VanDerWaalsContact CG-CB 3.5Å
43G94.9Very high95.3Very high26 Ų2644.8 Ų44.827%0.26823%0.225SC..Hα-helixtrans-59-48175.500000112V39 V40 C41 K47V39-G43 PolarHBondContact O-N 3.01Å; V40-G43 WeakPolarHBondContact O-CA 3.26Å; V40-G43 PolarHBondContact O-N 3.37Å; V40-G43 VanDerWaalsContact O-N 3.09Å; C41-G43 VanDerWaalsContact C-N 3.28Å; C41-G43 PolarHBondContact O-N 3.35Å; G43-K47 VanDerWaalsContact O-CB 3.26Å; G43-K47 WeakPolarHBondContact O-CB 3.48Å; G43-K47 WeakPolarHBondContact O-CD 3.17Å; G43-K47 WeakPolarHBondContact O-CG 3.33Å; G43-K47 PolarHBondContact O-N 3.44Å
44I96.8Very high95.6Very high14 Ų1448 Ų487%0.07223%0.228CC..Hα-helixtrans-61.7-49.2179.1-65170.2000111.4E16 F19 Y24 V27 V40 C41 K47 G48E16-I44 HydrophobicContact CG-CD1 4.13Å; E16-I44 HydrophobicContact CG-CG1 3.8Å; F19-I44 HydrophobicContact CB-CD1 3.39Å; F19-I44 HydrophobicContact CD2-CD1 4.03Å; F19-I44 HydrophobicContact CG-CD1 4.24Å; Y24-I44 HydrophobicContact CD1-CG2 4.39Å; Y24-I44 HydrophobicContact CE1-CG2 4.11Å; V27-I44 HydrophobicContact CG1-CB 4.02Å; V27-I44 HydrophobicContact CG1-CD1 4.34Å; V27-I44 HydrophobicContact CG1-CG2 3.94Å; V27-I44 HydrophobicContact CG2-CG2 4.38Å; V40-I44 HydrophobicContact CG1-CD1 3.89Å; V40-I44 WeakPolarHBondContact O-CG1 3.4Å; V40-I44 PolarHBondContact O-N 3.44Å; C41-I44 PolarHBondContact O-N 3.39Å; I44-K47 PolarHBondContact O-N 2.83Å; I44-G48 WeakPolarHBondContact O-CA 3.29Å; I44-G48 PolarHBondContact O-N 3.4Å
45L97.7Very high95.9Very high0 Ų048.7 Ų48.70%023%0.227CC..Hα-helixtrans-64.5-45.3-177.8-69.2162000111.8Y24 V27 C41 G48 F49 F111 L117Y24-L45 HydrophobicContact CD1-CD2 3.98Å; V27-L45 HydrophobicContact CG1-CD1 4.4Å; V27-L45 HydrophobicContact CG1-CD2 4.39Å; V27-L45 HydrophobicContact CG1-CG 4.03Å; C41-L45 WeakPolarHBondContact O-CB 3.12Å; C41-L45 WeakPolarHBondContact O-CG 3.43Å; C41-L45 PolarHBondContact O-N 2.89Å; L45-G48 PolarHBondContact O-N 3.27Å; L45-F49 PolarHBondContact O-N 3.08Å; L45-F111 VanDerWaalsContact CB-O 3.27Å; L45-F111 WeakPolarHBondContact CB-O 3.26Å; L45-F111 VanDerWaalsContact CD1-O 3.28Å; L45-F111 WeakPolarHBondContact CD1-O 3.47Å; L45-L117 HydrophobicContact CD2-CD1 4.27Å
46N97Very high96.2Very high25 Ų2540 Ų4013%0.13419%0.194CC..Hα-helixtrans-64.7-42.3178.1-70.9-6.5000111.5R42 G48 K50 M101 F111R42-N46 VanDerWaalsContact O-CB 3.31Å; R42-N46 WeakPolarHBondContact O-CB 3.4Å; R42-N46 PolarHBondContact O-N 2.76Å; N46-G48 VanDerWaalsContact C-N 3.34Å; N46-K50 WeakPolarHBondContact O-CG 2.87Å; N46-K50 PolarHBondContact O-N 2.93Å; N46-M101 HydrophobicContact CB-CE 4.21Å; N46-M101 VanDerWaalsContact O-CE 3.3Å; N46-M101 WeakPolarHBondContact O-CE 2.94Å; N46-F111 WeakPolarHBondContact OD1-CB 3.4Å; N46-F111 PolarHBondContact OD1-N 2.97Å
47K96.5Very high96.5Very high105 Ų10541.3 Ų41.346%0.45721%0.206SC..Hα-helixtrans-65.3-38.9173.8-73.6169178.8171.30111.3E16 G43 I44 K50 T51E16-K47 IonicContact OE1-NZ 2.88Å; E16-K47 PolarHBondContact OE1-NZ 2.94Å; E16-K47 IonicContact OE2-NZ 2.9Å; E16-K47 PolarHBondContact OE2-NZ 2.88Å; G43-K47 VanDerWaalsContact O-CB 3.26Å; G43-K47 WeakPolarHBondContact O-CB 3.48Å; G43-K47 WeakPolarHBondContact O-CD 3.17Å; G43-K47 WeakPolarHBondContact O-CG 3.33Å; G43-K47 PolarHBondContact O-N 3.44Å; I44-K47 PolarHBondContact O-N 2.83Å; K47-K50 PolarHBondContact O-N 3.23Å; K47-T51 WeakPolarHBondContact O-CB 3.47Å; K47-T51 PolarHBondContact O-N 3.41Å; K47-T51 PolarHBondContact O-OG1 3.3Å
48G97.4Very high96.6Very high2 Ų244 Ų442%0.02123%0.228CC..Hα-helixtrans-60.3-49.9178.900000112.2Y24 I44 L45 N46 K50 T51 I52Y24-G48 VanDerWaalsContact OH-CA 3.26Å; Y24-G48 WeakPolarHBondContact OH-CA 3.26Å; I44-G48 WeakPolarHBondContact O-CA 3.29Å; I44-G48 PolarHBondContact O-N 3.4Å; L45-G48 PolarHBondContact O-N 3.27Å; N46-G48 VanDerWaalsContact C-N 3.34Å; G48-K50 PolarHBondContact O-N 3.27Å; G48-T51 WeakPolarHBondContact O-CB 3.42Å; G48-T51 PolarHBondContact O-N 3.36Å; G48-T51 VanDerWaalsContact O-N 3.09Å; G48-I52 WeakPolarHBondContact O-CG1 3.39Å; G48-I52 PolarHBondContact O-N 2.9Å
49F98.2Very high96.8Very high1 Ų143 Ų430%0.00422%0.223CC..Hα-helixtrans-53.5-50.8174.3-175.6-84.1000111.8L45 T51 I52 E53 L93 L96 K97 M101 F111 L117L45-F49 PolarHBondContact O-N 3.08Å; F49-T51 VanDerWaalsContact C-N 3.27Å; F49-T51 PolarHBondContact O-N 3.28Å; F49-I52 PolarHBondContact O-N 3.13Å; F49-E53 WeakPolarHBondContact O-CB 3.14Å; F49-E53 PolarHBondContact O-N 3.49Å; F49-L93 HydrophobicContact CD2-CD2 4.35Å; F49-L93 HydrophobicContact CE1-CD2 4.5Å; F49-L93 HydrophobicContact CE2-CD2 3.78Å; F49-L93 HydrophobicContact CZ-CD2 3.86Å; F49-L93 WeakPolarHBondContact CZ-O 3.46Å; F49-L96 HydrophobicContact CE2-CB 3.83Å; F49-L96 HydrophobicContact CZ-CB 4.29Å; F49-K97 HydrophobicContact CE1-CB 4.04Å; F49-K97 HydrophobicContact CE1-CD 4.48Å; F49-K97 HydrophobicContact CE1-CG 4.31Å; F49-K97 HydrophobicContact CZ-CB 3.84Å; F49-M101 HydrophobicContact CB-CE 3.99Å; F49-M101 HydrophobicContact CB-SD 4.26Å; F49-M101 HydrophobicContact CD1-CB 4.5Å; F49-M101 HydrophobicContact CD1-CE 3.86Å; F49-M101 HydrophobicContact CD1-CG 3.89Å; F49-M101 HydrophobicContact CD1-SD 4.02Å; F49-M101 HydrophobicContact CE1-CB 4.26Å; F49-M101 HydrophobicContact CE1-CG 4.03Å; F49-M101 HydrophobicContact CG-CE 4.17Å; F49-M101 HydrophobicContact CG-CG 4.48Å; F49-M101 HydrophobicContact CG-SD 4.11Å; F49-M101 HydrophobicContact CZ-CB 4.49Å; F49-F111 HydrophobicContact CB-CG 4.42Å; F49-F111 HydrophobicContact CD2-CD1 4.41Å; F49-F111 AromaticContact CD2-CD2 3.82Å; F49-F111 HydrophobicContact CD2-CD2 3.82Å; F49-F111 HydrophobicContact CD2-CE1 4.07Å; F49-F111 AromaticContact CD2-CE2 3.42Å; F49-F111 HydrophobicContact CD2-CE2 3.42Å; F49-F111 VanDerWaalsContact CD2-CE2 3.42Å; F49-F111 HydrophobicContact CD2-CG 4.29Å; F49-F111 AromaticContact CD2-CZ 3.57Å; F49-F111 HydrophobicContact CD2-CZ 3.57Å; F49-F111 HydrophobicContact CE2-CD2 4.35Å; F49-F111 AromaticContact CE2-CE2 3.68Å; F49-F111 HydrophobicContact CE2-CE2 3.68Å; F49-F111 AromaticContact CE2-CZ 3.98Å; F49-F111 HydrophobicContact CE2-CZ 3.98Å; F49-F111 HydrophobicContact CG-CD2 4.35Å; F49-F111 HydrophobicContact CG-CE2 4.37Å; F49-L117 HydrophobicContact CB-CD2 4.21Å; F49-L117 HydrophobicContact CD2-CD2 3.97Å
50K97.5Very high96.9Very high80 Ų8039.2 Ų39.235%0.34820%0.199SC..Hα-helixtrans-63.7-33179.5-64.8178.4-173.6-176.50112.4N46 K47 G48 R54 M101 D105N46-K50 WeakPolarHBondContact O-CG 2.87Å; N46-K50 PolarHBondContact O-N 2.93Å; K47-K50 PolarHBondContact O-N 3.23Å; G48-K50 PolarHBondContact O-N 3.27Å; K50-R54 WeakPolarHBondContact O-CG 3.31Å; K50-R54 PolarHBondContact O-N 3.01Å; K50-R54 PolarHBondContact O-NH1 3.16Å; K50-M101 HydrophobicContact CD-CE 4.22Å; K50-M101 VanDerWaalsContact CE-CE 3.4Å; K50-M101 HydrophobicContact CG-CE 3.81Å; K50-D105 WeakPolarHBondContact CE-OD1 3.5Å; K50-D105 IonicContact NZ-OD1 2.75Å; K50-D105 PolarHBondContact NZ-OD1 3.44Å
51T97.6Very high97Very high64 Ų6442.9 Ų42.939%0.39323%0.225SC..Hα-helixtrans-72.4-44.9179.6-59.70000111K47 G48 F49 R54 M55K47-T51 WeakPolarHBondContact O-CB 3.47Å; K47-T51 PolarHBondContact O-N 3.41Å; K47-T51 PolarHBondContact O-OG1 3.3Å; G48-T51 WeakPolarHBondContact O-CB 3.42Å; G48-T51 PolarHBondContact O-N 3.36Å; G48-T51 VanDerWaalsContact O-N 3.09Å; F49-T51 VanDerWaalsContact C-N 3.27Å; F49-T51 PolarHBondContact O-N 3.28Å; T51-R54 PolarHBondContact O-N 3.39Å; T51-R54 PolarHBondContact OG1-NH2 2.99Å; T51-M55 WeakPolarHBondContact O-CB 3.09Å; T51-M55 PolarHBondContact O-N 3.36Å
52I97.8Very high97Very high0 Ų046.9 Ų46.90%024%0.244CC..Hα-helixtrans-63.7-42.1174.7-69.2162.5000110.4Y24 G48 F49 R54 M55 V56 L93 L117 M120 Q121Y24-I52 HydrophobicContact CE2-CD1 4.01Å; G48-I52 WeakPolarHBondContact O-CG1 3.39Å; G48-I52 PolarHBondContact O-N 2.9Å; F49-I52 PolarHBondContact O-N 3.13Å; I52-R54 PolarHBondContact O-N 3.03Å; I52-M55 HydrophobicContact CG2-CE 4.35Å; I52-M55 PolarHBondContact O-N 3.28Å; I52-V56 HydrophobicContact CG2-CG2 4.15Å; I52-V56 VanDerWaalsContact O-CG2 3.31Å; I52-V56 WeakPolarHBondContact O-CG2 3.29Å; I52-V56 PolarHBondContact O-N 3.02Å; I52-L93 HydrophobicContact CG2-CD2 4.35Å; I52-L117 HydrophobicContact CD1-CB 3.63Å; I52-L117 HydrophobicContact CD1-CD2 3.87Å; I52-L117 HydrophobicContact CD1-CG 4.2Å; I52-M120 HydrophobicContact CG2-CB 3.93Å; I52-M120 HydrophobicContact CG2-SD 4.22Å; I52-Q121 HydrophobicContact CD1-CG 3.65Å; I52-Q121 HydrophobicContact CG1-CG 3.74Å
53E97.9Very high96.9Very high44 Ų4443.5 Ų43.521%0.20623%0.231CC..Hα-helixtrans-54.7-50.5175.3-176.3178.5-131.900111.6F49 V56 V57 K97F49-E53 WeakPolarHBondContact O-CB 3.14Å; F49-E53 PolarHBondContact O-N 3.49Å; E53-V56 PolarHBondContact O-N 3.31Å; E53-V57 WeakPolarHBondContact O-CG2 3.35Å; E53-V57 PolarHBondContact O-N 3.02Å; E53-V57 VanDerWaalsContact O-N 3.16Å; E53-K97 VanDerWaalsContact CD-NZ 3.27Å; E53-K97 VanDerWaalsContact OE1-CD 3.27Å; E53-K97 WeakPolarHBondContact OE1-CD 3.42Å; E53-K97 IonicContact OE1-NZ 2.91Å; E53-K97 PolarHBondContact OE1-NZ 3.41Å; E53-K97 IonicContact OE2-NZ 3.34Å; E53-K97 PolarHBondContact OE2-NZ 2.87Å
54R97.9Very high96.8Very high150 Ų15049 Ų4957%0.56624%0.243SC*.Hα-helixtrans-64-41.5176.9-70.8-172.1-60-84.8-0.5112.8K50 T51 I52 V57 S58K50-R54 WeakPolarHBondContact O-CG 3.31Å; K50-R54 PolarHBondContact O-N 3.01Å; K50-R54 PolarHBondContact O-NH1 3.16Å; T51-R54 PolarHBondContact O-N 3.39Å; T51-R54 PolarHBondContact OG1-NH2 2.99Å; I52-R54 PolarHBondContact O-N 3.03Å; R54-V57 PolarHBondContact O-N 3.49Å; R54-S58 WeakPolarHBondContact O-CB 3.3Å; R54-S58 PolarHBondContact O-N 3.25Å
55M97.6Very high96.7Very high63 Ų6352.8 Ų52.831%0.3127%0.272SS..Hα-helixtrans-60.7-46.9179.2-179.9-165.770.200111.3T51 I52 S58 F59 C124T51-M55 WeakPolarHBondContact O-CB 3.09Å; T51-M55 PolarHBondContact O-N 3.36Å; I52-M55 HydrophobicContact CG2-CE 4.35Å; I52-M55 PolarHBondContact O-N 3.28Å; M55-S58 PolarHBondContact O-N 3.46Å; M55-F59 VanDerWaalsContact O-CB 3.24Å; M55-F59 WeakPolarHBondContact O-CB 3.3Å; M55-F59 PolarHBondContact O-N 3.31Å; M55-C124 HydrophobicContact CE-CB 3.68Å
56V97.7Very high96.4Very high0 Ų057.1 Ų57.10%029%0.292CS..Hα-helixtrans-62.8-47.8179.7173.40000110.5I52 E53 S58 F59 H60 I89 E90 L93I52-V56 HydrophobicContact CG2-CG2 4.15Å; I52-V56 VanDerWaalsContact O-CG2 3.31Å; I52-V56 WeakPolarHBondContact O-CG2 3.29Å; I52-V56 PolarHBondContact O-N 3.02Å; E53-V56 PolarHBondContact O-N 3.31Å; V56-S58 PolarHBondContact O-N 3.34Å; V56-F59 PolarHBondContact O-N 3.05Å; V56-H60 VanDerWaalsContact O-CB 3.28Å; V56-H60 WeakPolarHBondContact O-CB 3.36Å; V56-H60 PolarHBondContact O-N 3.32Å; V56-I89 HydrophobicContact CG1-CB 4.44Å; V56-I89 HydrophobicContact CG1-CG2 4.15Å; V56-I89 HydrophobicContact CG2-CG2 3.95Å; V56-E90 HydrophobicContact CG1-CG 3.5Å; V56-L93 HydrophobicContact CB-CD1 4.01Å; V56-L93 HydrophobicContact CG1-CD1 4.25Å; V56-L93 HydrophobicContact CG2-CD1 3.9Å
57V97.2Very high96.2Very high81 Ų8156.8 Ų56.849%0.49129%0.29SS..Hα-helixtrans-60.2-46178.9171.30000111.5E53 R54 H60 S61E53-V57 WeakPolarHBondContact O-CG2 3.35Å; E53-V57 PolarHBondContact O-N 3.02Å; E53-V57 VanDerWaalsContact O-N 3.16Å; R54-V57 PolarHBondContact O-N 3.49Å; V57-H60 PolarHBondContact O-N 2.97Å; V57-S61 WeakPolarHBondContact O-CB 3.31Å; V57-S61 PolarHBondContact O-N 2.89Å
58S97.1Very high96Very high80 Ų8053.3 Ų53.356%0.55928%0.278SS*.Hα-helixtrans-61.8-47.4177.6-174.50000111.5R54 M55 V56 S61 E62R54-S58 WeakPolarHBondContact O-CB 3.3Å; R54-S58 PolarHBondContact O-N 3.25Å; M55-S58 PolarHBondContact O-N 3.46Å; V56-S58 PolarHBondContact O-N 3.34Å; S58-S61 PolarHBondContact O-N 2.82Å; S58-E62 WeakPolarHBondContact O-CB 3.27Å; S58-E62 PolarHBondContact O-N 3.06Å
59F96.7Very high95.7Very high1 Ų164.6 Ų64.60%0.00432%0.32CS..Hα-helixtrans-67.1-37.7-178.2-177.4-147.2000112.2M55 V56 E62 L63 L86 I127 R128M55-F59 VanDerWaalsContact O-CB 3.24Å; M55-F59 WeakPolarHBondContact O-CB 3.3Å; M55-F59 PolarHBondContact O-N 3.31Å; V56-F59 PolarHBondContact O-N 3.05Å; F59-E62 PolarHBondContact O-N 3.34Å; F59-L63 HydrophobicContact CD2-CD1 4.34Å; F59-L63 HydrophobicContact CD2-CG 4.08Å; F59-L63 HydrophobicContact CE1-CD1 4.35Å; F59-L63 HydrophobicContact CE2-CD1 3.71Å; F59-L63 HydrophobicContact CE2-CD2 4.05Å; F59-L63 HydrophobicContact CE2-CG 3.66Å; F59-L63 HydrophobicContact CZ-CD1 3.72Å; F59-L63 HydrophobicContact CZ-CG 4.2Å; F59-L63 PolarHBondContact O-N 3.46Å; F59-L86 HydrophobicContact CD1-CD1 3.78Å; F59-L86 HydrophobicContact CD1-CD2 3.81Å; F59-L86 HydrophobicContact CD1-CG 4.45Å; F59-L86 HydrophobicContact CE1-CD1 4.04Å; F59-L86 HydrophobicContact CE1-CD2 4.07Å; F59-L86 HydrophobicContact CG-CD1 4.15Å; F59-I127 HydrophobicContact CE1-CB 4.08Å; F59-I127 HydrophobicContact CE1-CG2 3.72Å; F59-I127 HydrophobicContact CZ-CB 4.42Å; F59-I127 HydrophobicContact CZ-CG2 3.79Å; F59-R128 HydrophobicContact CE1-CB 4.23Å; F59-R128 HydrophobicContact CE2-CB 4.48Å; F59-R128 HydrophobicContact CZ-CB 3.81Å; F59-R128 HydrophobicContact CZ-CG 4.36Å
60H96.3Very high95.4Very high13 Ų1372.6 Ų72.66%0.0635%0.35CS..Hα-helixtrans-65.7-44.2175.6-175.4-163.2000111.6V56 V57 E62 L63 R64 L86 S87 E90V56-H60 VanDerWaalsContact O-CB 3.28Å; V56-H60 WeakPolarHBondContact O-CB 3.36Å; V56-H60 PolarHBondContact O-N 3.32Å; V57-H60 PolarHBondContact O-N 2.97Å; H60-E62 VanDerWaalsContact C-N 3.33Å; H60-E62 PolarHBondContact O-N 3.24Å; H60-L63 PolarHBondContact O-N 3.47Å; H60-R64 WeakPolarHBondContact O-CB 3.29Å; H60-R64 PolarHBondContact O-N 3.37Å; H60-L86 HydrophobicContact CB-CB 4.13Å; H60-L86 HydrophobicContact CB-CD1 3.95Å; H60-S87 PolarHBondContact CE1-OG 2.69Å; H60-S87 PolarHBondContact NE2-OG 2.9Å; H60-E90 WeakPolarHBondContact CB-OE1 3.47Å; H60-E90 IonicContact CE1-OE2 2.88Å; H60-E90 PolarHBondContact CE1-OE2 3.13Å; H60-E90 IonicContact CG-OE1 2.97Å; H60-E90 IonicContact ND1-OE1 2.73Å; H60-E90 PolarHBondContact ND1-OE1 3.35Å; H60-E90 IonicContact ND1-OE2 3.52Å; H60-E90 PolarHBondContact ND1-OE2 3.3Å
61S95.8Very high94.9Very high81 Ų8172.6 Ų72.657%0.56635%0.351SS*.Hα-helixtrans-60.9-42.2175.1-173.20000112V57 S58 R64 S65V57-S61 WeakPolarHBondContact O-CB 3.31Å; V57-S61 PolarHBondContact O-N 2.89Å; S58-S61 PolarHBondContact O-N 2.82Å; S61-R64 PolarHBondContact O-N 3.15Å; S61-S65 PolarHBondContact O-N 3.02Å; S61-S65 VanDerWaalsContact O-N 3.07Å
62E95.6Very high94.6Very high84 Ų8472.7 Ų72.739%0.39335%0.354SS..Hα-helixtrans-59-53.4176.1-175.5-171.5165.300111.3S58 F59 H60 R64 S65S58-E62 WeakPolarHBondContact O-CB 3.27Å; S58-E62 PolarHBondContact O-N 3.06Å; F59-E62 PolarHBondContact O-N 3.34Å; H60-E62 VanDerWaalsContact C-N 3.33Å; H60-E62 PolarHBondContact O-N 3.24Å; E62-R64 PolarHBondContact O-N 3.09Å; E62-S65 WeakPolarHBondContact O-CB 3.07Å; E62-S65 PolarHBondContact O-N 3.49Å; E62-S65 PolarHBondContact O-OG 3.1Å
63L93.6Very high94.3Very high0 Ų077.7 Ų77.70%038%0.378CS..Hα-helixtrans-64.6-39.6178.9-73.4-174.5000112.7F59 H60 S65 Q66 L79 H82 L86 I127F59-L63 HydrophobicContact CD2-CD1 4.34Å; F59-L63 HydrophobicContact CD2-CG 4.08Å; F59-L63 HydrophobicContact CE1-CD1 4.35Å; F59-L63 HydrophobicContact CE2-CD1 3.71Å; F59-L63 HydrophobicContact CE2-CD2 4.05Å; F59-L63 HydrophobicContact CE2-CG 3.66Å; F59-L63 HydrophobicContact CZ-CD1 3.72Å; F59-L63 HydrophobicContact CZ-CG 4.2Å; F59-L63 PolarHBondContact O-N 3.46Å; H60-L63 PolarHBondContact O-N 3.47Å; L63-S65 PolarHBondContact O-N 3.07Å; L63-Q66 PolarHBondContact O-N 3.23Å; L63-Q66 VanDerWaalsContact O-N 3.12Å; L63-L79 HydrophobicContact CD2-CD1 4.25Å; L63-L79 HydrophobicContact CD2-CD2 4.29Å; L63-H82 HydrophobicContact CD1-CB 4.11Å; L63-L86 HydrophobicContact CD1-CD1 3.69Å; L63-I127 HydrophobicContact CD1-CG2 4.15Å
64R93.1Very high94Very high140 Ų14078.3 Ų78.353%0.52838%0.378SS..Hα-helixtrans-63.8-30.6179-167.3-177.3-176.8112.2-0.4111.9H60 S61 E62 Q66 L67H60-R64 WeakPolarHBondContact O-CB 3.29Å; H60-R64 PolarHBondContact O-N 3.37Å; S61-R64 PolarHBondContact O-N 3.15Å; E62-R64 PolarHBondContact O-N 3.09Å; R64-Q66 PolarHBondContact O-N 3.46Å; R64-L67 HydrophobicContact CG-CD1 4.41Å; R64-L67 WeakPolarHBondContact O-CB 3.46Å; R64-L67 PolarHBondContact O-N 3.27Å
65S93.7Very high93.6Very high95 Ų9579.1 Ų79.166%0.66438%0.381SS*.Hα-helixtrans-66.8-23.8176.6790000113.6S61 E62 L63 L67S61-S65 PolarHBondContact O-N 3.02Å; S61-S65 VanDerWaalsContact O-N 3.07Å; E62-S65 WeakPolarHBondContact O-CB 3.07Å; E62-S65 PolarHBondContact O-N 3.49Å; E62-S65 PolarHBondContact O-OG 3.1Å; L63-S65 PolarHBondContact O-N 3.07Å; S65-L67 VanDerWaalsContact C-N 3.35Å
66Q93.2Very high93.1Very high91 Ų9183 Ų8343%0.42540%0.403SS..THydrogen-bonded Turntrans-85.9-8.8177.9-58176.931.600112.6L63 R64 L79L63-Q66 PolarHBondContact O-N 3.23Å; L63-Q66 VanDerWaalsContact O-N 3.12Å; R64-Q66 PolarHBondContact O-N 3.46Å; Q66-L79 HydrophobicContact CB-CD1 3.88Å
67L92Very high92.8Very high18 Ų1886 Ų869%0.09442%0.417CS..SBendtrans-77.9143.4179.3-65.7177.8000111.4R64 S65 R74 H77 L79 C83R64-L67 HydrophobicContact CG-CD1 4.41Å; R64-L67 WeakPolarHBondContact O-CB 3.46Å; R64-L67 PolarHBondContact O-N 3.27Å; S65-L67 VanDerWaalsContact C-N 3.35Å; L67-R74 HydrophobicContact CB-CG 4.26Å; L67-R74 HydrophobicContact CD1-CG 3.99Å; L67-R74 HydrophobicContact CD2-CG 4.47Å; L67-R74 HydrophobicContact CG-CG 4.49Å; L67-H77 HydrophobicContact CD2-CB 4.15Å; L67-L79 HydrophobicContact CD2-CB 3.81Å; L67-C83 HydrophobicContact CD1-CB 4.23Å
68P92.5Very high92.4Very high31 Ų3185.7 Ų85.720%0.20141%0.412CS..  trans-54.4145.9169.8-25.734000112.6R70 E73 R74P68-R70 VanDerWaalsContact C-N 3.32Å; P68-R70 PolarHBondContact O-N 3.08Å; P68-E73 HydrophobicContact CB-CB 3.75Å; P68-E73 HydrophobicContact CG-CB 4.06Å; P68-R74 PolarHBondContact O-NE 2.82Å; P68-R74 PolarHBondContact O-NH2 2.75Å
