A0A077YVP5_TRITR Loading...

G protein coupled receptor

AlphaFold DB , UniProt , Accession A0A077YVP5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 369 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
1M50Low54.7Low145 Ų14577.3 Ų77.371%0.71441%0.412SS*.  0122.10-154.1150.1-164.800106.3E5 E6 L9M1-E5 WeakPolarHBondContact CA-OE2 3.42Å; M1-E5 HydrophobicContact CE-CB 3.88Å; M1-E5 HydrophobicContact CG-CB 3.49Å; M1-E5 VanDerWaalsContact CG-CB 3.49Å; M1-E5 HydrophobicContact CG-CG 4.45Å; M1-E5 VanDerWaalsContact CG-OE2 3.31Å; M1-E5 WeakPolarHBondContact CG-OE2 3.38Å; M1-E6 HydrophobicContact CG-CG 4.19Å; M1-E6 HydrophobicContact SD-CG 4.15Å; M1-L9 HydrophobicContact CE-CD1 3.14Å; M1-L9 HydrophobicContact CE-CG 4.39Å
2S59.8Low55.2Low57 Ų5774 Ų7440%0.39940%0.397SS..  trans-65.6149.6175.556.60000109.5E4 E5S2-E4 PolarHBondContact O-N 3.49Å; S2-E5 PolarHBondContact N-OE2 3.48Å; S2-E5 WeakPolarHBondContact O-CB 3.32Å; S2-E5 PolarHBondContact O-N 3.47Å; S2-E5 VanDerWaalsContact OG-CG 3.29Å; S2-E5 WeakPolarHBondContact OG-CG 3.4Å; S2-E5 PolarHBondContact OG-N 3.48Å
3C58.6Low56.1Low63 Ų6373.4 Ų73.443%0.42640%0.402SS..Hα-helixtrans-54.4-26.1178.2-57.80000111.1C171C3-C171 HydrophobicContact CB-CB 4.35Å; C3-C171 WeakPolarHBondContact CB-SG 3.42Å; C3-C171 WeakPolarHBondContact SG-CB 3.46Å; C3-C171 CovalentContact SG-SG 2.1Å; C3-C171 PolarHBondContact SG-SG 2.88Å
4E56.5Low57.1Low95 Ų9578.9 Ų78.944%0.44442%0.424SS..Hα-helixtrans-65.7-45.6173-67.5-174.8138.800112.3S2 E6 S7 Y8 R84S2-E4 PolarHBondContact O-N 3.49Å; E4-E6 PolarHBondContact O-N 3.41Å; E4-S7 PolarHBondContact O-N 3.2Å; E4-S7 VanDerWaalsContact O-N 3.16Å; E4-S7 PolarHBondContact O-OG 3.34Å; E4-Y8 HydrophobicContact CB-CE2 4.27Å; E4-Y8 WeakPolarHBondContact O-CD2 3.09Å; E4-R84 IonicContact OE1-NH2 3.36Å; E4-R84 PolarHBondContact OE1-NH2 3.39Å
5E56.8Low57.8Low59 Ų5977.5 Ų77.528%0.27643%0.427SS..Hα-helixtrans-60.6-37.7-177.5-79.8174158.300113.7M1 S2 S7 L82M1-E5 WeakPolarHBondContact CA-OE2 3.42Å; M1-E5 HydrophobicContact CE-CB 3.88Å; M1-E5 HydrophobicContact CG-CB 3.49Å; M1-E5 VanDerWaalsContact CG-CB 3.49Å; M1-E5 HydrophobicContact CG-CG 4.45Å; M1-E5 VanDerWaalsContact CG-OE2 3.31Å; M1-E5 WeakPolarHBondContact CG-OE2 3.38Å; S2-E5 PolarHBondContact N-OE2 3.48Å; S2-E5 WeakPolarHBondContact O-CB 3.32Å; S2-E5 PolarHBondContact O-N 3.47Å; S2-E5 VanDerWaalsContact OG-CG 3.29Å; S2-E5 WeakPolarHBondContact OG-CG 3.4Å; S2-E5 PolarHBondContact OG-N 3.48Å; E5-S7 VanDerWaalsContact C-N 3.26Å; E5-S7 PolarHBondContact O-N 3.12Å; E5-L82 HydrophobicContact CB-CD2 4.39Å; E5-L82 HydrophobicContact CG-CD1 4.47Å; E5-L82 HydrophobicContact CG-CD2 3.74Å
6E56.2Low58.6Low104 Ų10475.8 Ų75.849%0.48642%0.42SS..Hα-helixtrans-64.9-29.8178.1-82.9-169.1159.300112.7M1 E4 P10M1-E6 HydrophobicContact CG-CG 4.19Å; M1-E6 HydrophobicContact SD-CG 4.15Å; E4-E6 PolarHBondContact O-N 3.41Å; E6-P10 VanDerWaalsContact O-CD 3.27Å; E6-P10 WeakPolarHBondContact O-CD 3.46Å
7S54.7Low59.5Low23 Ų2373.5 Ų73.516%0.16141%0.406CS..Hα-helixtrans-82.4-23.8-174.7680000114.4E4 E5 P10E4-S7 PolarHBondContact O-N 3.2Å; E4-S7 VanDerWaalsContact O-N 3.16Å; E4-S7 PolarHBondContact O-OG 3.34Å; E5-S7 VanDerWaalsContact C-N 3.26Å; E5-S7 PolarHBondContact O-N 3.12Å; S7-P10 WeakPolarHBondContact O-CD 3.45Å
8Y54Low60.5Low30 Ų3074.8 Ų74.812%0.11841%0.411CS..Hα-helixtrans-82.8-31.3-179.8-71.4-73.5000113.5E4 P10 F87 I177E4-Y8 HydrophobicContact CB-CE2 4.27Å; E4-Y8 WeakPolarHBondContact O-CD2 3.09Å; Y8-P10 VanDerWaalsContact C-CD 3.47Å; Y8-F87 HydrophobicContact CD1-CD1 4.1Å; Y8-F87 HydrophobicContact CD1-CD2 4.19Å; Y8-F87 AromaticContact CD1-CE1 3.97Å; Y8-F87 HydrophobicContact CD1-CE1 3.97Å; Y8-F87 HydrophobicContact CD1-CE2 4.07Å; Y8-F87 HydrophobicContact CD1-CG 4.21Å; Y8-F87 AromaticContact CD1-CZ 3.97Å; Y8-F87 HydrophobicContact CD1-CZ 3.97Å; Y8-F87 AromaticContact CE1-CD1 3.95Å; Y8-F87 HydrophobicContact CE1-CD1 3.95Å; Y8-F87 HydrophobicContact CE1-CE1 4.01Å; Y8-F87 HydrophobicContact CE1-CG 4.34Å; Y8-F87 HydrophobicContact CE1-CZ 4.48Å; Y8-I177 HydrophobicContact CE1-CG2 4.26Å
9L51.2Low61.3Low80 Ų8072.8 Ų72.842%0.41940%0.399SS..G310 helixtrans-72.3-27.9-172.5-72.8175.1000117.6M1 Q11M1-L9 HydrophobicContact CE-CD1 3.14Å; M1-L9 HydrophobicContact CE-CG 4.39Å; L9-Q11 PolarHBondContact O-N 3.04Å
10P50Low62.2Low103 Ų10369.2 Ų69.267%0.66938%0.379SS*.G310 helixtrans-69.3-7.6-173.5-20.431.8000115.3E6 S7 Y8E6-P10 VanDerWaalsContact O-CD 3.27Å; E6-P10 WeakPolarHBondContact O-CD 3.46Å; S7-P10 WeakPolarHBondContact O-CD 3.45Å; Y8-P10 VanDerWaalsContact C-CD 3.47Å
11Q54Low63.1Low91 Ų9171.5 Ų71.543%0.42538%0.382SS..G310 helixtrans-86.3-12.5-173.4-66.2-171.42.700114.8L9L9-Q11 PolarHBondContact O-N 3.04Å
12V60.6Low64.8Low38 Ų3871.3 Ų71.323%0.2338%0.378CS..SBendtrans-113.3121.1-177.4-169.70000109.7T16 M17V12-T16 HydrophobicContact CG1-CG2 3.74Å; V12-M17 HydrophobicContact CB-CG 4.27Å; V12-M17 HydrophobicContact CB-SD 4.05Å; V12-M17 HydrophobicContact CG1-CG 3.83Å; V12-M17 HydrophobicContact CG1-SD 3.67Å
13S67Low66Low66 Ų6671.5 Ų71.546%0.46237%0.374SS..  trans-60.7142.2177.465.90000111A15 T16 M17S13-A15 PolarHBondContact O-N 3.24Å; S13-A15 VanDerWaalsContact O-N 3.12Å; S13-T16 WeakPolarHBondContact O-CA 3.21Å; S13-T16 WeakPolarHBondContact O-CB 3.43Å; S13-T16 PolarHBondContact O-N 3.42Å; S13-T16 PolarHBondContact OG-N 3.41Å; S13-T16 PolarHBondContact OG-OG1 3.34Å; S13-M17 PolarHBondContact O-N 3.1Å; S13-M17 VanDerWaalsContact O-N 3.09Å
14Q69.7Low67.3Low151 Ų15169.1 Ų69.171%0.70636%0.356SS*.Hα-helixtrans-52-37.4177.6-69.7-65.8-15.300112.1T16 M17 I18Q14-T16 PolarHBondContact O-N 3.32Å; Q14-M17 WeakPolarHBondContact O-CB 3.32Å; Q14-M17 PolarHBondContact O-N 3.39Å; Q14-I18 WeakPolarHBondContact O-CG1 3.13Å; Q14-I18 PolarHBondContact O-N 3.48Å
15A67.8Low68.9Low57 Ų5766.5 Ų66.547%0.47135%0.348SS..Hα-helixtrans-58.2-48.5173.500000112S13 M17 I18 I19S13-A15 PolarHBondContact O-N 3.24Å; S13-A15 VanDerWaalsContact O-N 3.12Å; A15-M17 VanDerWaalsContact C-N 3.27Å; A15-M17 PolarHBondContact O-N 3.14Å; A15-I18 PolarHBondContact O-N 3.14Å; A15-I19 HydrophobicContact CB-CD1 4.41Å; A15-I19 WeakPolarHBondContact O-CB 3.23Å; A15-I19 WeakPolarHBondContact O-CD1 3.45Å; A15-I19 WeakPolarHBondContact O-CG1 3.27Å; A15-I19 PolarHBondContact O-N 3.28Å
16T70.5Confident70.4Confident51 Ų5169.8 Ų69.831%0.31336%0.361SS..Hα-helixtrans-60.8-38.4178.4-55.40000111.4V12 S13 Q14 G20 S76V12-T16 HydrophobicContact CG1-CG2 3.74Å; S13-T16 WeakPolarHBondContact O-CA 3.21Å; S13-T16 WeakPolarHBondContact O-CB 3.43Å; S13-T16 PolarHBondContact O-N 3.42Å; S13-T16 PolarHBondContact OG-N 3.41Å; S13-T16 PolarHBondContact OG-OG1 3.34Å; Q14-T16 PolarHBondContact O-N 3.32Å; T16-G20 PolarHBondContact O-N 3.11Å; T16-S76 PolarHBondContact O-OG 3.26Å
17M73.7Confident71.9Confident37 Ų3765 Ų6518%0.18234%0.339CS..Hα-helixtrans-63.5-50.6176.7-68.2-63.2-70.400112.1V12 S13 Q14 A15 I19 R21 S76V12-M17 HydrophobicContact CB-CG 4.27Å; V12-M17 HydrophobicContact CB-SD 4.05Å; V12-M17 HydrophobicContact CG1-CG 3.83Å; V12-M17 HydrophobicContact CG1-SD 3.67Å; S13-M17 PolarHBondContact O-N 3.1Å; S13-M17 VanDerWaalsContact O-N 3.09Å; Q14-M17 WeakPolarHBondContact O-CB 3.32Å; Q14-M17 PolarHBondContact O-N 3.39Å; A15-M17 VanDerWaalsContact C-N 3.27Å; A15-M17 PolarHBondContact O-N 3.14Å; M17-I19 VanDerWaalsContact C-N 3.34Å; M17-I19 PolarHBondContact O-N 3.45Å; M17-R21 WeakPolarHBondContact O-CB 3.35Å; M17-R21 PolarHBondContact O-N 3.21Å; M17-S76 WeakPolarHBondContact CE-O 3.18Å
18I77.7Confident73.6Confident97 Ų9765.5 Ų65.550%0.49734%0.338SS..Hα-helixtrans-60.7-47.1179.4-66166.9000110.2Q14 A15 R21 F22Q14-I18 WeakPolarHBondContact O-CG1 3.13Å; Q14-I18 PolarHBondContact O-N 3.48Å; A15-I18 PolarHBondContact O-N 3.14Å; I18-R21 PolarHBondContact O-N 3.1Å; I18-F22 HydrophobicContact CG2-CD2 4.28Å; I18-F22 WeakPolarHBondContact O-CD2 3.24Å; I18-F22 PolarHBondContact O-N 3.21Å
19I75.7Confident75.4Confident37 Ų3768.8 Ų68.819%0.1936%0.357CS..Iπ-helixtrans-65.6-49.3-177.8-67.6158.5000110.9A15 M17 R21 I23 F24 I273A15-I19 HydrophobicContact CB-CD1 4.41Å; A15-I19 WeakPolarHBondContact O-CB 3.23Å; A15-I19 WeakPolarHBondContact O-CD1 3.45Å; A15-I19 WeakPolarHBondContact O-CG1 3.27Å; A15-I19 PolarHBondContact O-N 3.28Å; M17-I19 VanDerWaalsContact C-N 3.34Å; M17-I19 PolarHBondContact O-N 3.45Å; I19-R21 VanDerWaalsContact C-N 3.27Å; I19-R21 PolarHBondContact O-N 3.33Å; I19-I23 HydrophobicContact CG1-CD1 4.21Å; I19-I23 HydrophobicContact CG2-CB 4.38Å; I19-I23 WeakPolarHBondContact O-CB 3.25Å; I19-I23 PolarHBondContact O-N 3.49Å; I19-F24 PolarHBondContact O-N 3.27Å; I19-I273 HydrophobicContact CD1-CD1 3.35Å; I19-I273 HydrophobicContact CD1-CG1 4.38Å; I19-I273 HydrophobicContact CG1-CD1 4.3Å; I19-I273 HydrophobicContact CG2-CD1 4.31Å; I19-I273 HydrophobicContact CG2-CG1 4.27Å
20G78.9Confident77.2Confident0 Ų066.9 Ų66.90%035%0.346CS..Iπ-helixtrans-63.3-33.2-179.700000112.9T16 P25T16-G20 PolarHBondContact O-N 3.11Å; G20-P25 WeakPolarHBondContact O-CD 3.43Å
21R82.5Confident79Confident117 Ų11762 Ų6244%0.44232%0.315SS..Iπ-helixtrans-82.2-40.5-177.2-172.7170.7-179.8166-0.5114M17 I18 I19 P25 F77M17-R21 WeakPolarHBondContact O-CB 3.35Å; M17-R21 PolarHBondContact O-N 3.21Å; I18-R21 PolarHBondContact O-N 3.1Å; I19-R21 VanDerWaalsContact C-N 3.27Å; I19-R21 PolarHBondContact O-N 3.33Å; R21-P25 WeakPolarHBondContact O-CG 3.17Å; R21-F77 HydrophobicContact CG-CD1 4.44Å; R21-F77 HydrophobicContact CG-CE1 4.07Å
22F85.2Confident80.9Confident141 Ų14158.7 Ų58.762%0.61830%0.301SS*.Iπ-helixtrans-109.1-40.9-171.2-64.1-71.2000113.8I18I18-F22 HydrophobicContact CG2-CD2 4.28Å; I18-F22 WeakPolarHBondContact O-CD2 3.24Å; I18-F22 PolarHBondContact O-N 3.21Å
23I84.4Confident82.4Confident62 Ų6260.9 Ų60.932%0.31831%0.31SS..Iπ-helixtrans-87.1-48.6-172.4-63.7177.6000110.5I19 F26 V27 F277I19-I23 HydrophobicContact CG1-CD1 4.21Å; I19-I23 HydrophobicContact CG2-CB 4.38Å; I19-I23 WeakPolarHBondContact O-CB 3.25Å; I19-I23 PolarHBondContact O-N 3.49Å; I23-F26 PolarHBondContact O-N 3.41Å; I23-V27 HydrophobicContact CG2-CG2 3.99Å; I23-V27 WeakPolarHBondContact O-CG2 3.38Å; I23-V27 PolarHBondContact O-N 3.16Å; I23-F277 HydrophobicContact CG2-CE1 4.35Å; I23-F277 HydrophobicContact CG2-CE2 3.4Å; I23-F277 HydrophobicContact CG2-CZ 3.22Å
24F86.4Confident83.4Confident12 Ų1257.8 Ų57.85%0.05329%0.288CS..Hα-helixtrans-58.8-43.3-173.6-179.2-98.3000114.1I19 F26 V27 F28 V69 L70 H73 V276I19-F24 PolarHBondContact O-N 3.27Å; F24-F26 VanDerWaalsContact C-N 3.32Å; F24-F26 PolarHBondContact O-N 3.24Å; F24-V27 PolarHBondContact O-N 3.31Å; F24-F28 HydrophobicContact CD1-CB 4.4Å; F24-F28 HydrophobicContact CE1-CB 4.01Å; F24-F28 HydrophobicContact CE1-CD2 4.16Å; F24-F28 HydrophobicContact CE1-CG 4.3Å; F24-F28 HydrophobicContact CZ-CB 4.1Å; F24-F28 AromaticContact CZ-CD2 3.92Å; F24-F28 HydrophobicContact CZ-CD2 3.92Å; F24-F28 HydrophobicContact CZ-CG 4.38Å; F24-F28 VanDerWaalsContact O-CB 3.26Å; F24-F28 WeakPolarHBondContact O-CB 3.33Å; F24-F28 PolarHBondContact O-N 3.21Å; F24-V69 HydrophobicContact CE2-CG1 3.65Å; F24-V69 HydrophobicContact CZ-CG1 4.03Å; F24-L70 HydrophobicContact CE1-CD1 3.89Å; F24-H73 HydrophobicContact CB-CB 4.23Å; F24-H73 HydrophobicContact CD1-CB 3.32Å; F24-H73 AromaticContact CD1-CD2 3.91Å; F24-H73 AromaticContact CD1-CG 3.6Å; F24-H73 HydrophobicContact CD2-CB 4.26Å; F24-H73 AromaticContact CD2-CD2 3.3Å; F24-H73 WeakPolarHBondContact CD2-CD2 3.44Å; F24-H73 AromaticContact CD2-CE1 3.9Å; F24-H73 AromaticContact CD2-CG 3.59Å; F24-H73 AromaticContact CD2-ND1 3.96Å; F24-H73 AromaticContact CD2-NE2 3.52Å; F24-H73 HydrophobicContact CE1-CB 3.64Å; F24-H73 AromaticContact CE1-CD2 3.86Å; F24-H73 AromaticContact CE1-CG 3.94Å; F24-H73 AromaticContact CE2-CD2 3.26Å; F24-H73 WeakPolarHBondContact CE2-CD2 3.24Å; F24-H73 AromaticContact CE2-CG 3.93Å; F24-H73 AromaticContact CE2-NE2 3.68Å; F24-H73 HydrophobicContact CG-CB 3.66Å; F24-H73 AromaticContact CG-CD2 3.63Å; F24-H73 AromaticContact CG-CG 3.4Å; F24-H73 VanDerWaalsContact CG-CG 3.4Å; F24-H73 AromaticContact CG-ND1 3.82Å; F24-H73 HydrophobicContact CZ-CB 4.23Å; F24-H73 AromaticContact CZ-CD2 3.54Å; F24-V276 HydrophobicContact CD2-CG1 4.42Å; F24-V276 HydrophobicContact CE2-CG1 4.32Å
25P90.1Very high84.3Confident41 Ų4150.8 Ų50.827%0.26626%0.256SS..Hα-helixtrans-60.1-41.1-178.5-25.235.9000112.9G20 R21 F28 I29 F77G20-P25 WeakPolarHBondContact O-CD 3.43Å; R21-P25 WeakPolarHBondContact O-CG 3.17Å; P25-F28 PolarHBondContact O-N 3.09Å; P25-I29 WeakPolarHBondContact O-CB 3.48Å; P25-I29 WeakPolarHBondContact O-CD1 3.41Å; P25-I29 VanDerWaalsContact O-CG1 3.24Å; P25-I29 WeakPolarHBondContact O-CG1 3.37Å; P25-I29 PolarHBondContact O-N 3.35Å; P25-F77 HydrophobicContact CG-CZ 4.2Å
26F89Confident85.4Confident128 Ų12851.5 Ų51.556%0.56125%0.251SS*.Hα-helixtrans-64-47.5176.4177.3-94.6000111.3I23 F24 F28 I29 M30 F281I23-F26 PolarHBondContact O-N 3.41Å; F24-F26 VanDerWaalsContact C-N 3.32Å; F24-F26 PolarHBondContact O-N 3.24Å; F26-F28 VanDerWaalsContact C-N 3.33Å; F26-F28 PolarHBondContact O-N 3.46Å; F26-I29 PolarHBondContact O-N 3.37Å; F26-M30 WeakPolarHBondContact O-CB 3.27Å; F26-M30 PolarHBondContact O-N 3.34Å; F26-F281 HydrophobicContact CE1-CZ 4.18Å
27V87.5Confident86.3Confident2 Ų250.3 Ų50.31%0.01224%0.243CC..Hα-helixtrans-64.7-39.1-179.7-179.90000111.1I23 F24 G31 F66 V276 F277 A280I23-V27 HydrophobicContact CG2-CG2 3.99Å; I23-V27 WeakPolarHBondContact O-CG2 3.38Å; I23-V27 PolarHBondContact O-N 3.16Å; F24-V27 PolarHBondContact O-N 3.31Å; V27-G31 PolarHBondContact O-N 3.5Å; V27-F66 HydrophobicContact CG1-CE1 4.42Å; V27-V276 HydrophobicContact CG1-CB 4.43Å; V27-V276 HydrophobicContact CG1-CG1 3.51Å; V27-F277 HydrophobicContact CG2-CD1 4.02Å; V27-F277 HydrophobicContact CG2-CD2 4.39Å; V27-F277 HydrophobicContact CG2-CE1 3.72Å; V27-F277 HydrophobicContact CG2-CE2 4.14Å; V27-F277 HydrophobicContact CG2-CG 4.35Å; V27-F277 HydrophobicContact CG2-CZ 3.82Å; V27-A280 HydrophobicContact CB-CB 4.44Å; V27-A280 HydrophobicContact CG1-CB 3.43Å; V27-A280 VanDerWaalsContact CG1-CB 3.43Å; V27-A280 WeakPolarHBondContact O-CB 3.5Å
28F90.6Very high86.8Confident35 Ų3549 Ų4915%0.15424%0.236CC..Hα-helixtrans-62.4-50.8174.7176.8-91.8000111.6F24 P25 F26 M30 G31 V32 F66 F67 L70F24-F28 HydrophobicContact CD1-CB 4.4Å; F24-F28 HydrophobicContact CE1-CB 4.01Å; F24-F28 HydrophobicContact CE1-CD2 4.16Å; F24-F28 HydrophobicContact CE1-CG 4.3Å; F24-F28 HydrophobicContact CZ-CB 4.1Å; F24-F28 AromaticContact CZ-CD2 3.92Å; F24-F28 HydrophobicContact CZ-CD2 3.92Å; F24-F28 HydrophobicContact CZ-CG 4.38Å; F24-F28 VanDerWaalsContact O-CB 3.26Å; F24-F28 WeakPolarHBondContact O-CB 3.33Å; F24-F28 PolarHBondContact O-N 3.21Å; P25-F28 PolarHBondContact O-N 3.09Å; F26-F28 VanDerWaalsContact C-N 3.33Å; F26-F28 PolarHBondContact O-N 3.46Å; F28-M30 PolarHBondContact O-N 3.3Å; F28-G31 PolarHBondContact O-N 3.31Å; F28-V32 HydrophobicContact CD1-CG2 4.3Å; F28-V32 HydrophobicContact CD2-CG2 4.26Å; F28-V32 HydrophobicContact CE1-CG2 3.98Å; F28-V32 HydrophobicContact CE2-CG2 3.93Å; F28-V32 HydrophobicContact CG-CG2 4.43Å; F28-V32 HydrophobicContact CZ-CG2 3.78Å; F28-V32 WeakPolarHBondContact O-CB 3.48Å; F28-V32 VanDerWaalsContact O-CG2 3.3Å; F28-V32 WeakPolarHBondContact O-CG2 3.21Å; F28-V32 PolarHBondContact O-N 3.47Å; F28-F66 HydrophobicContact CD2-CB 3.91Å; F28-F66 HydrophobicContact CD2-CD1 4.16Å; F28-F66 HydrophobicContact CD2-CG 4.41Å; F28-F66 HydrophobicContact CE2-CB 3.91Å; F28-F67 HydrophobicContact CZ-CD1 4.36Å; F28-F67 HydrophobicContact CZ-CE1 4.13Å; F28-L70 HydrophobicContact CD2-CD1 4.36Å; F28-L70 HydrophobicContact CE2-CB 4.09Å; F28-L70 HydrophobicContact CE2-CD1 4.17Å; F28-L70 HydrophobicContact CE2-CD2 4.11Å; F28-L70 HydrophobicContact CE2-CG 4.35Å; F28-L70 HydrophobicContact CZ-CD1 4.37Å; F28-L70 HydrophobicContact CZ-CD2 3.98Å
29I91.4Very high87.3Confident98 Ų9846.5 Ų46.550%0.50322%0.224SC..Hα-helixtrans-59.8-47.7179.2-69.7166000110.4P25 F26 V32 I33P25-I29 WeakPolarHBondContact O-CB 3.48Å; P25-I29 WeakPolarHBondContact O-CD1 3.41Å; P25-I29 VanDerWaalsContact O-CG1 3.24Å; P25-I29 WeakPolarHBondContact O-CG1 3.37Å; P25-I29 PolarHBondContact O-N 3.35Å; F26-I29 PolarHBondContact O-N 3.37Å; I29-V32 PolarHBondContact O-N 3.4Å; I29-I33 HydrophobicContact CG2-CD1 3.6Å; I29-I33 HydrophobicContact CG2-CG1 4.4Å; I29-I33 WeakPolarHBondContact O-CB 3.48Å; I29-I33 VanDerWaalsContact O-CG1 3.26Å; I29-I33 WeakPolarHBondContact O-CG1 3.49Å; I29-I33 PolarHBondContact O-N 3.37Å
30M88.5Confident87.8Confident40 Ų4047.3 Ų47.320%0.19723%0.228CC..Hα-helixtrans-63-44.4178.7-174.162.3-103.200111.5F26 F28 G34 F283 V284F26-M30 WeakPolarHBondContact O-CB 3.27Å; F26-M30 PolarHBondContact O-N 3.34Å; F28-M30 PolarHBondContact O-N 3.3Å; M30-G34 WeakPolarHBondContact O-CA 3.46Å; M30-G34 PolarHBondContact O-N 3.41Å; M30-F283 HydrophobicContact CE-CD1 3.56Å; M30-F283 HydrophobicContact CE-CE1 4.16Å; M30-F283 HydrophobicContact CE-CG 4.47Å; M30-V284 HydrophobicContact CE-CG2 4.3Å; M30-V284 HydrophobicContact SD-CG2 4.23Å
31G88.6Confident88Confident1 Ų147.3 Ų47.31%0.0123%0.228CC..Hα-helixtrans-63.9-43.4178.400000113.6V27 F28 N35 F66V27-G31 PolarHBondContact O-N 3.5Å; F28-G31 PolarHBondContact O-N 3.31Å; G31-N35 WeakPolarHBondContact O-CB 3.27Å; G31-N35 PolarHBondContact O-N 3.37Å; G31-N35 PolarHBondContact O-ND2 3.48Å; G31-F66 VanDerWaalsContact CA-CE2 3.48Å
32V93.1Very high87.8Confident21 Ų2142.6 Ų42.613%0.12721%0.212CC..Hα-helixtrans-67.3-50.4178.2170.70000110.9F28 I29 G34 N35 I36 L63 F66F28-V32 HydrophobicContact CD1-CG2 4.3Å; F28-V32 HydrophobicContact CD2-CG2 4.26Å; F28-V32 HydrophobicContact CE1-CG2 3.98Å; F28-V32 HydrophobicContact CE2-CG2 3.93Å; F28-V32 HydrophobicContact CG-CG2 4.43Å; F28-V32 HydrophobicContact CZ-CG2 3.78Å; F28-V32 WeakPolarHBondContact O-CB 3.48Å; F28-V32 VanDerWaalsContact O-CG2 3.3Å; F28-V32 WeakPolarHBondContact O-CG2 3.21Å; F28-V32 PolarHBondContact O-N 3.47Å; I29-V32 PolarHBondContact O-N 3.4Å; V32-G34 VanDerWaalsContact C-N 3.32Å; V32-G34 PolarHBondContact O-N 3.21Å; V32-N35 PolarHBondContact O-N 3.21Å; V32-I36 HydrophobicContact CG1-CD1 3.64Å; V32-I36 HydrophobicContact CG1-CG1 4.47Å; V32-I36 WeakPolarHBondContact O-CB 3.48Å; V32-I36 VanDerWaalsContact O-CG1 3.23Å; V32-I36 WeakPolarHBondContact O-CG1 3.48Å; V32-I36 PolarHBondContact O-N 3.37Å; V32-L63 HydrophobicContact CB-CD2 4.37Å; V32-L63 HydrophobicContact CG1-CD2 4.19Å; V32-L63 HydrophobicContact CG2-CD2 4.41Å; V32-F66 HydrophobicContact CG2-CB 4.14Å; V32-F66 HydrophobicContact CG2-CG 4.47Å
33I92Very high87.6Confident85 Ų8545.9 Ų45.944%0.43622%0.22SC..Hα-helixtrans-60.3-45.6178.4-68.9174000110.4I29 I36 L37I29-I33 HydrophobicContact CG2-CD1 3.6Å; I29-I33 HydrophobicContact CG2-CG1 4.4Å; I29-I33 WeakPolarHBondContact O-CB 3.48Å; I29-I33 VanDerWaalsContact O-CG1 3.26Å; I29-I33 WeakPolarHBondContact O-CG1 3.49Å; I29-I33 PolarHBondContact O-N 3.37Å; I33-I36 PolarHBondContact O-N 3.21Å; I33-L37 HydrophobicContact CG2-CD1 3.79Å; I33-L37 HydrophobicContact CG2-CG 4.3Å; I33-L37 WeakPolarHBondContact O-CB 3.23Å; I33-L37 VanDerWaalsContact O-CG 3.28Å; I33-L37 WeakPolarHBondContact O-CG 2.99Å; I33-L37 PolarHBondContact O-N 2.71Å
34G87.3Confident87.2Confident0 Ų046.3 Ų46.30%023%0.233CC..Hα-helixtrans-59.8-48.7-178.800000112.8M30 V32 L37 I38 F283M30-G34 WeakPolarHBondContact O-CA 3.46Å; M30-G34 PolarHBondContact O-N 3.41Å; V32-G34 VanDerWaalsContact C-N 3.32Å; V32-G34 PolarHBondContact O-N 3.21Å; G34-L37 PolarHBondContact O-N 3.39Å; G34-I38 WeakPolarHBondContact O-CG1 3.47Å; G34-I38 PolarHBondContact O-N 3.37Å; G34-F283 VanDerWaalsContact CA-CB 3.45Å; G34-F283 VanDerWaalsContact O-CD2 3.25Å; G34-F283 WeakPolarHBondContact O-CD2 3.34Å
35N89.4Confident86.3Confident4 Ų447 Ų472%0.02124%0.241CC..Hα-helixtrans-69.8-35.5179.1-74.3-61.7000113G31 V32 L37 I38 L39 A59 D62 L63G31-N35 WeakPolarHBondContact O-CB 3.27Å; G31-N35 PolarHBondContact O-N 3.37Å; G31-N35 PolarHBondContact O-ND2 3.48Å; V32-N35 PolarHBondContact O-N 3.21Å; N35-L37 VanDerWaalsContact C-N 3.34Å; N35-L37 PolarHBondContact O-N 3.15Å; N35-I38 WeakPolarHBondContact O-CB 3.42Å; N35-I38 PolarHBondContact O-N 3.33Å; N35-L39 WeakPolarHBondContact O-CG 3.33Å; N35-L39 PolarHBondContact O-N 2.74Å; N35-A59 HydrophobicContact CB-CB 4.48Å; N35-D62 WeakPolarHBondContact ND2-CB 3.05Å; N35-L63 HydrophobicContact CB-CD1 4.28Å; N35-L63 HydrophobicContact CB-CD2 3.8Å; N35-L63 HydrophobicContact CB-CG 3.67Å
36I91.8Very high84.9Confident72 Ų7249.2 Ų49.237%0.36926%0.263SS..Hα-helixtrans-61.1-44.7171.5-71169.1000110.5V32 I33 I38 L39 L40 L63V32-I36 HydrophobicContact CG1-CD1 3.64Å; V32-I36 HydrophobicContact CG1-CG1 4.47Å; V32-I36 WeakPolarHBondContact O-CB 3.48Å; V32-I36 VanDerWaalsContact O-CG1 3.23Å; V32-I36 WeakPolarHBondContact O-CG1 3.48Å; V32-I36 PolarHBondContact O-N 3.37Å; I33-I36 PolarHBondContact O-N 3.21Å; I36-I38 VanDerWaalsContact C-N 3.3Å; I36-I38 PolarHBondContact O-N 3.42Å; I36-L39 PolarHBondContact O-N 3.17Å; I36-L40 HydrophobicContact CG2-CD1 3.77Å; I36-L40 HydrophobicContact CG2-CG 4.15Å; I36-L40 WeakPolarHBondContact O-CB 3.29Å; I36-L40 VanDerWaalsContact O-CG 3.29Å; I36-L40 WeakPolarHBondContact O-CG 3.05Å; I36-L40 PolarHBondContact O-N 3.37Å; I36-L63 HydrophobicContact CG1-CD1 4.29Å; I36-L63 HydrophobicContact CG1-CD2 4.14Å
37L88Confident83.3Confident27 Ų2745.9 Ų45.914%0.14125%0.252CS..Hα-helixtrans-63.3-36.2177.6-73.1173000112.1I33 G34 N35 L40 A41 F283 L300I33-L37 HydrophobicContact CG2-CD1 3.79Å; I33-L37 HydrophobicContact CG2-CG 4.3Å; I33-L37 WeakPolarHBondContact O-CB 3.23Å; I33-L37 VanDerWaalsContact O-CG 3.28Å; I33-L37 WeakPolarHBondContact O-CG 2.99Å; I33-L37 PolarHBondContact O-N 2.71Å; G34-L37 PolarHBondContact O-N 3.39Å; N35-L37 VanDerWaalsContact C-N 3.34Å; N35-L37 PolarHBondContact O-N 3.15Å; L37-L40 PolarHBondContact O-N 3.33Å; L37-A41 WeakPolarHBondContact O-CB 3.38Å; L37-A41 PolarHBondContact O-N 3.27Å; L37-F283 HydrophobicContact CB-CD2 4.23Å; L37-F283 HydrophobicContact CB-CE2 3.51Å; L37-F283 HydrophobicContact CB-CZ 3.89Å; L37-F283 HydrophobicContact CD1-CE1 3.88Å; L37-F283 HydrophobicContact CD1-CE2 3.91Å; L37-F283 HydrophobicContact CD1-CZ 3.34Å; L37-F283 HydrophobicContact CG-CE2 4.37Å; L37-F283 HydrophobicContact CG-CZ 4.26Å; L37-L300 HydrophobicContact CD2-CD2 4.35Å
38I84.2Confident81.6Confident9 Ų951.6 Ų51.65%0.04629%0.292CS..Hα-helixtrans-59.9-50.8172.5-68.8165.8000110.3G34 N35 I36 L40 A41 L42 A59 F283 Y286 F293G34-I38 WeakPolarHBondContact O-CG1 3.47Å; G34-I38 PolarHBondContact O-N 3.37Å; N35-I38 WeakPolarHBondContact O-CB 3.42Å; N35-I38 PolarHBondContact O-N 3.33Å; I36-I38 VanDerWaalsContact C-N 3.3Å; I36-I38 PolarHBondContact O-N 3.42Å; I38-L40 PolarHBondContact O-N 3.42Å; I38-A41 PolarHBondContact O-N 3.38Å; I38-L42 HydrophobicContact CG2-CD1 3.74Å; I38-L42 HydrophobicContact CG2-CG 4.37Å; I38-L42 WeakPolarHBondContact O-CB 3.46Å; I38-L42 VanDerWaalsContact O-CG 3.24Å; I38-L42 WeakPolarHBondContact O-CG 3.36Å; I38-L42 PolarHBondContact O-N 3.17Å; I38-A59 HydrophobicContact CB-CB 4.36Å; I38-A59 HydrophobicContact CG2-CB 3.95Å; I38-F283 HydrophobicContact CD1-CB 4.35Å; I38-F283 HydrophobicContact CD1-CD2 4.33Å; I38-F283 HydrophobicContact CG1-CD2 3.93Å; I38-Y286 HydrophobicContact CD1-CD2 3.76Å; I38-Y286 HydrophobicContact CD1-CE2 4Å; I38-F293 HydrophobicContact CB-CZ 4.49Å; I38-F293 HydrophobicContact CG1-CE2 4.45Å; I38-F293 HydrophobicContact CG1-CZ 3.85Å
39L88Confident80.2Confident45 Ų4552.3 Ų52.324%0.23630%0.302CS..Hα-helixtrans-60-46.5179-68.7174.9000112N35 I36 L42 R43 I56 A59 V60 L63N35-L39 WeakPolarHBondContact O-CG 3.33Å; N35-L39 PolarHBondContact O-N 2.74Å; I36-L39 PolarHBondContact O-N 3.17Å; L39-L42 PolarHBondContact O-N 3.44Å; L39-R43 WeakPolarHBondContact O-CB 3.25Å; L39-R43 PolarHBondContact O-N 3.45Å; L39-I56 HydrophobicContact CD2-CB 4.33Å; L39-I56 HydrophobicContact CD2-CG1 4.42Å; L39-I56 HydrophobicContact CD2-CG2 3.87Å; L39-A59 HydrophobicContact CD2-CB 3.84Å; L39-A59 HydrophobicContact CG-CB 3.95Å; L39-V60 HydrophobicContact CD1-CG2 4.46Å; L39-V60 HydrophobicContact CD2-CG2 4.22Å; L39-L63 HydrophobicContact CD1-CD1 3.6Å
40L87.6Confident78.9Confident53 Ų5349.9 Ų49.928%0.27729%0.288SS..Hα-helixtrans-64.2-43.7178.9-71.1178.9000112I36 L37 I38 R43 A44 L300I36-L40 HydrophobicContact CG2-CD1 3.77Å; I36-L40 HydrophobicContact CG2-CG 4.15Å; I36-L40 WeakPolarHBondContact O-CB 3.29Å; I36-L40 VanDerWaalsContact O-CG 3.29Å; I36-L40 WeakPolarHBondContact O-CG 3.05Å; I36-L40 PolarHBondContact O-N 3.37Å; L37-L40 PolarHBondContact O-N 3.33Å; I38-L40 PolarHBondContact O-N 3.42Å; L40-R43 PolarHBondContact O-N 3.41Å; L40-A44 WeakPolarHBondContact O-CB 3.45Å; L40-A44 PolarHBondContact O-N 3.29Å; L40-L300 HydrophobicContact CB-CD1 3.73Å; L40-L300 HydrophobicContact CB-CD2 4.35Å; L40-L300 HydrophobicContact CD1-CD2 4.24Å
41A81.6Confident77.9Confident1 Ų148.5 Ų48.51%0.00828%0.283CS..Hα-helixtrans-67.1-37.417900000112.3L37 I38 A45 F293 K296 V297L37-A41 WeakPolarHBondContact O-CB 3.38Å; L37-A41 PolarHBondContact O-N 3.27Å; I38-A41 PolarHBondContact O-N 3.38Å; A41-A45 VanDerWaalsContact O-CB 3.27Å; A41-A45 WeakPolarHBondContact O-CB 3.28Å; A41-A45 PolarHBondContact O-N 3.38Å; A41-A45 VanDerWaalsContact O-N 3.1Å; A41-F293 HydrophobicContact CB-CD2 4.34Å; A41-F293 HydrophobicContact CB-CE2 3.67Å; A41-F293 HydrophobicContact CB-CZ 4.12Å; A41-K296 HydrophobicContact CB-CB 4.32Å; A41-V297 HydrophobicContact CB-CG2 4.14Å
42L79.1Confident77.3Confident18 Ų1849 Ų499%0.09429%0.286CS..Hα-helixtrans-70.1-41.7176.1-69.9174.6000111.5I38 L39 A45 L55 I56I38-L42 HydrophobicContact CG2-CD1 3.74Å; I38-L42 HydrophobicContact CG2-CG 4.37Å; I38-L42 WeakPolarHBondContact O-CB 3.46Å; I38-L42 VanDerWaalsContact O-CG 3.24Å; I38-L42 WeakPolarHBondContact O-CG 3.36Å; I38-L42 PolarHBondContact O-N 3.17Å; L39-L42 PolarHBondContact O-N 3.44Å; L42-A45 PolarHBondContact O-N 3.41Å; L42-L55 HydrophobicContact CD1-CB 3.78Å; L42-I56 HydrophobicContact CB-CG1 4.26Å; L42-I56 HydrophobicContact CD1-CG1 3.79Å
43R81Confident77Confident210 Ų21052.2 Ų52.279%0.79230%0.296SS*.Hα-helixtrans-62.2-49.9174.3-175.6176.4-178.9175.20.7111.7L39 L40 A45 A46L39-R43 WeakPolarHBondContact O-CB 3.25Å; L39-R43 PolarHBondContact O-N 3.45Å; L40-R43 PolarHBondContact O-N 3.41Å; R43-A45 PolarHBondContact O-N 3.35Å; R43-A46 PolarHBondContact O-N 3.23Å; R43-A46 VanDerWaalsContact O-N 3.15Å