69R90.7Very high92.2Very high240 Ų24082.4 Ų82.491%0.90639%0.388SS*.SBendtrans-66.9-34.6176.5-70.4-174.3178.9-176.40.5111.9R74R69-R74 PolarHBondContact O-NH2 3.42Å
70R91.8Very high92Very high168 Ų16883.1 Ų83.163%0.63439%0.392SS*.SBendtrans-78123.8-178.5-162.4179.9-173122.92110.5P68 S72 E73 R74P68-R70 VanDerWaalsContact C-N 3.32Å; P68-R70 PolarHBondContact O-N 3.08Å; R70-S72 VanDerWaalsContact C-N 3.3Å; R70-S72 PolarHBondContact O-N 3.34Å; R70-E73 HydrophobicContact CB-CB 4.45Å; R70-E73 HydrophobicContact CB-CG 4.36Å; R70-E73 WeakPolarHBondContact CD-OE1 3.17Å; R70-E73 PolarHBondContact O-N 2.86Å; R70-E73 VanDerWaalsContact O-N 3.14Å; R70-R74 PolarHBondContact O-N 3.04Å
71E86.6Confident91.9Very high81 Ų8188.4 Ų88.438%0.37941%0.412SS..Hα-helixtrans-60.3-35.2-174.7-178.159.9-160.900113.5E73 R74 R75E71-E73 PolarHBondContact O-N 2.78Å; E71-R74 PolarHBondContact O-N 3.41Å; E71-R74 IonicContact OE2-CZ 3.43Å; E71-R74 IonicContact OE2-NE 2.86Å; E71-R74 IonicContact OE2-NH1 2.96Å; E71-R74 PolarHBondContact OE2-NH1 3.03Å; E71-R75 WeakPolarHBondContact O-CG 3.42Å; E71-R75 PolarHBondContact O-N 3.2Å; E71-R75 IonicContact OE1-CZ 2.84Å; E71-R75 IonicContact OE1-NE 3.62Å; E71-R75 PolarHBondContact OE1-NE 2.89Å; E71-R75 IonicContact OE1-NH2 3.77Å; E71-R75 PolarHBondContact OE1-NH2 3.33Å
72S91.8Very high91.8Very high65 Ų6584.6 Ų84.646%0.45539%0.385SS..Hα-helixtrans-65.2-3617754.60000113.3R70 N76R70-S72 VanDerWaalsContact C-N 3.3Å; R70-S72 PolarHBondContact O-N 3.34Å; S72-N76 PolarHBondContact O-ND2 3.28Å
73E90.7Very high91.8Very high106 Ų10680.9 Ų80.950%0.49537%0.368SS..Hα-helixtrans-77.1-39.4175.8-69.1162.9-153.900110.5P68 R70 E71 R75 N76 H77P68-E73 HydrophobicContact CB-CB 3.75Å; P68-E73 HydrophobicContact CG-CB 4.06Å; R70-E73 HydrophobicContact CB-CB 4.45Å; R70-E73 HydrophobicContact CB-CG 4.36Å; R70-E73 WeakPolarHBondContact CD-OE1 3.17Å; R70-E73 PolarHBondContact O-N 2.86Å; R70-E73 VanDerWaalsContact O-N 3.14Å; E71-E73 PolarHBondContact O-N 2.78Å; E73-R75 PolarHBondContact O-N 3.37Å; E73-N76 PolarHBondContact O-N 2.94Å; E73-H77 PolarHBondContact O-N 3.24Å; E73-H77 VanDerWaalsContact O-N 3.07Å
74R92.5Very high91.8Very high57 Ų5784.5 Ų84.522%0.21539%0.385CS..Hα-helixtrans-55.4-49.3175.9-176.8-177-58.5159.2-0.2111.7L67 P68 R69 R70 E71 N76 H77 N80L67-R74 HydrophobicContact CB-CG 4.26Å; L67-R74 HydrophobicContact CD1-CG 3.99Å; L67-R74 HydrophobicContact CD2-CG 4.47Å; L67-R74 HydrophobicContact CG-CG 4.49Å; P68-R74 PolarHBondContact O-NE 2.82Å; P68-R74 PolarHBondContact O-NH2 2.75Å; R69-R74 PolarHBondContact O-NH2 3.42Å; R70-R74 PolarHBondContact O-N 3.04Å; E71-R74 PolarHBondContact O-N 3.41Å; E71-R74 IonicContact OE2-CZ 3.43Å; E71-R74 IonicContact OE2-NE 2.86Å; E71-R74 IonicContact OE2-NH1 2.96Å; E71-R74 PolarHBondContact OE2-NH1 3.03Å; R74-N76 PolarHBondContact O-N 3.13Å; R74-N76 VanDerWaalsContact O-N 3.15Å; R74-H77 VanDerWaalsContact O-CB 3.25Å; R74-H77 WeakPolarHBondContact O-CB 3.26Å; R74-H77 PolarHBondContact O-N 3.15Å; R74-N80 WeakPolarHBondContact O-CB 3.42Å
75R89.4Confident91.9Very high166 Ų16677.9 Ų77.963%0.62636%0.36SS*.Hα-helixtrans-59.4-28.8-177.5-73.6176.9-175.7-158.81.7113.8E71 E73E71-R75 WeakPolarHBondContact O-CG 3.42Å; E71-R75 PolarHBondContact O-N 3.2Å; E71-R75 IonicContact OE1-CZ 2.84Å; E71-R75 IonicContact OE1-NE 3.62Å; E71-R75 PolarHBondContact OE1-NE 2.89Å; E71-R75 IonicContact OE1-NH2 3.77Å; E71-R75 PolarHBondContact OE1-NH2 3.33Å; E73-R75 PolarHBondContact O-N 3.37Å
76N87.9Confident92Very high144 Ų14473.3 Ų73.377%0.7733%0.329SS*.Hα-helixtrans-93.1-9.1178.8-62.5-31.3000112.8S72 E73 R74S72-N76 PolarHBondContact O-ND2 3.28Å; E73-N76 PolarHBondContact O-N 2.94Å; R74-N76 PolarHBondContact O-N 3.13Å; R74-N76 VanDerWaalsContact O-N 3.15Å
77H90.6Very high92.1Very high64 Ų6470.9 Ų70.930%0.29632%0.322SS..SBendtrans-70.8137.9180-165.6-88.5000110.8L67 E73 R74 L79 N80L67-H77 HydrophobicContact CD2-CB 4.15Å; E73-H77 PolarHBondContact O-N 3.24Å; E73-H77 VanDerWaalsContact O-N 3.07Å; R74-H77 VanDerWaalsContact O-CB 3.25Å; R74-H77 WeakPolarHBondContact O-CB 3.26Å; R74-H77 PolarHBondContact O-N 3.15Å; H77-L79 VanDerWaalsContact C-N 3.3Å; H77-L79 WeakPolarHBondContact ND1-CB 3.46Å; H77-L79 PolarHBondContact ND1-N 3.38Å; H77-L79 VanDerWaalsContact ND1-N 3.16Å; H77-L79 PolarHBondContact O-N 3.38Å; H77-N80 VanDerWaalsContact O-CB 3.23Å; H77-N80 WeakPolarHBondContact O-CB 3.42Å; H77-N80 PolarHBondContact O-N 3.44Å
78L89.2Confident92.3Very high74 Ų7470.9 Ų70.939%0.38732%0.324SS..Hα-helixtrans-53-47.4-178.8-173.662000112N80 H82 Q131 P134L78-N80 PolarHBondContact O-N 2.92Å; L78-N80 VanDerWaalsContact O-N 3.14Å; L78-H82 PolarHBondContact O-CD2 3.11Å; L78-H82 VanDerWaalsContact O-CD2 3.32Å; L78-Q131 WeakPolarHBondContact CD2-O 3.4Å; L78-P134 HydrophobicContact CD1-CB 4.2Å
79L93.4Very high92.5Very high11 Ų1169.4 Ų69.46%0.05832%0.315CS..Hα-helixtrans-66-11.8179.5-59.1-179.8000115.2L63 Q66 L67 H77 R81 H82 C83 Q131L63-L79 HydrophobicContact CD2-CD1 4.25Å; L63-L79 HydrophobicContact CD2-CD2 4.29Å; Q66-L79 HydrophobicContact CB-CD1 3.88Å; L67-L79 HydrophobicContact CD2-CB 3.81Å; H77-L79 VanDerWaalsContact C-N 3.3Å; H77-L79 WeakPolarHBondContact ND1-CB 3.46Å; H77-L79 PolarHBondContact ND1-N 3.38Å; H77-L79 VanDerWaalsContact ND1-N 3.16Å; H77-L79 PolarHBondContact O-N 3.38Å; L79-R81 PolarHBondContact O-N 2.81Å; L79-H82 WeakPolarHBondContact O-CB 3.48Å; L79-H82 PolarHBondContact O-N 2.79Å; L79-C83 PolarHBondContact O-N 3.12Å; L79-C83 PolarHBondContact O-SG 3.1Å; L79-C83 VanDerWaalsContact O-SG 3.38Å; L79-Q131 HydrophobicContact CD2-CB 3.91Å; L79-Q131 HydrophobicContact CD2-CG 4.34Å
80N92.6Very high92.9Very high16 Ų1660.4 Ų60.49%0.08628%0.283CS..Hα-helixtrans-63.2-42.6-178.8-17965.8000111.7R74 H77 L78 H82 C83 E84R74-N80 WeakPolarHBondContact O-CB 3.42Å; H77-N80 VanDerWaalsContact O-CB 3.23Å; H77-N80 WeakPolarHBondContact O-CB 3.42Å; H77-N80 PolarHBondContact O-N 3.44Å; L78-N80 PolarHBondContact O-N 2.92Å; L78-N80 VanDerWaalsContact O-N 3.14Å; N80-H82 VanDerWaalsContact C-N 3.28Å; N80-H82 PolarHBondContact O-N 2.61Å; N80-C83 PolarHBondContact O-N 3.06Å; N80-E84 PolarHBondContact ND2-OE1 2.89Å; N80-E84 WeakPolarHBondContact O-CG 3.31Å; N80-E84 PolarHBondContact O-N 2.99Å
81R92.8Very high93.1Very high125 Ų12555.7 Ų55.747%0.47227%0.273SS..Hα-helixtrans-64.4-32.9175.5-64.6-57.5-170.4-177.71.2112.6L79 E84 T85 I135L79-R81 PolarHBondContact O-N 2.81Å; R81-E84 VanDerWaalsContact CD-OE2 3.23Å; R81-E84 WeakPolarHBondContact CD-OE2 3.36Å; R81-E84 IonicContact CZ-OE2 2.77Å; R81-E84 IonicContact NE-OE2 2.78Å; R81-E84 IonicContact NH1-OE1 3.71Å; R81-E84 IonicContact NH1-OE2 3.88Å; R81-E84 PolarHBondContact NH1-OE2 3.15Å; R81-T85 WeakPolarHBondContact O-CB 3.33Å; R81-T85 PolarHBondContact O-N 3.03Å; R81-T85 PolarHBondContact O-OG1 2.88Å; R81-I135 HydrophobicContact CB-CG1 3.95Å
82H94.7Very high93.7Very high0 Ų054.4 Ų54.40%026%0.264CS..Hα-helixtrans-66.2-44.1173.4-60.5-91.9000111.2L63 L78 L79 N80 T85 L86 I127 N130 V133 I135L63-H82 HydrophobicContact CD1-CB 4.11Å; L78-H82 PolarHBondContact O-CD2 3.11Å; L78-H82 VanDerWaalsContact O-CD2 3.32Å; L79-H82 WeakPolarHBondContact O-CB 3.48Å; L79-H82 PolarHBondContact O-N 2.79Å; N80-H82 VanDerWaalsContact C-N 3.28Å; N80-H82 PolarHBondContact O-N 2.61Å; H82-T85 WeakPolarHBondContact O-CB 3.47Å; H82-T85 PolarHBondContact O-N 3.44Å; H82-L86 PolarHBondContact O-N 3.27Å; H82-I127 HydrophobicContact CB-CG2 3.92Å; H82-N130 PolarHBondContact CE1-O 2.93Å; H82-V133 PolarHBondContact CE1-O 2.75Å; H82-V133 PolarHBondContact NE2-O 2.94Å; H82-V133 VanDerWaalsContact NE2-O 3.13Å; H82-I135 HydrophobicContact CB-CD1 4.47Å
83C94.2Very high93.9Very high6 Ų651.5 Ų51.54%0.04124%0.244CC..Hα-helixtrans-66.7-38.3176.1-65.30000112.7L67 L79 N80 T85 L86 S87L67-C83 HydrophobicContact CD1-CB 4.23Å; L79-C83 PolarHBondContact O-N 3.12Å; L79-C83 PolarHBondContact O-SG 3.1Å; L79-C83 VanDerWaalsContact O-SG 3.38Å; N80-C83 PolarHBondContact O-N 3.06Å; C83-T85 VanDerWaalsContact C-N 3.29Å; C83-T85 PolarHBondContact O-N 3.11Å; C83-L86 PolarHBondContact O-N 2.9Å; C83-S87 WeakPolarHBondContact O-CB 3.43Å; C83-S87 PolarHBondContact O-N 3.41Å; C83-S87 PolarHBondContact O-OG 2.91Å
84E93.8Very high94.3Very high77 Ų7749.2 Ų49.236%0.3624%0.24SC..Hα-helixtrans-59.4-41.7171.8-74.3173.7-172.200111.3N80 R81 S87 A88N80-E84 PolarHBondContact ND2-OE1 2.89Å; N80-E84 WeakPolarHBondContact O-CG 3.31Å; N80-E84 PolarHBondContact O-N 2.99Å; R81-E84 VanDerWaalsContact CD-OE2 3.23Å; R81-E84 WeakPolarHBondContact CD-OE2 3.36Å; R81-E84 IonicContact CZ-OE2 2.77Å; R81-E84 IonicContact NE-OE2 2.78Å; R81-E84 IonicContact NH1-OE1 3.71Å; R81-E84 IonicContact NH1-OE2 3.88Å; R81-E84 PolarHBondContact NH1-OE2 3.15Å; E84-S87 PolarHBondContact O-N 3.19Å; E84-A88 PolarHBondContact O-N 2.9Å; E84-A88 VanDerWaalsContact O-N 3.11Å
85T95.2Very high94.5Very high0 Ų048.7 Ų48.70%024%0.241CC..Hα-helixtrans-65.5-46.8177.7-54.40000111R81 H82 C83 S87 A88 I89 V123 I127 I135 P137 L141R81-T85 WeakPolarHBondContact O-CB 3.33Å; R81-T85 PolarHBondContact O-N 3.03Å; R81-T85 PolarHBondContact O-OG1 2.88Å; H82-T85 WeakPolarHBondContact O-CB 3.47Å; H82-T85 PolarHBondContact O-N 3.44Å; C83-T85 VanDerWaalsContact C-N 3.29Å; C83-T85 PolarHBondContact O-N 3.11Å; T85-S87 PolarHBondContact O-N 3.27Å; T85-A88 WeakPolarHBondContact O-CB 3.42Å; T85-A88 PolarHBondContact O-N 2.88Å; T85-A88 VanDerWaalsContact O-N 3.13Å; T85-I89 WeakPolarHBondContact O-CG1 3.34Å; T85-I89 PolarHBondContact O-N 3.02Å; T85-I89 VanDerWaalsContact O-N 3.07Å; T85-V123 HydrophobicContact CG2-CG1 4.3Å; T85-I127 HydrophobicContact CG2-CD1 3.6Å; T85-I127 HydrophobicContact CG2-CG1 4.39Å; T85-I135 HydrophobicContact CG2-CD1 4.4Å; T85-I135 WeakPolarHBondContact OG1-CD1 3.39Å; T85-P137 WeakPolarHBondContact OG1-CB 3.46Å; T85-P137 WeakPolarHBondContact OG1-CG 3.48Å; T85-L141 HydrophobicContact CG2-CD1 3.86Å; T85-L141 HydrophobicContact CG2-CD2 3.86Å; T85-L141 HydrophobicContact CG2-CG 3.84Å
86L96.4Very high95Very high0 Ų040.8 Ų40.80%021%0.211CC..Hα-helixtrans-61.7-41175.7-70.7-178.9000112.6F59 H60 L63 H82 C83 A88 I89 E90 I127F59-L86 HydrophobicContact CD1-CD1 3.78Å; F59-L86 HydrophobicContact CD1-CD2 3.81Å; F59-L86 HydrophobicContact CD1-CG 4.45Å; F59-L86 HydrophobicContact CE1-CD1 4.04Å; F59-L86 HydrophobicContact CE1-CD2 4.07Å; F59-L86 HydrophobicContact CG-CD1 4.15Å; H60-L86 HydrophobicContact CB-CB 4.13Å; H60-L86 HydrophobicContact CB-CD1 3.95Å; L63-L86 HydrophobicContact CD1-CD1 3.69Å; H82-L86 PolarHBondContact O-N 3.27Å; C83-L86 PolarHBondContact O-N 2.9Å; L86-A88 PolarHBondContact O-N 2.73Å; L86-I89 HydrophobicContact CD2-CD1 4.06Å; L86-I89 WeakPolarHBondContact O-CB 3.33Å; L86-I89 PolarHBondContact O-N 2.9Å; L86-E90 PolarHBondContact O-N 3.45Å; L86-I127 HydrophobicContact CD2-CD1 3.75Å; L86-I127 HydrophobicContact CG-CD1 4.12Å
87S95.7Very high95.4Very high40 Ų4037.6 Ų37.628%0.2819%0.19SC..Hα-helixtrans-58.7-36.4174.5-61.80000111.9H60 C83 E84 T85 T91H60-S87 PolarHBondContact CE1-OG 2.69Å; H60-S87 PolarHBondContact NE2-OG 2.9Å; C83-S87 WeakPolarHBondContact O-CB 3.43Å; C83-S87 PolarHBondContact O-N 3.41Å; C83-S87 PolarHBondContact O-OG 2.91Å; E84-S87 PolarHBondContact O-N 3.19Å; T85-S87 PolarHBondContact O-N 3.27Å; S87-T91 PolarHBondContact O-N 3.44Å; S87-T91 PolarHBondContact O-OG1 3.44Å
88A96.1Very high95.7Very high18 Ų1837.3 Ų37.315%0.14919%0.19CC..Hα-helixtrans-70.4-36.8175.400000112.3E84 T85 L86 T91 R92 L141E84-A88 PolarHBondContact O-N 2.9Å; E84-A88 VanDerWaalsContact O-N 3.11Å; T85-A88 WeakPolarHBondContact O-CB 3.42Å; T85-A88 PolarHBondContact O-N 2.88Å; T85-A88 VanDerWaalsContact O-N 3.13Å; L86-A88 PolarHBondContact O-N 2.73Å; A88-T91 WeakPolarHBondContact O-CB 3.43Å; A88-T91 PolarHBondContact O-N 2.97Å; A88-R92 PolarHBondContact O-N 2.97Å; A88-L141 HydrophobicContact CB-CD1 3.54Å
89I97.3Very high96Very high0 Ų034.5 Ų34.50%018%0.176CC..Hα-helixtrans-63.9-46173-60.1172000110.5V56 T85 L86 T91 R92 L93 M120 V123 I127 L141 L144V56-I89 HydrophobicContact CG1-CB 4.44Å; V56-I89 HydrophobicContact CG1-CG2 4.15Å; V56-I89 HydrophobicContact CG2-CG2 3.95Å; T85-I89 WeakPolarHBondContact O-CG1 3.34Å; T85-I89 PolarHBondContact O-N 3.02Å; T85-I89 VanDerWaalsContact O-N 3.07Å; L86-I89 HydrophobicContact CD2-CD1 4.06Å; L86-I89 WeakPolarHBondContact O-CB 3.33Å; L86-I89 PolarHBondContact O-N 2.9Å; I89-T91 PolarHBondContact O-N 3.44Å; I89-R92 WeakPolarHBondContact O-CB 3.26Å; I89-R92 PolarHBondContact O-N 3.17Å; I89-L93 HydrophobicContact CG2-CD1 4.22Å; I89-L93 PolarHBondContact O-N 3.38Å; I89-M120 HydrophobicContact CG2-CG 4.35Å; I89-V123 HydrophobicContact CD1-CB 4.15Å; I89-V123 HydrophobicContact CD1-CG1 3.46Å; I89-V123 VanDerWaalsContact CD1-CG1 3.46Å; I89-V123 HydrophobicContact CG1-CG1 4.34Å; I89-I127 HydrophobicContact CD1-CD1 4.22Å; I89-L141 HydrophobicContact CD1-CD2 4.42Å; I89-L141 HydrophobicContact CG1-CD2 3.8Å; I89-L144 HydrophobicContact CG1-CD2 4.01Å
90E97.5Very high96.2Very high50 Ų5034 Ų3423%0.23417%0.174CC..Hα-helixtrans-57.1-39.7175.3-72.3-179.3163.800112V56 H60 L86 L93 S94V56-E90 HydrophobicContact CG1-CG 3.5Å; H60-E90 WeakPolarHBondContact CB-OE1 3.47Å; H60-E90 IonicContact CE1-OE2 2.88Å; H60-E90 PolarHBondContact CE1-OE2 3.13Å; H60-E90 IonicContact CG-OE1 2.97Å; H60-E90 IonicContact ND1-OE1 2.73Å; H60-E90 PolarHBondContact ND1-OE1 3.35Å; H60-E90 IonicContact ND1-OE2 3.52Å; H60-E90 PolarHBondContact ND1-OE2 3.3Å; L86-E90 PolarHBondContact O-N 3.45Å; E90-L93 PolarHBondContact O-N 3.42Å; E90-S94 WeakPolarHBondContact O-CB 3.28Å; E90-S94 PolarHBondContact O-N 3.4Å; E90-S94 PolarHBondContact O-OG 3.09Å
91T97.3Very high96.4Very high69 Ų6933.3 Ų33.342%0.42317%0.17SC..Hα-helixtrans-63.6-43174.9-57.10000111.3S87 A88 I89 S94 L95S87-T91 PolarHBondContact O-N 3.44Å; S87-T91 PolarHBondContact O-OG1 3.44Å; A88-T91 WeakPolarHBondContact O-CB 3.43Å; A88-T91 PolarHBondContact O-N 2.97Å; I89-T91 PolarHBondContact O-N 3.44Å; T91-S94 PolarHBondContact O-N 2.97Å; T91-L95 WeakPolarHBondContact O-CG 3.32Å; T91-L95 PolarHBondContact O-N 3.29Å
92R97.6Very high96.5Very high54 Ų5431.2 Ų31.220%0.20416%0.162CC..Hα-helixtrans-64.4-44.9175.7-68.9-54.394.2109.52.2112.1A88 I89 S94 L95 L96 M120A88-R92 PolarHBondContact O-N 2.97Å; I89-R92 WeakPolarHBondContact O-CB 3.26Å; I89-R92 PolarHBondContact O-N 3.17Å; R92-S94 VanDerWaalsContact C-N 3.29Å; R92-S94 PolarHBondContact O-N 3.4Å; R92-L95 PolarHBondContact O-N 3.13Å; R92-L96 WeakPolarHBondContact O-CG 3.48Å; R92-L96 PolarHBondContact O-N 3.47Å; R92-M120 HydrophobicContact CB-CE 3.9Å
93L97.9Very high96.5Very high4 Ų432.7 Ų32.72%0.02117%0.168CC..Hα-helixtrans-56.3-45.3173.8-81.9167000111.3F49 I52 V56 I89 E90 L95 L96 K97 M120F49-L93 HydrophobicContact CD2-CD2 4.35Å; F49-L93 HydrophobicContact CE1-CD2 4.5Å; F49-L93 HydrophobicContact CE2-CD2 3.78Å; F49-L93 HydrophobicContact CZ-CD2 3.86Å; F49-L93 WeakPolarHBondContact CZ-O 3.46Å; I52-L93 HydrophobicContact CG2-CD2 4.35Å; V56-L93 HydrophobicContact CB-CD1 4.01Å; V56-L93 HydrophobicContact CG1-CD1 4.25Å; V56-L93 HydrophobicContact CG2-CD1 3.9Å; I89-L93 HydrophobicContact CG2-CD1 4.22Å; I89-L93 PolarHBondContact O-N 3.38Å; E90-L93 PolarHBondContact O-N 3.42Å; L93-L95 PolarHBondContact O-N 3.27Å; L93-L96 PolarHBondContact O-N 3.39Å; L93-K97 VanDerWaalsContact O-CB 3.26Å; L93-K97 WeakPolarHBondContact O-CB 3.5Å; L93-K97 PolarHBondContact O-N 3.27Å; L93-M120 HydrophobicContact CD1-SD 4.48Å; L93-M120 HydrophobicContact CD2-CE 3.93Å; L93-M120 HydrophobicContact CD2-SD 3.4Å; L93-M120 WeakPolarHBondContact CD2-SD 3.38Å; L93-M120 HydrophobicContact CG-CE 3.82Å; L93-M120 HydrophobicContact CG-SD 3.68Å
94S98Very high96.6Very high59 Ų5932.4 Ų32.441%0.41317%0.166SC..Hα-helixtrans-61.9-42.3178.1-610000112.1E90 T91 R92 K97 M98E90-S94 WeakPolarHBondContact O-CB 3.28Å; E90-S94 PolarHBondContact O-N 3.4Å; E90-S94 PolarHBondContact O-OG 3.09Å; T91-S94 PolarHBondContact O-N 2.97Å; R92-S94 VanDerWaalsContact C-N 3.29Å; R92-S94 PolarHBondContact O-N 3.4Å; S94-K97 PolarHBondContact O-N 3.03Å; S94-M98 WeakPolarHBondContact O-CB 3.21Å; S94-M98 VanDerWaalsContact O-CG 3.29Å; S94-M98 WeakPolarHBondContact O-CG 3.48Å; S94-M98 PolarHBondContact O-N 3.41Å
95L97.9Very high96.6Very high45 Ų4532.4 Ų32.424%0.23617%0.168CC..Hα-helixtrans-62.9-48.9175.5-69.9172.4000111.6T91 R92 L93 K97 M98 S99 M152T91-L95 WeakPolarHBondContact O-CG 3.32Å; T91-L95 PolarHBondContact O-N 3.29Å; R92-L95 PolarHBondContact O-N 3.13Å; L93-L95 PolarHBondContact O-N 3.27Å; L95-K97 VanDerWaalsContact C-N 3.29Å; L95-K97 PolarHBondContact O-N 2.91Å; L95-M98 HydrophobicContact CD2-CE 3.95Å; L95-M98 CarbonylContact O-C 3.59Å; L95-M98 PolarHBondContact O-N 2.71Å; L95-S99 WeakPolarHBondContact O-CB 3.27Å; L95-S99 PolarHBondContact O-N 3Å; L95-S99 PolarHBondContact O-OG 2.87Å; L95-S99 VanDerWaalsContact O-OG 3.11Å; L95-M152 HydrophobicContact CB-CE 4.34Å; L95-M152 HydrophobicContact CB-SD 3.84Å
96L98.2Very high96.5Very high0 Ų039.1 Ų39.10%020%0.198CC..Hα-helixtrans-62.6-37177.1-71.3163.3000112.4F49 R92 L93 S99 I100 M101 F111 V116 M120 M152F49-L96 HydrophobicContact CE2-CB 3.83Å; F49-L96 HydrophobicContact CZ-CB 4.29Å; R92-L96 WeakPolarHBondContact O-CG 3.48Å; R92-L96 PolarHBondContact O-N 3.47Å; L93-L96 PolarHBondContact O-N 3.39Å; L96-S99 PolarHBondContact O-N 3.47Å; L96-I100 HydrophobicContact CD2-CD1 4.08Å; L96-I100 PolarHBondContact O-N 2.9Å; L96-M101 PolarHBondContact O-N 3.09Å; L96-M101 VanDerWaalsContact O-N 3.11Å; L96-F111 HydrophobicContact CB-CE2 4.29Å; L96-V116 HydrophobicContact CD1-CG1 3.61Å; L96-M120 HydrophobicContact CD1-CE 3.52Å; L96-M152 HydrophobicContact CD2-CG 3.95Å; L96-M152 HydrophobicContact CD2-SD 4.5Å
97K97.8Very high96.2Very high78 Ų7845.9 Ų45.934%0.33923%0.234SC..Iπ-helixtrans-62.9-48.8175.6-173.1171.6-170.4163.40110.7F49 E53 L93 S94 L95 M101 R102F49-K97 HydrophobicContact CE1-CB 4.04Å; F49-K97 HydrophobicContact CE1-CD 4.48Å; F49-K97 HydrophobicContact CE1-CG 4.31Å; F49-K97 HydrophobicContact CZ-CB 3.84Å; E53-K97 VanDerWaalsContact CD-NZ 3.27Å; E53-K97 VanDerWaalsContact OE1-CD 3.27Å; E53-K97 WeakPolarHBondContact OE1-CD 3.42Å; E53-K97 IonicContact OE1-NZ 2.91Å; E53-K97 PolarHBondContact OE1-NZ 3.41Å; E53-K97 IonicContact OE2-NZ 3.34Å; E53-K97 PolarHBondContact OE2-NZ 2.87Å; L93-K97 VanDerWaalsContact O-CB 3.26Å; L93-K97 WeakPolarHBondContact O-CB 3.5Å; L93-K97 PolarHBondContact O-N 3.27Å; S94-K97 PolarHBondContact O-N 3.03Å; L95-K97 VanDerWaalsContact C-N 3.29Å; L95-K97 PolarHBondContact O-N 2.91Å; K97-M101 HydrophobicContact CB-CB 4.34Å; K97-M101 HydrophobicContact CG-CB 4.16Å; K97-M101 PolarHBondContact O-N 3.2Å; K97-R102 PolarHBondContact O-N 3.09Å
98M96.2Very high96Very high58 Ų5849.5 Ų49.529%0.28624%0.241SC..Iπ-helixtrans-63.4-42.5176.4-73.8-172.6-62.700110.9S94 L95 R102 I258S94-M98 WeakPolarHBondContact O-CB 3.21Å; S94-M98 VanDerWaalsContact O-CG 3.29Å; S94-M98 WeakPolarHBondContact O-CG 3.48Å; S94-M98 PolarHBondContact O-N 3.41Å; L95-M98 HydrophobicContact CD2-CE 3.95Å; L95-M98 CarbonylContact O-C 3.59Å; L95-M98 PolarHBondContact O-N 2.71Å; M98-R102 WeakPolarHBondContact O-CD 3.34Å; M98-R102 WeakPolarHBondContact O-CG 3.35Å; M98-R102 PolarHBondContact O-NE 3.12Å; M98-R102 VanDerWaalsContact O-NE 3.12Å; M98-R102 PolarHBondContact O-NH1 3.07Å; M98-I258 HydrophobicContact SD-CG2 4.04Å
99S95.7Very high95.8Very high15 Ų1549.2 Ų49.211%0.10524%0.238CC..Iπ-helixtrans-79.7-53.3-174-60.30000113.1L95 L96 Y103 F155L95-S99 WeakPolarHBondContact O-CB 3.27Å; L95-S99 PolarHBondContact O-N 3Å; L95-S99 PolarHBondContact O-OG 2.87Å; L95-S99 VanDerWaalsContact O-OG 3.11Å; L96-S99 PolarHBondContact O-N 3.47Å; S99-Y103 VanDerWaalsContact O-CD2 3.3Å; S99-Y103 WeakPolarHBondContact O-CD2 3.37Å; S99-Y103 VanDerWaalsContact O-CE2 3.31Å; S99-Y103 WeakPolarHBondContact O-CE2 3.42Å; S99-F155 WeakPolarHBondContact O-CE1 3.38Å
100I96.9Very high95.6Very high0 Ų049.5 Ų49.50%024%0.24CC..Iπ-helixtrans-106.7-53.9-168.6-54.5173.2000110.8L96 R102 Y103 A104 F111 F112 P113 A151 F155L96-I100 HydrophobicContact CD2-CD1 4.08Å; L96-I100 PolarHBondContact O-N 2.9Å; I100-R102 PolarHBondContact O-N 2.99Å; I100-R102 VanDerWaalsContact O-N 3.15Å; I100-Y103 PolarHBondContact O-N 3.19Å; I100-A104 PolarHBondContact O-N 2.85Å; I100-F111 HydrophobicContact CB-CD2 4.38Å; I100-F111 HydrophobicContact CB-CE2 4.46Å; I100-F111 HydrophobicContact CG2-CD2 4.04Å; I100-F111 HydrophobicContact CG2-CE2 4.5Å; I100-F112 HydrophobicContact CD1-CE1 3.92Å; I100-F112 HydrophobicContact CD1-CZ 4.23Å; I100-F112 HydrophobicContact CG2-CD1 4.29Å; I100-F112 HydrophobicContact CG2-CE1 4.17Å; I100-P113 HydrophobicContact CD1-CG 3.7Å; I100-A151 HydrophobicContact CD1-CB 4.45Å; I100-F155 HydrophobicContact CD1-CB 4.2Å; I100-F155 HydrophobicContact CG1-CB 3.9Å; I100-F155 HydrophobicContact CG1-CD1 4.22Å; I100-F155 HydrophobicContact CG1-CD2 4.11Å; I100-F155 HydrophobicContact CG1-CG 3.8Å; I100-F155 HydrophobicContact CG2-CD2 4.22Å; I100-F155 HydrophobicContact CG2-CE2 4.5Å
101M97.1Very high95.5Very high1 Ų147.1 Ų47.11%0.00523%0.229CC..Iπ-helixtrans-61.6-31.5-171.1-161.263168.800112.6N46 F49 K50 L96 K97 Y103 A104 D105 F111N46-M101 HydrophobicContact CB-CE 4.21Å; N46-M101 VanDerWaalsContact O-CE 3.3Å; N46-M101 WeakPolarHBondContact O-CE 2.94Å; F49-M101 HydrophobicContact CB-CE 3.99Å; F49-M101 HydrophobicContact CB-SD 4.26Å; F49-M101 HydrophobicContact CD1-CB 4.5Å; F49-M101 HydrophobicContact CD1-CE 3.86Å; F49-M101 HydrophobicContact CD1-CG 3.89Å; F49-M101 HydrophobicContact CD1-SD 4.02Å; F49-M101 HydrophobicContact CE1-CB 4.26Å; F49-M101 HydrophobicContact CE1-CG 4.03Å; F49-M101 HydrophobicContact CG-CE 4.17Å; F49-M101 HydrophobicContact CG-CG 4.48Å; F49-M101 HydrophobicContact CG-SD 4.11Å; F49-M101 HydrophobicContact CZ-CB 4.49Å; K50-M101 HydrophobicContact CD-CE 4.22Å; K50-M101 VanDerWaalsContact CE-CE 3.4Å; K50-M101 HydrophobicContact CG-CE 3.81Å; L96-M101 PolarHBondContact O-N 3.09Å; L96-M101 VanDerWaalsContact O-N 3.11Å; K97-M101 HydrophobicContact CB-CB 4.34Å; K97-M101 HydrophobicContact CG-CB 4.16Å; K97-M101 PolarHBondContact O-N 3.2Å; M101-Y103 PolarHBondContact O-N 2.98Å; M101-Y103 VanDerWaalsContact O-N 3.1Å; M101-A104 PolarHBondContact O-N 3.36Å; M101-A104 HydrophobicContact SD-CB 3.94Å; M101-D105 PolarHBondContact O-N 3.35Å; M101-F111 HydrophobicContact SD-CB 4.08Å; M101-F111 HydrophobicContact SD-CD2 4.15Å; M101-F111 HydrophobicContact SD-CG 4.44Å
102R95.3Very high95.4Very high82 Ų8244.1 Ų44.131%0.30921%0.21SC..Hα-helixtrans-56.8-25.7175.775.2168.9178.2-120.8-3.6114K97 M98 I100K97-R102 PolarHBondContact O-N 3.09Å; M98-R102 WeakPolarHBondContact O-CD 3.34Å; M98-R102 WeakPolarHBondContact O-CG 3.35Å; M98-R102 PolarHBondContact O-NE 3.12Å; M98-R102 VanDerWaalsContact O-NE 3.12Å; M98-R102 PolarHBondContact O-NH1 3.07Å; I100-R102 PolarHBondContact O-N 2.99Å; I100-R102 VanDerWaalsContact O-N 3.15Å
103Y95.2Very high95.4Very high30 Ų3042 Ų4212%0.11820%0.203CC..Hα-helixtrans-92.8-34.1175.1-64.1-88.1000111.5S99 I100 M101 K106 D107 R108 C109 F155 L160 L163S99-Y103 VanDerWaalsContact O-CD2 3.3Å; S99-Y103 WeakPolarHBondContact O-CD2 3.37Å; S99-Y103 VanDerWaalsContact O-CE2 3.31Å; S99-Y103 WeakPolarHBondContact O-CE2 3.42Å; I100-Y103 PolarHBondContact O-N 3.19Å; M101-Y103 PolarHBondContact O-N 2.98Å; M101-Y103 VanDerWaalsContact O-N 3.1Å; Y103-K106 CarbonylContact O-C 3.58Å; Y103-K106 PolarHBondContact O-N 2.95Å; Y103-K106 VanDerWaalsContact O-N 3.15Å; Y103-D107 PolarHBondContact O-N 3.03Å; Y103-R108 PolarHBondContact O-N 3.37Å; Y103-C109 VanDerWaalsContact CB-SG 3.58Å; Y103-F155 AromaticContact CD2-CE1 3.78Å; Y103-F155 HydrophobicContact CD2-CE1 3.78Å; Y103-F155 HydrophobicContact CD2-CE2 4.3Å; Y103-F155 AromaticContact CD2-CZ 3.29Å; Y103-F155 HydrophobicContact CD2-CZ 3.29Å; Y103-F155 AromaticContact CE2-CE1 3.62Å; Y103-F155 HydrophobicContact CE2-CE1 3.62Å; Y103-F155 AromaticContact CE2-CZ 3.55Å; Y103-F155 HydrophobicContact CE2-CZ 3.55Å; Y103-F155 AromaticContact CG-CZ 3.9Å; Y103-F155 HydrophobicContact CG-CZ 3.9Å; Y103-L160 HydrophobicContact CE1-CD1 3.85Å; Y103-L160 HydrophobicContact CE2-CD1 3.91Å; Y103-L160 VanDerWaalsContact OH-CD1 3.26Å; Y103-L160 WeakPolarHBondContact OH-CD1 3.46Å; Y103-L163 HydrophobicContact CD1-CD1 4.04Å; Y103-L163 HydrophobicContact CG-CD1 4.24Å
104A94.4Very high95.4Very high1 Ų142 Ų421%0.00820%0.203CC..Hα-helixtrans-64.3-40.1174.700000112.5I100 M101 K106 D107 C109I100-A104 PolarHBondContact O-N 2.85Å; M101-A104 PolarHBondContact O-N 3.36Å; M101-A104 HydrophobicContact SD-CB 3.94Å; A104-K106 PolarHBondContact O-N 2.87Å; A104-K106 VanDerWaalsContact O-N 3.13Å; A104-D107 PolarHBondContact O-N 3.18Å; A104-C109 WeakPolarHBondContact CA-O 3.47Å
105D94.5Very high95.4Very high76 Ų7643.1 Ų43.141%0.40620%0.201SC..THydrogen-bonded Turntrans-64.9-12.6174.2-78.8-33.8000113.3K50 M101K50-D105 WeakPolarHBondContact CE-OD1 3.5Å; K50-D105 IonicContact NZ-OD1 2.75Å; K50-D105 PolarHBondContact NZ-OD1 3.44Å; M101-D105 PolarHBondContact O-N 3.35Å
106K92.8Very high95.5Very high141 Ų14141 Ų4161%0.61319%0.19SC*.THydrogen-bonded Turntrans-108.414176-61177.6-175.6175.50112.4Y103 A104 R108Y103-K106 CarbonylContact O-C 3.58Å; Y103-K106 PolarHBondContact O-N 2.95Å; Y103-K106 VanDerWaalsContact O-N 3.15Å; A104-K106 PolarHBondContact O-N 2.87Å; A104-K106 VanDerWaalsContact O-N 3.13Å; K106-R108 HydrophobicContact CB-CG 4.22Å; K106-R108 PolarHBondContact O-N 2.92Å
107D90.6Very high95.5Very high142 Ų14241 Ų4176%0.75919%0.19SC*.THydrogen-bonded Turntrans53.424.6-176.6-59.8-51.5000114.4Y103 A104Y103-D107 PolarHBondContact O-N 3.03Å; A104-D107 PolarHBondContact O-N 3.18Å
108R90.7Very high95.5Very high117 Ų11738.8 Ų38.844%0.44218%0.182SC..SBendtrans-84.3-27.9177.1-66.4-162.2177.4-149.40.3112.6Y103 K106 L163Y103-R108 PolarHBondContact O-N 3.37Å; K106-R108 HydrophobicContact CB-CG 4.22Å; K106-R108 PolarHBondContact O-N 2.92Å; R108-L163 HydrophobicContact CB-CD1 4.5Å; R108-L163 HydrophobicContact CB-CD2 4.4Å; R108-L163 WeakPolarHBondContact O-CD2 3.45Å
109C92.1Very high95.5Very high11 Ų1138.7 Ų38.77%0.07418%0.181CC..SBendtrans-146.7-169.6170.870.90000108Y103 A104 I159 L163Y103-C109 VanDerWaalsContact CB-SG 3.58Å; A104-C109 WeakPolarHBondContact CA-O 3.47Å; C109-I159 HydrophobicContact CB-CG2 4.49Å; C109-L163 HydrophobicContact CB-CD1 4.31Å
110C93.2Very high95.6Very high6 Ų638 Ų384%0.04118%0.176CC..  trans-118.6165.7163.272.20000109.7R31 R42 F112R31-C110 PolarHBondContact NH1-SG 3.22Å; R31-C110 PolarHBondContact NH2-SG 3.07Å; R31-C110 VanDerWaalsContact NH2-SG 3.41Å; R42-C110 HydrophobicContact CB-CB 3.99Å; R42-C110 HydrophobicContact CG-CB 3.5Å; R42-C110 VanDerWaalsContact CG-CB 3.5Å; C110-F112 PolarHBondContact O-N 3.29Å
111F96.9Very high95.6Very high0 Ų040 Ų400%019%0.185CC..  trans-67.1117.7159.4-162-94.3000107.9L45 N46 F49 L96 I100 M101 P113 L117L45-F111 VanDerWaalsContact CB-O 3.27Å; L45-F111 WeakPolarHBondContact CB-O 3.26Å; L45-F111 VanDerWaalsContact CD1-O 3.28Å; L45-F111 WeakPolarHBondContact CD1-O 3.47Å; N46-F111 WeakPolarHBondContact OD1-CB 3.4Å; N46-F111 PolarHBondContact OD1-N 2.97Å; F49-F111 HydrophobicContact CB-CG 4.42Å; F49-F111 HydrophobicContact CD2-CD1 4.41Å; F49-F111 AromaticContact CD2-CD2 3.82Å; F49-F111 HydrophobicContact CD2-CD2 3.82Å; F49-F111 HydrophobicContact CD2-CE1 4.07Å; F49-F111 AromaticContact CD2-CE2 3.42Å; F49-F111 HydrophobicContact CD2-CE2 3.42Å; F49-F111 VanDerWaalsContact CD2-CE2 3.42Å; F49-F111 HydrophobicContact CD2-CG 4.29Å; F49-F111 AromaticContact CD2-CZ 3.57Å; F49-F111 HydrophobicContact CD2-CZ 3.57Å; F49-F111 HydrophobicContact CE2-CD2 4.35Å; F49-F111 AromaticContact CE2-CE2 3.68Å; F49-F111 HydrophobicContact CE2-CE2 3.68Å; F49-F111 AromaticContact CE2-CZ 3.98Å; F49-F111 HydrophobicContact CE2-CZ 3.98Å; F49-F111 HydrophobicContact CG-CD2 4.35Å; F49-F111 HydrophobicContact CG-CE2 4.37Å; L96-F111 HydrophobicContact CB-CE2 4.29Å; I100-F111 HydrophobicContact CB-CD2 4.38Å; I100-F111 HydrophobicContact CB-CE2 4.46Å; I100-F111 HydrophobicContact CG2-CD2 4.04Å; I100-F111 HydrophobicContact CG2-CE2 4.5Å; M101-F111 HydrophobicContact SD-CB 4.08Å; M101-F111 HydrophobicContact SD-CD2 4.15Å; M101-F111 HydrophobicContact SD-CG 4.44Å; F111-P113 HydrophobicContact CE1-CB 4.04Å; F111-P113 HydrophobicContact CE1-CG 4.22Å; F111-P113 WeakPolarHBondContact CE1-O 3.37Å; F111-P113 HydrophobicContact CE2-CG 4.46Å; F111-P113 HydrophobicContact CZ-CB 4.09Å; F111-P113 HydrophobicContact CZ-CG 4.04Å; F111-L117 HydrophobicContact CD1-CD1 4.01Å; F111-L117 HydrophobicContact CD1-CD2 4.28Å; F111-L117 HydrophobicContact CD1-CG 4.22Å; F111-L117 HydrophobicContact CE1-CD1 3.99Å; F111-L117 HydrophobicContact CE1-CD2 3.58Å; F111-L117 HydrophobicContact CE1-CG 3.67Å; F111-L117 HydrophobicContact CZ-CD2 4.1Å
112F95.3Very high95.6Very high7 Ų741 Ų413%0.03120%0.196CC..  trans-108.5-21.2-178.972.1-88.1000114.8S28 I100 C110 G114 A151 H154 F155 I159 V373S28-F112 PolarHBondContact OG-O 3.27Å; I100-F112 HydrophobicContact CD1-CE1 3.92Å; I100-F112 HydrophobicContact CD1-CZ 4.23Å; I100-F112 HydrophobicContact CG2-CD1 4.29Å; I100-F112 HydrophobicContact CG2-CE1 4.17Å; C110-F112 PolarHBondContact O-N 3.29Å; F112-G114 PolarHBondContact O-N 3.23Å; F112-A151 WeakPolarHBondContact CZ-O 3.47Å; F112-H154 AromaticContact CE2-ND1 3.65Å; F112-H154 AromaticContact CZ-ND1 3.6Å; F112-F155 HydrophobicContact CE1-CB 4.07Å; F112-F155 HydrophobicContact CE1-CD2 4.15Å; F112-F155 HydrophobicContact CZ-CB 4.22Å; F112-I159 HydrophobicContact CD1-CD1 3.76Å; F112-I159 HydrophobicContact CE1-CD1 3.45Å; F112-I159 VanDerWaalsContact CE1-CD1 3.45Å; F112-I159 HydrophobicContact CG-CD1 4.46Å; F112-I159 HydrophobicContact CZ-CD1 3.88Å; F112-V373 HydrophobicContact CD2-CG1 3.74Å; F112-V373 HydrophobicContact CD2-CG2 4.23Å; F112-V373 HydrophobicContact CE2-CG1 4.02Å; F112-V373 HydrophobicContact CG-CG2 4.5Å
113P97.4Very high95.7Very high10 Ų1037.2 Ų37.27%0.06518%0.182CC..  trans-73.271.1-178.8-19.933.8000113.6I100 F111 K115 V116 L117 A151I100-P113 HydrophobicContact CD1-CG 3.7Å; F111-P113 HydrophobicContact CE1-CB 4.04Å; F111-P113 HydrophobicContact CE1-CG 4.22Å; F111-P113 WeakPolarHBondContact CE1-O 3.37Å; F111-P113 HydrophobicContact CE2-CG 4.46Å; F111-P113 HydrophobicContact CZ-CB 4.09Å; F111-P113 HydrophobicContact CZ-CG 4.04Å; P113-K115 PolarHBondContact O-N 3.38Å; P113-V116 HydrophobicContact CB-CB 3.95Å; P113-V116 HydrophobicContact CB-CG2 3.45Å; P113-V116 VanDerWaalsContact CB-CG2 3.45Å; P113-V116 WeakPolarHBondContact O-CB 3.38Å; P113-V116 PolarHBondContact O-N 3.11Å; P113-V116 VanDerWaalsContact O-N 3.17Å; P113-L117 PolarHBondContact O-N 2.87Å; P113-A151 HydrophobicContact CB-CB 3.72Å; P113-A151 HydrophobicContact CG-CB 3.51Å
114G97.9Very high95.7Very high2 Ų236 Ų362%0.02118%0.177CC..Hα-helixtrans-56.8-46.7-17900000113Y24 F112 V116 L117 D118Y24-G114 VanDerWaalsContact CB-O 3.29Å; Y24-G114 WeakPolarHBondContact CB-O 3.37Å; Y24-G114 WeakPolarHBondContact O-CA 3.37Å; F112-G114 PolarHBondContact O-N 3.23Å; G114-V116 PolarHBondContact O-N 2.78Å; G114-V116 VanDerWaalsContact O-N 3.16Å; G114-L117 WeakPolarHBondContact O-CA 3.4Å; G114-L117 WeakPolarHBondContact O-CB 3.47Å; G114-L117 PolarHBondContact O-N 3.34Å; G114-D118 PolarHBondContact O-N 2.85Å; G114-D118 VanDerWaalsContact O-N 3.12Å
115K98Very high95.8Very high84 Ų8442.6 Ų42.637%0.36520%0.202SC..Hα-helixtrans-55.6-34.4177.3-174.551.3152.3-148.80113.5E25 P113 L117 D118 E119 I147E25-K115 HydrophobicContact CB-CB 4.4Å; E25-K115 HydrophobicContact CG-CB 4.3Å; E25-K115 VanDerWaalsContact OE2-CD 3.28Å; E25-K115 WeakPolarHBondContact OE2-CD 3.4Å; E25-K115 WeakPolarHBondContact OE2-CE 3.42Å; E25-K115 IonicContact OE2-NZ 3.54Å; E25-K115 PolarHBondContact OE2-NZ 3.41Å; P113-K115 PolarHBondContact O-N 3.38Å; K115-L117 VanDerWaalsContact C-N 3.34Å; K115-D118 PolarHBondContact O-N 2.94Å; K115-E119 PolarHBondContact O-N 3.05Å; K115-I147 HydrophobicContact CG-CD1 3.93Å
116V98.4Very high95.8Very high1 Ų143 Ų431%0.00620%0.2CC..Hα-helixtrans-65.2-39.9176.7-176.60000111L96 P113 G114 E119 M120 L144 I147 S148 A151L96-V116 HydrophobicContact CD1-CG1 3.61Å; P113-V116 HydrophobicContact CB-CB 3.95Å; P113-V116 HydrophobicContact CB-CG2 3.45Å; P113-V116 VanDerWaalsContact CB-CG2 3.45Å; P113-V116 WeakPolarHBondContact O-CB 3.38Å; P113-V116 PolarHBondContact O-N 3.11Å; P113-V116 VanDerWaalsContact O-N 3.17Å; G114-V116 PolarHBondContact O-N 2.78Å; G114-V116 VanDerWaalsContact O-N 3.16Å; V116-E119 PolarHBondContact O-N 2.75Å; V116-M120 HydrophobicContact CG1-CE 3.98Å; V116-M120 HydrophobicContact CG1-SD 4.46Å; V116-M120 VanDerWaalsContact O-CG 3.26Å; V116-M120 WeakPolarHBondContact O-CG 3.33Å; V116-M120 PolarHBondContact O-N 3.38Å; V116-L144 HydrophobicContact CG1-CD1 4.03Å; V116-I147 HydrophobicContact CB-CD1 4.36Å; V116-I147 HydrophobicContact CG2-CB 4.25Å; V116-I147 HydrophobicContact CG2-CD1 4.06Å; V116-I147 HydrophobicContact CG2-CG1 3.93Å; V116-S148 WeakPolarHBondContact CG1-OG 3.34Å; V116-A151 HydrophobicContact CG2-CB 4.28Å
117L98.2Very high96Very high0 Ų036.2 Ų36.20%017%0.171CC..Hα-helixtrans-66.9-42.3176.5-59.4-175000111.5Y24 L45 F49 I52 F111 P113 G114 K115 E119 M120 Q121Y24-L117 HydrophobicContact CD1-CB 4.49Å; Y24-L117 HydrophobicContact CD1-CD1 3.73Å; Y24-L117 HydrophobicContact CD2-CB 3.5Å; Y24-L117 VanDerWaalsContact CD2-CB 3.5Å; Y24-L117 HydrophobicContact CD2-CD1 4.2Å; Y24-L117 HydrophobicContact CD2-CG 4.5Å; Y24-L117 HydrophobicContact CE1-CD1 4.07Å; Y24-L117 HydrophobicContact CE2-CB 4.09Å; Y24-L117 HydrophobicContact CG-CB 3.72Å; Y24-L117 HydrophobicContact CG-CD1 3.79Å; Y24-L117 HydrophobicContact CG-CG 4.37Å; L45-L117 HydrophobicContact CD2-CD1 4.27Å; F49-L117 HydrophobicContact CB-CD2 4.21Å; F49-L117 HydrophobicContact CD2-CD2 3.97Å; I52-L117 HydrophobicContact CD1-CB 3.63Å; I52-L117 HydrophobicContact CD1-CD2 3.87Å; I52-L117 HydrophobicContact CD1-CG 4.2Å; F111-L117 HydrophobicContact CD1-CD1 4.01Å; F111-L117 HydrophobicContact CD1-CD2 4.28Å; F111-L117 HydrophobicContact CD1-CG 4.22Å; F111-L117 HydrophobicContact CE1-CD1 3.99Å; F111-L117 HydrophobicContact CE1-CD2 3.58Å; F111-L117 HydrophobicContact CE1-CG 3.67Å; F111-L117 HydrophobicContact CZ-CD2 4.1Å; P113-L117 PolarHBondContact O-N 2.87Å; G114-L117 WeakPolarHBondContact O-CA 3.4Å; G114-L117 WeakPolarHBondContact O-CB 3.47Å; G114-L117 PolarHBondContact O-N 3.34Å; K115-L117 VanDerWaalsContact C-N 3.34Å; L117-E119 VanDerWaalsContact C-N 3.33Å; L117-E119 PolarHBondContact O-N 3.42Å; L117-M120 PolarHBondContact O-N 2.91Å; L117-Q121 WeakPolarHBondContact O-CG 3.19Å; L117-Q121 PolarHBondContact O-N 2.8Å
118D98Very high96.1Very high30 Ų3034.9 Ų34.916%0.1616%0.155CC..Hα-helixtrans-60.4-44.6177-66.9-39.4000111.1Y24 E25 G114 K115 Q121 G122Y24-D118 WeakPolarHBondContact CD2-OD1 3.37Å; Y24-D118 PolarHBondContact N-OD1 3.48Å; Y24-D118 PolarHBondContact N-OD2 3.44Å; E25-D118 VanDerWaalsContact CB-OD2 3.3Å; E25-D118 WeakPolarHBondContact CB-OD2 3.32Å; E25-D118 PolarHBondContact N-OD2 3.21Å; G114-D118 PolarHBondContact O-N 2.85Å; G114-D118 VanDerWaalsContact O-N 3.12Å; K115-D118 PolarHBondContact O-N 2.94Å; D118-Q121 PolarHBondContact O-N 3.23Å; D118-G122 PolarHBondContact O-N 3.23Å