44A75.3Confident76.7Confident70 Ų7048.3 Ų48.358%0.57928%0.276SS*.Hα-helixtrans-63.8-27.3-179.500000112.9L40 A46 L300L40-A44 WeakPolarHBondContact O-CB 3.45Å; L40-A44 PolarHBondContact O-N 3.29Å; A44-A46 PolarHBondContact O-N 3.28Å; A44-L300 HydrophobicContact CB-CD1 4.02Å
45A67.2Low76.6Confident27 Ų2749.5 Ų49.522%0.22328%0.282CS..THydrogen-bonded Turntrans-71.4-15.8179.100000113.1A41 L42 R43 V47 K296A41-A45 VanDerWaalsContact O-CB 3.27Å; A41-A45 WeakPolarHBondContact O-CB 3.28Å; A41-A45 PolarHBondContact O-N 3.38Å; A41-A45 VanDerWaalsContact O-N 3.1Å; L42-A45 PolarHBondContact O-N 3.41Å; R43-A45 PolarHBondContact O-N 3.35Å; A45-V47 HydrophobicContact CB-CB 4.02Å; A45-V47 HydrophobicContact CB-CG2 3.55Å; A45-V47 WeakPolarHBondContact O-CG2 3.49Å; A45-V47 PolarHBondContact O-N 3.46Å; A45-K296 HydrophobicContact CB-CD 3.81Å; A45-K296 HydrophobicContact CB-CG 4.42Å
46A61.5Low76.6Confident88 Ų8852.5 Ų52.573%0.72730%0.297SS*.THydrogen-bonded Turntrans45.723.2-169.600000112.7R43 A44 S48R43-A46 PolarHBondContact O-N 3.23Å; R43-A46 VanDerWaalsContact O-N 3.15Å; A44-A46 PolarHBondContact O-N 3.28Å; A46-S48 PolarHBondContact O-N 3.43Å
47V55.4Low76.6Confident57 Ų5749.5 Ų49.535%0.34528%0.284SS..  trans-74.4103.8-168.8163.90000106.7A45 S49 S52A45-V47 HydrophobicContact CB-CB 4.02Å; A45-V47 HydrophobicContact CB-CG2 3.55Å; A45-V47 WeakPolarHBondContact O-CG2 3.49Å; A45-V47 PolarHBondContact O-N 3.46Å; V47-S49 VanDerWaalsContact CG1-OG 3.24Å; V47-S49 WeakPolarHBondContact CG1-OG 3.45Å; V47-S49 PolarHBondContact O-N 3.24Å; V47-S52 PolarHBondContact O-OG 3.18Å
48S51.5Low76.7Confident122 Ų12248.6 Ų48.685%0.85328%0.279SS*.  trans-65.517171.953.70000113.6A46A46-S48 PolarHBondContact O-N 3.43Å
49S61.9Low76.9Confident50 Ų5048.2 Ų48.235%0.3528%0.277SS..  trans-74.2135.2176.580.10000110.2V47 A51 S52V47-S49 VanDerWaalsContact CG1-OG 3.24Å; V47-S49 WeakPolarHBondContact CG1-OG 3.45Å; V47-S49 PolarHBondContact O-N 3.24Å; S49-A51 VanDerWaalsContact C-N 3.26Å; S49-A51 PolarHBondContact O-N 3.06Å; S49-S52 VanDerWaalsContact O-CB 3.23Å; S49-S52 WeakPolarHBondContact O-CB 3.39Å; S49-S52 PolarHBondContact O-N 3.14Å; S49-S52 PolarHBondContact O-OG 3.13Å; S49-S52 PolarHBondContact OG-OG 3.25Å
50K65Low77.2Confident48 Ų4849 Ų4921%0.20928%0.283CS..THydrogen-bonded Turntrans-57-37.6-179.1-64.9-179.6-173.2-161.70112.4S52 Y53 A129 R130 F133 F138K50-S52 PolarHBondContact O-N 3.32Å; K50-S52 VanDerWaalsContact O-N 3.08Å; K50-Y53 WeakPolarHBondContact O-CD2 3.29Å; K50-Y53 PolarHBondContact O-N 3.37Å; K50-A129 PolarHBondContact NZ-O 2.78Å; K50-R130 PolarHBondContact NZ-O 3.4Å; K50-F133 HydrophobicContact CD-CB 4.34Å; K50-F133 WeakPolarHBondContact CE-O 3.43Å; K50-F133 PolarHBondContact NZ-O 3.38Å; K50-F138 HydrophobicContact CB-CE1 4.15Å; K50-F138 HydrophobicContact CB-CE2 3.79Å; K50-F138 HydrophobicContact CB-CZ 3.5Å; K50-F138 HydrophobicContact CD-CE2 3.78Å; K50-F138 HydrophobicContact CD-CZ 3.83Å; K50-F138 HydrophobicContact CG-CE2 3.82Å; K50-F138 HydrophobicContact CG-CZ 3.97Å
51A66.4Low77.5Confident11 Ų1146.4 Ų46.49%0.09127%0.27CS..Hα-helixtrans-51.5-27.8171.100000115.2S49 Y53 L55 E118S49-A51 VanDerWaalsContact C-N 3.26Å; S49-A51 PolarHBondContact O-N 3.06Å; A51-Y53 VanDerWaalsContact C-N 3.27Å; A51-Y53 PolarHBondContact O-N 3.19Å; A51-L55 PolarHBondContact O-N 3.29Å; A51-E118 VanDerWaalsContact CB-OE2 3.23Å; A51-E118 WeakPolarHBondContact CB-OE2 3.13Å; A51-E118 PolarHBondContact N-OE1 3.41Å
52S75.9Confident78Confident10 Ų1046.5 Ų46.57%0.0727%0.27CS..Hα-helixtrans-66.9-28.1-175.6-57.50000112.4V47 S49 K50 L55 I56V47-S52 PolarHBondContact O-OG 3.18Å; S49-S52 VanDerWaalsContact O-CB 3.23Å; S49-S52 WeakPolarHBondContact O-CB 3.39Å; S49-S52 PolarHBondContact O-N 3.14Å; S49-S52 PolarHBondContact O-OG 3.13Å; S49-S52 PolarHBondContact OG-OG 3.25Å; K50-S52 PolarHBondContact O-N 3.32Å; K50-S52 VanDerWaalsContact O-N 3.08Å; S52-L55 PolarHBondContact O-N 3.36Å; S52-I56 WeakPolarHBondContact O-CB 3.32Å; S52-I56 WeakPolarHBondContact O-CD1 3.34Å; S52-I56 WeakPolarHBondContact O-CG1 3.13Å; S52-I56 PolarHBondContact O-N 3.03Å
53Y86.1Confident78.6Confident89 Ų8946.7 Ų46.735%0.34927%0.272SS..Hα-helixtrans-65.1-47.4179.4-70.4-75.7000112.4K50 A51 I56 A57 K135 F138K50-Y53 WeakPolarHBondContact O-CD2 3.29Å; K50-Y53 PolarHBondContact O-N 3.37Å; A51-Y53 VanDerWaalsContact C-N 3.27Å; A51-Y53 PolarHBondContact O-N 3.19Å; Y53-I56 PolarHBondContact O-N 3.27Å; Y53-A57 WeakPolarHBondContact O-CB 3.41Å; Y53-A57 PolarHBondContact O-N 3.07Å; Y53-K135 WeakPolarHBondContact OH-CD 3.24Å; Y53-F138 HydrophobicContact CD2-CB 4.45Å; Y53-F138 HydrophobicContact CD2-CG 4.43Å; Y53-F138 HydrophobicContact CG-CB 4.4Å
54F87.1Confident79.3Confident4 Ų438.7 Ų38.72%0.01825%0.247CC..Hα-helixtrans-67.8-38.1177.7-65.9-58.1000112.4A57 M58 L111 A114 V115 E118 F138 L141 I142 I145F54-A57 PolarHBondContact O-N 3.49Å; F54-M58 VanDerWaalsContact O-CB 3.28Å; F54-M58 WeakPolarHBondContact O-CB 3.38Å; F54-M58 PolarHBondContact O-N 3.27Å; F54-L111 HydrophobicContact CD1-CD2 3.81Å; F54-A114 HydrophobicContact CD1-CB 3.9Å; F54-A114 HydrophobicContact CD2-CB 4.27Å; F54-A114 HydrophobicContact CE1-CB 3.81Å; F54-A114 HydrophobicContact CE2-CB 4.17Å; F54-A114 HydrophobicContact CG-CB 4.14Å; F54-A114 HydrophobicContact CZ-CB 3.94Å; F54-V115 HydrophobicContact CB-CG2 3.43Å; F54-V115 VanDerWaalsContact CB-CG2 3.43Å; F54-V115 HydrophobicContact CG-CG2 4.42Å; F54-E118 HydrophobicContact CD2-CB 4.45Å; F54-E118 HydrophobicContact CE2-CB 4.26Å; F54-F138 HydrophobicContact CD2-CD1 4.27Å; F54-F138 HydrophobicContact CD2-CE1 4.45Å; F54-F138 AromaticContact CE2-CD1 3.55Å; F54-F138 HydrophobicContact CE2-CD1 3.55Å; F54-F138 AromaticContact CE2-CE1 3.65Å; F54-F138 HydrophobicContact CE2-CE1 3.65Å; F54-F138 AromaticContact CZ-CD1 3.67Å; F54-F138 HydrophobicContact CZ-CD1 3.67Å; F54-F138 HydrophobicContact CZ-CE1 4.13Å; F54-L141 HydrophobicContact CE1-CD2 4.16Å; F54-L141 HydrophobicContact CE1-CG 4.19Å; F54-L141 HydrophobicContact CZ-CD2 3.68Å; F54-L141 HydrophobicContact CZ-CG 4.2Å; F54-I142 HydrophobicContact CD1-CD1 4.04Å; F54-I142 HydrophobicContact CD1-CG1 3.62Å; F54-I142 HydrophobicContact CE1-CD1 4.35Å; F54-I142 HydrophobicContact CE1-CG1 3.7Å; F54-I145 HydrophobicContact CE1-CD1 4.49Å
55L84.3Confident80.2Confident25 Ų2535.9 Ų35.913%0.13122%0.222CC..Hα-helixtrans-64.7-40176.5-72.5171.9000112.1L42 A51 S52 A59 V115L42-L55 HydrophobicContact CD1-CB 3.78Å; A51-L55 PolarHBondContact O-N 3.29Å; S52-L55 PolarHBondContact O-N 3.36Å; L55-A59 WeakPolarHBondContact O-CB 3.17Å; L55-A59 PolarHBondContact O-N 2.86Å; L55-V115 HydrophobicContact CD2-CG1 4.15Å; L55-V115 HydrophobicContact CD2-CG2 3.98Å; L55-V115 HydrophobicContact CG-CG1 4.45Å; L55-V115 HydrophobicContact CG-CG2 4.09Å
56I89.1Confident81.3Confident66 Ų6634.6 Ų34.634%0.33821%0.211SC..Hα-helixtrans-64.2-49.3174-71.4165.4000110L39 L42 S52 Y53 M58 A59 V60L39-I56 HydrophobicContact CD2-CB 4.33Å; L39-I56 HydrophobicContact CD2-CG1 4.42Å; L39-I56 HydrophobicContact CD2-CG2 3.87Å; L42-I56 HydrophobicContact CB-CG1 4.26Å; L42-I56 HydrophobicContact CD1-CG1 3.79Å; S52-I56 WeakPolarHBondContact O-CB 3.32Å; S52-I56 WeakPolarHBondContact O-CD1 3.34Å; S52-I56 WeakPolarHBondContact O-CG1 3.13Å; S52-I56 PolarHBondContact O-N 3.03Å; Y53-I56 PolarHBondContact O-N 3.27Å; I56-M58 VanDerWaalsContact C-N 3.27Å; I56-M58 PolarHBondContact O-N 3.31Å; I56-A59 PolarHBondContact O-N 2.92Å; I56-V60 WeakPolarHBondContact O-CG2 3.43Å; I56-V60 PolarHBondContact O-N 3.39Å
57A92.3Very high82.9Confident10 Ų1035.9 Ų35.98%0.08320%0.201CC..Hα-helixtrans-59.1-40179.300000112Y53 F54 V60 A61 L111 I142 Y146Y53-A57 WeakPolarHBondContact O-CB 3.41Å; Y53-A57 PolarHBondContact O-N 3.07Å; F54-A57 PolarHBondContact O-N 3.49Å; A57-V60 PolarHBondContact O-N 2.82Å; A57-A61 PolarHBondContact O-N 3.09Å; A57-L111 HydrophobicContact CB-CD1 3.92Å; A57-L111 HydrophobicContact CB-CD2 4.08Å; A57-I142 HydrophobicContact CB-CD1 4.06Å; A57-I142 HydrophobicContact CB-CG1 4.31Å; A57-I142 HydrophobicContact CB-CG2 3.86Å; A57-Y146 HydrophobicContact CB-CE2 4.43Å; A57-Y146 PolarHBondContact O-OH 2.85Å
58M89.3Confident84.7Confident7 Ų733.7 Ų33.73%0.03419%0.188CC..Hα-helixtrans-64.9-45.9176.8-177.2-168.2-54.300111.8F54 I56 V60 A61 D62 S108 L111 A112 V115F54-M58 VanDerWaalsContact O-CB 3.28Å; F54-M58 WeakPolarHBondContact O-CB 3.38Å; F54-M58 PolarHBondContact O-N 3.27Å; I56-M58 VanDerWaalsContact C-N 3.27Å; I56-M58 PolarHBondContact O-N 3.31Å; M58-V60 VanDerWaalsContact C-N 3.28Å; M58-V60 PolarHBondContact O-N 3.05Å; M58-A61 WeakPolarHBondContact O-CB 3.23Å; M58-A61 PolarHBondContact O-N 3.42Å; M58-D62 PolarHBondContact O-N 3.41Å; M58-S108 WeakPolarHBondContact CG-OG 3.47Å; M58-L111 HydrophobicContact CB-CB 4.15Å; M58-L111 HydrophobicContact CB-CD1 4.38Å; M58-L111 HydrophobicContact CE-CB 4.26Å; M58-A112 HydrophobicContact CE-CB 3.67Å; M58-A112 HydrophobicContact SD-CB 4.45Å; M58-V115 HydrophobicContact CE-CG2 3.83Å
59A89.8Confident86.5Confident2 Ų228.7 Ų28.72%0.01715%0.152CC..Hα-helixtrans-63.3-35.2177.400000112.2N35 I38 L39 L55 I56 L63N35-A59 HydrophobicContact CB-CB 4.48Å; I38-A59 HydrophobicContact CB-CB 4.36Å; I38-A59 HydrophobicContact CG2-CB 3.95Å; L39-A59 HydrophobicContact CD2-CB 3.84Å; L39-A59 HydrophobicContact CG-CB 3.95Å; L55-A59 WeakPolarHBondContact O-CB 3.17Å; L55-A59 PolarHBondContact O-N 2.86Å; I56-A59 PolarHBondContact O-N 2.92Å; A59-L63 WeakPolarHBondContact O-CG 3.26Å; A59-L63 PolarHBondContact O-N 3.14Å
60V94.1Very high87.9Confident60 Ų6028.5 Ų28.536%0.36415%0.147SC..Hα-helixtrans-65-48172.1172.20000110.8L39 I56 A57 M58 D62 L63 C64L39-V60 HydrophobicContact CD1-CG2 4.46Å; L39-V60 HydrophobicContact CD2-CG2 4.22Å; I56-V60 WeakPolarHBondContact O-CG2 3.43Å; I56-V60 PolarHBondContact O-N 3.39Å; A57-V60 PolarHBondContact O-N 2.82Å; M58-V60 VanDerWaalsContact C-N 3.28Å; M58-V60 PolarHBondContact O-N 3.05Å; V60-D62 VanDerWaalsContact C-N 3.32Å; V60-D62 PolarHBondContact O-N 2.9Å; V60-L63 PolarHBondContact O-N 3.17Å; V60-C64 PolarHBondContact O-N 3.09Å; V60-C64 PolarHBondContact O-SG 2.75Å; V60-C64 VanDerWaalsContact O-SG 3.35Å
61A93.7Very high89.1Confident0 Ų027.1 Ų27.10%014%0.143CC..Hα-helixtrans-57.4-45.4176.100000111.6A57 M58 L63 C64 F65 F104 Y146A57-A61 PolarHBondContact O-N 3.09Å; M58-A61 WeakPolarHBondContact O-CB 3.23Å; M58-A61 PolarHBondContact O-N 3.42Å; A61-L63 PolarHBondContact O-N 3.09Å; A61-C64 PolarHBondContact O-N 3.12Å; A61-F65 WeakPolarHBondContact O-CB 3.41Å; A61-F65 PolarHBondContact O-N 3.2Å; A61-F104 HydrophobicContact CB-CD1 4.47Å; A61-F104 WeakPolarHBondContact O-CB 3.44Å; A61-Y146 HydrophobicContact CB-CE1 4.3Å; A61-Y146 WeakPolarHBondContact CB-OH 3.47Å
62D91.2Very high90Very high2 Ų228.6 Ų28.61%0.01115%0.149CC..Hα-helixtrans-65.1-37.8179.9-70.2-20.9000112.1N35 M58 V60 F65 F66 S108 K279N35-D62 WeakPolarHBondContact ND2-CB 3.05Å; M58-D62 PolarHBondContact O-N 3.41Å; V60-D62 VanDerWaalsContact C-N 3.32Å; V60-D62 PolarHBondContact O-N 2.9Å; D62-F65 WeakPolarHBondContact O-CB 3.19Å; D62-F65 PolarHBondContact O-N 2.93Å; D62-F66 WeakPolarHBondContact O-CD2 3.25Å; D62-F66 PolarHBondContact O-N 3.34Å; D62-F66 VanDerWaalsContact O-N 3.12Å; D62-S108 VanDerWaalsContact OD1-CB 3.22Å; D62-S108 WeakPolarHBondContact OD1-CB 3.29Å; D62-S108 PolarHBondContact OD1-OG 3.04Å; D62-K279 IonicContact OD1-NZ 3.41Å; D62-K279 PolarHBondContact OD1-NZ 3.16Å
63L93.4Very high90.5Very high23 Ų2329.4 Ų29.412%0.1215%0.152CC..Hα-helixtrans-62.4-50.3171.5-75.7170.8000111.7V32 N35 I36 L39 A59 V60 A61 F65 F66 F67V32-L63 HydrophobicContact CB-CD2 4.37Å; V32-L63 HydrophobicContact CG1-CD2 4.19Å; V32-L63 HydrophobicContact CG2-CD2 4.41Å; N35-L63 HydrophobicContact CB-CD1 4.28Å; N35-L63 HydrophobicContact CB-CD2 3.8Å; N35-L63 HydrophobicContact CB-CG 3.67Å; I36-L63 HydrophobicContact CG1-CD1 4.29Å; I36-L63 HydrophobicContact CG1-CD2 4.14Å; L39-L63 HydrophobicContact CD1-CD1 3.6Å; A59-L63 WeakPolarHBondContact O-CG 3.26Å; A59-L63 PolarHBondContact O-N 3.14Å; V60-L63 PolarHBondContact O-N 3.17Å; A61-L63 PolarHBondContact O-N 3.09Å; L63-F65 VanDerWaalsContact C-N 3.25Å; L63-F65 PolarHBondContact O-N 3.48Å; L63-F66 PolarHBondContact O-N 2.85Å; L63-F66 VanDerWaalsContact O-N 3.14Å; L63-F67 WeakPolarHBondContact O-CD2 3.33Å; L63-F67 PolarHBondContact O-N 3.43Å; L63-F67 VanDerWaalsContact O-N 3.12Å
64C95.5Very high90.6Very high42 Ų4227.3 Ų27.328%0.28415%0.146SC..Hα-helixtrans-58.2-39.7177.9-69.70000111.6V60 A61 F67 C68 F104V60-C64 PolarHBondContact O-N 3.09Å; V60-C64 PolarHBondContact O-SG 2.75Å; V60-C64 VanDerWaalsContact O-SG 3.35Å; A61-C64 PolarHBondContact O-N 3.12Å; C64-F67 PolarHBondContact O-N 2.99Å; C64-C68 WeakPolarHBondContact O-CB 3.5Å; C64-C68 PolarHBondContact O-N 3.03Å; C64-C68 PolarHBondContact O-SG 3.34Å; C64-F104 HydrophobicContact CB-CB 4.44Å; C64-F104 HydrophobicContact CB-CD1 3.71Å; C64-F104 HydrophobicContact CB-CD2 3.54Å; C64-F104 HydrophobicContact CB-CE1 3.75Å; C64-F104 HydrophobicContact CB-CE2 3.6Å; C64-F104 HydrophobicContact CB-CG 3.62Å; C64-F104 HydrophobicContact CB-CZ 3.7Å