119E97.8Very high96.3Very high57 Ų5736.3 Ų36.327%0.26617%0.171SC..Hα-helixtrans-67.9-41.1177-101.7-49.9162.800113K115 V116 L117 Q121 G122 V123 E143 L144 I147K115-E119 PolarHBondContact O-N 3.05Å; V116-E119 PolarHBondContact O-N 2.75Å; L117-E119 VanDerWaalsContact C-N 3.33Å; L117-E119 PolarHBondContact O-N 3.42Å; E119-Q121 PolarHBondContact O-N 3.18Å; E119-G122 CarbonylContact O-C 3.55Å; E119-G122 WeakPolarHBondContact O-CA 3.49Å; E119-G122 PolarHBondContact O-N 2.89Å; E119-V123 WeakPolarHBondContact O-CG2 3.48Å; E119-V123 PolarHBondContact O-N 3.4Å; E119-E143 HydrophobicContact CG-CG 4.03Å; E119-L144 HydrophobicContact CB-CB 4.47Å; E119-L144 HydrophobicContact CB-CD1 4.11Å; E119-I147 HydrophobicContact CB-CD1 3.84Å; E119-I147 HydrophobicContact CG-CD1 3.9Å
120M97.6Very high96.3Very high0 Ų038.1 Ų38.10%018%0.18CC..Hα-helixtrans-57.2-42.4174.6-75.2-176.7172.400111.7I52 I89 R92 L93 L96 V116 L117 C124 L144I52-M120 HydrophobicContact CG2-CB 3.93Å; I52-M120 HydrophobicContact CG2-SD 4.22Å; I89-M120 HydrophobicContact CG2-CG 4.35Å; R92-M120 HydrophobicContact CB-CE 3.9Å; L93-M120 HydrophobicContact CD1-SD 4.48Å; L93-M120 HydrophobicContact CD2-CE 3.93Å; L93-M120 HydrophobicContact CD2-SD 3.4Å; L93-M120 WeakPolarHBondContact CD2-SD 3.38Å; L93-M120 HydrophobicContact CG-CE 3.82Å; L93-M120 HydrophobicContact CG-SD 3.68Å; L96-M120 HydrophobicContact CD1-CE 3.52Å; V116-M120 HydrophobicContact CG1-CE 3.98Å; V116-M120 HydrophobicContact CG1-SD 4.46Å; V116-M120 VanDerWaalsContact O-CG 3.26Å; V116-M120 WeakPolarHBondContact O-CG 3.33Å; V116-M120 PolarHBondContact O-N 3.38Å; L117-M120 PolarHBondContact O-N 2.91Å; M120-C124 WeakPolarHBondContact O-CB 3.38Å; M120-C124 PolarHBondContact O-N 3.3Å; M120-C124 PolarHBondContact O-SG 2.91Å; M120-L144 HydrophobicContact CB-CD1 4.47Å; M120-L144 HydrophobicContact CE-CD1 4.01Å; M120-L144 HydrophobicContact CG-CD1 3.41Å; M120-L144 VanDerWaalsContact CG-CD1 3.41Å; M120-L144 HydrophobicContact CG-CD2 4.01Å; M120-L144 HydrophobicContact CG-CG 4.37Å
121Q96.8Very high96.1Very high43 Ų4340.4 Ų40.420%0.20119%0.19CC..Hα-helixtrans-67.8-39.9173.7-70.1-169.8-17.300112.3I52 L117 D118 E119 C124 R125I52-Q121 HydrophobicContact CD1-CG 3.65Å; I52-Q121 HydrophobicContact CG1-CG 3.74Å; L117-Q121 WeakPolarHBondContact O-CG 3.19Å; L117-Q121 PolarHBondContact O-N 2.8Å; D118-Q121 PolarHBondContact O-N 3.23Å; E119-Q121 PolarHBondContact O-N 3.18Å; Q121-C124 PolarHBondContact O-N 3.08Å; Q121-R125 WeakPolarHBondContact O-CB 3.36Å; Q121-R125 WeakPolarHBondContact O-CG 3.35Å; Q121-R125 PolarHBondContact O-N 2.96Å
122G96.8Very high95.7Very high22 Ų2243.3 Ų43.323%0.22722%0.22CC..Hα-helixtrans-55.4-54.6175.600000111.9D118 E119 C124 R125 F126D118-G122 PolarHBondContact O-N 3.23Å; E119-G122 CarbonylContact O-C 3.55Å; E119-G122 WeakPolarHBondContact O-CA 3.49Å; E119-G122 PolarHBondContact O-N 2.89Å; G122-C124 PolarHBondContact O-N 3.41Å; G122-R125 PolarHBondContact O-N 3.22Å; G122-F126 WeakPolarHBondContact O-CB 3.46Å; G122-F126 PolarHBondContact O-N 3.41Å
123V96.3Very high95.4Very high2 Ų246.5 Ų46.51%0.01224%0.24CC..Hα-helixtrans-59.7-44.6175.9176.40000111.5T85 I89 E119 R125 F126 I127 I140 L141 L144T85-V123 HydrophobicContact CG2-CG1 4.3Å; I89-V123 HydrophobicContact CD1-CB 4.15Å; I89-V123 HydrophobicContact CD1-CG1 3.46Å; I89-V123 VanDerWaalsContact CD1-CG1 3.46Å; I89-V123 HydrophobicContact CG1-CG1 4.34Å; E119-V123 WeakPolarHBondContact O-CG2 3.48Å; E119-V123 PolarHBondContact O-N 3.4Å; V123-R125 PolarHBondContact O-N 3.12Å; V123-F126 WeakPolarHBondContact O-CB 3.45Å; V123-F126 PolarHBondContact O-N 2.82Å; V123-I127 HydrophobicContact CG1-CD1 3.82Å; V123-I127 HydrophobicContact CG1-CG1 4.35Å; V123-I127 VanDerWaalsContact O-CG1 3.28Å; V123-I127 WeakPolarHBondContact O-CG1 3.5Å; V123-I127 PolarHBondContact O-N 3.28Å; V123-I140 HydrophobicContact CB-CG2 4.27Å; V123-I140 HydrophobicContact CG1-CG2 3.66Å; V123-I140 HydrophobicContact CG2-CG2 3.9Å; V123-L141 HydrophobicContact CG1-CD2 4.09Å; V123-L144 HydrophobicContact CG2-CD2 4.46Å
124C96.3Very high94.9Very high4 Ų451 Ų513%0.02727%0.269CS..Hα-helixtrans-62.7-41.7178.3-71.50000112.5M55 M120 Q121 G122 R128M55-C124 HydrophobicContact CE-CB 3.68Å; M120-C124 WeakPolarHBondContact O-CB 3.38Å; M120-C124 PolarHBondContact O-N 3.3Å; M120-C124 PolarHBondContact O-SG 2.91Å; Q121-C124 PolarHBondContact O-N 3.08Å; G122-C124 PolarHBondContact O-N 3.41Å; C124-R128 WeakPolarHBondContact O-CB 3.29Å; C124-R128 PolarHBondContact O-N 3.49Å
125R96.1Very high94.6Very high139 Ų13951.5 Ų51.553%0.52527%0.271SS..Hα-helixtrans-62.9-45.1174.1-75.1-172.7-63-101.1-0.9110.9Q121 G122 V123 I127 R128 L129Q121-R125 WeakPolarHBondContact O-CB 3.36Å; Q121-R125 WeakPolarHBondContact O-CG 3.35Å; Q121-R125 PolarHBondContact O-N 2.96Å; G122-R125 PolarHBondContact O-N 3.22Å; V123-R125 PolarHBondContact O-N 3.12Å; R125-I127 PolarHBondContact O-N 3.41Å; R125-R128 PolarHBondContact O-N 3.16Å; R125-L129 WeakPolarHBondContact O-CG 3.38Å; R125-L129 PolarHBondContact O-N 3.37Å
126F95.5Very high94.3Very high84 Ų8454.3 Ų54.337%0.36828%0.279SS..Hα-helixtrans-57.5-48.7177.2179.2-90.9000111.7G122 V123 R128 L129 N130 I135 I140G122-F126 WeakPolarHBondContact O-CB 3.46Å; G122-F126 PolarHBondContact O-N 3.41Å; V123-F126 WeakPolarHBondContact O-CB 3.45Å; V123-F126 PolarHBondContact O-N 2.82Å; F126-R128 VanDerWaalsContact C-N 3.33Å; F126-R128 PolarHBondContact O-N 2.9Å; F126-L129 PolarHBondContact O-N 2.89Å; F126-N130 WeakPolarHBondContact CD2-ND2 3.4Å; F126-N130 HydrophobicContact CE1-CB 4.45Å; F126-N130 HydrophobicContact CZ-CB 4.47Å; F126-N130 WeakPolarHBondContact O-CB 3.35Å; F126-N130 PolarHBondContact O-N 3.09Å; F126-N130 PolarHBondContact O-ND2 3.36Å; F126-I135 HydrophobicContact CE1-CG2 3.85Å; F126-I140 HydrophobicContact CD1-CD1 3.87Å; F126-I140 HydrophobicContact CD1-CG1 4.27Å; F126-I140 HydrophobicContact CD1-CG2 4.23Å; F126-I140 HydrophobicContact CE1-CD1 3.38Å; F126-I140 HydrophobicContact CE1-CG1 3.91Å; F126-I140 HydrophobicContact CZ-CD1 4.29Å
127I95.1Very high93.9Very high0 Ų055.6 Ų55.60%029%0.287CS..Hα-helixtrans-61.1-43177.4-66.5168000110.8F59 L63 H82 T85 L86 I89 V123 R125 L129 N130 Q131 I135F59-I127 HydrophobicContact CE1-CB 4.08Å; F59-I127 HydrophobicContact CE1-CG2 3.72Å; F59-I127 HydrophobicContact CZ-CB 4.42Å; F59-I127 HydrophobicContact CZ-CG2 3.79Å; L63-I127 HydrophobicContact CD1-CG2 4.15Å; H82-I127 HydrophobicContact CB-CG2 3.92Å; T85-I127 HydrophobicContact CG2-CD1 3.6Å; T85-I127 HydrophobicContact CG2-CG1 4.39Å; L86-I127 HydrophobicContact CD2-CD1 3.75Å; L86-I127 HydrophobicContact CG-CD1 4.12Å; I89-I127 HydrophobicContact CD1-CD1 4.22Å; V123-I127 HydrophobicContact CG1-CD1 3.82Å; V123-I127 HydrophobicContact CG1-CG1 4.35Å; V123-I127 VanDerWaalsContact O-CG1 3.28Å; V123-I127 WeakPolarHBondContact O-CG1 3.5Å; V123-I127 PolarHBondContact O-N 3.28Å; R125-I127 PolarHBondContact O-N 3.41Å; I127-L129 PolarHBondContact O-N 3.33Å; I127-N130 PolarHBondContact O-N 3.38Å; I127-Q131 WeakPolarHBondContact O-CG 3.37Å; I127-Q131 PolarHBondContact O-N 3.2Å; I127-I135 HydrophobicContact CG1-CD1 4.44Å
128R94.1Very high93.6Very high113 Ų11362.5 Ų62.543%0.42631%0.314SS..Hα-helixtrans-63.7-39.8-179.1-174176.8-67.8-91.7-3.2112.4F59 C124 R125 F126 Q131F59-R128 HydrophobicContact CE1-CB 4.23Å; F59-R128 HydrophobicContact CE2-CB 4.48Å; F59-R128 HydrophobicContact CZ-CB 3.81Å; F59-R128 HydrophobicContact CZ-CG 4.36Å; C124-R128 WeakPolarHBondContact O-CB 3.29Å; C124-R128 PolarHBondContact O-N 3.49Å; R125-R128 PolarHBondContact O-N 3.16Å; F126-R128 VanDerWaalsContact C-N 3.33Å; F126-R128 PolarHBondContact O-N 2.9Å; R128-Q131 PolarHBondContact O-NE2 2.75Å
129L94.4Very high93.2Very high147 Ų14765.9 Ų65.977%0.7733%0.333SS*.Hα-helixtrans-78.7-25.9-179.7-66.3173.8000113.2R125 F126 I127R125-L129 WeakPolarHBondContact O-CG 3.38Å; R125-L129 PolarHBondContact O-N 3.37Å; F126-L129 PolarHBondContact O-N 2.89Å; I127-L129 PolarHBondContact O-N 3.33Å
130N92.8Very high93Very high49 Ų4964.7 Ų64.726%0.26233%0.328SS..THydrogen-bonded Turntrans-112.130.6-172-64.9-81.2000114H82 F126 I127 G132 V133H82-N130 PolarHBondContact CE1-O 2.93Å; F126-N130 WeakPolarHBondContact CD2-ND2 3.4Å; F126-N130 HydrophobicContact CE1-CB 4.45Å; F126-N130 HydrophobicContact CZ-CB 4.47Å; F126-N130 WeakPolarHBondContact O-CB 3.35Å; F126-N130 PolarHBondContact O-N 3.09Å; F126-N130 PolarHBondContact O-ND2 3.36Å; I127-N130 PolarHBondContact O-N 3.38Å; N130-G132 PolarHBondContact O-N 3.17Å; N130-V133 HydrophobicContact CB-CB 4.48Å; N130-V133 PolarHBondContact O-N 3.37Å
131Q89.2Confident92.9Very high54 Ų5464.8 Ų64.825%0.25233%0.328SS..THydrogen-bonded Turntrans-59.7-20.3-179.2-66-178.231.400114.2L78 L79 I127 R128L78-Q131 WeakPolarHBondContact CD2-O 3.4Å; L79-Q131 HydrophobicContact CD2-CB 3.91Å; L79-Q131 HydrophobicContact CD2-CG 4.34Å; I127-Q131 WeakPolarHBondContact O-CG 3.37Å; I127-Q131 PolarHBondContact O-N 3.2Å; R128-Q131 PolarHBondContact O-NE2 2.75Å
132G87.4Confident92.8Very high61 Ų6167.1 Ų67.163%0.62934%0.339SS*.THydrogen-bonded Turntrans-89.70177.800000115.1N130N130-G132 PolarHBondContact O-N 3.17Å
133V89.5Confident92.8Very high75 Ų7569.9 Ų69.946%0.45535%0.346SS..SBendtrans-120.5131.1-173.7-178.10000109.8H82 N130 I135H82-V133 PolarHBondContact CE1-O 2.75Å; H82-V133 PolarHBondContact NE2-O 2.94Å; H82-V133 VanDerWaalsContact NE2-O 3.13Å; N130-V133 HydrophobicContact CB-CB 4.48Å; N130-V133 PolarHBondContact O-N 3.37Å; V133-I135 PolarHBondContact O-N 2.97Å
134P87.4Confident92.9Very high103 Ų10369.8 Ų69.867%0.66935%0.346SS*.  trans-63.8122.8175.626.4-33.8000110.3L78L78-P134 HydrophobicContact CD1-CB 4.2Å
135I91.7Very high92.9Very high13 Ų1373.4 Ų73.47%0.06736%0.359CS..  trans-101.5149.5178.662.8167.4000112.1R81 H82 T85 F126 I127 V133 P137 I140R81-I135 HydrophobicContact CB-CG1 3.95Å; H82-I135 HydrophobicContact CB-CD1 4.47Å; T85-I135 HydrophobicContact CG2-CD1 4.4Å; T85-I135 WeakPolarHBondContact OG1-CD1 3.39Å; F126-I135 HydrophobicContact CE1-CG2 3.85Å; I127-I135 HydrophobicContact CG1-CD1 4.44Å; V133-I135 PolarHBondContact O-N 2.97Å; I135-P137 WeakPolarHBondContact O-CD 3.31Å; I135-I140 HydrophobicContact CB-CD1 3.59Å; I135-I140 HydrophobicContact CD1-CD1 3.93Å; I135-I140 HydrophobicContact CG1-CD1 4.31Å; I135-I140 HydrophobicContact CG2-CD1 3.88Å
136R91.5Very high93Very high144 Ų14470.2 Ų70.254%0.54335%0.352SS..  trans-98.7110.3166.7-68.7-179.2-176.1178.66.7108.3Y138 D139 F339R136-Y138 PolarHBondContact O-N 3.28Å; R136-Y138 VanDerWaalsContact O-N 3.13Å; R136-D139 HydrophobicContact CB-CB 4.36Å; R136-D139 VanDerWaalsContact CB-OD2 3.29Å; R136-D139 WeakPolarHBondContact CB-OD2 3.42Å; R136-D139 VanDerWaalsContact CD-OD2 3.24Å; R136-D139 WeakPolarHBondContact CD-OD2 3.43Å; R136-D139 PolarHBondContact O-N 3.24Å; R136-F339 VanDerWaalsContact CZ-CE1 3.41Å; R136-F339 VanDerWaalsContact NH2-CE1 3.33Å
137P90.2Very high93.1Very high27 Ų2766.4 Ų66.418%0.17534%0.335CS..Hα-helixtrans-58.6-29.3-175.5-27.134.6000114.1T85 I135 L141T85-P137 WeakPolarHBondContact OG1-CB 3.46Å; T85-P137 WeakPolarHBondContact OG1-CG 3.48Å; I135-P137 WeakPolarHBondContact O-CD 3.31Å; P137-L141 HydrophobicContact CB-CD1 4.29Å; P137-L141 WeakPolarHBondContact O-CB 3.39Å; P137-L141 WeakPolarHBondContact O-CD1 3.35Å; P137-L141 WeakPolarHBondContact O-CG 3.28Å; P137-L141 PolarHBondContact O-N 2.96Å; P137-L141 VanDerWaalsContact O-N 3.11Å
138Y90.2Very high93.2Very high145 Ų14566.4 Ų66.457%0.56934%0.335SS*.Hα-helixtrans-64.4-49.3179-178.8-97.7000111.9R136 I140 L141 H142R136-Y138 PolarHBondContact O-N 3.28Å; R136-Y138 VanDerWaalsContact O-N 3.13Å; Y138-I140 PolarHBondContact O-N 3.45Å; Y138-L141 PolarHBondContact O-N 3.49Å; Y138-H142 AromaticContact CZ-CD2 3.85Å; Y138-H142 WeakPolarHBondContact O-CB 3.41Å; Y138-H142 PolarHBondContact O-N 3.27Å; Y138-H142 PolarHBondContact OH-CD2 2.91Å
139D90.9Very high93.4Very high102 Ų10263.7 Ų63.755%0.54533%0.333SS..Hα-helixtrans-61.2-35.1-175.1-55.9-8.4000111.8R136R136-D139 HydrophobicContact CB-CB 4.36Å; R136-D139 VanDerWaalsContact CB-OD2 3.29Å; R136-D139 WeakPolarHBondContact CB-OD2 3.42Å; R136-D139 VanDerWaalsContact CD-OD2 3.24Å; R136-D139 WeakPolarHBondContact CD-OD2 3.43Å; R136-D139 PolarHBondContact O-N 3.24Å
140I92.5Very high93.6Very high32 Ų3258.2 Ų58.216%0.16430%0.304CS..Hα-helixtrans-86.4-31.4-177.1-58.5158.5000111.7V123 F126 I135 Y138V123-I140 HydrophobicContact CB-CG2 4.27Å; V123-I140 HydrophobicContact CG1-CG2 3.66Å; V123-I140 HydrophobicContact CG2-CG2 3.9Å; F126-I140 HydrophobicContact CD1-CD1 3.87Å; F126-I140 HydrophobicContact CD1-CG1 4.27Å; F126-I140 HydrophobicContact CD1-CG2 4.23Å; F126-I140 HydrophobicContact CE1-CD1 3.38Å; F126-I140 HydrophobicContact CE1-CG1 3.91Å; F126-I140 HydrophobicContact CZ-CD1 4.29Å; I135-I140 HydrophobicContact CB-CD1 3.59Å; I135-I140 HydrophobicContact CD1-CD1 3.93Å; I135-I140 HydrophobicContact CG1-CD1 4.31Å; I135-I140 HydrophobicContact CG2-CD1 3.88Å; Y138-I140 PolarHBondContact O-N 3.45Å
141L96.2Very high93.8Very high1 Ų155.9 Ų55.91%0.00529%0.292CS..Hα-helixtrans-96.4-9.1-173.9-64.8172.9000113.8T85 A88 I89 V123 P137 Y138 E143 L144 R145T85-L141 HydrophobicContact CG2-CD1 3.86Å; T85-L141 HydrophobicContact CG2-CD2 3.86Å; T85-L141 HydrophobicContact CG2-CG 3.84Å; A88-L141 HydrophobicContact CB-CD1 3.54Å; I89-L141 HydrophobicContact CD1-CD2 4.42Å; I89-L141 HydrophobicContact CG1-CD2 3.8Å; V123-L141 HydrophobicContact CG1-CD2 4.09Å; P137-L141 HydrophobicContact CB-CD1 4.29Å; P137-L141 WeakPolarHBondContact O-CB 3.39Å; P137-L141 WeakPolarHBondContact O-CD1 3.35Å; P137-L141 WeakPolarHBondContact O-CG 3.28Å; P137-L141 PolarHBondContact O-N 2.96Å; P137-L141 VanDerWaalsContact O-N 3.11Å; Y138-L141 PolarHBondContact O-N 3.49Å; L141-E143 PolarHBondContact O-N 3.4Å; L141-L144 HydrophobicContact CD2-CD2 4Å; L141-L144 PolarHBondContact O-N 2.99Å; L141-R145 HydrophobicContact CB-CG 4.33Å; L141-R145 WeakPolarHBondContact O-CB 3.2Å; L141-R145 WeakPolarHBondContact O-CG 3.47Å; L141-R145 PolarHBondContact O-N 3.14Å
142H95.5Very high94.2Very high92 Ų9254.5 Ų54.543%0.42629%0.286SS..Hα-helixtrans-54.3-56.2-174.7178.5-85.4000111.4Y138 L144 R145 D146Y138-H142 AromaticContact CZ-CD2 3.85Å; Y138-H142 WeakPolarHBondContact O-CB 3.41Å; Y138-H142 PolarHBondContact O-N 3.27Å; Y138-H142 PolarHBondContact OH-CD2 2.91Å; H142-L144 PolarHBondContact O-N 3.29Å; H142-R145 PolarHBondContact O-N 3.41Å; H142-D146 PolarHBondContact O-N 3.31Å
143E96.3Very high94.7Very high81 Ų8156.8 Ų56.838%0.37928%0.28SS..Hα-helixtrans-56.1-56178.8-17761.8-162.700110.9E119 L141 R145 D146 I147E119-E143 HydrophobicContact CG-CG 4.03Å; L141-E143 PolarHBondContact O-N 3.4Å; E143-R145 PolarHBondContact O-N 3.5Å; E143-R145 VanDerWaalsContact O-N 3.11Å; E143-D146 WeakPolarHBondContact O-CB 3.24Å; E143-D146 PolarHBondContact O-N 3.5Å; E143-I147 WeakPolarHBondContact O-CG1 3.44Å; E143-I147 PolarHBondContact O-N 3.17Å; E143-I147 VanDerWaalsContact OE1-CG2 3.28Å; E143-I147 WeakPolarHBondContact OE1-CG2 3.48Å
144L97.5Very high95Very high0 Ų054.3 Ų54.30%026%0.263CS..Hα-helixtrans-53-39.9180175.261.7000112.7I89 V116 E119 M120 V123 L141 H142 S148I89-L144 HydrophobicContact CG1-CD2 4.01Å; V116-L144 HydrophobicContact CG1-CD1 4.03Å; E119-L144 HydrophobicContact CB-CB 4.47Å; E119-L144 HydrophobicContact CB-CD1 4.11Å; M120-L144 HydrophobicContact CB-CD1 4.47Å; M120-L144 HydrophobicContact CE-CD1 4.01Å; M120-L144 HydrophobicContact CG-CD1 3.41Å; M120-L144 VanDerWaalsContact CG-CD1 3.41Å; M120-L144 HydrophobicContact CG-CD2 4.01Å; M120-L144 HydrophobicContact CG-CG 4.37Å; V123-L144 HydrophobicContact CG2-CD2 4.46Å; L141-L144 HydrophobicContact CD2-CD2 4Å; L141-L144 PolarHBondContact O-N 2.99Å; H142-L144 PolarHBondContact O-N 3.29Å; L144-S148 WeakPolarHBondContact O-CB 3.37Å; L144-S148 PolarHBondContact O-N 2.89Å; L144-S148 VanDerWaalsContact O-N 3.13Å; L144-S148 PolarHBondContact O-OG 2.94Å
145R96.8Very high95.4Very high80 Ų8049.4 Ų49.430%0.30223%0.232SC..Hα-helixtrans-69.4-40.5179.1-72.4173.6178.9179.83.4111.6L141 H142 E143 S149L141-R145 HydrophobicContact CB-CG 4.33Å; L141-R145 WeakPolarHBondContact O-CB 3.2Å; L141-R145 WeakPolarHBondContact O-CG 3.47Å; L141-R145 PolarHBondContact O-N 3.14Å; H142-R145 PolarHBondContact O-N 3.41Å; E143-R145 PolarHBondContact O-N 3.5Å; E143-R145 VanDerWaalsContact O-N 3.11Å; R145-S149 WeakPolarHBondContact O-CB 3.44Å; R145-S149 PolarHBondContact O-N 3.39Å; R145-S149 VanDerWaalsContact O-N 3.09Å; R145-S149 PolarHBondContact O-OG 3.17Å
146D97.6Very high95.5Very high71 Ų7153.8 Ų53.838%0.3825%0.252SS..Hα-helixtrans-66.2-57.6-179.2-168.938.6000110.8H142 E143 S148 S149 M150H142-D146 PolarHBondContact O-N 3.31Å; E143-D146 WeakPolarHBondContact O-CB 3.24Å; E143-D146 PolarHBondContact O-N 3.5Å; D146-S148 VanDerWaalsContact C-N 3.26Å; D146-S148 PolarHBondContact O-N 2.9Å; D146-S149 WeakPolarHBondContact O-CA 3.43Å; D146-S149 WeakPolarHBondContact O-CB 3.42Å; D146-S149 PolarHBondContact O-N 3.42Å; D146-M150 PolarHBondContact O-N 3.46Å; D146-M150 WeakPolarHBondContact OD2-CE 3.44Å
147I97.8Very high95.7Very high4 Ų452.8 Ų52.82%0.02125%0.253CS..Hα-helixtrans-61.9-31.2178.964.4172.9000113.3K115 V116 E119 E143 M150 A151 L376K115-I147 HydrophobicContact CG-CD1 3.93Å; V116-I147 HydrophobicContact CB-CD1 4.36Å; V116-I147 HydrophobicContact CG2-CB 4.25Å; V116-I147 HydrophobicContact CG2-CD1 4.06Å; V116-I147 HydrophobicContact CG2-CG1 3.93Å; E119-I147 HydrophobicContact CB-CD1 3.84Å; E119-I147 HydrophobicContact CG-CD1 3.9Å; E143-I147 WeakPolarHBondContact O-CG1 3.44Å; E143-I147 PolarHBondContact O-N 3.17Å; E143-I147 VanDerWaalsContact OE1-CG2 3.28Å; E143-I147 WeakPolarHBondContact OE1-CG2 3.48Å; I147-M150 HydrophobicContact CB-CE 4.5Å; I147-M150 HydrophobicContact CG2-CE 3.88Å; I147-A151 WeakPolarHBondContact O-CB 3.44Å; I147-A151 PolarHBondContact O-N 3.02Å; I147-L376 HydrophobicContact CB-CD2 3.8Å; I147-L376 HydrophobicContact CG2-CD2 4.05Å
148S98.2Very high95.8Very high0 Ų055.5 Ų55.50%027%0.266CS..Hα-helixtrans-67.2-39.2172.6-64.40000111.6V116 L144 D146 M152V116-S148 WeakPolarHBondContact CG1-OG 3.34Å; L144-S148 WeakPolarHBondContact O-CB 3.37Å; L144-S148 PolarHBondContact O-N 2.89Å; L144-S148 VanDerWaalsContact O-N 3.13Å; L144-S148 PolarHBondContact O-OG 2.94Å; D146-S148 VanDerWaalsContact C-N 3.26Å; D146-S148 PolarHBondContact O-N 2.9Å; S148-M152 WeakPolarHBondContact O-CE 3.36Å; S148-M152 WeakPolarHBondContact O-CG 3.35Å; S148-M152 PolarHBondContact O-N 3.43Å; S148-M152 VanDerWaalsContact O-N 3.17Å
149S97.9Very high95.9Very high56 Ų5649.2 Ų49.239%0.39224%0.242SC..Hα-helixtrans-70.8-49.1-179.5-56.40000110.5R145 D146 A151 M152 E153R145-S149 WeakPolarHBondContact O-CB 3.44Å; R145-S149 PolarHBondContact O-N 3.39Å; R145-S149 VanDerWaalsContact O-N 3.09Å; R145-S149 PolarHBondContact O-OG 3.17Å; D146-S149 WeakPolarHBondContact O-CA 3.43Å; D146-S149 WeakPolarHBondContact O-CB 3.42Å; D146-S149 PolarHBondContact O-N 3.42Å; S149-A151 VanDerWaalsContact C-N 3.27Å; S149-A151 PolarHBondContact O-N 3.05Å; S149-M152 PolarHBondContact O-N 3.3Å; S149-E153 PolarHBondContact O-N 2.87Å
150M97.9Very high96Very high32 Ų3245.4 Ų45.416%0.15822%0.222CC..Hα-helixtrans-53.6-43.2172.9-74.4-162.2-88.300112D146 I147 M152 E153 H154 L376 I379D146-M150 PolarHBondContact O-N 3.46Å; D146-M150 WeakPolarHBondContact OD2-CE 3.44Å; I147-M150 HydrophobicContact CB-CE 4.5Å; I147-M150 HydrophobicContact CG2-CE 3.88Å; M150-M152 PolarHBondContact O-N 3.37Å; M150-E153 PolarHBondContact O-N 3.04Å; M150-H154 WeakPolarHBondContact O-CB 3.46Å; M150-H154 PolarHBondContact O-N 3.04Å; M150-L376 HydrophobicContact CB-CD2 3.46Å; M150-L376 VanDerWaalsContact CB-CD2 3.46Å; M150-L376 HydrophobicContact CB-CG 3.96Å; M150-L376 HydrophobicContact CE-CD2 3.72Å; M150-L376 HydrophobicContact CE-CG 4.27Å; M150-L376 HydrophobicContact CG-CD2 4.3Å; M150-L376 HydrophobicContact SD-CD2 3.98Å; M150-L376 HydrophobicContact SD-CG 4.06Å; M150-I379 HydrophobicContact SD-CD1 3.63Å
151A97.8Very high95.9Very high0 Ų047.1 Ų47.10%024%0.235CC..Hα-helixtrans-63-39.7176.600000113.6I100 F112 P113 V116 I147 S149 F155I100-A151 HydrophobicContact CD1-CB 4.45Å; F112-A151 WeakPolarHBondContact CZ-O 3.47Å; P113-A151 HydrophobicContact CB-CB 3.72Å; P113-A151 HydrophobicContact CG-CB 3.51Å; V116-A151 HydrophobicContact CG2-CB 4.28Å; I147-A151 WeakPolarHBondContact O-CB 3.44Å; I147-A151 PolarHBondContact O-N 3.02Å; S149-A151 VanDerWaalsContact C-N 3.27Å; S149-A151 PolarHBondContact O-N 3.05Å; A151-F155 WeakPolarHBondContact O-CB 3.41Å; A151-F155 PolarHBondContact O-N 2.76Å; A151-F155 VanDerWaalsContact O-N 3.07Å
152M98Very high95.6Very high26 Ų2649.9 Ų49.913%0.12825%0.254CS..Hα-helixtrans-69.8-42.2177.5-71-177.1-68.400111.5L95 L96 S148 S149 M150 F155 E156L95-M152 HydrophobicContact CB-CE 4.34Å; L95-M152 HydrophobicContact CB-SD 3.84Å; L96-M152 HydrophobicContact CD2-CG 3.95Å; L96-M152 HydrophobicContact CD2-SD 4.5Å; S148-M152 WeakPolarHBondContact O-CE 3.36Å; S148-M152 WeakPolarHBondContact O-CG 3.35Å; S148-M152 PolarHBondContact O-N 3.43Å; S148-M152 VanDerWaalsContact O-N 3.17Å; S149-M152 PolarHBondContact O-N 3.3Å; M150-M152 PolarHBondContact O-N 3.37Å; M152-F155 WeakPolarHBondContact O-CB 3.17Å; M152-F155 PolarHBondContact O-N 3.07Å; M152-E156 WeakPolarHBondContact O-CG 3.4Å; M152-E156 PolarHBondContact O-N 2.96Å
153E97.2Very high95.1Very high109 Ų10945.8 Ų45.851%0.50924%0.236SC..Hα-helixtrans-61.2-50.6175.4-177.1171.8-161.900110.9S149 M150 F155 E156 E157S149-E153 PolarHBondContact O-N 2.87Å; M150-E153 PolarHBondContact O-N 3.04Å; E153-F155 VanDerWaalsContact C-N 3.25Å; E153-F155 PolarHBondContact O-N 3.31Å; E153-E156 PolarHBondContact O-N 3.45Å; E153-E157 HydrophobicContact CG-CG 4.31Å; E153-E157 WeakPolarHBondContact O-CB 3.47Å; E153-E157 WeakPolarHBondContact O-CG 3.46Å; E153-E157 PolarHBondContact O-N 2.9Å
154H95.4Very high94.4Very high22 Ų2246.2 Ų46.210%0.10224%0.238CC..Hα-helixtrans-56-41.4175.5177.6-88.3000112F112 M150 N158F112-H154 AromaticContact CE2-ND1 3.65Å; F112-H154 AromaticContact CZ-ND1 3.6Å; M150-H154 WeakPolarHBondContact O-CB 3.46Å; M150-H154 PolarHBondContact O-N 3.04Å; H154-N158 PolarHBondContact CD2-ND2 2.94Å; H154-N158 WeakPolarHBondContact O-CB 3.26Å; H154-N158 PolarHBondContact O-N 2.86Å; H154-N158 PolarHBondContact O-ND2 2.85Å
155F96.3Very high93.1Very high0 Ų051.8 Ų51.80%027%0.267CS..Iπ-helixtrans-63.1-47.1175.2177-95.9000112S99 I100 Y103 F112 A151 M152 E153 I159 L160 L163S99-F155 WeakPolarHBondContact O-CE1 3.38Å; I100-F155 HydrophobicContact CD1-CB 4.2Å; I100-F155 HydrophobicContact CG1-CB 3.9Å; I100-F155 HydrophobicContact CG1-CD1 4.22Å; I100-F155 HydrophobicContact CG1-CD2 4.11Å; I100-F155 HydrophobicContact CG1-CG 3.8Å; I100-F155 HydrophobicContact CG2-CD2 4.22Å; I100-F155 HydrophobicContact CG2-CE2 4.5Å; Y103-F155 AromaticContact CD2-CE1 3.78Å; Y103-F155 HydrophobicContact CD2-CE1 3.78Å; Y103-F155 HydrophobicContact CD2-CE2 4.3Å; Y103-F155 AromaticContact CD2-CZ 3.29Å; Y103-F155 HydrophobicContact CD2-CZ 3.29Å; Y103-F155 AromaticContact CE2-CE1 3.62Å; Y103-F155 HydrophobicContact CE2-CE1 3.62Å; Y103-F155 AromaticContact CE2-CZ 3.55Å; Y103-F155 HydrophobicContact CE2-CZ 3.55Å; Y103-F155 AromaticContact CG-CZ 3.9Å; Y103-F155 HydrophobicContact CG-CZ 3.9Å; F112-F155 HydrophobicContact CE1-CB 4.07Å; F112-F155 HydrophobicContact CE1-CD2 4.15Å; F112-F155 HydrophobicContact CZ-CB 4.22Å; A151-F155 WeakPolarHBondContact O-CB 3.41Å; A151-F155 PolarHBondContact O-N 2.76Å; A151-F155 VanDerWaalsContact O-N 3.07Å; M152-F155 WeakPolarHBondContact O-CB 3.17Å; M152-F155 PolarHBondContact O-N 3.07Å; E153-F155 VanDerWaalsContact C-N 3.25Å; E153-F155 PolarHBondContact O-N 3.31Å; F155-I159 HydrophobicContact CD2-CB 3.79Å; F155-I159 HydrophobicContact CD2-CD1 4.07Å; F155-I159 HydrophobicContact CD2-CG1 4.49Å; F155-I159 HydrophobicContact CD2-CG2 3.84Å; F155-I159 HydrophobicContact CE2-CB 4.13Å; F155-I159 HydrophobicContact CE2-CG2 3.73Å; F155-I159 HydrophobicContact CG-CB 4.5Å; F155-I159 PolarHBondContact O-N 3.43Å; F155-L160 HydrophobicContact CD1-CB 4.31Å; F155-L160 HydrophobicContact CE1-CB 3.93Å; F155-L160 HydrophobicContact CE1-CD1 3.95Å; F155-L160 HydrophobicContact CE1-CD2 4.31Å; F155-L160 HydrophobicContact CE1-CG 4.28Å; F155-L160 HydrophobicContact CZ-CB 4.26Å; F155-L160 HydrophobicContact CZ-CD1 4.07Å; F155-L160 VanDerWaalsContact O-CB 3.29Å; F155-L160 WeakPolarHBondContact O-CB 3.3Å; F155-L160 PolarHBondContact O-N 3.49Å; F155-L163 HydrophobicContact CE2-CD1 4.15Å; F155-L163 HydrophobicContact CZ-CD1 4.09Å
156E94.6Very high91.5Very high106 Ų10652.8 Ų52.850%0.49527%0.273SS..Iπ-helixtrans-65.9-37.6-178.5-73.9-174.7178.300112.8M152 E153 L160 P161M152-E156 WeakPolarHBondContact O-CG 3.4Å; M152-E156 PolarHBondContact O-N 2.96Å; E153-E156 PolarHBondContact O-N 3.45Å; E156-L160 HydrophobicContact CG-CD2 4.47Å; E156-P161 WeakPolarHBondContact O-CD 3.38Å
157E94.5Very high89.7Confident122 Ų12251.6 Ų51.657%0.5727%0.271SS*.Iπ-helixtrans-84.8-41.1-176.3-66-174.9158.600113.6E153 P161E153-E157 HydrophobicContact CG-CG 4.31Å; E153-E157 WeakPolarHBondContact O-CB 3.47Å; E153-E157 WeakPolarHBondContact O-CG 3.46Å; E153-E157 PolarHBondContact O-N 2.9Å; E157-P161 WeakPolarHBondContact O-CG 3.28Å
158N92.6Very high87.5Confident84 Ų8456.8 Ų56.845%0.44930%0.299SS..Iπ-helixtrans-107.1-37.3-168.3-59.6-79.6000113H154H154-N158 PolarHBondContact CD2-ND2 2.94Å; H154-N158 WeakPolarHBondContact O-CB 3.26Å; H154-N158 PolarHBondContact O-N 2.86Å; H154-N158 PolarHBondContact O-ND2 2.85Å
159I92.8Very high85.6Confident13 Ų1361.9 Ų61.97%0.06733%0.325CS..Iπ-helixtrans-96.2-50.6-170.8-57.4175.2000110.8C109 F112 F155 P161 S162 L163C109-I159 HydrophobicContact CB-CG2 4.49Å; F112-I159 HydrophobicContact CD1-CD1 3.76Å; F112-I159 HydrophobicContact CE1-CD1 3.45Å; F112-I159 VanDerWaalsContact CE1-CD1 3.45Å; F112-I159 HydrophobicContact CG-CD1 4.46Å; F112-I159 HydrophobicContact CZ-CD1 3.88Å; F155-I159 HydrophobicContact CD2-CB 3.79Å; F155-I159 HydrophobicContact CD2-CD1 4.07Å; F155-I159 HydrophobicContact CD2-CG1 4.49Å; F155-I159 HydrophobicContact CD2-CG2 3.84Å; F155-I159 HydrophobicContact CE2-CB 4.13Å; F155-I159 HydrophobicContact CE2-CG2 3.73Å; F155-I159 HydrophobicContact CG-CB 4.5Å; F155-I159 PolarHBondContact O-N 3.43Å; I159-P161 VanDerWaalsContact C-CD 3.48Å; I159-S162 WeakPolarHBondContact O-CB 3.47Å; I159-S162 PolarHBondContact O-N 3.17Å; I159-L163 HydrophobicContact CG2-CD1 4.15Å; I159-L163 HydrophobicContact CG2-CG 4.33Å; I159-L163 WeakPolarHBondContact O-CG 3.43Å; I159-L163 PolarHBondContact O-N 3.47Å
160L92.2Very high83.2Confident23 Ų2361.5 Ų61.512%0.1233%0.33CS..Hα-helixtrans-58.3-41.2-174-176.160.7000113.9Y103 F155 E156 S162 L163 H164Y103-L160 HydrophobicContact CE1-CD1 3.85Å; Y103-L160 HydrophobicContact CE2-CD1 3.91Å; Y103-L160 VanDerWaalsContact OH-CD1 3.26Å; Y103-L160 WeakPolarHBondContact OH-CD1 3.46Å; F155-L160 HydrophobicContact CD1-CB 4.31Å; F155-L160 HydrophobicContact CE1-CB 3.93Å; F155-L160 HydrophobicContact CE1-CD1 3.95Å; F155-L160 HydrophobicContact CE1-CD2 4.31Å; F155-L160 HydrophobicContact CE1-CG 4.28Å; F155-L160 HydrophobicContact CZ-CB 4.26Å; F155-L160 HydrophobicContact CZ-CD1 4.07Å; F155-L160 VanDerWaalsContact O-CB 3.29Å; F155-L160 WeakPolarHBondContact O-CB 3.3Å; F155-L160 PolarHBondContact O-N 3.49Å; E156-L160 HydrophobicContact CG-CD2 4.47Å; L160-S162 VanDerWaalsContact C-N 3.3Å; L160-S162 PolarHBondContact O-N 3.42Å; L160-L163 WeakPolarHBondContact O-CB 3.34Å; L160-L163 PolarHBondContact O-N 2.87Å; L160-L163 VanDerWaalsContact O-N 3.08Å; L160-H164 WeakPolarHBondContact CD1-NE2 3.38Å; L160-H164 PolarHBondContact O-N 3.09Å; L160-H164 VanDerWaalsContact O-N 3.1Å
161P91.5Very high80.7Confident67 Ų6765.8 Ų65.844%0.43535%0.353SS..Hα-helixtrans-59.8-41.4177.9-25.137000112.3E156 E157 I159 L163 H164 L165E156-P161 WeakPolarHBondContact O-CD 3.38Å; E157-P161 WeakPolarHBondContact O-CG 3.28Å; I159-P161 VanDerWaalsContact C-CD 3.48Å; P161-L163 VanDerWaalsContact C-N 3.26Å; P161-L163 PolarHBondContact O-N 3.12Å; P161-H164 PolarHBondContact O-N 3.16Å; P161-L165 PolarHBondContact O-N 3.23Å
162S88.2Confident77.9Confident59 Ų5969.9 Ų69.941%0.41338%0.382SS..Hα-helixtrans-64.7-29177.2-58.90000112.7I159 L160I159-S162 WeakPolarHBondContact O-CB 3.47Å; I159-S162 PolarHBondContact O-N 3.17Å; L160-S162 VanDerWaalsContact C-N 3.3Å; L160-S162 PolarHBondContact O-N 3.42Å
163L87Confident75.2Confident7 Ų779 Ų794%0.03742%0.416CS..Hα-helixtrans-77.6-33.6176.3-60-178000112.8Y103 R108 C109 F155 I159 L160 P161 S167Y103-L163 HydrophobicContact CD1-CD1 4.04Å; Y103-L163 HydrophobicContact CG-CD1 4.24Å; R108-L163 HydrophobicContact CB-CD1 4.5Å; R108-L163 HydrophobicContact CB-CD2 4.4Å; R108-L163 WeakPolarHBondContact O-CD2 3.45Å; C109-L163 HydrophobicContact CB-CD1 4.31Å; F155-L163 HydrophobicContact CE2-CD1 4.15Å; F155-L163 HydrophobicContact CZ-CD1 4.09Å; I159-L163 HydrophobicContact CG2-CD1 4.15Å; I159-L163 HydrophobicContact CG2-CG 4.33Å; I159-L163 WeakPolarHBondContact O-CG 3.43Å; I159-L163 PolarHBondContact O-N 3.47Å; L160-L163 WeakPolarHBondContact O-CB 3.34Å; L160-L163 PolarHBondContact O-N 2.87Å; L160-L163 VanDerWaalsContact O-N 3.08Å; P161-L163 VanDerWaalsContact C-N 3.26Å; P161-L163 PolarHBondContact O-N 3.12Å; L163-S167 PolarHBondContact O-N 2.9Å
164H80.2Confident72.6Confident89 Ų8980.9 Ų80.941%0.41243%0.428SS..Hα-helixtrans-74.7-37.4176.9-70.8167.6000112.3L160 P161 K166 S167 N168L160-H164 WeakPolarHBondContact CD1-NE2 3.38Å; L160-H164 PolarHBondContact O-N 3.09Å; L160-H164 VanDerWaalsContact O-N 3.1Å; P161-H164 PolarHBondContact O-N 3.16Å; H164-K166 VanDerWaalsContact C-N 3.29Å; H164-K166 PolarHBondContact O-N 3.09Å; H164-S167 WeakPolarHBondContact O-CA 3.21Å; H164-S167 WeakPolarHBondContact O-CB 3.48Å; H164-S167 PolarHBondContact O-N 3.31Å; H164-N168 PolarHBondContact O-N 2.86Å
165L71.4Confident69.7Low118 Ų11885 Ų8562%0.61846%0.459SS*.Hα-helixtrans-57.5-44.2176.7-17361.9000111.5P161 S167 N168 L169P161-L165 PolarHBondContact O-N 3.23Å; L165-S167 VanDerWaalsContact C-N 3.26Å; L165-S167 PolarHBondContact O-N 3.41Å; L165-N168 PolarHBondContact O-N 3.48Å; L165-L169 PolarHBondContact O-N 2.84Å
166K61.9Low66.8Low100 Ų10090.4 Ų90.444%0.43550%0.497SS..Hα-helixtrans-62.1-33.1175-68.8178.7-179.1177.10112.8H164 G170 C367H164-K166 VanDerWaalsContact C-N 3.29Å; H164-K166 PolarHBondContact O-N 3.09Å; K166-G170 PolarHBondContact O-N 3.31Å; K166-C367 PolarHBondContact NZ-O 3.48Å
167S59.6Low64.1Low46 Ų4694 Ų9432%0.32251%0.514SS..Hα-helixtrans-73.3-34178.2-157.70000112.8L163 H164 L165L163-S167 PolarHBondContact O-N 2.9Å; H164-S167 WeakPolarHBondContact O-CA 3.21Å; H164-S167 WeakPolarHBondContact O-CB 3.48Å; H164-S167 PolarHBondContact O-N 3.31Å; L165-S167 VanDerWaalsContact C-N 3.26Å; L165-S167 PolarHBondContact O-N 3.41Å
168N52.6Low61.3Low114 Ų11495.9 Ų95.961%0.6153%0.527SS*.Hα-helixtrans-78.4-35178.3-71.1-18000111.8H164 L165 G170 N171 S172H164-N168 PolarHBondContact O-N 2.86Å; L165-N168 PolarHBondContact O-N 3.48Å; N168-G170 VanDerWaalsContact C-N 3.29Å; N168-G170 PolarHBondContact O-N 3.45Å; N168-N171 PolarHBondContact O-N 2.87Å; N168-N171 VanDerWaalsContact O-N 3.16Å; N168-S172 PolarHBondContact O-N 2.88Å
169L56.9Low58.4Low107 Ų10797.7 Ų97.756%0.5655%0.546SS*.Hα-helixtrans-65.3-33.8176.5-133.970.6000112.3L165 N171 S172L165-L169 PolarHBondContact O-N 2.84Å; L169-N171 PolarHBondContact O-N 3.19Å; L169-S172 PolarHBondContact O-N 2.93Å
170G48.9Very low55.5Low48 Ų48102.4 Ų102.450%0.49558%0.58SS.*Hα-helixtrans-66.1-17.5174.600000115.1K166 N168K166-G170 PolarHBondContact O-N 3.31Å; N168-G170 VanDerWaalsContact C-N 3.29Å; N168-G170 PolarHBondContact O-N 3.45Å
171N44.9Very low52.8Low121 Ų121106.7 Ų106.765%0.64761%0.61SS**Hα-helixtrans-105.6-13179.6-69.217.4000113N168 L169 S175N168-N171 PolarHBondContact O-N 2.87Å; N168-N171 VanDerWaalsContact O-N 3.16Å; L169-N171 PolarHBondContact O-N 3.19Å; N171-S175 PolarHBondContact O-OG 3.46Å
172S38.2Very low50.2Low87 Ų87109 Ų10961%0.60863%0.627SS**Hα-helixtrans-85.6-20.8-174.4-166.40000114.1N168 L169N168-S172 PolarHBondContact O-N 2.88Å; L169-S172 PolarHBondContact O-N 2.93Å
173W41.6Very low47.7Very low217 Ų217114.3 Ų114.382%0.82265%0.649SS**SBendtrans-93.5-2.9-176.7-80.488.4000115
174L43.7Very low45.3Very low149 Ų149119 Ų11978%0.7868%0.682SS**SBendtrans-118.311.5-175.6-62.4177.6000114.5
175S33.5Very low43.3Very low107 Ų107123.6 Ų123.675%0.74870%0.704SS**SBendtrans-11315-173.9-57.30000115.3N171N171-S175 PolarHBondContact O-OG 3.46Å
176S36Very low41.6Very low114 Ų114122.2 Ų122.280%0.79771%0.71SS**SBendtrans-120.40.1-175.1-158.50000117
177E38.2Very low40.3Very low183 Ų183129.7 Ų129.786%0.85574%0.735SS**  trans-136.762.1-178.3-65.9-169.8131.800112.7
178L34.8Very low39.2Very low161 Ų161131 Ų13184%0.84376%0.756SS**  trans-120.884.6154.5-98.689000108.5
179S32.6Very low38.6Very low121 Ų121131.1 Ų131.185%0.84676%0.763SS**  trans-128.887.9159.8-74.10000106.9
180S31.7Very low38.1Very low112 Ų112133.4 Ų133.478%0.78377%0.774SS**  trans-85.8132.1173.6-45.20000109.7
181P35.8Very low37.6Very low114 Ų114137 Ų13774%0.7479%0.789SS**  trans-118118.3154.727.4-11.2000111.3
182S37Very low37.1Very low115 Ų115138 Ų13880%0.80479%0.793SS**  trans45107.9130.8-38.30000119.9
183I34.8Very low37.2Very low171 Ų171141.5 Ų141.588%0.87781%0.805SS**  trans-70.1133.6162.5-72.4166.6000110.7
184S37Very low37Very low104 Ų104140.1 Ų140.173%0.72781%0.808SS**  trans-148.7112.6161.6-59.60000111.9
185Q38.2Very low36.6Very low187 Ų187140.7 Ų140.787%0.87481%0.811SS**  trans48.5118.9134.3-66.8-177.827.800121.8
186A36.6Very low37Very low89 Ų89146.3 Ų146.374%0.73682%0.816SS**  130.3124.4107.400000118.2
187R34.5Very low37.3Very low256 Ų256145.1 Ų145.197%0.96681%0.813SS**  trans71.3123.7137.7-83.9-178.3170.6168.9-2.1122.5
188G36.3Very low37.2Very low73 Ų73141.3 Ų141.375%0.75380%0.802SS**  trans167.9109.2149.500000113.2
189P38.7Very low37.7Very low117 Ų117138 Ų13876%0.7679%0.792SS**  trans-105.3-168.9-175.437.6-27.6000113.8
190I46.5Very low38.3Very low156 Ų156137.6 Ų137.680%0.878%0.784SS**  trans114.4143.2163.1-56.6155.3000112.5
191P38.6Very low38.9Very low123 Ų123139.8 Ų139.880%0.79978%0.78SS**  cis-132.1170.4-22.231.5-12.5000115.6
192L35.4Very low39.5Very low142 Ų142140.8 Ų140.874%0.74377%0.773SS**  trans-88.3125.9179.2173.974000111.8
193D39.5Very low40.2Very low160 Ų160144.9 Ų144.986%0.85677%0.771SS**  trans-157.7150.5152.3-101.4-32.6000109
194E37.1Very low41.1Very low188 Ų188143.9 Ų143.988%0.87976%0.762SS**  trans88.217.8-176.4-60.9-162.4135.400120.1R196E194-R196 PolarHBondContact O-N 3.41Å
195L36Very low41.8Very low161 Ų161144.4 Ų144.484%0.84375%0.753SS**THydrogen-bonded Turntrans-8869.4162.1-136.691.7000111.6
196R42.6Very low42.5Very low226 Ų226140.7 Ų140.785%0.85374%0.739SS**THydrogen-bonded Turntrans-148.8-12.5169.5-160.7165.7-81.1159.2-3.7118.1E194E194-R196 PolarHBondContact O-N 3.41Å
197A40.5Very low43.4Very low89 Ų89142 Ų14274%0.73673%0.734SS**SBendtrans-98.3-8.9-17900000115.6
198V37.7Very low44.6Very low103 Ų103136.1 Ų136.162%0.62472%0.717SS**SBendtrans-94.4-0.3-174-175.10000113.1T200V198-T200 PolarHBondContact O-N 2.99Å
199S45.5Very low45.4Very low90 Ų90138 Ų13863%0.62971%0.709SS**THydrogen-bonded Turntrans-79.7-14.2-172.648.20000115.6
200T44.6Very low46.3Very low113 Ų113135 Ų13569%0.69370%0.695SS**THydrogen-bonded Turntrans-100.1-30-179.546.10000113.8V198V198-T200 PolarHBondContact O-N 2.99Å
201F43.8Very low46.8Very low158 Ų158134.7 Ų134.769%0.69369%0.69SS**Hα-helixtrans-74.5-28.6-179.8-162.9-102.8000113.3R203F201-R203 VanDerWaalsContact C-N 3.32Å; F201-R203 PolarHBondContact O-N 3.48Å