65F93.1Very high90.5Very high10 Ų1027.4 Ų27.44%0.04415%0.147CC..Hα-helixtrans-56.3-51.5173.2169.3-98.3000112A61 D62 L63 F67 C68 V69 A101 F104 V275 V276 K279A61-F65 WeakPolarHBondContact O-CB 3.41Å; A61-F65 PolarHBondContact O-N 3.2Å; D62-F65 WeakPolarHBondContact O-CB 3.19Å; D62-F65 PolarHBondContact O-N 2.93Å; L63-F65 VanDerWaalsContact C-N 3.25Å; L63-F65 PolarHBondContact O-N 3.48Å; F65-F67 VanDerWaalsContact C-N 3.32Å; F65-F67 PolarHBondContact O-N 3.36Å; F65-C68 PolarHBondContact O-N 2.89Å; F65-C68 VanDerWaalsContact O-N 3.14Å; F65-V69 HydrophobicContact CD2-CG2 4.01Å; F65-V69 HydrophobicContact CE1-CG2 4.27Å; F65-V69 HydrophobicContact CE2-CG2 3.65Å; F65-V69 HydrophobicContact CG-CG2 4.49Å; F65-V69 HydrophobicContact CZ-CG2 3.8Å; F65-V69 WeakPolarHBondContact O-CG2 3.26Å; F65-V69 PolarHBondContact O-N 3.4Å; F65-A101 HydrophobicContact CD2-CB 4.05Å; F65-A101 VanDerWaalsContact CD2-O 3.31Å; F65-A101 WeakPolarHBondContact CD2-O 3.34Å; F65-A101 HydrophobicContact CE2-CB 4.2Å; F65-F104 HydrophobicContact CB-CB 4.03Å; F65-V275 HydrophobicContact CZ-CG1 4.4Å; F65-V276 HydrophobicContact CE1-CB 4.35Å; F65-V276 HydrophobicContact CE1-CG1 4.41Å; F65-V276 HydrophobicContact CE1-CG2 3.83Å; F65-V276 HydrophobicContact CZ-CG2 3.67Å; F65-K279 HydrophobicContact CD1-CD 3.61Å; F65-K279 HydrophobicContact CE1-CD 3.78Å; F65-K279 HydrophobicContact CG-CD 4.11Å; F65-K279 HydrophobicContact CZ-CD 4.39Å
66F91.7Very high90.4Very high0 Ų026.2 Ų26.20%014%0.141CC..Hα-helixtrans-59.2-42.5179.6-79.4-65.7000112.3V27 F28 G31 V32 D62 L63 V69 L70 V276 K279 A280V27-F66 HydrophobicContact CG1-CE1 4.42Å; F28-F66 HydrophobicContact CD2-CB 3.91Å; F28-F66 HydrophobicContact CD2-CD1 4.16Å; F28-F66 HydrophobicContact CD2-CG 4.41Å; F28-F66 HydrophobicContact CE2-CB 3.91Å; G31-F66 VanDerWaalsContact CA-CE2 3.48Å; V32-F66 HydrophobicContact CG2-CB 4.14Å; V32-F66 HydrophobicContact CG2-CG 4.47Å; D62-F66 WeakPolarHBondContact O-CD2 3.25Å; D62-F66 PolarHBondContact O-N 3.34Å; D62-F66 VanDerWaalsContact O-N 3.12Å; L63-F66 PolarHBondContact O-N 2.85Å; L63-F66 VanDerWaalsContact O-N 3.14Å; F66-V69 PolarHBondContact O-N 3.14Å; F66-L70 WeakPolarHBondContact O-CB 3.23Å; F66-L70 PolarHBondContact O-N 3.27Å; F66-V276 HydrophobicContact CD1-CG1 4.44Å; F66-V276 HydrophobicContact CE1-CG1 3.71Å; F66-K279 HydrophobicContact CE2-CB 4.26Å; F66-K279 HydrophobicContact CZ-CB 4.06Å; F66-A280 HydrophobicContact CZ-CB 4.02Å
67F94.1Very high90.3Very high115 Ų11526.6 Ų26.650%0.50414%0.14SC..Hα-helixtrans-68.7-33.5176.5-73.5-69.6000113.1F28 L63 C64 F65 P71F28-F67 HydrophobicContact CZ-CD1 4.36Å; F28-F67 HydrophobicContact CZ-CE1 4.13Å; L63-F67 WeakPolarHBondContact O-CD2 3.33Å; L63-F67 PolarHBondContact O-N 3.43Å; L63-F67 VanDerWaalsContact O-N 3.12Å; C64-F67 PolarHBondContact O-N 2.99Å; F65-F67 VanDerWaalsContact C-N 3.32Å; F65-F67 PolarHBondContact O-N 3.36Å; F67-P71 VanDerWaalsContact O-CD 3.31Å; F67-P71 WeakPolarHBondContact O-CD 3.42Å
68C93.1Very high89.7Confident12 Ų1228.5 Ų28.58%0.08115%0.152CC..Hα-helixtrans-71.3-33.7176.1-67.30000112.4C64 F65 P71 F97 L100 A101C64-C68 WeakPolarHBondContact O-CB 3.5Å; C64-C68 PolarHBondContact O-N 3.03Å; C64-C68 PolarHBondContact O-SG 3.34Å; F65-C68 PolarHBondContact O-N 2.89Å; F65-C68 VanDerWaalsContact O-N 3.14Å; C68-P71 WeakPolarHBondContact O-CD 3.49Å; C68-F97 HydrophobicContact CB-CD1 4.36Å; C68-F97 WeakPolarHBondContact O-CB 3.36Å; C68-L100 HydrophobicContact CB-CB 4.2Å; C68-L100 VanDerWaalsContact SG-CB 3.57Å; C68-A101 HydrophobicContact CB-CB 3.91Å
69V90.6Very high89.4Confident17 Ų1732.7 Ų32.710%0.10318%0.181CC..Hα-helixtrans-79.6-25.7179.5172.70000111.9F24 F65 F66 N72 H73 A101F24-V69 HydrophobicContact CE2-CG1 3.65Å; F24-V69 HydrophobicContact CZ-CG1 4.03Å; F65-V69 HydrophobicContact CD2-CG2 4.01Å; F65-V69 HydrophobicContact CE1-CG2 4.27Å; F65-V69 HydrophobicContact CE2-CG2 3.65Å; F65-V69 HydrophobicContact CG-CG2 4.49Å; F65-V69 HydrophobicContact CZ-CG2 3.8Å; F65-V69 WeakPolarHBondContact O-CG2 3.26Å; F65-V69 PolarHBondContact O-N 3.4Å; F66-V69 PolarHBondContact O-N 3.14Å; V69-N72 WeakPolarHBondContact O-CB 3.42Å; V69-N72 PolarHBondContact O-N 3.32Å; V69-H73 WeakPolarHBondContact CG1-CD2 3.23Å; V69-H73 VanDerWaalsContact CG1-NE2 3.26Å; V69-H73 WeakPolarHBondContact CG1-NE2 3.36Å; V69-H73 PolarHBondContact O-CD2 3.08Å; V69-H73 PolarHBondContact O-N 2.68Å; V69-A101 HydrophobicContact CG2-CB 3.47Å; V69-A101 VanDerWaalsContact CG2-CB 3.47Å
70L91.1Very high89.1Confident46 Ų4635.3 Ų35.324%0.24120%0.195CC..Hα-helixtrans-51.7-50.1-176.3175.866000114.6F24 F28 F66 N72 H73 I74F24-L70 HydrophobicContact CE1-CD1 3.89Å; F28-L70 HydrophobicContact CD2-CD1 4.36Å; F28-L70 HydrophobicContact CE2-CB 4.09Å; F28-L70 HydrophobicContact CE2-CD1 4.17Å; F28-L70 HydrophobicContact CE2-CD2 4.11Å; F28-L70 HydrophobicContact CE2-CG 4.35Å; F28-L70 HydrophobicContact CZ-CD1 4.37Å; F28-L70 HydrophobicContact CZ-CD2 3.98Å; F66-L70 WeakPolarHBondContact O-CB 3.23Å; F66-L70 PolarHBondContact O-N 3.27Å; L70-N72 PolarHBondContact O-N 3.07Å; L70-H73 PolarHBondContact O-N 2.96Å; L70-H73 VanDerWaalsContact O-N 3.07Å; L70-I74 HydrophobicContact CD1-CD1 3.77Å; L70-I74 HydrophobicContact CD1-CG1 3.85Å; L70-I74 HydrophobicContact CD2-CD1 4.27Å; L70-I74 HydrophobicContact CG-CD1 3.64Å; L70-I74 HydrophobicContact CG-CG1 4.18Å; L70-I74 WeakPolarHBondContact O-CG1 3.36Å; L70-I74 PolarHBondContact O-N 3.39Å
71P89.4Confident88.3Confident18 Ų1833.1 Ų33.112%0.11718%0.183CC..Hα-helixtrans-57.6-33.2178.1-24.734.3000113.3F67 C68 H73 Y86 F97F67-P71 VanDerWaalsContact O-CD 3.31Å; F67-P71 WeakPolarHBondContact O-CD 3.42Å; C68-P71 WeakPolarHBondContact O-CD 3.49Å; P71-H73 VanDerWaalsContact C-N 3.3Å; P71-H73 PolarHBondContact O-N 3.35Å; P71-Y86 PolarHBondContact O-OH 3.29Å; P71-F97 HydrophobicContact CB-CD2 4.3Å; P71-F97 HydrophobicContact CB-CE2 4.47Å; P71-F97 HydrophobicContact CG-CD1 4.23Å; P71-F97 HydrophobicContact CG-CD2 4.08Å; P71-F97 HydrophobicContact CG-CE1 4.17Å; P71-F97 HydrophobicContact CG-CE2 4.03Å; P71-F97 HydrophobicContact CG-CG 4.19Å; P71-F97 HydrophobicContact CG-CZ 4.07Å
72N85Confident87.7Confident43 Ų4336.6 Ų36.623%0.2320%0.201CC..Hα-helixtrans-70.7-24.2-179.8-176.972000113.2V69 L70 I75V69-N72 WeakPolarHBondContact O-CB 3.42Å; V69-N72 PolarHBondContact O-N 3.32Å; L70-N72 PolarHBondContact O-N 3.07Å; N72-I75 VanDerWaalsContact O-CG2 3.25Å; N72-I75 WeakPolarHBondContact O-CG2 3.3Å
73H87.2Confident87.4Confident26 Ų2641.2 Ų41.212%0.1222%0.223CC..Hα-helixtrans-97.8-22.8176.7-68.1-78.1000113.5F24 V69 L70 P71 I75 S76F24-H73 HydrophobicContact CB-CB 4.23Å; F24-H73 HydrophobicContact CD1-CB 3.32Å; F24-H73 AromaticContact CD1-CD2 3.91Å; F24-H73 AromaticContact CD1-CG 3.6Å; F24-H73 HydrophobicContact CD2-CB 4.26Å; F24-H73 AromaticContact CD2-CD2 3.3Å; F24-H73 WeakPolarHBondContact CD2-CD2 3.44Å; F24-H73 AromaticContact CD2-CE1 3.9Å; F24-H73 AromaticContact CD2-CG 3.59Å; F24-H73 AromaticContact CD2-ND1 3.96Å; F24-H73 AromaticContact CD2-NE2 3.52Å; F24-H73 HydrophobicContact CE1-CB 3.64Å; F24-H73 AromaticContact CE1-CD2 3.86Å; F24-H73 AromaticContact CE1-CG 3.94Å; F24-H73 AromaticContact CE2-CD2 3.26Å; F24-H73 WeakPolarHBondContact CE2-CD2 3.24Å; F24-H73 AromaticContact CE2-CG 3.93Å; F24-H73 AromaticContact CE2-NE2 3.68Å; F24-H73 HydrophobicContact CG-CB 3.66Å; F24-H73 AromaticContact CG-CD2 3.63Å; F24-H73 AromaticContact CG-CG 3.4Å; F24-H73 VanDerWaalsContact CG-CG 3.4Å; F24-H73 AromaticContact CG-ND1 3.82Å; F24-H73 HydrophobicContact CZ-CB 4.23Å; F24-H73 AromaticContact CZ-CD2 3.54Å; V69-H73 WeakPolarHBondContact CG1-CD2 3.23Å; V69-H73 VanDerWaalsContact CG1-NE2 3.26Å; V69-H73 WeakPolarHBondContact CG1-NE2 3.36Å; V69-H73 PolarHBondContact O-CD2 3.08Å; V69-H73 PolarHBondContact O-N 2.68Å; L70-H73 PolarHBondContact O-N 2.96Å; L70-H73 VanDerWaalsContact O-N 3.07Å; P71-H73 VanDerWaalsContact C-N 3.3Å; P71-H73 PolarHBondContact O-N 3.35Å; H73-I75 PolarHBondContact O-N 3.11Å; H73-S76 VanDerWaalsContact O-CB 3.24Å; H73-S76 WeakPolarHBondContact O-CB 3.41Å; H73-S76 PolarHBondContact O-N 3.27Å; H73-S76 PolarHBondContact O-OG 3.34Å
74I87.1Confident86.8Confident46 Ų4647.2 Ų47.224%0.23624%0.244CC..Hα-helixtrans-62.2-31.7175.3-72.6172.5000111.3L70 S76 F77 L80 Y86L70-I74 HydrophobicContact CD1-CD1 3.77Å; L70-I74 HydrophobicContact CD1-CG1 3.85Å; L70-I74 HydrophobicContact CD2-CD1 4.27Å; L70-I74 HydrophobicContact CG-CD1 3.64Å; L70-I74 HydrophobicContact CG-CG1 4.18Å; L70-I74 WeakPolarHBondContact O-CG1 3.36Å; L70-I74 PolarHBondContact O-N 3.39Å; I74-S76 PolarHBondContact O-N 2.86Å; I74-S76 VanDerWaalsContact O-N 3.08Å; I74-F77 WeakPolarHBondContact O-CD2 3.41Å; I74-F77 PolarHBondContact O-N 2.77Å; I74-L80 HydrophobicContact CG2-CB 4.33Å; I74-L80 HydrophobicContact CG2-CD2 3.18Å; I74-L80 HydrophobicContact CG2-CG 4.36Å; I74-Y86 WeakPolarHBondContact CB-OH 3.48Å; I74-Y86 HydrophobicContact CG2-CE1 4.06Å; I74-Y86 HydrophobicContact CG2-CE2 4.15Å; I74-Y86 WeakPolarHBondContact CG2-OH 3.12Å
75I84.6Confident86.4Confident5 Ų549.8 Ų49.83%0.02626%0.262CS..THydrogen-bonded Turntrans-60.7-17.3174-159.268.3000113.2N72 H73 F77 A81 Y86 F87 Y90N72-I75 VanDerWaalsContact O-CG2 3.25Å; N72-I75 WeakPolarHBondContact O-CG2 3.3Å; H73-I75 PolarHBondContact O-N 3.11Å; I75-F77 PolarHBondContact O-N 3.47Å; I75-A81 HydrophobicContact CD1-CB 4.19Å; I75-A81 HydrophobicContact CG1-CB 4.49Å; I75-A81 WeakPolarHBondContact O-CB 3.43Å; I75-Y86 HydrophobicContact CB-CE1 4.21Å; I75-Y86 HydrophobicContact CD1-CD1 3.76Å; I75-Y86 HydrophobicContact CD1-CE1 3.59Å; I75-F87 HydrophobicContact CD1-CD2 4.24Å; I75-Y90 HydrophobicContact CB-CD2 4.24Å; I75-Y90 HydrophobicContact CB-CE2 4.28Å; I75-Y90 HydrophobicContact CB-CG 4.42Å; I75-Y90 HydrophobicContact CD1-CD1 4.04Å; I75-Y90 HydrophobicContact CD1-CG 4.1Å; I75-Y90 HydrophobicContact CG1-CD1 4Å; I75-Y90 HydrophobicContact CG1-CD2 4.48Å; I75-Y90 HydrophobicContact CG1-CE1 4.08Å; I75-Y90 HydrophobicContact CG1-CG 4.19Å; I75-Y90 HydrophobicContact CG2-CD2 4.44Å; I75-Y90 HydrophobicContact CG2-CE2 3.98Å
76S84.1Confident86.1Confident0 Ų050.8 Ų50.80%027%0.266CS..THydrogen-bonded Turntrans-72.3-9.6175.1-55.60000113.6T16 M17 H73 I74T16-S76 PolarHBondContact O-OG 3.26Å; M17-S76 WeakPolarHBondContact CE-O 3.18Å; H73-S76 VanDerWaalsContact O-CB 3.24Å; H73-S76 WeakPolarHBondContact O-CB 3.41Å; H73-S76 PolarHBondContact O-N 3.27Å; H73-S76 PolarHBondContact O-OG 3.34Å; I74-S76 PolarHBondContact O-N 2.86Å; I74-S76 VanDerWaalsContact O-N 3.08Å
77F85.8Confident85.9Confident75 Ų7551.5 Ų51.533%0.32927%0.269SS..SBendtrans-89.5118.2173.2-66.1-83.8000110.2R21 P25 I74 I75 S79 L80 A81R21-F77 HydrophobicContact CG-CD1 4.44Å; R21-F77 HydrophobicContact CG-CE1 4.07Å; P25-F77 HydrophobicContact CG-CZ 4.2Å; I74-F77 WeakPolarHBondContact O-CD2 3.41Å; I74-F77 PolarHBondContact O-N 2.77Å; I75-F77 PolarHBondContact O-N 3.47Å; F77-S79 PolarHBondContact O-N 2.89Å; F77-S79 VanDerWaalsContact O-N 3.15Å; F77-L80 PolarHBondContact O-N 3.15Å; F77-A81 PolarHBondContact O-N 3.36Å
78P79.4Confident85.6Confident50 Ų5047.3 Ų47.333%0.32526%0.256SS..Hα-helixtrans-53.9-39.4-176.2-27.534.2000113.8L80 A81 L82P78-L80 PolarHBondContact O-N 2.97Å; P78-A81 PolarHBondContact O-N 2.89Å; P78-L82 WeakPolarHBondContact O-CB 3.38Å; P78-L82 VanDerWaalsContact O-CG 3.25Å; P78-L82 WeakPolarHBondContact O-CG 3.5Å; P78-L82 PolarHBondContact O-N 3.03Å
79S82.9Confident85.5Confident94 Ų9451.6 Ų51.666%0.65727%0.273SS*.Hα-helixtrans-57.8-32.2-179.8-48.50000113.6F77F77-S79 PolarHBondContact O-N 2.89Å; F77-S79 VanDerWaalsContact O-N 3.15Å
80L83.4Confident85.4Confident58 Ų5851.6 Ų51.630%0.30427%0.271SS..Hα-helixtrans-95.5-32.5177.4-91.168.6000111.9I74 F77 P78 L82 Q83 Y86I74-L80 HydrophobicContact CG2-CB 4.33Å; I74-L80 HydrophobicContact CG2-CD2 3.18Å; I74-L80 HydrophobicContact CG2-CG 4.36Å; F77-L80 PolarHBondContact O-N 3.15Å; P78-L80 PolarHBondContact O-N 2.97Å; L80-L82 PolarHBondContact O-N 3.2Å; L80-Q83 PolarHBondContact O-N 3.4Å; L80-Q83 VanDerWaalsContact O-N 3.15Å; L80-Y86 HydrophobicContact CB-CD1 3.99Å; L80-Y86 HydrophobicContact CB-CE1 4.25Å; L80-Y86 HydrophobicContact CB-CG 4.41Å; L80-Y86 HydrophobicContact CD2-CE2 4.44Å; L80-Y86 WeakPolarHBondContact O-CD1 3.23Å
81A78.6Confident85.3Confident14 Ų1449.5 Ų49.512%0.11626%0.26CS..Hα-helixtrans-59.6-35.2175.600000112.9I75 F77 P78 Q83I75-A81 HydrophobicContact CD1-CB 4.19Å; I75-A81 HydrophobicContact CG1-CB 4.49Å; I75-A81 WeakPolarHBondContact O-CB 3.43Å; F77-A81 PolarHBondContact O-N 3.36Å; P78-A81 PolarHBondContact O-N 2.89Å; A81-Q83 VanDerWaalsContact C-N 3.34Å
82L81Confident85.4Confident72 Ų7255.5 Ų55.538%0.37728%0.281SS..THydrogen-bonded Turntrans-79.6-13.6179.5-65.8175.4000113.5E5 P78 L80 R84E5-L82 HydrophobicContact CB-CD2 4.39Å; E5-L82 HydrophobicContact CG-CD1 4.47Å; E5-L82 HydrophobicContact CG-CD2 3.74Å; P78-L82 WeakPolarHBondContact O-CB 3.38Å; P78-L82 VanDerWaalsContact O-CG 3.25Å; P78-L82 WeakPolarHBondContact O-CG 3.5Å; P78-L82 PolarHBondContact O-N 3.03Å; L80-L82 PolarHBondContact O-N 3.2Å; L82-R84 PolarHBondContact O-N 3.1Å
83Q84.5Confident85.7Confident99 Ų9954.2 Ų54.246%0.46328%0.275SS..  trans-76.5112.1175.9-72.1-178.6-30.200110.5L80 A81 S85 Y86 F87L80-Q83 PolarHBondContact O-N 3.4Å; L80-Q83 VanDerWaalsContact O-N 3.15Å; A81-Q83 VanDerWaalsContact C-N 3.34Å; Q83-S85 PolarHBondContact O-N 3.27Å; Q83-S85 VanDerWaalsContact O-N 3.16Å; Q83-Y86 PolarHBondContact O-N 3.33Å; Q83-Y86 VanDerWaalsContact O-N 3.08Å; Q83-F87 PolarHBondContact O-N 2.75Å