202K49.5Very low47.6Very low136 Ų136134.7 Ų134.759%0.59168%0.679SS**Hα-helixtrans-72-18.9179.3-92.5-175.3173.8-179.50114.8L206K202-L206 WeakPolarHBondContact O-CB 3.46Å; K202-L206 WeakPolarHBondContact O-CD1 3.44Å; K202-L206 WeakPolarHBondContact O-CG 3.5Å; K202-L206 PolarHBondContact O-N 2.89Å
203R51.7Low48.2Very low200 Ų200131.5 Ų131.576%0.75567%0.668SS**Hα-helixtrans-80.3-33.6-171.5-142.2174.2-173.3-179.31.3113.4F201 N207F201-R203 VanDerWaalsContact C-N 3.32Å; F201-R203 PolarHBondContact O-N 3.48Å; R203-N207 PolarHBondContact O-N 3.07Å
204Q53.3Low48.9Very low150 Ų150132.9 Ų132.970%0.70166%0.663SS**Hα-helixtrans-74.6-36.4174.6-83.8-179.4-27.700112.3L206 N207 Q208Q204-L206 VanDerWaalsContact C-N 3.32Å; Q204-L206 PolarHBondContact O-N 3.43Å; Q204-N207 PolarHBondContact O-N 2.92Å; Q204-Q208 PolarHBondContact O-N 3.46Å
205Q51.6Low49.6Very low115 Ų115130.7 Ų130.754%0.53765%0.653SS.*Hα-helixtrans-67.6-34.1177-141.5-177.645.200112Q208 L209Q205-Q208 PolarHBondContact O-N 3.39Å; Q205-L209 PolarHBondContact O-N 3.02Å
206L52.6Low50.3Low109 Ų109128.4 Ų128.457%0.57164%0.641SS**Hα-helixtrans-66.3-35174.9-88.1163.3000113.6K202 Q204 L209 A210K202-L206 WeakPolarHBondContact O-CB 3.46Å; K202-L206 WeakPolarHBondContact O-CD1 3.44Å; K202-L206 WeakPolarHBondContact O-CG 3.5Å; K202-L206 PolarHBondContact O-N 2.89Å; Q204-L206 VanDerWaalsContact C-N 3.32Å; Q204-L206 PolarHBondContact O-N 3.43Å; L206-L209 PolarHBondContact O-N 3.49Å; L206-A210 WeakPolarHBondContact O-CB 3.36Å; L206-A210 PolarHBondContact O-N 3.24Å
207N55.9Low50.7Low117 Ų117119.8 Ų119.863%0.62662%0.617SS**Hα-helixtrans-73.1-30.2176.8-87.7-10000113R203 Q204 Q211R203-N207 PolarHBondContact O-N 3.07Å; Q204-N207 PolarHBondContact O-N 2.92Å; N207-Q211 PolarHBondContact O-N 2.75Å
208Q58.7Low51.2Low133 Ų133121.5 Ų121.562%0.62162%0.615SS**Hα-helixtrans-72.7-38172.1-67.718013.300111.7Q204 Q205 A210 Q211 H212Q204-Q208 PolarHBondContact O-N 3.46Å; Q205-Q208 PolarHBondContact O-N 3.39Å; Q208-A210 VanDerWaalsContact C-N 3.32Å; Q208-A210 PolarHBondContact O-N 3.35Å; Q208-Q211 PolarHBondContact O-N 2.83Å; Q208-H212 PolarHBondContact O-N 3.4Å
209L54.4Low51.8Low112 Ų112122.9 Ų122.959%0.58662%0.616SS**Hα-helixtrans-64.8-33.8171.7-101.1124000112.8Q205 L206 Q211 H212 S213Q205-L209 PolarHBondContact O-N 3.02Å; L206-L209 PolarHBondContact O-N 3.49Å; L209-Q211 VanDerWaalsContact C-N 3.34Å; L209-Q211 PolarHBondContact O-N 3.13Å; L209-H212 PolarHBondContact O-N 3.3Å; L209-S213 PolarHBondContact O-N 3.23Å
210A56.6Low52.1Low55 Ų55123.7 Ų123.746%0.45561%0.609SS.*Hα-helixtrans-66.2-34.5175.600000112.7L206 Q208 S213L206-A210 WeakPolarHBondContact O-CB 3.36Å; L206-A210 PolarHBondContact O-N 3.24Å; Q208-A210 VanDerWaalsContact C-N 3.32Å; Q208-A210 PolarHBondContact O-N 3.35Å; A210-S213 WeakPolarHBondContact O-CB 3.32Å; A210-S213 PolarHBondContact O-N 2.63Å
211Q57.4Low52.2Low149 Ų149123.7 Ų123.770%0.69661%0.605SS**Hα-helixtrans-71.8-37.6173.9-73.3-175-11.500112.4N207 Q208 L209 S213 Y214N207-Q211 PolarHBondContact O-N 2.75Å; Q208-Q211 PolarHBondContact O-N 2.83Å; L209-Q211 VanDerWaalsContact C-N 3.34Å; L209-Q211 PolarHBondContact O-N 3.13Å; Q211-S213 VanDerWaalsContact C-N 3.3Å; Q211-S213 PolarHBondContact O-N 3Å; Q211-Y214 PolarHBondContact O-N 3.24Å
212H55.8Low52.6Low123 Ų123121.2 Ų121.257%0.56960%0.603SS**Hα-helixtrans-65.9-31.3173-98.1-86000113.1Q208 L209 Y214 Q215 L216Q208-H212 PolarHBondContact O-N 3.4Å; L209-H212 PolarHBondContact O-N 3.3Å; H212-Y214 VanDerWaalsContact C-N 3.31Å; H212-Y214 PolarHBondContact O-N 3.29Å; H212-Q215 PolarHBondContact O-N 3.02Å; H212-L216 PolarHBondContact O-N 3.36Å; H212-L216 VanDerWaalsContact O-N 3.17Å
213S48.3Very low52.7Low74 Ų74117.9 Ų117.952%0.51759%0.594SS.*Hα-helixtrans-61.6-37175.7-175.50000112.7L209 A210 Q211 Q215 L216 A217L209-S213 PolarHBondContact O-N 3.23Å; A210-S213 WeakPolarHBondContact O-CB 3.32Å; A210-S213 PolarHBondContact O-N 2.63Å; Q211-S213 VanDerWaalsContact C-N 3.3Å; Q211-S213 PolarHBondContact O-N 3Å; S213-Q215 VanDerWaalsContact C-N 3.31Å; S213-Q215 PolarHBondContact O-N 3.47Å; S213-L216 PolarHBondContact O-N 3.42Å; S213-A217 PolarHBondContact O-N 3.12Å; S213-A217 VanDerWaalsContact O-N 3.11Å
214Y52.8Low52.5Low189 Ų189116.6 Ų116.674%0.74159%0.589SS**Hα-helixtrans-71.1-24.5179.5-124.8-87.5000113.5Q211 H212Q211-Y214 PolarHBondContact O-N 3.24Å; H212-Y214 VanDerWaalsContact C-N 3.31Å; H212-Y214 PolarHBondContact O-N 3.29Å
215Q52.6Low52.4Low143 Ų143117.7 Ų117.767%0.66859%0.594SS**Hα-helixtrans-83.6-32.1174.5-68.4-176-3.100112.4H212 S213 N218H212-Q215 PolarHBondContact O-N 3.02Å; S213-Q215 VanDerWaalsContact C-N 3.31Å; S213-Q215 PolarHBondContact O-N 3.47Å; Q215-N218 PolarHBondContact O-N 2.88Å
216L50.2Low52.2Low113 Ų113118.2 Ų118.259%0.59260%0.597SS**Hα-helixtrans-68.6-36173.8-82.3163.9000112.6H212 S213 N218 M219 E220H212-L216 PolarHBondContact O-N 3.36Å; H212-L216 VanDerWaalsContact O-N 3.17Å; S213-L216 PolarHBondContact O-N 3.42Å; L216-N218 PolarHBondContact O-N 2.71Å; L216-M219 PolarHBondContact O-N 2.9Å; L216-E220 PolarHBondContact O-N 3.09Å
217A52Low52Low44 Ų44116.5 Ų116.536%0.36459%0.594SS.*Hα-helixtrans-62-25.717800000113.6S213S213-A217 PolarHBondContact O-N 3.12Å; S213-A217 VanDerWaalsContact O-N 3.11Å
218N51.3Low51.8Low126 Ų126112.9 Ų112.967%0.67458%0.584SS**Hα-helixtrans-83.5-16.5176.4-78-10.3000113.5Q215 L216Q215-N218 PolarHBondContact O-N 2.88Å; L216-N218 PolarHBondContact O-N 2.71Å
219M50.2Low51.7Low131 Ų131110.6 Ų110.665%0.64558%0.579SS**Hα-helixtrans-86.1-27.5170.3-77-158.569.400113L216 N221 V222 T223L216-M219 PolarHBondContact O-N 2.9Å; M219-N221 PolarHBondContact O-N 3.19Å; M219-N221 VanDerWaalsContact O-N 3.14Å; M219-V222 PolarHBondContact O-N 3.41Å; M219-T223 PolarHBondContact O-N 3.08Å; M219-T223 PolarHBondContact O-OG1 3.35Å
220E49.9Very low52Low107 Ų107109 Ų10950%0.557%0.574SS.*Hα-helixtrans-63.1-20.7-178.9-79.8-172.7131.900114.5L216 V222 T223 R224L216-E220 PolarHBondContact O-N 3.09Å; E220-V222 VanDerWaalsContact C-N 3.33Å; E220-T223 PolarHBondContact O-N 2.98Å; E220-R224 WeakPolarHBondContact O-CG 3.47Å; E220-R224 PolarHBondContact O-N 2.64Å; E220-R224 VanDerWaalsContact O-N 3.16Å
221N47.7Very low52.3Low114 Ų114110 Ų11061%0.6158%0.578SS**Hα-helixtrans-76.7-19.4175.5-78.6-18.6000113.6M219M219-N221 PolarHBondContact O-N 3.19Å; M219-N221 VanDerWaalsContact O-N 3.14Å
222V52.6Low52.8Low105 Ų105110.4 Ų110.464%0.63658%0.577SS**Hα-helixtrans-86.5-31.6170.5-178.40000110.5M219 E220 R224M219-V222 PolarHBondContact O-N 3.41Å; E220-V222 VanDerWaalsContact C-N 3.33Å; V222-R224 PolarHBondContact O-N 3.13Å
223T50.2Low53.4Low67 Ų67110.2 Ų110.241%0.41158%0.577SS.*Hα-helixtrans-77-17.4179.6-18.60000114.4M219 E220 S227M219-T223 PolarHBondContact O-N 3.08Å; M219-T223 PolarHBondContact O-OG1 3.35Å; E220-T223 PolarHBondContact O-N 2.98Å; T223-S227 PolarHBondContact O-N 2.71Å; T223-S227 VanDerWaalsContact O-N 3.08Å; T223-S227 PolarHBondContact O-OG 3.06Å; T223-S227 VanDerWaalsContact O-OG 3.11Å
224R49.5Very low54.5Low173 Ų173111.3 Ų111.365%0.65358%0.576SS**Hα-helixtrans-74.9-26.9179.1-87.3178170.21610.8114.4E220 V222E220-R224 WeakPolarHBondContact O-CG 3.47Å; E220-R224 PolarHBondContact O-N 2.64Å; E220-R224 VanDerWaalsContact O-N 3.16Å; V222-R224 PolarHBondContact O-N 3.13Å
225Q49.2Very low55.6Low173 Ų173106.8 Ų106.881%0.80857%0.568SS**Hα-helixtrans-78.3-29.6176.9-142.8168.27.600111.6
226E48.3Very low56.8Low125 Ų125104.3 Ų104.358%0.58456%0.563SS**Hα-helixtrans-79.9-28.9174.2-64.4-175.1156.400113.2G228 T229 V230E226-G228 VanDerWaalsContact C-N 3.25Å; E226-G228 PolarHBondContact O-N 2.88Å; E226-T229 PolarHBondContact O-N 2.88Å; E226-T229 PolarHBondContact O-OG1 3.15Å; E226-V230 WeakPolarHBondContact O-CG2 3.37Å; E226-V230 PolarHBondContact O-N 3.06Å; E226-V230 VanDerWaalsContact O-N 3.16Å
227S48.1Very low58Low74 Ų74103 Ų10352%0.51756%0.556SS.*Hα-helixtrans-65.5-27.4174.4-71.50000113.3T223 S231T223-S227 PolarHBondContact O-N 2.71Å; T223-S227 VanDerWaalsContact O-N 3.08Å; T223-S227 PolarHBondContact O-OG 3.06Å; T223-S227 VanDerWaalsContact O-OG 3.11Å; S227-S231 PolarHBondContact O-N 3.47Å
228G51.8Low59.4Low40 Ų40107 Ų10741%0.41257%0.567SS.*Hα-helixtrans-72.6-31.2176.900000114E226 K232E226-G228 VanDerWaalsContact C-N 3.25Å; E226-G228 PolarHBondContact O-N 2.88Å; G228-K232 WeakPolarHBondContact O-CG 3.35Å
229T56.5Low61Low85 Ų85107.8 Ų107.852%0.52157%0.565SS.*Hα-helixtrans-77.6-43.6174.943.80000110.9E226 S231 K232 E233E226-T229 PolarHBondContact O-N 2.88Å; E226-T229 PolarHBondContact O-OG1 3.15Å; T229-S231 VanDerWaalsContact C-N 3.34Å; T229-S231 PolarHBondContact O-N 3.29Å; T229-K232 PolarHBondContact O-N 3.46Å; T229-E233 WeakPolarHBondContact O-CB 3.14Å; T229-E233 PolarHBondContact O-N 3.37Å
230V60.2Low62.6Low78 Ų78106.4 Ų106.447%0.47356%0.559SS.*Hα-helixtrans-62.2-36.6179176.60000112.5E226 E233 L234E226-V230 WeakPolarHBondContact O-CG2 3.37Å; E226-V230 PolarHBondContact O-N 3.06Å; E226-V230 VanDerWaalsContact O-N 3.16Å; V230-E233 PolarHBondContact O-N 3.07Å; V230-L234 HydrophobicContact CG1-CD1 4.34Å; V230-L234 PolarHBondContact O-N 2.95Å
231S63.8Low64.2Low77 Ų77104.9 Ų104.954%0.53856%0.557SS.*Hα-helixtrans-70.3-37.6178.1-164.60000113.3S227 T229 E233 L234 T235S227-S231 PolarHBondContact O-N 3.47Å; T229-S231 VanDerWaalsContact C-N 3.34Å; T229-S231 PolarHBondContact O-N 3.29Å; S231-E233 VanDerWaalsContact C-N 3.34Å; S231-L234 PolarHBondContact O-N 3.13Å; S231-T235 PolarHBondContact O-N 3.11Å; S231-T235 VanDerWaalsContact O-N 3.15Å; S231-T235 PolarHBondContact O-OG1 3.35Å
232K67.9Low65.9Low157 Ų157102 Ų10268%0.68355%0.546SS*.Hα-helixtrans-64.9-41.5171.6-71.5177.5-1781760110.7G228 T229 T235 V236G228-K232 WeakPolarHBondContact O-CG 3.35Å; T229-K232 PolarHBondContact O-N 3.46Å; K232-T235 PolarHBondContact O-N 3.45Å; K232-V236 WeakPolarHBondContact O-CG2 3.17Å; K232-V236 PolarHBondContact O-N 2.88Å
233E69Low67.6Low120 Ų12099.6 Ų99.656%0.56153%0.53SS*.Hα-helixtrans-67.1-36.9179.1-154165.2-15800112.3T229 V230 S231 V236 N237T229-E233 WeakPolarHBondContact O-CB 3.14Å; T229-E233 PolarHBondContact O-N 3.37Å; V230-E233 PolarHBondContact O-N 3.07Å; S231-E233 VanDerWaalsContact C-N 3.34Å; E233-V236 PolarHBondContact O-N 3.5Å; E233-N237 WeakPolarHBondContact O-CB 3.28Å; E233-N237 PolarHBondContact O-N 2.97Å; E233-N237 PolarHBondContact O-ND2 2.77Å
234L71.4Confident69.3Low97 Ų9799.4 Ų99.451%0.50853%0.528SS..Hα-helixtrans-61.7-44.4171.1-122.996.9000111.5V230 S231 N237 H238V230-L234 HydrophobicContact CG1-CD1 4.34Å; V230-L234 PolarHBondContact O-N 2.95Å; S231-L234 PolarHBondContact O-N 3.13Å; L234-N237 PolarHBondContact O-N 3.49Å; L234-H238 PolarHBondContact O-N 3.21Å; L234-H238 PolarHBondContact O-ND1 3.22Å
235T75.4Confident71.1Confident94 Ų9498.1 Ų98.158%0.57753%0.527SS*.Hα-helixtrans-65.9-42-179.8-53.50000111.3S231 K232 H238 K239S231-T235 PolarHBondContact O-N 3.11Å; S231-T235 VanDerWaalsContact O-N 3.15Å; S231-T235 PolarHBondContact O-OG1 3.35Å; K232-T235 PolarHBondContact O-N 3.45Å; T235-H238 PolarHBondContact O-N 3.32Å; T235-K239 PolarHBondContact O-N 3.16Å
236V77.2Confident72.9Confident90 Ų9097.9 Ų97.955%0.54552%0.519SS..Hα-helixtrans-62.9-43.21741730000110.9K232 E233 K239 L240K232-V236 WeakPolarHBondContact O-CG2 3.17Å; K232-V236 PolarHBondContact O-N 2.88Å; E233-V236 PolarHBondContact O-N 3.5Å; V236-K239 PolarHBondContact O-N 3.34Å; V236-L240 WeakPolarHBondContact O-CB 3.23Å; V236-L240 PolarHBondContact O-N 3.33Å
237N76.1Confident74.8Confident86 Ų8697.5 Ų97.546%0.4652%0.52SS..Hα-helixtrans-63.9-39.8177-85.6-55.4000113.1E233 L234 L240 T241E233-N237 WeakPolarHBondContact O-CB 3.28Å; E233-N237 PolarHBondContact O-N 2.97Å; E233-N237 PolarHBondContact O-ND2 2.77Å; L234-N237 PolarHBondContact O-N 3.49Å; N237-L240 PolarHBondContact O-N 2.84Å; N237-T241 WeakPolarHBondContact O-CB 3.36Å; N237-T241 PolarHBondContact O-N 3.36Å; N237-T241 PolarHBondContact O-OG1 3.37Å
238H81Confident76.6Confident127 Ų127100.6 Ų100.659%0.58853%0.525SS*.Hα-helixtrans-63.3-43.9174.1-78.682.5000111.4L234 T235 T241 S242L234-H238 PolarHBondContact O-N 3.21Å; L234-H238 PolarHBondContact O-ND1 3.22Å; T235-H238 PolarHBondContact O-N 3.32Å; H238-T241 PolarHBondContact O-N 3.38Å; H238-S242 PolarHBondContact O-N 2.95Å
239K85.2Confident78.2Confident144 Ų144105.2 Ų105.263%0.62654%0.535SS*.Hα-helixtrans-61.8-48.7175.5-172.2177.1179.4-176.90111.4T235 V236 T241 S242 D243T235-K239 PolarHBondContact O-N 3.16Å; V236-K239 PolarHBondContact O-N 3.34Å; K239-T241 VanDerWaalsContact C-N 3.3Å; K239-T241 PolarHBondContact O-N 3.38Å; K239-S242 PolarHBondContact O-N 3.1Å; K239-S242 VanDerWaalsContact O-N 3.1Å; K239-S242 PolarHBondContact O-OG 3.32Å; K239-D243 PolarHBondContact O-N 3.04Å
240L83.9Confident79.6Confident101 Ų101102.5 Ų102.553%0.52953%0.525SS..Hα-helixtrans-59.1-41.5178.2-155.5106.5000111.5V236 N237 S242 D243 V244V236-L240 WeakPolarHBondContact O-CB 3.23Å; V236-L240 PolarHBondContact O-N 3.33Å; N237-L240 PolarHBondContact O-N 2.84Å; L240-S242 PolarHBondContact O-N 3.44Å; L240-D243 PolarHBondContact O-N 3.04Å; L240-V244 VanDerWaalsContact O-CG2 3.28Å; L240-V244 WeakPolarHBondContact O-CG2 3.48Å; L240-V244 PolarHBondContact O-N 2.86Å
241T83.2Confident80.9Confident75 Ų75104.7 Ų104.746%0.4653%0.53SS..Hα-helixtrans-62.9-41.2176.1-59.80000111.7N237 H238 K239 K245N237-T241 WeakPolarHBondContact O-CB 3.36Å; N237-T241 PolarHBondContact O-N 3.36Å; N237-T241 PolarHBondContact O-OG1 3.37Å; H238-T241 PolarHBondContact O-N 3.38Å; K239-T241 VanDerWaalsContact C-N 3.3Å; K239-T241 PolarHBondContact O-N 3.38Å; T241-K245 WeakPolarHBondContact O-CG 3.32Å; T241-K245 PolarHBondContact O-N 3.01Å; T241-K245 VanDerWaalsContact O-N 3.08Å
242S84.2Confident81.7Confident55 Ų55104 Ų10439%0.38553%0.529SS..Hα-helixtrans-66.1-40.1176.178.30000112.2H238 K239 L240 K245 R246H238-S242 PolarHBondContact O-N 2.95Å; K239-S242 PolarHBondContact O-N 3.1Å; K239-S242 VanDerWaalsContact O-N 3.1Å; K239-S242 PolarHBondContact O-OG 3.32Å; L240-S242 PolarHBondContact O-N 3.44Å; S242-K245 PolarHBondContact O-N 2.81Å; S242-R246 WeakPolarHBondContact O-CG 3.46Å; S242-R246 PolarHBondContact O-N 3.5Å
243D87.9Confident82.6Confident54 Ų54101.5 Ų101.529%0.28952%0.522SS..Hα-helixtrans-68.8-38.8177.5-75.5-31.1000111.6K239 L240 K245 R246 L247K239-D243 PolarHBondContact O-N 3.04Å; L240-D243 PolarHBondContact O-N 3.04Å; D243-K245 VanDerWaalsContact C-N 3.33Å; D243-K245 PolarHBondContact O-N 2.68Å; D243-R246 PolarHBondContact O-N 3.24Å; D243-R246 IonicContact OD1-NH1 2.88Å; D243-R246 PolarHBondContact OD1-NH1 3.26Å; D243-L247 WeakPolarHBondContact O-CB 3.41Å; D243-L247 VanDerWaalsContact O-CG 3.31Å; D243-L247 WeakPolarHBondContact O-CG 3.39Å; D243-L247 PolarHBondContact O-N 2.81Å
244V86.6Confident83.5Confident62 Ų6299.7 Ų99.738%0.37652%0.516SS..Hα-helixtrans-61.3-40.6172.2169.80000111.3L240 L247 K248L240-V244 VanDerWaalsContact O-CG2 3.28Å; L240-V244 WeakPolarHBondContact O-CG2 3.48Å; L240-V244 PolarHBondContact O-N 2.86Å; V244-L247 PolarHBondContact O-N 3.28Å; V244-K248 HydrophobicContact CG1-CD 4.32Å; V244-K248 WeakPolarHBondContact O-CB 3.16Å; V244-K248 WeakPolarHBondContact O-CG 3.47Å; V244-K248 PolarHBondContact O-N 3.35Å
245K87.2Confident84Confident146 Ų146100.3 Ų100.364%0.63552%0.518SS*.Hα-helixtrans-62.9-44.7174.8-73.9178.7-178.4-178.70111.6T241 S242 D243 K248 Q249T241-K245 WeakPolarHBondContact O-CG 3.32Å; T241-K245 PolarHBondContact O-N 3.01Å; T241-K245 VanDerWaalsContact O-N 3.08Å; S242-K245 PolarHBondContact O-N 2.81Å; D243-K245 VanDerWaalsContact C-N 3.33Å; D243-K245 PolarHBondContact O-N 2.68Å; K245-K248 PolarHBondContact O-N 2.77Å; K245-Q249 PolarHBondContact O-N 3.46Å
246R87Confident84.4Confident169 Ų16998.9 Ų98.964%0.63852%0.516SS*.Hα-helixtrans-62.3-43.5175.9-71.5172.662.1-137.70.8112.2S242 D243 Q249 G250S242-R246 WeakPolarHBondContact O-CG 3.46Å; S242-R246 PolarHBondContact O-N 3.5Å; D243-R246 PolarHBondContact O-N 3.24Å; D243-R246 IonicContact OD1-NH1 2.88Å; D243-R246 PolarHBondContact OD1-NH1 3.26Å; R246-Q249 PolarHBondContact O-N 3.12Å; R246-G250 PolarHBondContact O-N 3.04Å
247L88Confident85Confident116 Ų116102.5 Ų102.561%0.60752%0.519SS*.Hα-helixtrans-63.5-42.3176.5-73.9171.9000111.7D243 V244 Q249 G250 Q251D243-L247 WeakPolarHBondContact O-CB 3.41Å; D243-L247 VanDerWaalsContact O-CG 3.31Å; D243-L247 WeakPolarHBondContact O-CG 3.39Å; D243-L247 PolarHBondContact O-N 2.81Å; V244-L247 PolarHBondContact O-N 3.28Å; L247-Q249 PolarHBondContact O-N 3Å; L247-G250 PolarHBondContact O-N 3.28Å; L247-Q251 WeakPolarHBondContact O-CB 3.5Å; L247-Q251 WeakPolarHBondContact O-CG 3.4Å; L247-Q251 PolarHBondContact O-N 3.01Å
248K85.3Confident85.7Confident139 Ų139102 Ų10260%0.60452%0.516SS*.Hα-helixtrans-61.7-41.5174.5-77.3-178.6177.8-177.10112.2V244 K245 Q251 A252V244-K248 HydrophobicContact CG1-CD 4.32Å; V244-K248 WeakPolarHBondContact O-CB 3.16Å; V244-K248 WeakPolarHBondContact O-CG 3.47Å; V244-K248 PolarHBondContact O-N 3.35Å; K245-K248 PolarHBondContact O-N 2.77Å; K248-Q251 PolarHBondContact O-N 3.31Å; K248-A252 PolarHBondContact O-N 3.38Å
249Q85.9Confident86Confident137 Ų13798.1 Ų98.164%0.6450%0.503SS*.Hα-helixtrans-65-42.5175-170.7178.210.300111.7K245 R246 L247 A252 L253K245-Q249 PolarHBondContact O-N 3.46Å; R246-Q249 PolarHBondContact O-N 3.12Å; L247-Q249 PolarHBondContact O-N 3Å; Q249-A252 PolarHBondContact O-N 3.45Å; Q249-L253 PolarHBondContact O-N 3.42Å; Q249-L253 VanDerWaalsContact O-N 3.13Å
250G85.7Confident86.1Confident29 Ų2998.6 Ų98.630%0.29951%0.505SS..Hα-helixtrans-62.4-40.217400000113R246 L247 L253 N254R246-G250 PolarHBondContact O-N 3.04Å; L247-G250 PolarHBondContact O-N 3.28Å; G250-L253 PolarHBondContact O-N 3.43Å; G250-N254 PolarHBondContact O-N 3.02Å
251Q86.4Confident86.4Confident124 Ų12498.7 Ų98.758%0.57951%0.505SS*.Hα-helixtrans-62.5-42.1173.7-78.4-178.4-1900111.9L247 K248 L253 N254 M255L247-Q251 WeakPolarHBondContact O-CB 3.5Å; L247-Q251 WeakPolarHBondContact O-CG 3.4Å; L247-Q251 PolarHBondContact O-N 3.01Å; K248-Q251 PolarHBondContact O-N 3.31Å; Q251-L253 PolarHBondContact O-N 3.04Å; Q251-N254 PolarHBondContact O-N 2.98Å; Q251-M255 VanDerWaalsContact O-CG 3.29Å; Q251-M255 WeakPolarHBondContact O-CG 3.43Å; Q251-M255 PolarHBondContact O-N 3.2Å
252A81.4Confident86.7Confident63 Ų6397 Ų9752%0.52150%0.497SS..Hα-helixtrans-61.5-42.4176.500000112.4K248 Q249 M255 A256K248-A252 PolarHBondContact O-N 3.38Å; Q249-A252 PolarHBondContact O-N 3.45Å; A252-M255 PolarHBondContact O-N 2.68Å; A252-A256 PolarHBondContact O-N 3.11Å
253L86.8Confident87Confident104 Ų104103.7 Ų103.755%0.54551%0.513SS..Hα-helixtrans-64.5-42.5175.1-73170.4000112.3Q249 G250 Q251 M255 A256 R257Q249-L253 PolarHBondContact O-N 3.42Å; Q249-L253 VanDerWaalsContact O-N 3.13Å; G250-L253 PolarHBondContact O-N 3.43Å; Q251-L253 PolarHBondContact O-N 3.04Å; L253-M255 VanDerWaalsContact C-N 3.33Å; L253-M255 PolarHBondContact O-N 2.93Å; L253-A256 PolarHBondContact O-N 3.31Å; L253-R257 WeakPolarHBondContact O-CG 3.14Å; L253-R257 PolarHBondContact O-N 2.97Å
254N87.6Confident87.1Confident81 Ų81106 Ų10643%0.43352%0.524SS..Hα-helixtrans-63.8-38.9175.5-77-18.9000111.8G250 Q251 A256 R257 I258G250-N254 PolarHBondContact O-N 3.02Å; Q251-N254 PolarHBondContact O-N 2.98Å; N254-A256 PolarHBondContact O-N 3.21Å; N254-R257 WeakPolarHBondContact O-CB 3.25Å; N254-R257 PolarHBondContact O-N 2.77Å; N254-I258 VanDerWaalsContact O-CG1 3.26Å; N254-I258 WeakPolarHBondContact O-CG1 3.23Å; N254-I258 PolarHBondContact O-N 2.9Å
255M82.3Confident87.3Confident111 Ų111106.9 Ų106.955%0.54753%0.529SS..Hα-helixtrans-63.1-41.4175.2-72.3-63148.200112.1Q251 A252 L253 R257 I258 C259Q251-M255 VanDerWaalsContact O-CG 3.29Å; Q251-M255 WeakPolarHBondContact O-CG 3.43Å; Q251-M255 PolarHBondContact O-N 3.2Å; A252-M255 PolarHBondContact O-N 2.68Å; L253-M255 VanDerWaalsContact C-N 3.33Å; L253-M255 PolarHBondContact O-N 2.93Å; M255-R257 VanDerWaalsContact C-N 3.34Å; M255-R257 PolarHBondContact O-N 3.11Å; M255-I258 HydrophobicContact CE-CD1 4.26Å; M255-I258 PolarHBondContact O-N 3.41Å; M255-I258 HydrophobicContact SD-CD1 4.36Å; M255-C259 PolarHBondContact O-N 3.03Å; M255-C259 PolarHBondContact O-SG 3.47Å; M255-C259 VanDerWaalsContact O-SG 3.34Å
256A83.5Confident87.4Confident63 Ų63107.9 Ų107.952%0.52153%0.53SS..Hα-helixtrans-61.8-41.217400000112.2A252 L253 N254 C259 K260A252-A256 PolarHBondContact O-N 3.11Å; L253-A256 PolarHBondContact O-N 3.31Å; N254-A256 PolarHBondContact O-N 3.21Å; A256-C259 PolarHBondContact O-N 3.5Å; A256-K260 PolarHBondContact O-N 2.92Å; A256-K260 VanDerWaalsContact O-N 3.09Å
257R89.9Confident87.6Confident166 Ų166106.5 Ų106.563%0.62653%0.526SS*.Hα-helixtrans-63.5-44.4175-70.4173.4176.8-179.1-3.1112L253 N254 M255 K260 L261L253-R257 WeakPolarHBondContact O-CG 3.14Å; L253-R257 PolarHBondContact O-N 2.97Å; N254-R257 WeakPolarHBondContact O-CB 3.25Å; N254-R257 PolarHBondContact O-N 2.77Å; M255-R257 VanDerWaalsContact C-N 3.34Å; M255-R257 PolarHBondContact O-N 3.11Å; R257-K260 PolarHBondContact O-N 2.76Å; R257-L261 WeakPolarHBondContact O-CG 3.49Å; R257-L261 PolarHBondContact O-N 3.42Å
258I91.1Very high87.8Confident75 Ų75106 Ų10639%0.38552%0.523SS..Hα-helixtrans-61.8-44.8177-69.9165.3000110.5M98 N254 M255 K260 L261 S262M98-I258 HydrophobicContact SD-CG2 4.04Å; N254-I258 VanDerWaalsContact O-CG1 3.26Å; N254-I258 WeakPolarHBondContact O-CG1 3.23Å; N254-I258 PolarHBondContact O-N 2.9Å; M255-I258 HydrophobicContact CE-CD1 4.26Å; M255-I258 PolarHBondContact O-N 3.41Å; M255-I258 HydrophobicContact SD-CD1 4.36Å; I258-K260 VanDerWaalsContact C-N 3.31Å; I258-K260 PolarHBondContact O-N 3.27Å; I258-L261 PolarHBondContact O-N 3.37Å; I258-S262 WeakPolarHBondContact O-CB 3.42Å; I258-S262 PolarHBondContact O-N 3.23Å
259C86.3Confident88.2Confident46 Ų46104.5 Ų104.531%0.31152%0.521SS..Hα-helixtrans-59.3-41.1175.4-73.20000112.2M255 A256 S262 R263M255-C259 PolarHBondContact O-N 3.03Å; M255-C259 PolarHBondContact O-SG 3.47Å; M255-C259 VanDerWaalsContact O-SG 3.34Å; A256-C259 PolarHBondContact O-N 3.5Å; C259-S262 PolarHBondContact O-N 3.45Å; C259-R263 WeakPolarHBondContact O-CG 3.28Å; C259-R263 PolarHBondContact O-N 2.78Å; C259-R263 VanDerWaalsContact O-N 3.11Å
260K87Confident88.3Confident154 Ų154100.8 Ų100.867%0.6751%0.51SS*.Hα-helixtrans-65.8-44.7176.8-170.1176.7-178.3179.40112A256 R257 I258 S262 R263 M264A256-K260 PolarHBondContact O-N 2.92Å; A256-K260 VanDerWaalsContact O-N 3.09Å; R257-K260 PolarHBondContact O-N 2.76Å; I258-K260 VanDerWaalsContact C-N 3.31Å; I258-K260 PolarHBondContact O-N 3.27Å; K260-S262 VanDerWaalsContact C-N 3.34Å; K260-R263 PolarHBondContact O-N 3.02Å; K260-M264 PolarHBondContact O-N 3.15Å; K260-M264 VanDerWaalsContact O-N 3.07Å
261L92.3Very high88.6Confident103 Ų103103.3 Ų103.354%0.53951%0.512SS..Hα-helixtrans-62.9-41175.6-73.8172000111.6R257 I258 R263 M264 V265R257-L261 WeakPolarHBondContact O-CG 3.49Å; R257-L261 PolarHBondContact O-N 3.42Å; I258-L261 PolarHBondContact O-N 3.37Å; L261-R263 PolarHBondContact O-N 2.95Å; L261-M264 WeakPolarHBondContact O-CB 3.46Å; L261-M264 PolarHBondContact O-N 2.89Å; L261-V265 WeakPolarHBondContact O-CG2 3.43Å; L261-V265 PolarHBondContact O-N 3.38Å
262S88.8Confident88.9Confident40 Ų40103.1 Ų103.128%0.2851%0.511SS..Hα-helixtrans-60.4-42.9177.3179.60000111.9I258 C259 K260 V265 Y266I258-S262 WeakPolarHBondContact O-CB 3.42Å; I258-S262 PolarHBondContact O-N 3.23Å; C259-S262 PolarHBondContact O-N 3.45Å; K260-S262 VanDerWaalsContact C-N 3.34Å; S262-V265 PolarHBondContact O-N 3.18Å; S262-Y266 PolarHBondContact O-N 3.47Å
263R89.4Confident89.4Confident195 Ų195109.2 Ų109.274%0.73652%0.521SS*.Hα-helixtrans-62.6-42.8173-71.2177.7179.4178.8-1.7112.7C259 K260 L261 Y266 Y267C259-R263 WeakPolarHBondContact O-CG 3.28Å; C259-R263 PolarHBondContact O-N 2.78Å; C259-R263 VanDerWaalsContact O-N 3.11Å; K260-R263 PolarHBondContact O-N 3.02Å; L261-R263 PolarHBondContact O-N 2.95Å; R263-Y266 PolarHBondContact O-N 3.14Å; R263-Y267 PolarHBondContact O-N 2.97Å
264M89.9Confident89.6Confident103 Ų103108.7 Ų108.751%0.50752%0.516SS..Hα-helixtrans-61.7-44.1175-91.217756.500112.1K260 L261 Y266 Y267 L268K260-M264 PolarHBondContact O-N 3.15Å; K260-M264 VanDerWaalsContact O-N 3.07Å; L261-M264 WeakPolarHBondContact O-CB 3.46Å; L261-M264 PolarHBondContact O-N 2.89Å; M264-Y266 VanDerWaalsContact C-N 3.34Å; M264-Y266 PolarHBondContact O-N 3.19Å; M264-Y267 PolarHBondContact O-N 2.95Å; M264-L268 WeakPolarHBondContact O-CG 3.46Å; M264-L268 PolarHBondContact O-N 3.26Å
265V92.4Very high89.9Confident81 Ų81107.8 Ų107.849%0.49151%0.513SS..Hα-helixtrans-62.6-42.9177.5170.10000110.6L261 S262 Y267 L268 L269L261-V265 WeakPolarHBondContact O-CG2 3.43Å; L261-V265 PolarHBondContact O-N 3.38Å; S262-V265 PolarHBondContact O-N 3.18Å; V265-Y267 PolarHBondContact O-N 2.98Å; V265-L268 PolarHBondContact O-N 3.45Å; V265-L269 HydrophobicContact CG1-CD1 4.08Å; V265-L269 HydrophobicContact CG1-CG 4.42Å; V265-L269 WeakPolarHBondContact O-CG 3.33Å; V265-L269 PolarHBondContact O-N 3.45Å
266Y88.9Confident90.4Very high166 Ų166105.2 Ų105.265%0.65150%0.504SS*.Hα-helixtrans-59-48175.1-178.9-94.6000111.7S262 R263 M264 L268 L269 C270S262-Y266 PolarHBondContact O-N 3.47Å; R263-Y266 PolarHBondContact O-N 3.14Å; M264-Y266 VanDerWaalsContact C-N 3.34Å; M264-Y266 PolarHBondContact O-N 3.19Å; Y266-L268 PolarHBondContact O-N 2.87Å; Y266-L269 WeakPolarHBondContact O-CB 3.37Å; Y266-L269 PolarHBondContact O-N 3.14Å; Y266-C270 PolarHBondContact O-N 3.27Å; Y266-C270 PolarHBondContact O-SG 3.36Å
267Y90.6Very high90.8Very high141 Ų141106.3 Ų106.355%0.55350%0.498SS*.Hα-helixtrans-58.6-44.2175.7177.5-98.6000112.6R263 M264 V265 L269 C270 K271R263-Y267 PolarHBondContact O-N 2.97Å; M264-Y267 PolarHBondContact O-N 2.95Å; V265-Y267 PolarHBondContact O-N 2.98Å; Y267-L269 VanDerWaalsContact C-N 3.34Å; Y267-L269 PolarHBondContact O-N 2.92Å; Y267-C270 PolarHBondContact O-N 3.16Å; Y267-K271 HydrophobicContact CD1-CG 4.46Å; Y267-K271 HydrophobicContact CE1-CG 3.97Å; Y267-K271 HydrophobicContact CE2-CG 4.43Å; Y267-K271 PolarHBondContact O-N 3.2Å; Y267-K271 WeakPolarHBondContact OH-CE 3.35Å
268L92.8Very high90.9Very high104 Ų104103.5 Ų103.555%0.54549%0.492SS..Hα-helixtrans-64.3-36.6176.7-71.9173.4000112.3M264 V265 Y266 K271 Q272M264-L268 WeakPolarHBondContact O-CG 3.46Å; M264-L268 PolarHBondContact O-N 3.26Å; V265-L268 PolarHBondContact O-N 3.45Å; Y266-L268 PolarHBondContact O-N 2.87Å; L268-K271 PolarHBondContact O-N 3Å; L268-Q272 WeakPolarHBondContact O-CB 3.36Å; L268-Q272 PolarHBondContact O-N 3.42Å
269L92.5Very high90.9Very high109 Ų109104.6 Ų104.657%0.57150%0.498SS*.Hα-helixtrans-65.6-40.4174.8-74170.5000111.9V265 Y266 Y267 Q272 R273V265-L269 HydrophobicContact CG1-CD1 4.08Å; V265-L269 HydrophobicContact CG1-CG 4.42Å; V265-L269 WeakPolarHBondContact O-CG 3.33Å; V265-L269 PolarHBondContact O-N 3.45Å; Y266-L269 WeakPolarHBondContact O-CB 3.37Å; Y266-L269 PolarHBondContact O-N 3.14Å; Y267-L269 VanDerWaalsContact C-N 3.34Å; Y267-L269 PolarHBondContact O-N 2.92Å; L269-Q272 PolarHBondContact O-N 3.45Å; L269-R273 PolarHBondContact O-N 3.41Å
270C89.7Confident91.2Very high58 Ų58108.6 Ų108.639%0.39251%0.511SS..Hα-helixtrans-61.7-45173.2-66.50000111.3Y266 Y267 R273 E274Y266-C270 PolarHBondContact O-N 3.27Å; Y266-C270 PolarHBondContact O-SG 3.36Å; Y267-C270 PolarHBondContact O-N 3.16Å; C270-R273 WeakPolarHBondContact O-CB 3.47Å; C270-R273 PolarHBondContact O-N 3.48Å; C270-E274 PolarHBondContact O-N 2.97Å; C270-E274 VanDerWaalsContact O-N 3.12Å
271K90.9Very high91.5Very high83 Ų83107 Ų10736%0.36151%0.506SS..Hα-helixtrans-65-38.6176.5-74.6-72.6164.3-161.20112.9Y267 L268 R273 E274 V275Y267-K271 HydrophobicContact CD1-CG 4.46Å; Y267-K271 HydrophobicContact CE1-CG 3.97Å; Y267-K271 HydrophobicContact CE2-CG 4.43Å; Y267-K271 PolarHBondContact O-N 3.2Å; Y267-K271 WeakPolarHBondContact OH-CE 3.35Å; L268-K271 PolarHBondContact O-N 3Å; K271-R273 VanDerWaalsContact C-N 3.3Å; K271-R273 PolarHBondContact O-N 3.39Å; K271-E274 IonicContact NZ-OE2 2.91Å; K271-E274 PolarHBondContact NZ-OE2 3.43Å; K271-E274 WeakPolarHBondContact O-CB 3.5Å; K271-E274 PolarHBondContact O-N 2.99Å; K271-V275 WeakPolarHBondContact O-CG2 3.48Å; K271-V275 PolarHBondContact O-N 3.4Å
272Q93.1Very high91.6Very high119 Ų119107 Ų10756%0.55651%0.506SS*.Hα-helixtrans-61.2-40.5174.4-172.864.726.700111.3L268 L269 V275 T276L268-Q272 WeakPolarHBondContact O-CB 3.36Å; L268-Q272 PolarHBondContact O-N 3.42Å; L269-Q272 PolarHBondContact O-N 3.45Å; Q272-V275 PolarHBondContact O-N 3.19Å; Q272-T276 WeakPolarHBondContact O-CG2 3.44Å; Q272-T276 PolarHBondContact O-N 3.46Å; Q272-T276 PolarHBondContact O-OG1 3.27Å
273R92Very high91.9Very high191 Ų191106.6 Ų106.672%0.72151%0.507SS*.Hα-helixtrans-61.2-46.7175.5-175.7-173.4-71.3-112.85.9111.5L269 C270 K271 V275 T276 E277L269-R273 PolarHBondContact O-N 3.41Å; C270-R273 WeakPolarHBondContact O-CB 3.47Å; C270-R273 PolarHBondContact O-N 3.48Å; K271-R273 VanDerWaalsContact C-N 3.3Å; K271-R273 PolarHBondContact O-N 3.39Å; R273-V275 PolarHBondContact O-N 3.1Å; R273-T276 WeakPolarHBondContact CA-OG1 3.5Å; R273-T276 PolarHBondContact O-N 3.45Å; R273-T276 PolarHBondContact O-OG1 2.94Å; R273-E277 PolarHBondContact O-N 3.4Å
274E90.7Very high92.1Very high94 Ų94100.7 Ų100.744%0.43950%0.496SS..Hα-helixtrans-57.1-47.6177.4-169.3179.7176.600111.5C270 K271 T276 E277 Q278C270-E274 PolarHBondContact O-N 2.97Å; C270-E274 VanDerWaalsContact O-N 3.12Å; K271-E274 IonicContact NZ-OE2 2.91Å; K271-E274 PolarHBondContact NZ-OE2 3.43Å; K271-E274 WeakPolarHBondContact O-CB 3.5Å; K271-E274 PolarHBondContact O-N 2.99Å; E274-T276 PolarHBondContact O-N 3.45Å; E274-E277 PolarHBondContact O-N 3.49Å; E274-Q278 WeakPolarHBondContact O-CG 3.35Å; E274-Q278 PolarHBondContact O-N 3.25Å
275V93.4Very high92.3Very high62 Ų62100 Ų10038%0.37649%0.494SS..Hα-helixtrans-63-40.2176.4172.70000111.9K271 Q272 R273 E277 Q278 N279K271-V275 WeakPolarHBondContact O-CG2 3.48Å; K271-V275 PolarHBondContact O-N 3.4Å; Q272-V275 PolarHBondContact O-N 3.19Å; R273-V275 PolarHBondContact O-N 3.1Å; V275-E277 VanDerWaalsContact C-N 3.28Å; V275-E277 PolarHBondContact O-N 3.13Å; V275-Q278 PolarHBondContact O-N 3.26Å; V275-N279 WeakPolarHBondContact O-CB 3.49Å; V275-N279 PolarHBondContact O-N 3.26Å; V275-N279 PolarHBondContact O-ND2 3.21Å
276T92.6Very high92.4Very high57 Ų57100.4 Ų100.435%0.3550%0.497SS..Hα-helixtrans-64-34.7176.555.60000112.4Q272 R273 E274 N279 K280Q272-T276 WeakPolarHBondContact O-CG2 3.44Å; Q272-T276 PolarHBondContact O-N 3.46Å; Q272-T276 PolarHBondContact O-OG1 3.27Å; R273-T276 WeakPolarHBondContact CA-OG1 3.5Å; R273-T276 PolarHBondContact O-N 3.45Å; R273-T276 PolarHBondContact O-OG1 2.94Å; E274-T276 PolarHBondContact O-N 3.45Å; T276-N279 PolarHBondContact O-N 3.07Å; T276-K280 WeakPolarHBondContact O-CG 3.49Å; T276-K280 PolarHBondContact O-N 2.84Å; T276-K280 VanDerWaalsContact O-N 3.1Å
277E91.6Very high92.6Very high86 Ų8699.4 Ų99.440%0.40250%0.496SS..Hα-helixtrans-73.4-40.7177.9-159.856.3-145.200111.5R273 E274 V275 N279 K280 Q281R273-E277 PolarHBondContact O-N 3.4Å; E274-E277 PolarHBondContact O-N 3.49Å; V275-E277 VanDerWaalsContact C-N 3.28Å; V275-E277 PolarHBondContact O-N 3.13Å; E277-N279 VanDerWaalsContact C-N 3.3Å; E277-N279 PolarHBondContact O-N 3.32Å; E277-K280 WeakPolarHBondContact O-CB 3.44Å; E277-K280 PolarHBondContact O-N 3.13Å; E277-K280 VanDerWaalsContact O-N 3.16Å; E277-K280 WeakPolarHBondContact OE2-CD 3.37Å; E277-K280 IonicContact OE2-NZ 2.84Å; E277-K280 PolarHBondContact OE2-NZ 3.24Å; E277-Q281 WeakPolarHBondContact O-CG 3.48Å; E277-Q281 PolarHBondContact O-N 3.12Å
278Q92.1Very high92.7Very high106 Ų10697.6 Ų97.650%0.49549%0.494SS..Hα-helixtrans-58.1-41.6170.6-71.6178.1-20.400111.9E274 V275 K280 Q281 L282E274-Q278 WeakPolarHBondContact O-CG 3.35Å; E274-Q278 PolarHBondContact O-N 3.25Å; V275-Q278 PolarHBondContact O-N 3.26Å; Q278-K280 PolarHBondContact O-N 3.19Å; Q278-Q281 PolarHBondContact O-N 3.22Å; Q278-L282 WeakPolarHBondContact O-CB 3.24Å; Q278-L282 PolarHBondContact O-N 2.87Å
279N92.4Very high92.7Very high98 Ų9896.8 Ų96.852%0.52449%0.487SS..Hα-helixtrans-65.3-35.6176.3-78.7-27.1000112.9V275 T276 E277 G283V275-N279 WeakPolarHBondContact O-CB 3.49Å; V275-N279 PolarHBondContact O-N 3.26Å; V275-N279 PolarHBondContact O-ND2 3.21Å; T276-N279 PolarHBondContact O-N 3.07Å; E277-N279 VanDerWaalsContact C-N 3.3Å; E277-N279 PolarHBondContact O-N 3.32Å; N279-G283 PolarHBondContact O-N 2.87Å
280K93Very high92.7Very high131 Ų13194.2 Ų94.257%0.5748%0.478SS*.Hα-helixtrans-65.4-42.9172.8-70.7178.7-162.5160.60111.6T276 E277 Q278 G283 S284T276-K280 WeakPolarHBondContact O-CG 3.49Å; T276-K280 PolarHBondContact O-N 2.84Å; T276-K280 VanDerWaalsContact O-N 3.1Å; E277-K280 WeakPolarHBondContact O-CB 3.44Å; E277-K280 PolarHBondContact O-N 3.13Å; E277-K280 VanDerWaalsContact O-N 3.16Å; E277-K280 WeakPolarHBondContact OE2-CD 3.37Å; E277-K280 IonicContact OE2-NZ 2.84Å; E277-K280 PolarHBondContact OE2-NZ 3.24Å; Q278-K280 PolarHBondContact O-N 3.19Å; K280-G283 PolarHBondContact O-N 3.26Å; K280-S284 PolarHBondContact O-N 3.42Å
281Q93.1Very high92.9Very high121 Ų121100.1 Ų100.157%0.56549%0.492SS*.Hα-helixtrans-63.2-43.3176.5-68.9177.7-300111.6E277 Q278 G283 S284 L285E277-Q281 WeakPolarHBondContact O-CG 3.48Å; E277-Q281 PolarHBondContact O-N 3.12Å; Q278-Q281 PolarHBondContact O-N 3.22Å; Q281-G283 VanDerWaalsContact C-N 3.33Å; Q281-G283 PolarHBondContact O-N 3.04Å; Q281-S284 PolarHBondContact O-N 3.06Å; Q281-S284 PolarHBondContact O-OG 3.27Å; Q281-L285 PolarHBondContact O-N 3.01Å
282L93.9Very high93Very high102 Ų102102.7 Ų102.753%0.53450%0.5SS..Hα-helixtrans-62.5-42.2174.1-174.660.9000111.1Q278 S284 L285 V286Q278-L282 WeakPolarHBondContact O-CB 3.24Å; Q278-L282 PolarHBondContact O-N 2.87Å; L282-S284 VanDerWaalsContact C-N 3.34Å; L282-S284 PolarHBondContact O-N 3.03Å; L282-L285 PolarHBondContact O-N 2.91Å; L282-V286 WeakPolarHBondContact O-CG2 3.34Å; L282-V286 PolarHBondContact O-N 2.91Å
283G94.6Very high92.9Very high31 Ų31101.2 Ų101.232%0.3250%0.495SS..Hα-helixtrans-61.6-36.5175.500000113.7N279 K280 Q281 K287N279-G283 PolarHBondContact O-N 2.87Å; K280-G283 PolarHBondContact O-N 3.26Å; Q281-G283 VanDerWaalsContact C-N 3.33Å; Q281-G283 PolarHBondContact O-N 3.04Å; G283-K287 WeakPolarHBondContact O-CG 3.29Å; G283-K287 PolarHBondContact O-N 3.46Å
284S93.1Very high92.8Very high71 Ų7198.7 Ų98.750%0.49749%0.489SS..Hα-helixtrans-70.5-39.1175.375.60000111.8K280 Q281 L282 K287 M288K280-S284 PolarHBondContact O-N 3.42Å; Q281-S284 PolarHBondContact O-N 3.06Å; Q281-S284 PolarHBondContact O-OG 3.27Å; L282-S284 VanDerWaalsContact C-N 3.34Å; L282-S284 PolarHBondContact O-N 3.03Å; S284-K287 PolarHBondContact O-N 2.9Å; S284-M288 WeakPolarHBondContact O-CB 3.42Å; S284-M288 PolarHBondContact O-N 3.42Å
285L94.6Very high92.7Very high88 Ų88100.3 Ų100.346%0.46150%0.496SS..Hα-helixtrans-63.2-44.3174.5-171.168.2000111.5Q281 L282 K287 M288 Q289Q281-L285 PolarHBondContact O-N 3.01Å; L282-L285 PolarHBondContact O-N 2.91Å; L285-K287 PolarHBondContact O-N 3.16Å; L285-M288 WeakPolarHBondContact O-CB 3.47Å; L285-M288 PolarHBondContact O-N 2.86Å; L285-Q289 WeakPolarHBondContact O-CG 3.5Å; L285-Q289 PolarHBondContact O-N 3.27Å