84R81.6Confident85.8Confident150 Ų15056 Ų5657%0.56628%0.283SS*.Hα-helixtrans-53.3-39-179.3-172.1-177.3-91.3-1650.7113.1E4 L82 A88E4-R84 IonicContact OE1-NH2 3.36Å; E4-R84 PolarHBondContact OE1-NH2 3.39Å; L82-R84 PolarHBondContact O-N 3.1Å; R84-A88 WeakPolarHBondContact O-CB 3.35Å; R84-A88 PolarHBondContact O-N 3.15Å
85S86.7Confident85.8Confident95 Ų9554.7 Ų54.766%0.66428%0.275SS*.Hα-helixtrans-65.6-45177.854.90000112.7Q83 A88 F89Q83-S85 PolarHBondContact O-N 3.27Å; Q83-S85 VanDerWaalsContact O-N 3.16Å; S85-A88 PolarHBondContact O-N 2.94Å; S85-F89 PolarHBondContact O-N 2.85Å
86Y87.3Confident86.2Confident32 Ų3257.7 Ų57.713%0.12529%0.294CS..Hα-helixtrans-68.7-41.4177.7-176.7-98.7000111.5P71 I74 I75 L80 Q83 A88 F89 Y90P71-Y86 PolarHBondContact O-OH 3.29Å; I74-Y86 WeakPolarHBondContact CB-OH 3.48Å; I74-Y86 HydrophobicContact CG2-CE1 4.06Å; I74-Y86 HydrophobicContact CG2-CE2 4.15Å; I74-Y86 WeakPolarHBondContact CG2-OH 3.12Å; I75-Y86 HydrophobicContact CB-CE1 4.21Å; I75-Y86 HydrophobicContact CD1-CD1 3.76Å; I75-Y86 HydrophobicContact CD1-CE1 3.59Å; L80-Y86 HydrophobicContact CB-CD1 3.99Å; L80-Y86 HydrophobicContact CB-CE1 4.25Å; L80-Y86 HydrophobicContact CB-CG 4.41Å; L80-Y86 HydrophobicContact CD2-CE2 4.44Å; L80-Y86 WeakPolarHBondContact O-CD1 3.23Å; Q83-Y86 PolarHBondContact O-N 3.33Å; Q83-Y86 VanDerWaalsContact O-N 3.08Å; Y86-A88 PolarHBondContact O-N 3.39Å; Y86-F89 HydrophobicContact CD2-CD1 4.42Å; Y86-F89 HydrophobicContact CE2-CD1 4.26Å; Y86-F89 PolarHBondContact O-N 2.85Å; Y86-Y90 WeakPolarHBondContact O-CB 3.31Å; Y86-Y90 PolarHBondContact O-N 3Å
87F86.6Confident86.6Confident15 Ų1560.3 Ų60.37%0.06631%0.306CS..Hα-helixtrans-59.9-45.4175.4-172.7-92.3000111.6Y8 I75 Q83 Y90 V91 W178Y8-F87 HydrophobicContact CD1-CD1 4.1Å; Y8-F87 HydrophobicContact CD1-CD2 4.19Å; Y8-F87 AromaticContact CD1-CE1 3.97Å; Y8-F87 HydrophobicContact CD1-CE1 3.97Å; Y8-F87 HydrophobicContact CD1-CE2 4.07Å; Y8-F87 HydrophobicContact CD1-CG 4.21Å; Y8-F87 AromaticContact CD1-CZ 3.97Å; Y8-F87 HydrophobicContact CD1-CZ 3.97Å; Y8-F87 AromaticContact CE1-CD1 3.95Å; Y8-F87 HydrophobicContact CE1-CD1 3.95Å; Y8-F87 HydrophobicContact CE1-CE1 4.01Å; Y8-F87 HydrophobicContact CE1-CG 4.34Å; Y8-F87 HydrophobicContact CE1-CZ 4.48Å; I75-F87 HydrophobicContact CD1-CD2 4.24Å; Q83-F87 PolarHBondContact O-N 2.75Å; F87-Y90 PolarHBondContact O-N 3.28Å; F87-V91 HydrophobicContact CD1-CG2 4.1Å; F87-V91 HydrophobicContact CE1-CG2 3.7Å; F87-V91 HydrophobicContact CZ-CG2 3.94Å; F87-V91 WeakPolarHBondContact O-CG2 3.33Å; F87-V91 PolarHBondContact O-N 3.11Å; F87-W178 WeakPolarHBondContact CE1-O 3.2Å
88A87.5Confident86.8Confident27 Ų2758.8 Ų58.822%0.22330%0.303CS..Hα-helixtrans-62-43.6175.500000112.3R84 S85 Y86 R92R84-A88 WeakPolarHBondContact O-CB 3.35Å; R84-A88 PolarHBondContact O-N 3.15Å; S85-A88 PolarHBondContact O-N 2.94Å; Y86-A88 PolarHBondContact O-N 3.39Å; A88-R92 WeakPolarHBondContact O-CB 3.43Å; A88-R92 PolarHBondContact O-N 2.77Å; A88-R92 VanDerWaalsContact O-N 3.08Å
89F90.4Very high87.4Confident101 Ų10156.4 Ų56.444%0.44329%0.287SS..Hα-helixtrans-59.7-46.3173.5169.3-98.9000111.7S85 Y86 R92 S93 F97S85-F89 PolarHBondContact O-N 2.85Å; Y86-F89 HydrophobicContact CD2-CD1 4.42Å; Y86-F89 HydrophobicContact CE2-CD1 4.26Å; Y86-F89 PolarHBondContact O-N 2.85Å; F89-R92 PolarHBondContact O-N 3.37Å; F89-S93 VanDerWaalsContact O-CB 3.27Å; F89-S93 WeakPolarHBondContact O-CB 3.48Å; F89-S93 PolarHBondContact O-N 2.85Å; F89-S93 PolarHBondContact O-OG 3.49Å; F89-F97 HydrophobicContact CE1-CE2 4.34Å; F89-F97 AromaticContact CZ-CE2 3.77Å; F89-F97 HydrophobicContact CZ-CE2 3.77Å; F89-F97 HydrophobicContact CZ-CZ 4.32Å
90Y89.3Confident88Confident17 Ų1754 Ų547%0.06727%0.267CS..Hα-helixtrans-58.5-54.8178.4164.4-105.9000110.6I75 Y86 F87 R92 S93 K94I75-Y90 HydrophobicContact CB-CD2 4.24Å; I75-Y90 HydrophobicContact CB-CE2 4.28Å; I75-Y90 HydrophobicContact CB-CG 4.42Å; I75-Y90 HydrophobicContact CD1-CD1 4.04Å; I75-Y90 HydrophobicContact CD1-CG 4.1Å; I75-Y90 HydrophobicContact CG1-CD1 4Å; I75-Y90 HydrophobicContact CG1-CD2 4.48Å; I75-Y90 HydrophobicContact CG1-CE1 4.08Å; I75-Y90 HydrophobicContact CG1-CG 4.19Å; I75-Y90 HydrophobicContact CG2-CD2 4.44Å; I75-Y90 HydrophobicContact CG2-CE2 3.98Å; Y86-Y90 WeakPolarHBondContact O-CB 3.31Å; Y86-Y90 PolarHBondContact O-N 3Å; F87-Y90 PolarHBondContact O-N 3.28Å; Y90-R92 VanDerWaalsContact C-N 3.3Å; Y90-R92 PolarHBondContact O-N 3.4Å; Y90-S93 PolarHBondContact O-N 3.43Å; Y90-K94 HydrophobicContact CE1-CD 4.47Å; Y90-K94 HydrophobicContact CE2-CB 4.38Å; Y90-K94 HydrophobicContact CE2-CD 4.09Å; Y90-K94 HydrophobicContact CE2-CG 4.08Å; Y90-K94 WeakPolarHBondContact O-CA 3.03Å; Y90-K94 WeakPolarHBondContact O-CB 3.34Å; Y90-K94 PolarHBondContact O-N 2.89Å; Y90-K94 VanDerWaalsContact OH-CE 3.28Å; Y90-K94 WeakPolarHBondContact OH-CE 3.18Å; Y90-K94 PolarHBondContact OH-NZ 3.26Å
91V89.3Confident88.4Confident2 Ų251.5 Ų51.51%0.01226%0.255CS..Hα-helixtrans-58.6-42.9-178.9174.30000111.6F87 P162 W178 L180F87-V91 HydrophobicContact CD1-CG2 4.1Å; F87-V91 HydrophobicContact CE1-CG2 3.7Å; F87-V91 HydrophobicContact CZ-CG2 3.94Å; F87-V91 WeakPolarHBondContact O-CG2 3.33Å; F87-V91 PolarHBondContact O-N 3.11Å; V91-P162 HydrophobicContact CG1-CB 4.13Å; V91-W178 HydrophobicContact CB-CB 4.16Å; V91-W178 HydrophobicContact CG1-CB 3.93Å; V91-W178 HydrophobicContact CG2-CB 4.32Å; V91-L180 HydrophobicContact CG1-CD1 4.49Å; V91-L180 HydrophobicContact CG1-CG 4.17Å
92R90.3Very high88.9Confident145 Ų14552.9 Ų52.955%0.54726%0.26SS..Hα-helixtrans-69.9-37.4-178.7-172.6163.5-63.2164.24.7113.5A88 F89 Y90A88-R92 WeakPolarHBondContact O-CB 3.43Å; A88-R92 PolarHBondContact O-N 2.77Å; A88-R92 VanDerWaalsContact O-N 3.08Å; F89-R92 PolarHBondContact O-N 3.37Å; Y90-R92 VanDerWaalsContact C-N 3.3Å; Y90-R92 PolarHBondContact O-N 3.4Å
93S91.3Very high89.6Confident16 Ų1651.9 Ų51.911%0.11225%0.251CS..Hα-helixtrans-97.7-13-17467.60000114F89 Y90 M95 T96 F97F89-S93 VanDerWaalsContact O-CB 3.27Å; F89-S93 WeakPolarHBondContact O-CB 3.48Å; F89-S93 PolarHBondContact O-N 2.85Å; F89-S93 PolarHBondContact O-OG 3.49Å; Y90-S93 PolarHBondContact O-N 3.43Å; S93-M95 VanDerWaalsContact C-N 3.32Å; S93-M95 PolarHBondContact O-N 2.93Å; S93-T96 WeakPolarHBondContact O-CB 3.24Å; S93-T96 PolarHBondContact O-N 3.06Å; S93-T96 VanDerWaalsContact O-N 3.14Å; S93-F97 WeakPolarHBondContact O-CD2 3.38Å; S93-F97 PolarHBondContact O-N 3.03Å; S93-F97 WeakPolarHBondContact OG-CD2 3.33Å
94K89.4Confident90Very high64 Ų6448.5 Ų48.528%0.27824%0.235SC..Hα-helixtrans-51.5-48.6-174.3-174.4-174.2-172.1169.10112.3Y90 F97 T98 L180Y90-K94 HydrophobicContact CE1-CD 4.47Å; Y90-K94 HydrophobicContact CE2-CB 4.38Å; Y90-K94 HydrophobicContact CE2-CD 4.09Å; Y90-K94 HydrophobicContact CE2-CG 4.08Å; Y90-K94 WeakPolarHBondContact O-CA 3.03Å; Y90-K94 WeakPolarHBondContact O-CB 3.34Å; Y90-K94 PolarHBondContact O-N 2.89Å; Y90-K94 VanDerWaalsContact OH-CE 3.28Å; Y90-K94 WeakPolarHBondContact OH-CE 3.18Å; Y90-K94 PolarHBondContact OH-NZ 3.26Å; K94-F97 PolarHBondContact O-N 3Å; K94-T98 VanDerWaalsContact O-CB 3.26Å; K94-T98 WeakPolarHBondContact O-CB 3.48Å; K94-T98 PolarHBondContact O-N 3.36Å; K94-T98 PolarHBondContact O-OG1 3.46Å; K94-L180 HydrophobicContact CB-CD1 4.32Å; K94-L180 HydrophobicContact CD-CD1 3.35Å; K94-L180 HydrophobicContact CG-CD1 4.43Å
95M89Confident90.4Very high17 Ų1741.9 Ų41.98%0.08421%0.212CC..Hα-helixtrans-69.8-39.1-175.6-156.768-14700111.7S93 T98 A99 N156 W159 F160S93-M95 VanDerWaalsContact C-N 3.32Å; S93-M95 PolarHBondContact O-N 2.93Å; M95-T98 HydrophobicContact CE-CG2 4.41Å; M95-T98 PolarHBondContact O-N 3.45Å; M95-A99 VanDerWaalsContact O-CB 3.29Å; M95-A99 WeakPolarHBondContact O-CB 3.1Å; M95-A99 PolarHBondContact O-N 2.93Å; M95-N156 HydrophobicContact CE-CB 3.79Å; M95-N156 WeakPolarHBondContact CE-O 3.5Å; M95-N156 WeakPolarHBondContact CG-O 3.4Å; M95-W159 HydrophobicContact CE-CB 3.96Å; M95-W159 HydrophobicContact CE-CE3 4.03Å; M95-F160 HydrophobicContact SD-CB 3.94Å; M95-F160 HydrophobicContact SD-CD2 3.91Å; M95-F160 HydrophobicContact SD-CG 4.42Å
96T92.5Very high90.6Very high69 Ų6937.9 Ų37.942%0.42318%0.183SC..Hα-helixtrans-59.9-50.6173.8-50.20000111.1S93 T98 A99 L100 F157S93-T96 WeakPolarHBondContact O-CB 3.24Å; S93-T96 PolarHBondContact O-N 3.06Å; S93-T96 VanDerWaalsContact O-N 3.14Å; T96-T98 VanDerWaalsContact C-N 3.35Å; T96-T98 PolarHBondContact O-N 2.86Å; T96-A99 PolarHBondContact O-N 3.44Å; T96-L100 HydrophobicContact CG2-CD1 4.29Å; T96-L100 VanDerWaalsContact O-CG 3.28Å; T96-L100 WeakPolarHBondContact O-CG 3.31Å; T96-L100 PolarHBondContact O-N 3.01Å; T96-F157 HydrophobicContact CG2-CE1 4.13Å
97F92.6Very high90.8Very high54 Ų5436.4 Ų36.424%0.23718%0.177CC..Hα-helixtrans-65-37.8178.9-82.8-62.2000112.9C68 P71 F89 S93 K94 L100 A101C68-F97 HydrophobicContact CB-CD1 4.36Å; C68-F97 WeakPolarHBondContact O-CB 3.36Å; P71-F97 HydrophobicContact CB-CD2 4.3Å; P71-F97 HydrophobicContact CB-CE2 4.47Å; P71-F97 HydrophobicContact CG-CD1 4.23Å; P71-F97 HydrophobicContact CG-CD2 4.08Å; P71-F97 HydrophobicContact CG-CE1 4.17Å; P71-F97 HydrophobicContact CG-CE2 4.03Å; P71-F97 HydrophobicContact CG-CG 4.19Å; P71-F97 HydrophobicContact CG-CZ 4.07Å; F89-F97 HydrophobicContact CE1-CE2 4.34Å; F89-F97 AromaticContact CZ-CE2 3.77Å; F89-F97 HydrophobicContact CZ-CE2 3.77Å; F89-F97 HydrophobicContact CZ-CZ 4.32Å; S93-F97 WeakPolarHBondContact O-CD2 3.38Å; S93-F97 PolarHBondContact O-N 3.03Å; S93-F97 WeakPolarHBondContact OG-CD2 3.33Å; K94-F97 PolarHBondContact O-N 3Å; F97-L100 PolarHBondContact O-N 2.84Å; F97-A101 VanDerWaalsContact O-CB 3.3Å; F97-A101 WeakPolarHBondContact O-CB 3.13Å; F97-A101 PolarHBondContact O-N 2.93Å
98T89.7Confident91Very high44 Ų4436 Ų3627%0.2718%0.176SC..Hα-helixtrans-63.8-44174.6-58.90000111.1K94 M95 T96 A101 N102K94-T98 VanDerWaalsContact O-CB 3.26Å; K94-T98 WeakPolarHBondContact O-CB 3.48Å; K94-T98 PolarHBondContact O-N 3.36Å; K94-T98 PolarHBondContact O-OG1 3.46Å; M95-T98 HydrophobicContact CE-CG2 4.41Å; M95-T98 PolarHBondContact O-N 3.45Å; T96-T98 VanDerWaalsContact C-N 3.35Å; T96-T98 PolarHBondContact O-N 2.86Å; T98-A101 PolarHBondContact O-N 3.39Å; T98-N102 WeakPolarHBondContact O-CB 3.43Å; T98-N102 PolarHBondContact O-N 3.5Å; T98-N102 PolarHBondContact O-ND2 2.88Å
99A92Very high91Very high0 Ų036.1 Ų36.10%017%0.173CC..Hα-helixtrans-63.1-45.1176.700000111.7M95 T96 N102 W103 N156 F157M95-A99 VanDerWaalsContact O-CB 3.29Å; M95-A99 WeakPolarHBondContact O-CB 3.1Å; M95-A99 PolarHBondContact O-N 2.93Å; T96-A99 PolarHBondContact O-N 3.44Å; A99-N102 PolarHBondContact O-N 3.07Å; A99-W103 WeakPolarHBondContact O-CB 3.46Å; A99-W103 PolarHBondContact O-N 2.79Å; A99-N156 HydrophobicContact CB-CB 3.59Å; A99-F157 HydrophobicContact CB-CD1 3.71Å; A99-F157 HydrophobicContact CB-CD2 3.9Å; A99-F157 HydrophobicContact CB-CE1 3.53Å; A99-F157 HydrophobicContact CB-CE2 3.72Å; A99-F157 HydrophobicContact CB-CG 3.89Å; A99-F157 HydrophobicContact CB-CZ 3.53Å
100L94.6Very high91Very high44 Ų4435.3 Ų35.323%0.2317%0.167CC..Hα-helixtrans-62.4-43.2175.7-68.9174.5000111.9C68 T96 F97 N102 W103 F104 F157C68-L100 HydrophobicContact CB-CB 4.2Å; C68-L100 VanDerWaalsContact SG-CB 3.57Å; T96-L100 HydrophobicContact CG2-CD1 4.29Å; T96-L100 VanDerWaalsContact O-CG 3.28Å; T96-L100 WeakPolarHBondContact O-CG 3.31Å; T96-L100 PolarHBondContact O-N 3.01Å; F97-L100 PolarHBondContact O-N 2.84Å; L100-N102 PolarHBondContact O-N 3.42Å; L100-W103 HydrophobicContact CD2-CE3 3.7Å; L100-W103 HydrophobicContact CD2-CZ3 3.94Å; L100-W103 WeakPolarHBondContact O-CB 3.04Å; L100-W103 PolarHBondContact O-N 3.45Å; L100-F104 HydrophobicContact CB-CE2 4.26Å; L100-F104 WeakPolarHBondContact O-CD2 3.5Å; L100-F104 PolarHBondContact O-N 3.35Å; L100-F157 HydrophobicContact CD2-CZ 4.44Å
101A92Very high91.1Very high5 Ų534.5 Ų34.54%0.04116%0.164CC..Hα-helixtrans-59.4-48.1175.100000111.4F65 C68 V69 F97 T98 W103 F104 S105F65-A101 HydrophobicContact CD2-CB 4.05Å; F65-A101 VanDerWaalsContact CD2-O 3.31Å; F65-A101 WeakPolarHBondContact CD2-O 3.34Å; F65-A101 HydrophobicContact CE2-CB 4.2Å; C68-A101 HydrophobicContact CB-CB 3.91Å; V69-A101 HydrophobicContact CG2-CB 3.47Å; V69-A101 VanDerWaalsContact CG2-CB 3.47Å; F97-A101 VanDerWaalsContact O-CB 3.3Å; F97-A101 WeakPolarHBondContact O-CB 3.13Å; F97-A101 PolarHBondContact O-N 2.93Å; T98-A101 PolarHBondContact O-N 3.39Å; A101-W103 VanDerWaalsContact C-N 3.3Å; A101-W103 PolarHBondContact O-N 2.93Å; A101-F104 PolarHBondContact O-N 3.35Å; A101-S105 VanDerWaalsContact O-CB 3.28Å; A101-S105 WeakPolarHBondContact O-CB 3.36Å; A101-S105 PolarHBondContact O-N 3.39Å
102N90.4Very high90.9Very high42 Ų4235.6 Ų35.623%0.22517%0.173CC..Hα-helixtrans-61.1-39.9176.8-76.5-31.8000111.9T98 A99 L100 S105 V106 V153 N156T98-N102 WeakPolarHBondContact O-CB 3.43Å; T98-N102 PolarHBondContact O-N 3.5Å; T98-N102 PolarHBondContact O-ND2 2.88Å; A99-N102 PolarHBondContact O-N 3.07Å; L100-N102 PolarHBondContact O-N 3.42Å; N102-S105 PolarHBondContact O-N 3.24Å; N102-V106 WeakPolarHBondContact O-CB 3.3Å; N102-V106 VanDerWaalsContact O-CG2 3.27Å; N102-V106 WeakPolarHBondContact O-CG2 3.4Å; N102-V106 PolarHBondContact O-N 2.97Å; N102-V153 HydrophobicContact CB-CB 4.39Å; N102-V153 HydrophobicContact CB-CG1 4.41Å; N102-N156 PolarHBondContact ND2-OD1 2.92Å
103W94.1Very high90.8Very high51 Ų5129.5 Ų29.519%0.19315%0.151CC..Hα-helixtrans-58.3-56.1175.4173.229.4000112.1A99 L100 A101 S105 V106 A107 Y146 S149 L150 V153A99-W103 WeakPolarHBondContact O-CB 3.46Å; A99-W103 PolarHBondContact O-N 2.79Å; L100-W103 HydrophobicContact CD2-CE3 3.7Å; L100-W103 HydrophobicContact CD2-CZ3 3.94Å; L100-W103 WeakPolarHBondContact O-CB 3.04Å; L100-W103 PolarHBondContact O-N 3.45Å; A101-W103 VanDerWaalsContact C-N 3.3Å; A101-W103 PolarHBondContact O-N 2.93Å; W103-S105 VanDerWaalsContact C-N 3.27Å; W103-S105 PolarHBondContact O-N 3.05Å; W103-V106 PolarHBondContact O-N 3.35Å; W103-A107 WeakPolarHBondContact O-CB 3.31Å; W103-A107 PolarHBondContact O-N 3.39Å; W103-Y146 HydrophobicContact CZ2-CD1 4.28Å; W103-Y146 AromaticContact NE1-CD1 3.98Å; W103-Y146 PolarHBondContact NE1-O 2.83Å; W103-S149 VanDerWaalsContact CD1-OG 3.25Å; W103-S149 PolarHBondContact NE1-OG 3.21Å; W103-L150 HydrophobicContact CB-CD1 4.46Å; W103-L150 VanDerWaalsContact CD1-N 3.33Å; W103-L150 HydrophobicContact CD2-CB 4.15Å; W103-L150 HydrophobicContact CD2-CD1 3.79Å; W103-L150 HydrophobicContact CD2-CG 4.44Å; W103-L150 HydrophobicContact CE3-CD1 3.93Å; W103-L150 HydrophobicContact CG-CB 4.22Å; W103-L150 HydrophobicContact CG-CD1 4.03Å; W103-L150 HydrophobicContact CH2-CD2 4.27Å; W103-L150 HydrophobicContact CZ2-CB 4.17Å; W103-L150 HydrophobicContact CZ2-CD2 4.16Å; W103-L150 HydrophobicContact CZ3-CD1 4.39Å; W103-V153 HydrophobicContact CB-CG2 3.75Å
104F94Very high90.6Very high29 Ų2929.3 Ų29.313%0.12715%0.151CC..Hα-helixtrans-64-34.1-179.8-68.2-58000112.6A61 C64 F65 L100 A101 S108 Y146A61-F104 HydrophobicContact CB-CD1 4.47Å; A61-F104 WeakPolarHBondContact O-CB 3.44Å; C64-F104 HydrophobicContact CB-CB 4.44Å; C64-F104 HydrophobicContact CB-CD1 3.71Å; C64-F104 HydrophobicContact CB-CD2 3.54Å; C64-F104 HydrophobicContact CB-CE1 3.75Å; C64-F104 HydrophobicContact CB-CE2 3.6Å; C64-F104 HydrophobicContact CB-CG 3.62Å; C64-F104 HydrophobicContact CB-CZ 3.7Å; F65-F104 HydrophobicContact CB-CB 4.03Å; L100-F104 HydrophobicContact CB-CE2 4.26Å; L100-F104 WeakPolarHBondContact O-CD2 3.5Å; L100-F104 PolarHBondContact O-N 3.35Å; A101-F104 PolarHBondContact O-N 3.35Å; F104-S108 VanDerWaalsContact O-CB 3.31Å; F104-S108 WeakPolarHBondContact O-CB 3.49Å; F104-S108 PolarHBondContact O-N 2.93Å; F104-Y146 HydrophobicContact CD1-CE1 4.17Å; F104-Y146 HydrophobicContact CE1-CE1 4.36Å
105S89.7Confident90.3Very high11 Ų1126.7 Ų26.78%0.07714%0.14CC..Hα-helixtrans-62.7-50.6175.3-171.40000111.8A101 N102 W103 S108 I109 K279A101-S105 VanDerWaalsContact O-CB 3.28Å; A101-S105 WeakPolarHBondContact O-CB 3.36Å; A101-S105 PolarHBondContact O-N 3.39Å; N102-S105 PolarHBondContact O-N 3.24Å; W103-S105 VanDerWaalsContact C-N 3.27Å; W103-S105 PolarHBondContact O-N 3.05Å; S105-S108 WeakPolarHBondContact O-CB 3.37Å; S105-S108 PolarHBondContact O-N 2.9Å; S105-I109 WeakPolarHBondContact O-CG1 3.28Å; S105-I109 PolarHBondContact O-N 3.43Å; S105-I109 VanDerWaalsContact O-N 3.14Å; S105-K279 WeakPolarHBondContact OG-CE 3.39Å
106V90.3Very high89.9Confident11 Ų1126.4 Ų26.47%0.06714%0.139CC..Hα-helixtrans-65.1-43.3179.3173.20000111.2N102 W103 S108 I109 W110 V153 T206N102-V106 WeakPolarHBondContact O-CB 3.3Å; N102-V106 VanDerWaalsContact O-CG2 3.27Å; N102-V106 WeakPolarHBondContact O-CG2 3.4Å; N102-V106 PolarHBondContact O-N 2.97Å; W103-V106 PolarHBondContact O-N 3.35Å; V106-S108 VanDerWaalsContact C-N 3.3Å; V106-S108 PolarHBondContact O-N 3.39Å; V106-I109 PolarHBondContact O-N 2.99Å; V106-W110 VanDerWaalsContact O-CD1 3.32Å; V106-W110 PolarHBondContact O-N 2.89Å; V106-W110 VanDerWaalsContact O-N 3.12Å; V106-V153 HydrophobicContact CB-CG1 4.35Å; V106-V153 HydrophobicContact CG2-CG1 3.83Å; V106-T206 HydrophobicContact CG1-CG2 4.07Å; V106-T206 HydrophobicContact CG2-CG2 3.61Å
107A92.5Very high89.5Confident0 Ų028.2 Ų28.20%014%0.141CC..Hα-helixtrans-56.2-45.9175.100000111.4W103 I109 W110 L111 Y146W103-A107 WeakPolarHBondContact O-CB 3.31Å; W103-A107 PolarHBondContact O-N 3.39Å; A107-I109 PolarHBondContact O-N 3.5Å; A107-W110 PolarHBondContact O-N 3.49Å; A107-L111 WeakPolarHBondContact O-CB 3.36Å; A107-L111 WeakPolarHBondContact O-CD1 3.46Å; A107-L111 WeakPolarHBondContact O-CG 3.43Å; A107-L111 PolarHBondContact O-N 3.36Å; A107-Y146 HydrophobicContact CB-CD1 3.79Å; A107-Y146 HydrophobicContact CB-CE1 3.78Å
108S90.3Very high89.1Confident6 Ų626.7 Ų26.74%0.04214%0.135CC..Hα-helixtrans-61.3-39.9178.2173.50000112.9M58 D62 F104 S105 V106 L111 A112 K279M58-S108 WeakPolarHBondContact CG-OG 3.47Å; D62-S108 VanDerWaalsContact OD1-CB 3.22Å; D62-S108 WeakPolarHBondContact OD1-CB 3.29Å; D62-S108 PolarHBondContact OD1-OG 3.04Å; F104-S108 VanDerWaalsContact O-CB 3.31Å; F104-S108 WeakPolarHBondContact O-CB 3.49Å; F104-S108 PolarHBondContact O-N 2.93Å; S105-S108 WeakPolarHBondContact O-CB 3.37Å; S105-S108 PolarHBondContact O-N 2.9Å; V106-S108 VanDerWaalsContact C-N 3.3Å; V106-S108 PolarHBondContact O-N 3.39Å; S108-L111 PolarHBondContact O-N 3.26Å; S108-A112 PolarHBondContact O-N 2.95Å; S108-K279 PolarHBondContact OG-NZ 3.47Å
109I87.6Confident88.6Confident31 Ų3129.3 Ų29.316%0.15914%0.14CC..Hα-helixtrans-62.4-47.8176-64.9166.7000111S105 V106 A107 L111 A112 I113 L207 P210S105-I109 WeakPolarHBondContact O-CG1 3.28Å; S105-I109 PolarHBondContact O-N 3.43Å; S105-I109 VanDerWaalsContact O-N 3.14Å; V106-I109 PolarHBondContact O-N 2.99Å; A107-I109 PolarHBondContact O-N 3.5Å; I109-L111 VanDerWaalsContact C-N 3.35Å; I109-L111 PolarHBondContact O-N 2.89Å; I109-A112 WeakPolarHBondContact O-CB 3.47Å; I109-A112 PolarHBondContact O-N 3.09Å; I109-A112 VanDerWaalsContact O-N 3.11Å; I109-I113 PolarHBondContact O-N 2.85Å; I109-I113 VanDerWaalsContact O-N 3.12Å; I109-L207 HydrophobicContact CD1-CD2 4.32Å; I109-P210 HydrophobicContact CG2-CB 3.6Å; I109-P210 HydrophobicContact CG2-CG 4.47Å
110W91.2Very high88Confident84 Ų8429.7 Ų29.732%0.31814%0.142SC..Hα-helixtrans-67.5-34.7178.3-78.4104.1000112.7V106 A107 A112 I113 A114 I145 P210V106-W110 VanDerWaalsContact O-CD1 3.32Å; V106-W110 PolarHBondContact O-N 2.89Å; V106-W110 VanDerWaalsContact O-N 3.12Å; A107-W110 PolarHBondContact O-N 3.49Å; W110-A112 VanDerWaalsContact C-N 3.28Å; W110-A112 PolarHBondContact O-N 3.29Å; W110-I113 HydrophobicContact CD2-CD1 4.46Å; W110-I113 HydrophobicContact CE3-CD1 3.97Å; W110-I113 HydrophobicContact CZ3-CD1 4.22Å; W110-I113 WeakPolarHBondContact O-CB 3.38Å; W110-I113 PolarHBondContact O-N 3.42Å; W110-A114 PolarHBondContact O-N 3.37Å; W110-I145 HydrophobicContact CB-CG2 3.68Å; W110-P210 HydrophobicContact CH2-CG 4.4Å; W110-P210 HydrophobicContact CZ2-CG 3.71Å
111L91Very high87.5Confident0 Ų030 Ų300%014%0.143CC..Hα-helixtrans-63.5-34.9170.9-71.7166.3000111.3F54 A57 M58 A107 S108 I109 A114 V115 I142 I145 Y146F54-L111 HydrophobicContact CD1-CD2 3.81Å; A57-L111 HydrophobicContact CB-CD1 3.92Å; A57-L111 HydrophobicContact CB-CD2 4.08Å; M58-L111 HydrophobicContact CB-CB 4.15Å; M58-L111 HydrophobicContact CB-CD1 4.38Å; M58-L111 HydrophobicContact CE-CB 4.26Å; A107-L111 WeakPolarHBondContact O-CB 3.36Å; A107-L111 WeakPolarHBondContact O-CD1 3.46Å; A107-L111 WeakPolarHBondContact O-CG 3.43Å; A107-L111 PolarHBondContact O-N 3.36Å; S108-L111 PolarHBondContact O-N 3.26Å; I109-L111 VanDerWaalsContact C-N 3.35Å; I109-L111 PolarHBondContact O-N 2.89Å; L111-A114 WeakPolarHBondContact O-CB 3.37Å; L111-A114 PolarHBondContact O-N 3.37Å; L111-V115 WeakPolarHBondContact O-CG2 3.41Å; L111-V115 PolarHBondContact O-N 2.87Å; L111-I142 HydrophobicContact CD2-CG1 4.11Å; L111-I145 HydrophobicContact CD2-CD1 3.97Å; L111-I145 HydrophobicContact CD2-CG2 4.38Å; L111-I145 HydrophobicContact CG-CG2 4.1Å; L111-Y146 HydrophobicContact CD1-CE2 4.37Å
112A85.2Confident86.9Confident24 Ų2432.8 Ų32.820%0.19816%0.16CC..Hα-helixtrans-65.9-42.5176.100000111.7M58 S108 I109 W110 A114 V115 T116M58-A112 HydrophobicContact CE-CB 3.67Å; M58-A112 HydrophobicContact SD-CB 4.45Å; S108-A112 PolarHBondContact O-N 2.95Å; I109-A112 WeakPolarHBondContact O-CB 3.47Å; I109-A112 PolarHBondContact O-N 3.09Å; I109-A112 VanDerWaalsContact O-N 3.11Å; W110-A112 VanDerWaalsContact C-N 3.28Å; W110-A112 PolarHBondContact O-N 3.29Å; A112-A114 VanDerWaalsContact C-N 3.33Å; A112-A114 PolarHBondContact O-N 3.01Å; A112-V115 PolarHBondContact O-N 2.89Å; A112-T116 WeakPolarHBondContact O-CG2 3.5Å; A112-T116 PolarHBondContact O-N 3.46Å
113I86.9Confident86.2Confident17 Ų1733.5 Ų33.59%0.08716%0.163CC..Hα-helixtrans-57.8-47.9170.6-68.4170000110.1I109 W110 V115 T116 F117 P210 M213 L214 L217I109-I113 PolarHBondContact O-N 2.85Å; I109-I113 VanDerWaalsContact O-N 3.12Å; W110-I113 HydrophobicContact CD2-CD1 4.46Å; W110-I113 HydrophobicContact CE3-CD1 3.97Å; W110-I113 HydrophobicContact CZ3-CD1 4.22Å; W110-I113 WeakPolarHBondContact O-CB 3.38Å; W110-I113 PolarHBondContact O-N 3.42Å; I113-V115 VanDerWaalsContact C-N 3.32Å; I113-V115 PolarHBondContact O-N 2.9Å; I113-T116 PolarHBondContact O-N 3.01Å; I113-T116 VanDerWaalsContact O-N 3.08Å; I113-T116 PolarHBondContact O-OG1 3.41Å; I113-F117 WeakPolarHBondContact O-CB 3.42Å; I113-F117 PolarHBondContact O-N 3.46Å; I113-P210 HydrophobicContact CD1-CB 3.69Å; I113-P210 WeakPolarHBondContact CD1-O 3.4Å; I113-M213 HydrophobicContact CD1-CB 4.23Å; I113-L214 HydrophobicContact CG1-CB 4.24Å; I113-L214 HydrophobicContact CG1-CD1 4.05Å; I113-L217 HydrophobicContact CG2-CD1 3.68Å
114A88.7Confident85.6Confident13 Ų1336.9 Ų36.911%0.10718%0.176CC..Hα-helixtrans-59.4-39.5178.600000112.8F54 W110 L111 A112 F117 E118 I145F54-A114 HydrophobicContact CD1-CB 3.9Å; F54-A114 HydrophobicContact CD2-CB 4.27Å; F54-A114 HydrophobicContact CE1-CB 3.81Å; F54-A114 HydrophobicContact CE2-CB 4.17Å; F54-A114 HydrophobicContact CG-CB 4.14Å; F54-A114 HydrophobicContact CZ-CB 3.94Å; W110-A114 PolarHBondContact O-N 3.37Å; L111-A114 WeakPolarHBondContact O-CB 3.37Å; L111-A114 PolarHBondContact O-N 3.37Å; A112-A114 VanDerWaalsContact C-N 3.33Å; A112-A114 PolarHBondContact O-N 3.01Å; A114-F117 PolarHBondContact O-N 3.05Å; A114-E118 WeakPolarHBondContact O-CB 3.22Å; A114-E118 PolarHBondContact O-N 2.99Å; A114-I145 HydrophobicContact CB-CD1 4.16Å
115V82.3Confident84.9Confident9 Ų941.7 Ų41.76%0.05520%0.197CC..Hα-helixtrans-61.2-46.9172.7172.30000111.2F54 L55 M58 L111 A112 I113 F117 R119F54-V115 HydrophobicContact CB-CG2 3.43Å; F54-V115 VanDerWaalsContact CB-CG2 3.43Å; F54-V115 HydrophobicContact CG-CG2 4.42Å; L55-V115 HydrophobicContact CD2-CG1 4.15Å; L55-V115 HydrophobicContact CD2-CG2 3.98Å; L55-V115 HydrophobicContact CG-CG1 4.45Å; L55-V115 HydrophobicContact CG-CG2 4.09Å; M58-V115 HydrophobicContact CE-CG2 3.83Å; L111-V115 WeakPolarHBondContact O-CG2 3.41Å; L111-V115 PolarHBondContact O-N 2.87Å; A112-V115 PolarHBondContact O-N 2.89Å; I113-V115 VanDerWaalsContact C-N 3.32Å; I113-V115 PolarHBondContact O-N 2.9Å; V115-F117 VanDerWaalsContact C-N 3.33Å; V115-F117 PolarHBondContact O-N 2.95Å; V115-R119 VanDerWaalsContact O-CG 3.31Å; V115-R119 WeakPolarHBondContact O-CG 3.11Å; V115-R119 PolarHBondContact O-N 3.06Å; V115-R119 VanDerWaalsContact O-N 3.11Å
116T79.8Confident84.1Confident10 Ų1045.3 Ų45.36%0.06122%0.22CC..Hα-helixtrans-65.4-39-179.8610000112A112 I113 R119 L120 L214 N218A112-T116 WeakPolarHBondContact O-CG2 3.5Å; A112-T116 PolarHBondContact O-N 3.46Å; I113-T116 PolarHBondContact O-N 3.01Å; I113-T116 VanDerWaalsContact O-N 3.08Å; I113-T116 PolarHBondContact O-OG1 3.41Å; T116-R119 PolarHBondContact O-N 3.3Å; T116-L120 WeakPolarHBondContact O-CG 3.41Å; T116-L120 PolarHBondContact O-N 3.34Å; T116-L214 HydrophobicContact CG2-CD1 3.9Å; T116-N218 WeakPolarHBondContact CG2-OD1 3.37Å
117F85.3Confident83Confident107 Ų10751.2 Ų51.247%0.46925%0.25SS..Hα-helixtrans-67.2-45177.8-177.2-104.1000112.1I113 A114 V115 R119 L120 L121 L217I113-F117 WeakPolarHBondContact O-CB 3.42Å; I113-F117 PolarHBondContact O-N 3.46Å; A114-F117 PolarHBondContact O-N 3.05Å; V115-F117 VanDerWaalsContact C-N 3.33Å; V115-F117 PolarHBondContact O-N 2.95Å; F117-R119 VanDerWaalsContact C-N 3.3Å; F117-R119 PolarHBondContact O-N 3.27Å; F117-L120 WeakPolarHBondContact O-CB 3.16Å; F117-L120 PolarHBondContact O-N 3.35Å; F117-L120 VanDerWaalsContact O-N 3.16Å; F117-L121 HydrophobicContact CD1-CD1 3.81Å; F117-L121 HydrophobicContact CD1-CG 4.25Å; F117-L121 HydrophobicContact CE1-CD1 3.36Å; F117-L121 HydrophobicContact CE1-CD2 4.37Å; F117-L121 HydrophobicContact CE1-CG 3.91Å; F117-L121 HydrophobicContact CZ-CD1 3.94Å; F117-L121 HydrophobicContact CZ-CD2 4.1Å; F117-L121 HydrophobicContact CZ-CG 4.08Å; F117-L121 WeakPolarHBondContact O-CG 3.44Å; F117-L121 PolarHBondContact O-N 2.93Å; F117-L217 HydrophobicContact CD2-CD2 4.39Å