286V95Very high92.4Very high91 Ų91102.6 Ų102.655%0.55251%0.506SS*.Hα-helixtrans-61.2-43.4175.5170.90000111.1L282 M288 Q289 S290L282-V286 WeakPolarHBondContact O-CG2 3.34Å; L282-V286 PolarHBondContact O-N 2.91Å; V286-M288 VanDerWaalsContact C-N 3.35Å; V286-M288 PolarHBondContact O-N 3.26Å; V286-Q289 PolarHBondContact O-N 3.04Å; V286-S290 WeakPolarHBondContact O-CB 3.32Å; V286-S290 PolarHBondContact O-N 3.07Å
287K93.1Very high92.1Very high144 Ų144105.7 Ų105.763%0.62652%0.517SS*.Hα-helixtrans-62.5-40.1174.5-75.1175.4-177.9178.40112.2G283 S284 L285 S290 R291G283-K287 WeakPolarHBondContact O-CG 3.29Å; G283-K287 PolarHBondContact O-N 3.46Å; S284-K287 PolarHBondContact O-N 2.9Å; L285-K287 PolarHBondContact O-N 3.16Å; K287-S290 PolarHBondContact O-N 2.89Å; K287-R291 WeakPolarHBondContact O-CG 3.35Å; K287-R291 PolarHBondContact O-N 3.46Å
288M92.6Very high91.8Very high104 Ų104105 Ų10551%0.51253%0.525SS..Hα-helixtrans-64.1-45.2176.4-174.4-172.4-68.500111.5S284 L285 V286 R291 R292S284-M288 WeakPolarHBondContact O-CB 3.42Å; S284-M288 PolarHBondContact O-N 3.42Å; L285-M288 WeakPolarHBondContact O-CB 3.47Å; L285-M288 PolarHBondContact O-N 2.86Å; V286-M288 VanDerWaalsContact C-N 3.35Å; V286-M288 PolarHBondContact O-N 3.26Å; M288-R291 PolarHBondContact O-N 3.37Å; M288-R292 PolarHBondContact O-N 3.19Å
289Q93.4Very high91.2Very high86 Ų86105.8 Ų105.840%0.40253%0.532SS..Hα-helixtrans-63.4-42.1176.1-69.2-67.5-800111.5L285 V286 R291 R292 I293L285-Q289 WeakPolarHBondContact O-CG 3.5Å; L285-Q289 PolarHBondContact O-N 3.27Å; V286-Q289 PolarHBondContact O-N 3.04Å; Q289-R291 VanDerWaalsContact C-N 3.32Å; Q289-R291 PolarHBondContact O-N 3.47Å; Q289-R292 WeakPolarHBondContact O-CB 3.37Å; Q289-R292 PolarHBondContact O-N 3.47Å; Q289-R292 VanDerWaalsContact O-N 3.15Å; Q289-I293 WeakPolarHBondContact O-CG1 3.43Å; Q289-I293 PolarHBondContact O-N 3.33Å
290S92.7Very high90.3Very high56 Ų56105.8 Ų105.839%0.39254%0.538SS..Hα-helixtrans-60.2-39.3175.1-178.10000112.6V286 K287 I293 K294V286-S290 WeakPolarHBondContact O-CB 3.32Å; V286-S290 PolarHBondContact O-N 3.07Å; K287-S290 PolarHBondContact O-N 2.89Å; S290-I293 PolarHBondContact O-N 3.1Å; S290-K294 WeakPolarHBondContact O-CG 3.4Å; S290-K294 PolarHBondContact O-N 3.43Å; S290-K294 VanDerWaalsContact O-N 3.1Å
291R92.7Very high88.8Confident181 Ų181102.6 Ų102.668%0.68354%0.543SS*.Hα-helixtrans-64.7-42.2173.6-70.9175.1-175.8-175.40.4112.2K287 M288 Q289 K294 Q295K287-R291 WeakPolarHBondContact O-CG 3.35Å; K287-R291 PolarHBondContact O-N 3.46Å; M288-R291 PolarHBondContact O-N 3.37Å; Q289-R291 VanDerWaalsContact C-N 3.32Å; Q289-R291 PolarHBondContact O-N 3.47Å; R291-K294 PolarHBondContact O-N 3.5Å; R291-Q295 WeakPolarHBondContact O-CG 3.47Å; R291-Q295 PolarHBondContact O-N 2.88Å
292R92.5Very high86.9Confident138 Ų138102 Ų10252%0.52155%0.548SS..Hα-helixtrans-62.2-44.4176.2-78.7179153.3-178.8-6.4112M288 Q289 Q295 L296M288-R292 PolarHBondContact O-N 3.19Å; Q289-R292 WeakPolarHBondContact O-CB 3.37Å; Q289-R292 PolarHBondContact O-N 3.47Å; Q289-R292 VanDerWaalsContact O-N 3.15Å; R292-Q295 PolarHBondContact O-N 2.91Å; R292-L296 WeakPolarHBondContact O-CG 3.38Å; R292-L296 PolarHBondContact O-N 3.47Å
293I91.6Very high84.4Confident88 Ų88104.4 Ų104.445%0.45156%0.561SS.*Hα-helixtrans-59.4-48.7176.7-68.2166.7000110.3Q289 S290 Q295 L296 E297Q289-I293 WeakPolarHBondContact O-CG1 3.43Å; Q289-I293 PolarHBondContact O-N 3.33Å; S290-I293 PolarHBondContact O-N 3.1Å; I293-Q295 VanDerWaalsContact C-N 3.29Å; I293-Q295 PolarHBondContact O-N 2.94Å; I293-L296 PolarHBondContact O-N 3.07Å; I293-L296 VanDerWaalsContact O-N 3.1Å; I293-E297 HydrophobicContact CG2-CG 4.35Å; I293-E297 WeakPolarHBondContact O-CG 3.39Å; I293-E297 PolarHBondContact O-N 3.36Å
294K90.4Very high82.1Confident138 Ų138108.1 Ų108.160%0.658%0.582SS**Hα-helixtrans-59.7-36.3176.5-72-177.2-179.9-170.20113.5S290 R291 A298S290-K294 WeakPolarHBondContact O-CG 3.4Å; S290-K294 PolarHBondContact O-N 3.43Å; S290-K294 VanDerWaalsContact O-N 3.1Å; R291-K294 PolarHBondContact O-N 3.5Å; K294-A298 WeakPolarHBondContact O-CB 3.35Å; K294-A298 PolarHBondContact O-N 2.9Å
295Q89Confident79.9Confident127 Ų127110.2 Ų110.259%0.59359%0.591SS**Hα-helixtrans-68.1-41.1175.1-74.3173.9-13.200111.8R291 R292 I293 A298 I299R291-Q295 WeakPolarHBondContact O-CG 3.47Å; R291-Q295 PolarHBondContact O-N 2.88Å; R292-Q295 PolarHBondContact O-N 2.91Å; I293-Q295 VanDerWaalsContact C-N 3.29Å; I293-Q295 PolarHBondContact O-N 2.94Å; Q295-A298 PolarHBondContact O-N 3.21Å; Q295-I299 WeakPolarHBondContact O-CD1 3.49Å; Q295-I299 VanDerWaalsContact O-CG1 3.3Å; Q295-I299 WeakPolarHBondContact O-CG1 3.44Å; Q295-I299 PolarHBondContact O-N 3.37Å; Q295-I299 VanDerWaalsContact O-N 3.11Å
296L87.5Confident77.3Confident110 Ų110114.3 Ų114.358%0.57661%0.614SS**Hα-helixtrans-66.3-40.9176.4-70.1171.2000111.9R292 I293 A298 I299 C300R292-L296 WeakPolarHBondContact O-CG 3.38Å; R292-L296 PolarHBondContact O-N 3.47Å; I293-L296 PolarHBondContact O-N 3.07Å; I293-L296 VanDerWaalsContact O-N 3.1Å; L296-A298 VanDerWaalsContact C-N 3.33Å; L296-A298 PolarHBondContact O-N 3.29Å; L296-I299 PolarHBondContact O-N 3.15Å; L296-C300 PolarHBondContact O-N 3.05Å; L296-C300 PolarHBondContact O-SG 3.03Å; L296-C300 VanDerWaalsContact O-SG 3.36Å
297E86.3Confident74.8Confident123 Ų123115.1 Ų115.158%0.57562%0.622SS**Hα-helixtrans-60.9-41.4173.7-72.4171168.300111.5I293 I299 C300 G301I293-E297 HydrophobicContact CG2-CG 4.35Å; I293-E297 WeakPolarHBondContact O-CG 3.39Å; I293-E297 PolarHBondContact O-N 3.36Å; E297-I299 VanDerWaalsContact C-N 3.33Å; E297-I299 PolarHBondContact O-N 2.95Å; E297-C300 PolarHBondContact O-N 3.25Å; E297-G301 PolarHBondContact O-N 3.1Å
298A83.7Confident72.3Confident70 Ų70113 Ų11358%0.57963%0.626SS**Hα-helixtrans-65.9-33.3176.400000113.2K294 Q295 L296K294-A298 WeakPolarHBondContact O-CB 3.35Å; K294-A298 PolarHBondContact O-N 2.9Å; Q295-A298 PolarHBondContact O-N 3.21Å; L296-A298 VanDerWaalsContact C-N 3.33Å; L296-A298 PolarHBondContact O-N 3.29Å
299I80.3Confident69.9Low123 Ų123115.9 Ų115.963%0.63164%0.643SS**Hα-helixtrans-76.1-36.5176.9-65.1163.3000111.1Q295 L296 E297 T302Q295-I299 WeakPolarHBondContact O-CD1 3.49Å; Q295-I299 VanDerWaalsContact O-CG1 3.3Å; Q295-I299 WeakPolarHBondContact O-CG1 3.44Å; Q295-I299 PolarHBondContact O-N 3.37Å; Q295-I299 VanDerWaalsContact O-N 3.11Å; L296-I299 PolarHBondContact O-N 3.15Å; E297-I299 VanDerWaalsContact C-N 3.33Å; E297-I299 PolarHBondContact O-N 2.95Å; I299-T302 PolarHBondContact O-OG1 3.49Å
300C73.3Confident67.4Low98 Ų98115.1 Ų115.166%0.66266%0.658SS**Hα-helixtrans-81.4-21.3179.6-650000113.4L296 E297 T302L296-C300 PolarHBondContact O-N 3.05Å; L296-C300 PolarHBondContact O-SG 3.03Å; L296-C300 VanDerWaalsContact O-SG 3.36Å; E297-C300 PolarHBondContact O-N 3.25Å; C300-T302 VanDerWaalsContact C-N 3.26Å; C300-T302 PolarHBondContact O-N 2.88Å
301G61.6Low65.2Low65 Ų65119.8 Ų119.867%0.6768%0.678SS**THydrogen-bonded Turntrans-74.72.5-174.900000116.7E297E297-G301 PolarHBondContact O-N 3.1Å
302T52.2Low62.7Low109 Ų109119.4 Ų119.467%0.66968%0.684SS**THydrogen-bonded Turntrans-100.3-0.4-178.847.30000115I299 C300I299-T302 PolarHBondContact O-OG1 3.49Å; C300-T302 VanDerWaalsContact C-N 3.26Å; C300-T302 PolarHBondContact O-N 2.88Å
303N42.8Very low60.4Low151 Ų151117.2 Ų117.281%0.80769%0.69SS**  trans-128.381.6178.1-78.3-21.9000111.4
304S44.9Very low58.1Low110 Ų110118.8 Ų118.877%0.76970%0.704SS**  trans-145.683.7156.2-171.50000111.1
305V48.2Very low55.9Low114 Ų114117.5 Ų117.569%0.69171%0.712SS**  trans48.594.4136.5-167.70000116.7C307V305-C307 HydrophobicContact CG1-CB 3.92Å; V305-C307 PolarHBondContact O-N 3.11Å
306N38.5Very low53.9Low175 Ų175116.2 Ų116.294%0.93672%0.717SS**  trans-65.9102.2143.7-84.2-10.6000108.3
307C43.8Very low51.8Low107 Ų107115.8 Ų115.872%0.72372%0.724SS**  trans-121.6116154.7-930000107.6V305V305-C307 HydrophobicContact CG1-CB 3.92Å; V305-C307 PolarHBondContact O-N 3.11Å
308S41.1Very low49.8Very low101 Ų101115.8 Ų115.871%0.70674%0.737SS**  trans-33.2137.2163.340.40000114.7
309D42Very low47.9Very low164 Ų164117.9 Ų117.988%0.87775%0.745SS**  -162.5136.8113.5-88.2-24.5000110.5
310G39.4Very low46Very low69 Ų69117.9 Ų117.971%0.71176%0.755SS**  trans-95.3-167.9-173.400000114.3
311L47.2Very low44.5Very low154 Ų154118.8 Ų118.881%0.80676%0.763SS**  trans103.7107166.7-56.1173.8000115.9
312E40.2Very low43.6Very low173 Ų173120 Ų12081%0.80877%0.766SS**  trans68.1137.2135.4-63.3-178.113300117.6
313S43.8Very low42.9Very low92 Ų92121 Ų12164%0.64377%0.772SS**  cis-175.3141.12.837.90000107.8
314T43.8Very low42.5Very low121 Ų121119.1 Ų119.174%0.74277%0.77SS**  trans64.3125142.458.70000122.9
315S44.4Very low42.1Very low111 Ų111119.5 Ų119.578%0.77677%0.768SS**  trans66.8140.1140.164.90000118.6
316S46.5Very low41.6Very low100 Ų100119.4 Ų119.470%0.69977%0.772SS**  cis-174.2152.71.340.70000107.8
317S43.7Very low41.7Very low102 Ų102116.5 Ų116.571%0.71377%0.765SS**  trans60.698.3149.559.10000120.9
318S44.2Very low41.4Very low123 Ų123116.9 Ų116.986%0.8677%0.769SS**  48.7151.7115.9-60.70000123.8
319P44.7Very low41.3Very low114 Ų114117.8 Ų117.874%0.7477%0.773SS**  trans-115.7167.1-145.739.9-27.3000115.1
320S39.7Very low41.2Very low122 Ų122115.3 Ų115.385%0.85377%0.768SS**  trans147.9112137.4-65.70000112.7
321S41.6Very low40.9Very low117 Ų117121.2 Ų121.282%0.81878%0.777SS**  trans-152.9111.6155.351.70000106.7
322A41.8Very low40.2Very low90 Ų90119.7 Ų119.774%0.74478%0.778SS**  76.2104.485.700000114.2
323V38Very low39.8Very low130 Ų130118 Ų11879%0.78877%0.774SS**  trans50.3124.5130.3-170.30000119.6
324C35.7Very low39.3Very low112 Ų112122.8 Ų122.876%0.75779%0.786SS**  trans162.7107132.2-83.50000109.6
325T35.9Very low38.6Very low118 Ų118124.5 Ų124.572%0.72479%0.79SS**  79.213387.554.40000117.1
326S37.7Very low38Very low112 Ų112125 Ų12578%0.78379%0.794SS**  trans73.2140.216677.70000115.9
327S40.6Very low37.4Very low114 Ų114126.1 Ų126.180%0.79780%0.797SS**  cis-166.1154.522.528.50000109.8
328S38Very low36.8Very low115 Ų115127.4 Ų127.480%0.80480%0.801SS**  trans-75.4-168.8-177-47.80000114.3
329P39.3Very low36.2Very low121 Ų121129.4 Ų129.479%0.78679%0.794SS**  cis-133.6159.2-49.930.2-12000113.7
330S38.3Very low35.6Very low111 Ų111129.6 Ų129.678%0.77680%0.798SS**  trans-168.2125.2152.447.50000113.5
331H34.8Very low35.4Very low193 Ų193133.2 Ų133.289%0.89480%0.801SS**  trans32.6115.9149.7-81.4-100000119.7
332C32.1Very low35.1Very low123 Ų123136.1 Ų136.183%0.83180%0.802SS**  -177.8151.1110.8-151.20000112
333N31.6Very low34.8Very low136 Ų136138.6 Ų138.673%0.72780%0.803SS**  trans-47.6145.8176.9-62.7-47.3000114.6
334Q34Very low34.6Very low193 Ų193138.5 Ų138.590%0.90280%0.797SS**  trans-163.7127.8132.9-109.4170.286.800112.7
335L28.5Very low34.5Very low158 Ų158139.8 Ų139.883%0.82780%0.795SS**  trans-71.9138.5171.2-71.6104.5000110.5
336S32.1Very low34.4Very low122 Ų122142.9 Ų142.985%0.85380%0.799SS**  trans-125.2107.1160.9-73.30000109.3
337T32.8Very low34.2Very low123 Ų123143.8 Ų143.876%0.75581%0.805SS**  trans-92.4128.9169.848.50000109.8
338T31.3Very low33.8Very low129 Ų129142.1 Ų142.179%0.79181%0.805SS**  trans-129.1110.5161.6510000108.7
339F32.8Very low33.4Very low165 Ų165144.7 Ų144.772%0.72481%0.81SS**  trans-147.6124.6159.5-110.8-79.2000109.4R136R136-F339 VanDerWaalsContact CZ-CE1 3.41Å; R136-F339 VanDerWaalsContact NH2-CE1 3.33Å
340S31Very low33.1Very low118 Ų118149.1 Ų149.183%0.82582%0.817SS**  trans-93.3134.7175-64.90000109.5
341E35Very low32.6Very low197 Ų197153.8 Ų153.892%0.92182%0.818SS**  trans-134.4132.2161.5-88.4-179.6155.200109.3
342Q36.9Very low32.4Very low179 Ų179151.7 Ų151.784%0.83682%0.818SS**  trans-101.7123.2170-76.3177.8-18.700108.4
343N33.8Very low32.3Very low141 Ų141153.6 Ų153.675%0.75481%0.812SS**  53.1144.8123.1-73.6-19.4000119.4
344I34.5Very low32.5Very low129 Ų129153 Ų15366%0.66282%0.818SS**  cis-176.6123.711.6-100162.7000102.8
345L32.8Very low32.2Very low139 Ų139151.7 Ų151.773%0.72882%0.818SS**  90.5131.789-119.6155.4000116.5
346K35.5Very low32.5Very low183 Ų183147.8 Ų147.880%0.79682%0.816SS**  trans92.2111.8156.1-55.8-177.5179.3178.30117.1
347S31.9Very low32.2Very low131 Ų131149.7 Ų149.792%0.91682%0.817SS**  91.2119.551176.90000114.3
348G33.5Very low32.2Very low78 Ų78150.3 Ų150.380%0.80482%0.82SS**  trans16394156.200000117.5
349N29.8Very low32.1Very low169 Ų169152.5 Ų152.590%0.90482%0.821SS**  trans-69.4149.4172.3-102.5-20.3000114.6
350K33.2Very low31.8Very low215 Ų215151.6 Ų151.694%0.93582%0.822SS**  trans-163.1131140.4-113.9172.6-173.2177.20114.1
351R26.8Very low31.9Very low209 Ų209151.8 Ų151.879%0.78982%0.822SS**  trans-102.2145-177.1-178.7-176.3-168.6178.97.5111.5
352V30.8Very low31.5Very low148 Ų148148.9 Ų148.990%0.89781%0.812SS**  trans-136.1139161.9178.10000110.2
353K29.9Very low31.1Very low164 Ų164147.9 Ų147.971%0.71381%0.813SS**  trans-101.6152.9178.6-83.4176.5168.2179.70110.8
354S35.9Very low30.9Very low122 Ų122150.2 Ų150.285%0.85382%0.819SS**  trans-151141.6147.356.90000112.3
355N28.1Very low30.5Very low166 Ų166151.8 Ų151.889%0.88883%0.828SS**  trans-93.4160.4179.2-78.4-10.7000111.2
356G34.6Very low30.3Very low77 Ų77153 Ų15379%0.79483%0.829SS**  trans172.2106.9160.200000113.9
357D26Very low30.1Very low162 Ų162149 Ų14987%0.86682%0.823SS**  trans-63.4163.1171.7-72.8-58.1000113.4
358V32.2Very low30.2Very low135 Ų135148 Ų14882%0.81881%0.805SS**  168.2124.6125.8160.70000113.1
359H30.2Very low30.5Very low176 Ų176146 Ų14682%0.81578%0.777SS**  trans49.5127.3150.3-97.8-90000125.2
360I26.3Very low30.7Very low145 Ų145142.6 Ų142.674%0.74476%0.764SS**  trans-89.3138.5163-65.1165.8000109.1
361C31.7Very low30.9Very low122 Ų122134.3 Ų134.382%0.82473%0.733SS**  trans-140.3138152.6-81.10000109.6
362D27Very low31.2Very low136 Ų136132.8 Ų132.873%0.72773%0.732SS**  trans-67.8141.8-172.3-56.6-70.2000114.4
363N29.5Very low31.7Very low158 Ų158127.5 Ų127.585%0.84570%0.7SS**  166.3144123.3-82.6-30.3000111.7
364E28.9Very low32Very low191 Ų191125.5 Ų125.589%0.89370%0.697SS**  trans80.4114.7174.5-69.8-169.3138.100119.6H366E364-H366 PolarHBondContact O-N 3.36Å; E364-H366 VanDerWaalsContact O-N 3.15Å
365I26.5Very low32.1Very low162 Ų162123.2 Ų123.283%0.83167%0.674SS**SBendtrans-7693.5-171.4-62.7159.6000109.3
366H28.2Very low32.9Very low165 Ų165117.6 Ų117.676%0.76464%0.644SS**  trans-155.874.7158.9-120.6-85.4000108.5E364 M368E364-H366 PolarHBondContact O-N 3.36Å; E364-H366 VanDerWaalsContact O-N 3.15Å; H366-M368 VanDerWaalsContact C-N 3.33Å; H366-M368 PolarHBondContact O-N 3.3Å
367C31.3Very low33.3Very low97 Ų97117.6 Ų117.666%0.65563%0.632SS**  trans-73.985.4-169.6-62.30000113K166K166-C367 PolarHBondContact NZ-O 3.48Å
368M34.1Very low34.1Very low111 Ų111115.4 Ų115.455%0.54762%0.621SS.*  trans-23.8132.4143.8-64.6169.565.700112.1H366H366-M368 VanDerWaalsContact C-N 3.33Å; H366-M368 PolarHBondContact O-N 3.3Å
369V39.1Very low34.7Very low37 Ų37114.5 Ų114.522%0.22461%0.61CS.*  trans-71.4121.8148.5-1790000103.7S371V369-S371 PolarHBondContact O-N 3.06Å
370P34.5Very low34.8Very low96 Ų96117.6 Ų117.662%0.62363%0.632SS**  trans-56.1119.8171.8-17.129.2000107K372P370-K372 PolarHBondContact O-N 3.21Å
371S36.4Very low35.3Very low41 Ų41116.2 Ų116.229%0.28763%0.627SS.*  trans-6871.7170.3-58.70000109.4V369V369-S371 PolarHBondContact O-N 3.06Å
372K34.7Very low35.4Very low178 Ų178115.9 Ų115.977%0.77462%0.616SS**  trans-11169.2151.9-75.9-172.7175.9-176.30105.8P370 L374P370-K372 PolarHBondContact O-N 3.21Å; K372-L374 PolarHBondContact O-N 3.38Å
373V40.1Very low35.9Very low36 Ų36114.8 Ų114.822%0.21861%0.61CS.*  trans-84.798.3158.8177.50000104F112 L375F112-V373 HydrophobicContact CD2-CG1 3.74Å; F112-V373 HydrophobicContact CD2-CG2 4.23Å; F112-V373 HydrophobicContact CE2-CG1 4.02Å; F112-V373 HydrophobicContact CG-CG2 4.5Å; V373-L375 PolarHBondContact O-N 3.45Å
374L36.4Very low36.3Very low123 Ų123112.2 Ų112.264%0.64460%0.596SS**  trans-55.1133.1171.1-70.1168.3000108.2K372 L376K372-L374 PolarHBondContact O-N 3.38Å; L374-L376 PolarHBondContact O-N 3.24Å
375L37.4Very low36.8Very low73 Ų73107.3 Ų107.338%0.38258%0.578SS.*  trans-59.8131.2-176.4-71.1157.4000109.5K29 V373 S377 D378K29-L375 HydrophobicContact CD-CD2 4.39Å; K29-L375 HydrophobicContact CG-CD2 4.49Å; V373-L375 PolarHBondContact O-N 3.45Å; L375-S377 WeakPolarHBondContact CB-OG 3.3Å; L375-S377 PolarHBondContact O-N 2.9Å; L375-S377 VanDerWaalsContact O-N 3.08Å; L375-D378 PolarHBondContact O-N 3.45Å
376L45Very low37.4Very low48 Ų48103.7 Ų103.725%0.25156%0.561SS.*THydrogen-bonded Turntrans-62.4-7.7164.5-9584.3000112.3I147 M150 L374I147-L376 HydrophobicContact CB-CD2 3.8Å; I147-L376 HydrophobicContact CG2-CD2 4.05Å; M150-L376 HydrophobicContact CB-CD2 3.46Å; M150-L376 VanDerWaalsContact CB-CD2 3.46Å; M150-L376 HydrophobicContact CB-CG 3.96Å; M150-L376 HydrophobicContact CE-CD2 3.72Å; M150-L376 HydrophobicContact CE-CG 4.27Å; M150-L376 HydrophobicContact CG-CD2 4.3Å; M150-L376 HydrophobicContact SD-CD2 3.98Å; M150-L376 HydrophobicContact SD-CG 4.06Å; L374-L376 PolarHBondContact O-N 3.24Å
377S43.5Very low38.1Very low78 Ų7899.3 Ų99.355%0.54555%0.546SS..THydrogen-bonded Turntrans-89.86.1172.457.10000114.2L375L375-S377 WeakPolarHBondContact CB-OG 3.3Å; L375-S377 PolarHBondContact O-N 2.9Å; L375-S377 VanDerWaalsContact O-N 3.08Å
378D43.1Very low38.6Very low116 Ų11699.5 Ų99.562%0.6254%0.538SS*.SBendtrans-104.120.6174-66.5-27.5000112.7L375L375-D378 PolarHBondContact O-N 3.45Å
379I43.8Very low39Very low115 Ų11598.5 Ų98.559%0.5954%0.537SS*.  trans-116.2112.1174.4-57.5174.1000106.7M150M150-I379 HydrophobicContact SD-CD1 3.63Å
380D33.9Very low39Very low241 Ų241104.1 Ų104.1100%1.28957%0.566SS**  trans-51.20-178.1-78.4-48.2000114.9

Retrieved 380 of 380 residues in 699.8 ms (Link to these results)

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