118E83.4Confident81.6Confident23 Ų2357.7 Ų57.711%0.10728%0.28CS..Hα-helixtrans-57.8-44174.9-177-89.4179.400111.3A51 F54 A114 L120 L121 V122 F138A51-E118 VanDerWaalsContact CB-OE2 3.23Å; A51-E118 WeakPolarHBondContact CB-OE2 3.13Å; A51-E118 PolarHBondContact N-OE1 3.41Å; F54-E118 HydrophobicContact CD2-CB 4.45Å; F54-E118 HydrophobicContact CE2-CB 4.26Å; A114-E118 WeakPolarHBondContact O-CB 3.22Å; A114-E118 PolarHBondContact O-N 2.99Å; E118-L120 VanDerWaalsContact C-N 3.34Å; E118-L120 PolarHBondContact O-N 3.03Å; E118-L121 WeakPolarHBondContact O-CB 3.27Å; E118-L121 PolarHBondContact O-N 3.22Å; E118-V122 WeakPolarHBondContact O-CG2 3.3Å; E118-V122 PolarHBondContact O-N 3.04Å; E118-F138 HydrophobicContact CG-CE1 4.41Å
119R79.3Confident80.3Confident99 Ų9958 Ų5837%0.37428%0.283SS..Hα-helixtrans-61.4-41.9176.6-72.2179.2-179.7-155.93.9112.3V115 T116 F117 L121 V122 I123 L221V115-R119 VanDerWaalsContact O-CG 3.31Å; V115-R119 WeakPolarHBondContact O-CG 3.11Å; V115-R119 PolarHBondContact O-N 3.06Å; V115-R119 VanDerWaalsContact O-N 3.11Å; T116-R119 PolarHBondContact O-N 3.3Å; F117-R119 VanDerWaalsContact C-N 3.3Å; F117-R119 PolarHBondContact O-N 3.27Å; R119-L121 VanDerWaalsContact C-N 3.35Å; R119-V122 PolarHBondContact O-N 3.49Å; R119-I123 WeakPolarHBondContact O-CD1 3.49Å; R119-I123 VanDerWaalsContact O-CG1 3.26Å; R119-I123 WeakPolarHBondContact O-CG1 3.47Å; R119-I123 PolarHBondContact O-N 3.24Å; R119-L221 HydrophobicContact CB-CD1 4.17Å
120L79.9Confident79.3Confident7 Ų766.5 Ų66.54%0.03731%0.313CS..Hα-helixtrans-62.7-40.9175.4-80.5171000112.4T116 F117 E118 I123 R124 L217 A220 L221 Y224T116-L120 WeakPolarHBondContact O-CG 3.41Å; T116-L120 PolarHBondContact O-N 3.34Å; F117-L120 WeakPolarHBondContact O-CB 3.16Å; F117-L120 PolarHBondContact O-N 3.35Å; F117-L120 VanDerWaalsContact O-N 3.16Å; E118-L120 VanDerWaalsContact C-N 3.34Å; E118-L120 PolarHBondContact O-N 3.03Å; L120-I123 PolarHBondContact O-N 3.26Å; L120-R124 WeakPolarHBondContact O-CB 3.48Å; L120-R124 PolarHBondContact O-N 2.95Å; L120-L217 HydrophobicContact CD1-CB 4.25Å; L120-L217 HydrophobicContact CD1-CD2 3.65Å; L120-A220 HydrophobicContact CD1-CB 4.32Å; L120-A220 HydrophobicContact CD2-CB 4.25Å; L120-L221 HydrophobicContact CD2-CB 4Å; L120-L221 HydrophobicContact CD2-CD1 4.18Å; L120-L221 HydrophobicContact CG-CB 4.24Å; L120-L221 HydrophobicContact CG-CD1 4.34Å; L120-Y224 HydrophobicContact CD2-CD2 4.11Å
121L83.7Confident78Confident50 Ų5069.7 Ų69.726%0.26234%0.335SS..Hα-helixtrans-63.8-43.7176.4-72.7178.7000111.7F117 E118 R119 I123 R124 K125 F133F117-L121 HydrophobicContact CD1-CD1 3.81Å; F117-L121 HydrophobicContact CD1-CG 4.25Å; F117-L121 HydrophobicContact CE1-CD1 3.36Å; F117-L121 HydrophobicContact CE1-CD2 4.37Å; F117-L121 HydrophobicContact CE1-CG 3.91Å; F117-L121 HydrophobicContact CZ-CD1 3.94Å; F117-L121 HydrophobicContact CZ-CD2 4.1Å; F117-L121 HydrophobicContact CZ-CG 4.08Å; F117-L121 WeakPolarHBondContact O-CG 3.44Å; F117-L121 PolarHBondContact O-N 2.93Å; E118-L121 WeakPolarHBondContact O-CB 3.27Å; E118-L121 PolarHBondContact O-N 3.22Å; R119-L121 VanDerWaalsContact C-N 3.35Å; L121-I123 VanDerWaalsContact C-N 3.32Å; L121-I123 PolarHBondContact O-N 3.18Å; L121-R124 PolarHBondContact O-N 3.08Å; L121-K125 PolarHBondContact O-N 3.3Å; L121-F133 HydrophobicContact CD1-CE2 3.97Å; L121-F133 HydrophobicContact CD1-CZ 4.15Å
122V79.5Confident76.8Confident65 Ų6576.8 Ų76.839%0.39437%0.367SS..Hα-helixtrans-61.8-40.5177.4171.30000111.3E118 R119 P126 A129E118-V122 WeakPolarHBondContact O-CG2 3.3Å; E118-V122 PolarHBondContact O-N 3.04Å; R119-V122 PolarHBondContact O-N 3.49Å; V122-P126 WeakPolarHBondContact O-CA 3.33Å; V122-A129 HydrophobicContact CG2-CB 4.3Å
123I75.8Confident76.2Confident57 Ų5778.9 Ų78.929%0.29237%0.371SS..Hα-helixtrans-71.2-43.4179.7-66.6162.3000111.6R119 L120 L121 L221 L225R119-I123 WeakPolarHBondContact O-CD1 3.49Å; R119-I123 VanDerWaalsContact O-CG1 3.26Å; R119-I123 WeakPolarHBondContact O-CG1 3.47Å; R119-I123 PolarHBondContact O-N 3.24Å; L120-I123 PolarHBondContact O-N 3.26Å; L121-I123 VanDerWaalsContact C-N 3.32Å; L121-I123 PolarHBondContact O-N 3.18Å; I123-L221 HydrophobicContact CD1-CD1 3.49Å; I123-L221 VanDerWaalsContact CD1-CD1 3.49Å; I123-L225 HydrophobicContact CD1-CD2 3.6Å; I123-L225 HydrophobicContact CD1-CG 3.94Å; I123-L225 HydrophobicContact CG1-CD2 4.49Å
124R80.8Confident75.9Confident122 Ų12287.3 Ų87.346%0.4640%0.402SS..Hα-helixtrans-77.5-39-175.9-77.5-159.7173.7104-29113.7L120 L121 Y224L120-R124 WeakPolarHBondContact O-CB 3.48Å; L120-R124 PolarHBondContact O-N 2.95Å; L121-R124 PolarHBondContact O-N 3.08Å; R124-Y224 HydrophobicContact CG-CD1 4.23Å; R124-Y224 HydrophobicContact CG-CE1 4.27Å; R124-Y224 VanDerWaalsContact NE-CE1 3.35Å; R124-Y224 PolarHBondContact NE-OH 3.39Å; R124-Y224 PolarHBondContact NH2-OH 3.22Å
125K79Confident75.6Confident130 Ų13094.1 Ų94.157%0.56543%0.429SS*.  trans-132.867.8-174.1-63.3-168.5177.1-173.50110.3L121 L127 H128 A129L121-K125 PolarHBondContact O-N 3.3Å; K125-L127 VanDerWaalsContact C-N 3.28Å; K125-L127 PolarHBondContact O-N 2.96Å; K125-H128 HydrophobicContact CB-CB 4.2Å; K125-H128 PolarHBondContact O-N 3.3Å; K125-A129 VanDerWaalsContact O-CB 3.3Å; K125-A129 WeakPolarHBondContact O-CB 3.46Å; K125-A129 PolarHBondContact O-N 3.25Å
126P73Confident75.7Confident86 Ų86103.3 Ų103.356%0.55846%0.463SS*.Hα-helixtrans-57.9-39.9-173.922.7-33.8000112.8V122V122-P126 WeakPolarHBondContact O-CA 3.33Å
127L67.1Low76.2Confident136 Ų136107.2 Ų107.271%0.71248%0.481SS*.Hα-helixtrans-69.7-47.8-179.7-66.9170.7000112.4K125 R130 L131K125-L127 VanDerWaalsContact C-N 3.28Å; K125-L127 PolarHBondContact O-N 2.96Å; L127-R130 PolarHBondContact O-N 2.76Å; L127-L131 WeakPolarHBondContact O-CD1 3.26Å
128H63.5Low76.3Confident136 Ų136102.6 Ų102.663%0.6346%0.46SS*.Hα-helixtrans-72.5-36.3-177.7-75.659.5000112.5K125 R130 L131 F132K125-H128 HydrophobicContact CB-CB 4.2Å; K125-H128 PolarHBondContact O-N 3.3Å; H128-R130 PolarHBondContact O-N 2.74Å; H128-L131 PolarHBondContact O-N 3.45Å; H128-F132 WeakPolarHBondContact O-CB 3.49Å; H128-F132 PolarHBondContact O-N 2.74Å
129A63.1Low76.6Confident11 Ų11104.2 Ų104.29%0.09148%0.477CS..Hα-helixtrans-61.6-31.8178.700000111.8K50 V122 K125K50-A129 PolarHBondContact NZ-O 2.78Å; V122-A129 HydrophobicContact CG2-CB 4.3Å; K125-A129 VanDerWaalsContact O-CB 3.3Å; K125-A129 WeakPolarHBondContact O-CB 3.46Å; K125-A129 PolarHBondContact O-N 3.25Å
130R66.2Low77.3Confident210 Ų210102.2 Ų102.279%0.79248%0.476SS*.Hα-helixtrans-71.8-41.6177.7-165.7174.7178-175.8-1.9112.6K50 L127 H128K50-R130 PolarHBondContact NZ-O 3.4Å; L127-R130 PolarHBondContact O-N 2.76Å; H128-R130 PolarHBondContact O-N 2.74Å
131L64.8Low78Confident151 Ų151105.6 Ų105.679%0.79149%0.494SS*.Hα-helixtrans-79.3-40.8-178.6-86.9105000114.1L127 H128L127-L131 WeakPolarHBondContact O-CD1 3.26Å; H128-L131 PolarHBondContact O-N 3.45Å
132F65.3Low78.5Confident149 Ų149104.3 Ų104.365%0.65449%0.487SS*.Hα-helixtrans-77.1-44-164.7-160-102000113.5H128 R134H128-F132 WeakPolarHBondContact O-CB 3.49Å; H128-F132 PolarHBondContact O-N 2.74Å; F132-R134 PolarHBondContact O-N 3.48Å
133F73.2Confident79.4Confident69 Ų69103 Ų10330%0.30349%0.487SS..  trans-88.196.4-174.4-66.4-78.6000112.5K50 L121 H137 F138K50-F133 HydrophobicContact CD-CB 4.34Å; K50-F133 WeakPolarHBondContact CE-O 3.43Å; K50-F133 PolarHBondContact NZ-O 3.38Å; L121-F133 HydrophobicContact CD1-CE2 3.97Å; L121-F133 HydrophobicContact CD1-CZ 4.15Å; F133-H137 HydrophobicContact CD1-CB 4.38Å; F133-F138 HydrophobicContact CB-CE2 3.52Å; F133-F138 HydrophobicContact CB-CZ 3.61Å; F133-F138 HydrophobicContact CG-CE2 4.47Å; F133-F138 HydrophobicContact CG-CZ 4.17Å
134R80.7Confident80.4Confident193 Ų193104.5 Ų104.573%0.72850%0.495SS*.  trans-69.7158165.5-68.4-174.1172.9-165.5-1.3111.9F132 W136 H137 F138F132-R134 PolarHBondContact O-N 3.48Å; R134-W136 PolarHBondContact O-N 2.98Å; R134-H137 PolarHBondContact N-ND1 2.79Å; R134-H137 WeakPolarHBondContact O-CB 3.2Å; R134-H137 PolarHBondContact O-N 2.95Å; R134-H137 VanDerWaalsContact O-N 3.09Å; R134-F138 WeakPolarHBondContact O-CD2 3.43Å
135K82.1Confident81.2Confident156 Ų15699.7 Ų99.768%0.67848%0.478SS*.Hα-helixtrans-51.6-39.3179.6-66.5-179.5178.4176.80113.4Y53 H137 F138 A139Y53-K135 WeakPolarHBondContact OH-CD 3.24Å; K135-H137 VanDerWaalsContact C-N 3.33Å; K135-H137 PolarHBondContact O-N 3.16Å; K135-F138 PolarHBondContact O-N 3.32Å; K135-A139 PolarHBondContact O-N 3.13Å
136W85.2Confident82.1Confident202 Ų20295.5 Ų95.577%0.76546%0.459SS*.Hα-helixtrans-65.8-32.8-178.1-148.779000113R134 F138 A139 V140R134-W136 PolarHBondContact O-N 2.98Å; W136-F138 VanDerWaalsContact C-N 3.29Å; W136-F138 PolarHBondContact O-N 2.97Å; W136-A139 PolarHBondContact O-N 3.46Å; W136-A139 VanDerWaalsContact O-N 3.17Å; W136-V140 HydrophobicContact CD2-CG2 3.95Å; W136-V140 HydrophobicContact CE3-CG2 3.37Å; W136-V140 HydrophobicContact CH2-CG2 3.8Å; W136-V140 HydrophobicContact CZ2-CG2 4.32Å; W136-V140 HydrophobicContact CZ3-CG2 3.3Å; W136-V140 WeakPolarHBondContact O-CG2 3.27Å; W136-V140 PolarHBondContact O-N 3.47Å
137H88.4Confident83.2Confident93 Ų9394.1 Ų94.143%0.43146%0.455SS..Hα-helixtrans-61.6-38174.6-65102.7000112.2F133 R134 K135 L141F133-H137 HydrophobicContact CD1-CB 4.38Å; R134-H137 PolarHBondContact N-ND1 2.79Å; R134-H137 WeakPolarHBondContact O-CB 3.2Å; R134-H137 PolarHBondContact O-N 2.95Å; R134-H137 VanDerWaalsContact O-N 3.09Å; K135-H137 VanDerWaalsContact C-N 3.33Å; K135-H137 PolarHBondContact O-N 3.16Å; H137-L141 VanDerWaalsContact O-CB 3.28Å; H137-L141 WeakPolarHBondContact O-CB 3.36Å; H137-L141 PolarHBondContact O-N 2.97Å
138F88.4Confident84.6Confident9 Ų992.3 Ų92.34%0.03945%0.445CS..Hα-helixtrans-66.8-42.1175.3-67.8-78.8000111.5K50 Y53 F54 E118 F133 R134 K135 W136 L141 I142K50-F138 HydrophobicContact CB-CE1 4.15Å; K50-F138 HydrophobicContact CB-CE2 3.79Å; K50-F138 HydrophobicContact CB-CZ 3.5Å; K50-F138 HydrophobicContact CD-CE2 3.78Å; K50-F138 HydrophobicContact CD-CZ 3.83Å; K50-F138 HydrophobicContact CG-CE2 3.82Å; K50-F138 HydrophobicContact CG-CZ 3.97Å; Y53-F138 HydrophobicContact CD2-CB 4.45Å; Y53-F138 HydrophobicContact CD2-CG 4.43Å; Y53-F138 HydrophobicContact CG-CB 4.4Å; F54-F138 HydrophobicContact CD2-CD1 4.27Å; F54-F138 HydrophobicContact CD2-CE1 4.45Å; F54-F138 AromaticContact CE2-CD1 3.55Å; F54-F138 HydrophobicContact CE2-CD1 3.55Å; F54-F138 AromaticContact CE2-CE1 3.65Å; F54-F138 HydrophobicContact CE2-CE1 3.65Å; F54-F138 AromaticContact CZ-CD1 3.67Å; F54-F138 HydrophobicContact CZ-CD1 3.67Å; F54-F138 HydrophobicContact CZ-CE1 4.13Å; E118-F138 HydrophobicContact CG-CE1 4.41Å; F133-F138 HydrophobicContact CB-CE2 3.52Å; F133-F138 HydrophobicContact CB-CZ 3.61Å; F133-F138 HydrophobicContact CG-CE2 4.47Å; F133-F138 HydrophobicContact CG-CZ 4.17Å; R134-F138 WeakPolarHBondContact O-CD2 3.43Å; K135-F138 PolarHBondContact O-N 3.32Å; W136-F138 VanDerWaalsContact C-N 3.29Å; W136-F138 PolarHBondContact O-N 2.97Å; F138-L141 PolarHBondContact O-N 3.45Å; F138-I142 WeakPolarHBondContact O-CB 3.3Å; F138-I142 WeakPolarHBondContact O-CD1 3.06Å; F138-I142 WeakPolarHBondContact O-CG1 3.44Å; F138-I142 PolarHBondContact O-N 3.46Å
139A90.4Very high86.2Confident57 Ų5786 Ų8647%0.47142%0.416SS..Hα-helixtrans-61.5-45.5177.100000111.7K135 W136 I142 G143K135-A139 PolarHBondContact O-N 3.13Å; W136-A139 PolarHBondContact O-N 3.46Å; W136-A139 VanDerWaalsContact O-N 3.17Å; A139-I142 PolarHBondContact O-N 3.37Å; A139-G143 PolarHBondContact O-N 2.99Å
140V94.1Very high87.7Confident58 Ų5888.1 Ų88.135%0.35243%0.426SS..Hα-helixtrans-62.2-48.1175.9172.90000111.1W136 I142 G143 L144W136-V140 HydrophobicContact CD2-CG2 3.95Å; W136-V140 HydrophobicContact CE3-CG2 3.37Å; W136-V140 HydrophobicContact CH2-CG2 3.8Å; W136-V140 HydrophobicContact CZ2-CG2 4.32Å; W136-V140 HydrophobicContact CZ3-CG2 3.3Å; W136-V140 WeakPolarHBondContact O-CG2 3.27Å; W136-V140 PolarHBondContact O-N 3.47Å; V140-I142 VanDerWaalsContact C-N 3.34Å; V140-I142 PolarHBondContact O-N 3.5Å; V140-G143 PolarHBondContact O-N 2.84Å; V140-L144 HydrophobicContact CG1-CD1 3.93Å; V140-L144 HydrophobicContact CG1-CG 4.25Å; V140-L144 WeakPolarHBondContact O-CB 3.46Å; V140-L144 WeakPolarHBondContact O-CG 3.17Å; V140-L144 PolarHBondContact O-N 3.22Å
141L93.7Very high89.1Confident77 Ų7784.3 Ų84.340%0.40342%0.42SS..Hα-helixtrans-63.9-39.6-178.8-177.154.3000112F54 H137 F138 L144 I145F54-L141 HydrophobicContact CE1-CD2 4.16Å; F54-L141 HydrophobicContact CE1-CG 4.19Å; F54-L141 HydrophobicContact CZ-CD2 3.68Å; F54-L141 HydrophobicContact CZ-CG 4.2Å; H137-L141 VanDerWaalsContact O-CB 3.28Å; H137-L141 WeakPolarHBondContact O-CB 3.36Å; H137-L141 PolarHBondContact O-N 2.97Å; F138-L141 PolarHBondContact O-N 3.45Å; L141-L144 PolarHBondContact O-N 3.13Å; L141-I145 HydrophobicContact CD1-CD1 4.39Å; L141-I145 HydrophobicContact CG-CD1 4.25Å; L141-I145 VanDerWaalsContact O-CG1 3.24Å; L141-I145 WeakPolarHBondContact O-CG1 3.22Å; L141-I145 PolarHBondContact O-N 3.35Å
142I95.3Very high90.4Very high23 Ų2378.6 Ų78.612%0.11839%0.392CS..Hα-helixtrans-62.7-47.1172.9-70.2164.9000110.4F54 A57 L111 F138 A139 V140 L144 I145 Y146F54-I142 HydrophobicContact CD1-CD1 4.04Å; F54-I142 HydrophobicContact CD1-CG1 3.62Å; F54-I142 HydrophobicContact CE1-CD1 4.35Å; F54-I142 HydrophobicContact CE1-CG1 3.7Å; A57-I142 HydrophobicContact CB-CD1 4.06Å; A57-I142 HydrophobicContact CB-CG1 4.31Å; A57-I142 HydrophobicContact CB-CG2 3.86Å; L111-I142 HydrophobicContact CD2-CG1 4.11Å; F138-I142 WeakPolarHBondContact O-CB 3.3Å; F138-I142 WeakPolarHBondContact O-CD1 3.06Å; F138-I142 WeakPolarHBondContact O-CG1 3.44Å; F138-I142 PolarHBondContact O-N 3.46Å; A139-I142 PolarHBondContact O-N 3.37Å; V140-I142 VanDerWaalsContact C-N 3.34Å; V140-I142 PolarHBondContact O-N 3.5Å; I142-L144 VanDerWaalsContact C-N 3.33Å; I142-L144 PolarHBondContact O-N 2.97Å; I142-I145 PolarHBondContact O-N 2.92Å; I142-Y146 HydrophobicContact CG2-CD2 3.7Å; I142-Y146 HydrophobicContact CG2-CE2 3.62Å; I142-Y146 VanDerWaalsContact O-CD2 3.28Å; I142-Y146 WeakPolarHBondContact O-CD2 3.42Å; I142-Y146 PolarHBondContact O-N 3.48Å
143G96.8Very high91.7Very high38 Ų3871.7 Ų71.739%0.39236%0.362SS..Hα-helixtrans-58.4-43176.800000112.7A139 V140 Y146 A147A139-G143 PolarHBondContact O-N 2.99Å; V140-G143 PolarHBondContact O-N 2.84Å; G143-Y146 PolarHBondContact O-N 2.85Å; G143-A147 WeakPolarHBondContact O-CB 3.36Å; G143-A147 PolarHBondContact O-N 3.45Å
144L97.4Very high92.6Very high88 Ų8869.3 Ų69.346%0.46136%0.355SS..Hα-helixtrans-63.5-42.9175.2-72.5174.4000112V140 L141 I142 Y146 A147 I148V140-L144 HydrophobicContact CG1-CD1 3.93Å; V140-L144 HydrophobicContact CG1-CG 4.25Å; V140-L144 WeakPolarHBondContact O-CB 3.46Å; V140-L144 WeakPolarHBondContact O-CG 3.17Å; V140-L144 PolarHBondContact O-N 3.22Å; L141-L144 PolarHBondContact O-N 3.13Å; I142-L144 VanDerWaalsContact C-N 3.33Å; I142-L144 PolarHBondContact O-N 2.97Å; L144-Y146 VanDerWaalsContact C-N 3.33Å; L144-Y146 PolarHBondContact O-N 3.3Å; L144-A147 PolarHBondContact O-N 3.49Å; L144-I148 WeakPolarHBondContact O-CB 3.4Å; L144-I148 VanDerWaalsContact O-CG1 3.23Å; L144-I148 WeakPolarHBondContact O-CG1 3.42Å; L144-I148 PolarHBondContact O-N 2.85Å
145I96.8Very high93.1Very high22 Ų2261.1 Ų61.111%0.11332%0.324CS..Hα-helixtrans-60.5-44.6176.2-69.9164.2000110.5F54 W110 L111 A114 L141 I142 S149F54-I145 HydrophobicContact CE1-CD1 4.49Å; W110-I145 HydrophobicContact CB-CG2 3.68Å; L111-I145 HydrophobicContact CD2-CD1 3.97Å; L111-I145 HydrophobicContact CD2-CG2 4.38Å; L111-I145 HydrophobicContact CG-CG2 4.1Å; A114-I145 HydrophobicContact CB-CD1 4.16Å; L141-I145 HydrophobicContact CD1-CD1 4.39Å; L141-I145 HydrophobicContact CG-CD1 4.25Å; L141-I145 VanDerWaalsContact O-CG1 3.24Å; L141-I145 WeakPolarHBondContact O-CG1 3.22Å; L141-I145 PolarHBondContact O-N 3.35Å; I142-I145 PolarHBondContact O-N 2.92Å; I145-S149 VanDerWaalsContact O-CB 3.23Å; I145-S149 WeakPolarHBondContact O-CB 3.43Å; I145-S149 PolarHBondContact O-N 3.44Å; I145-S149 PolarHBondContact O-OG 2.88Å
146Y97.9Very high93.5Very high41 Ų4153.9 Ų53.916%0.16129%0.292CS..Hα-helixtrans-64-43.2175.5-83.1-69.6000112.7A57 A61 W103 F104 A107 L111 I142 G143 L144 S149 L150A57-Y146 HydrophobicContact CB-CE2 4.43Å; A57-Y146 PolarHBondContact O-OH 2.85Å; A61-Y146 HydrophobicContact CB-CE1 4.3Å; A61-Y146 WeakPolarHBondContact CB-OH 3.47Å; W103-Y146 HydrophobicContact CZ2-CD1 4.28Å; W103-Y146 AromaticContact NE1-CD1 3.98Å; W103-Y146 PolarHBondContact NE1-O 2.83Å; F104-Y146 HydrophobicContact CD1-CE1 4.17Å; F104-Y146 HydrophobicContact CE1-CE1 4.36Å; A107-Y146 HydrophobicContact CB-CD1 3.79Å; A107-Y146 HydrophobicContact CB-CE1 3.78Å; L111-Y146 HydrophobicContact CD1-CE2 4.37Å; I142-Y146 HydrophobicContact CG2-CD2 3.7Å; I142-Y146 HydrophobicContact CG2-CE2 3.62Å; I142-Y146 VanDerWaalsContact O-CD2 3.28Å; I142-Y146 WeakPolarHBondContact O-CD2 3.42Å; I142-Y146 PolarHBondContact O-N 3.48Å; G143-Y146 PolarHBondContact O-N 2.85Å; L144-Y146 VanDerWaalsContact C-N 3.33Å; L144-Y146 PolarHBondContact O-N 3.3Å; Y146-S149 WeakPolarHBondContact CA-OG 3.49Å; Y146-S149 PolarHBondContact O-OG 3.44Å; Y146-L150 WeakPolarHBondContact O-CB 3.49Å; Y146-L150 PolarHBondContact O-N 2.99Å; Y146-L150 VanDerWaalsContact O-N 3.07Å
147A97.7Very high93.8Very high57 Ų5747.5 Ų47.547%0.47127%0.27SS..Hα-helixtrans-66.7-47-179.800000112.2G143 L144 L150 L151G143-A147 WeakPolarHBondContact O-CB 3.36Å; G143-A147 PolarHBondContact O-N 3.45Å; L144-A147 PolarHBondContact O-N 3.49Å; A147-L150 PolarHBondContact O-N 3.46Å; A147-L151 PolarHBondContact O-N 3.11Å
148I96.7Very high93.9Very high99 Ų9947.6 Ų47.651%0.50827%0.27SS..Hα-helixtrans-65.2-44.1179.1-66.3167.4000110.2L144 L150 L151 V152L144-I148 WeakPolarHBondContact O-CB 3.4Å; L144-I148 VanDerWaalsContact O-CG1 3.23Å; L144-I148 WeakPolarHBondContact O-CG1 3.42Å; L144-I148 PolarHBondContact O-N 2.85Å; I148-L150 VanDerWaalsContact C-N 3.31Å; I148-L150 PolarHBondContact O-N 3.05Å; I148-L151 PolarHBondContact O-N 3.05Å; I148-V152 HydrophobicContact CG2-CG2 4.2Å; I148-V152 WeakPolarHBondContact O-CB 3.48Å; I148-V152 VanDerWaalsContact O-CG2 3.24Å; I148-V152 WeakPolarHBondContact O-CG2 3.47Å; I148-V152 PolarHBondContact O-N 3.16Å
149S95.3Very high93.8Very high2 Ų251 Ų511%0.01428%0.282CS..Hα-helixtrans-61.7-38.7177.953.80000112.4W103 I145 Y146 V152 V153W103-S149 VanDerWaalsContact CD1-OG 3.25Å; W103-S149 PolarHBondContact NE1-OG 3.21Å; I145-S149 VanDerWaalsContact O-CB 3.23Å; I145-S149 WeakPolarHBondContact O-CB 3.43Å; I145-S149 PolarHBondContact O-N 3.44Å; I145-S149 PolarHBondContact O-OG 2.88Å; Y146-S149 WeakPolarHBondContact CA-OG 3.49Å; Y146-S149 PolarHBondContact O-OG 3.44Å; S149-V152 PolarHBondContact O-N 3.41Å; S149-V153 VanDerWaalsContact O-CG2 3.32Å; S149-V153 WeakPolarHBondContact O-CG2 3.4Å; S149-V153 PolarHBondContact O-N 3.39Å
150L95.7Very high93.8Very high57 Ų5751.2 Ų51.230%0.29827%0.273SS..Hα-helixtrans-62.2-47.9174.2-179.158.3000111.2W103 Y146 A147 I148 V152 V153 A154 F157W103-L150 HydrophobicContact CB-CD1 4.46Å; W103-L150 VanDerWaalsContact CD1-N 3.33Å; W103-L150 HydrophobicContact CD2-CB 4.15Å; W103-L150 HydrophobicContact CD2-CD1 3.79Å; W103-L150 HydrophobicContact CD2-CG 4.44Å; W103-L150 HydrophobicContact CE3-CD1 3.93Å; W103-L150 HydrophobicContact CG-CB 4.22Å; W103-L150 HydrophobicContact CG-CD1 4.03Å; W103-L150 HydrophobicContact CH2-CD2 4.27Å; W103-L150 HydrophobicContact CZ2-CB 4.17Å; W103-L150 HydrophobicContact CZ2-CD2 4.16Å; W103-L150 HydrophobicContact CZ3-CD1 4.39Å; Y146-L150 WeakPolarHBondContact O-CB 3.49Å; Y146-L150 PolarHBondContact O-N 2.99Å; Y146-L150 VanDerWaalsContact O-N 3.07Å; A147-L150 PolarHBondContact O-N 3.46Å; I148-L150 VanDerWaalsContact C-N 3.31Å; I148-L150 PolarHBondContact O-N 3.05Å; L150-V152 VanDerWaalsContact C-N 3.32Å; L150-V152 PolarHBondContact O-N 3.03Å; L150-V153 PolarHBondContact O-N 3.23Å; L150-A154 WeakPolarHBondContact O-CB 3.31Å; L150-A154 PolarHBondContact O-N 3.38Å; L150-F157 HydrophobicContact CD1-CE2 4.07Å
151L94.8Very high93.6Very high130 Ų13052.5 Ų52.568%0.68127%0.272SS*.Hα-helixtrans-60-43.3-179.8-178.263000111.7A147 I148 V153 A154A147-L151 PolarHBondContact O-N 3.11Å; I148-L151 PolarHBondContact O-N 3.05Å; L151-V153 VanDerWaalsContact C-N 3.35Å; L151-V153 PolarHBondContact O-N 3.34Å; L151-A154 WeakPolarHBondContact O-CB 3.47Å; L151-A154 PolarHBondContact O-N 3.38Å
152V92.7Very high93.4Very high31 Ų3151.2 Ų51.219%0.18827%0.268CS..Hα-helixtrans-62.4-40.5179.3168.70000111.3I148 S149 L150 I202 I205 T206I148-V152 HydrophobicContact CG2-CG2 4.2Å; I148-V152 WeakPolarHBondContact O-CB 3.48Å; I148-V152 VanDerWaalsContact O-CG2 3.24Å; I148-V152 WeakPolarHBondContact O-CG2 3.47Å; I148-V152 PolarHBondContact O-N 3.16Å; S149-V152 PolarHBondContact O-N 3.41Å; L150-V152 VanDerWaalsContact C-N 3.32Å; L150-V152 PolarHBondContact O-N 3.03Å; V152-I202 HydrophobicContact CG1-CD1 3.76Å; V152-I202 HydrophobicContact CG1-CG2 4.28Å; V152-I202 WeakPolarHBondContact O-CD1 3.29Å; V152-I205 HydrophobicContact CG1-CG2 3.95Å; V152-I205 HydrophobicContact CG2-CG2 4.42Å; V152-T206 HydrophobicContact CG1-CG2 3.63Å
153V92Very high93.1Very high3 Ų351.9 Ų51.92%0.01827%0.273CS..Hα-helixtrans-95.21.4-177.2-53.80000114.1N102 W103 V106 S149 L150 L151 Y155 N156 T206N102-V153 HydrophobicContact CB-CB 4.39Å; N102-V153 HydrophobicContact CB-CG1 4.41Å; W103-V153 HydrophobicContact CB-CG2 3.75Å; V106-V153 HydrophobicContact CB-CG1 4.35Å; V106-V153 HydrophobicContact CG2-CG1 3.83Å; S149-V153 VanDerWaalsContact O-CG2 3.32Å; S149-V153 WeakPolarHBondContact O-CG2 3.4Å; S149-V153 PolarHBondContact O-N 3.39Å; L150-V153 PolarHBondContact O-N 3.23Å; L151-V153 VanDerWaalsContact C-N 3.35Å; L151-V153 PolarHBondContact O-N 3.34Å; V153-Y155 PolarHBondContact O-N 2.86Å; V153-Y155 VanDerWaalsContact O-N 3.08Å; V153-N156 WeakPolarHBondContact O-CB 3.18Å; V153-N156 PolarHBondContact O-N 3.49Å; V153-N156 PolarHBondContact O-ND2 2.9Å; V153-T206 HydrophobicContact CG1-CG2 4.38Å
154A93.1Very high92.7Very high19 Ų1955.3 Ų55.316%0.15728%0.279CS..THydrogen-bonded Turntrans-57.3-27.3-17500000113.3L150 L151 N156 F157 F158L150-A154 WeakPolarHBondContact O-CB 3.31Å; L150-A154 PolarHBondContact O-N 3.38Å; L151-A154 WeakPolarHBondContact O-CB 3.47Å; L151-A154 PolarHBondContact O-N 3.38Å; A154-N156 PolarHBondContact O-N 3.18Å; A154-N156 VanDerWaalsContact O-N 3.08Å; A154-F157 WeakPolarHBondContact O-CB 3.42Å; A154-F157 WeakPolarHBondContact O-CD2 3.46Å; A154-F157 PolarHBondContact O-N 2.94Å; A154-F158 WeakPolarHBondContact O-CD2 3.43Å
155Y91.2Very high92.2Very high22 Ų2254.3 Ų54.39%0.08627%0.274CS..THydrogen-bonded Turntrans-54.5-27.717481.8-82000113.4V153 F157 F158 W159 Y194 L199 I202V153-Y155 PolarHBondContact O-N 2.86Å; V153-Y155 VanDerWaalsContact O-N 3.08Å; Y155-F157 PolarHBondContact O-N 3.41Å; Y155-F158 PolarHBondContact O-N 2.96Å; Y155-F158 VanDerWaalsContact O-N 3.07Å; Y155-W159 PolarHBondContact O-N 3.44Å; Y155-Y194 PolarHBondContact N-OH 2.95Å; Y155-L199 HydrophobicContact CE2-CD2 3.75Å; Y155-L199 HydrophobicContact CE2-CG 4.25Å; Y155-I202 HydrophobicContact CD1-CG1 3.98Å; Y155-I202 HydrophobicContact CE1-CB 4.07Å; Y155-I202 HydrophobicContact CE1-CG1 3.89Å; Y155-I202 HydrophobicContact CE1-CG2 3.76Å
156N89.8Confident91.7Very high3 Ų357.7 Ų57.72%0.01630%0.295CS..Hα-helixtrans-59.9-34.7176.2-76.7-82.4000111.2M95 A99 N102 V153 A154 F158 W159M95-N156 HydrophobicContact CE-CB 3.79Å; M95-N156 WeakPolarHBondContact CE-O 3.5Å; M95-N156 WeakPolarHBondContact CG-O 3.4Å; A99-N156 HydrophobicContact CB-CB 3.59Å; N102-N156 PolarHBondContact ND2-OD1 2.92Å; V153-N156 WeakPolarHBondContact O-CB 3.18Å; V153-N156 PolarHBondContact O-N 3.49Å; V153-N156 PolarHBondContact O-ND2 2.9Å; A154-N156 PolarHBondContact O-N 3.18Å; A154-N156 VanDerWaalsContact O-N 3.08Å; N156-F158 PolarHBondContact O-N 2.97Å; N156-F158 VanDerWaalsContact O-N 3.07Å; N156-W159 PolarHBondContact O-N 3Å
157F91.7Very high90.9Very high69 Ų6958 Ų5830%0.30330%0.299SS..Hα-helixtrans-62-22.4178.4-68.4-75.6000113.5T96 A99 L100 L150 A154 Y155T96-F157 HydrophobicContact CG2-CE1 4.13Å; A99-F157 HydrophobicContact CB-CD1 3.71Å; A99-F157 HydrophobicContact CB-CD2 3.9Å; A99-F157 HydrophobicContact CB-CE1 3.53Å; A99-F157 HydrophobicContact CB-CE2 3.72Å; A99-F157 HydrophobicContact CB-CG 3.89Å; A99-F157 HydrophobicContact CB-CZ 3.53Å; L100-F157 HydrophobicContact CD2-CZ 4.44Å; L150-F157 HydrophobicContact CD1-CE2 4.07Å; A154-F157 WeakPolarHBondContact O-CB 3.42Å; A154-F157 WeakPolarHBondContact O-CD2 3.46Å; A154-F157 PolarHBondContact O-N 2.94Å; Y155-F157 PolarHBondContact O-N 3.41Å
158F89.9Confident90.1Very high95 Ų9560 Ų6042%0.41731%0.306SS..Hα-helixtrans-112.5-3.3-171.6-53-72000114.1A154 Y155 N156 M191 Y194 V195A154-F158 WeakPolarHBondContact O-CD2 3.43Å; Y155-F158 PolarHBondContact O-N 2.96Å; Y155-F158 VanDerWaalsContact O-N 3.07Å; N156-F158 PolarHBondContact O-N 2.97Å; N156-F158 VanDerWaalsContact O-N 3.07Å; F158-M191 HydrophobicContact CB-SD 4.46Å; F158-M191 HydrophobicContact CD1-CE 3.61Å; F158-M191 HydrophobicContact CD1-SD 4.4Å; F158-M191 HydrophobicContact CE1-CE 3.89Å; F158-M191 HydrophobicContact CG-CE 4.13Å; F158-M191 HydrophobicContact CG-SD 4.34Å; F158-Y194 HydrophobicContact CD2-CE1 4.33Å; F158-V195 HydrophobicContact CB-CG2 4.32Å
159W87.8Confident89.2Confident79 Ų7956.3 Ų56.330%0.29929%0.288SS..Hα-helixtrans-69.9-46.1-175.2-174.59.7000112.3M95 Y155 N156 V183 V195 L199M95-W159 HydrophobicContact CE-CB 3.96Å; M95-W159 HydrophobicContact CE-CE3 4.03Å; Y155-W159 PolarHBondContact O-N 3.44Å; N156-W159 PolarHBondContact O-N 3Å; W159-V183 PolarHBondContact O-N 3.27Å; W159-V195 HydrophobicContact CB-CG1 4.04Å; W159-V195 HydrophobicContact CG-CG1 3.84Å; W159-L199 HydrophobicContact CD2-CD1 4.43Å; W159-L199 HydrophobicContact CD2-CD2 4.22Å; W159-L199 HydrophobicContact CE3-CD2 4.1Å; W159-L199 HydrophobicContact CH2-CD2 3.79Å; W159-L199 HydrophobicContact CZ2-CD1 4.01Å; W159-L199 HydrophobicContact CZ2-CD2 3.9Å; W159-L199 HydrophobicContact CZ3-CD2 3.89Å
160F90.3Very high88.2Confident63 Ų6363 Ų6328%0.27632%0.323SS..EExtended strand (participates in β ladder)trans-125.9140.1177.4-68.1-90.2000110.7M95 L180 K181 A182M95-F160 HydrophobicContact SD-CB 3.94Å; M95-F160 HydrophobicContact SD-CD2 3.91Å; M95-F160 HydrophobicContact SD-CG 4.42Å; F160-L180 HydrophobicContact CB-CB 4.34Å; F160-L180 HydrophobicContact CB-CD2 3.74Å; F160-L180 HydrophobicContact CD1-CB 4.26Å; F160-K181 WeakPolarHBondContact CA-O 3.28Å; F160-A182 HydrophobicContact CD1-CB 3.95Å; F160-A182 HydrophobicContact CE1-CB 3.64Å; F160-A182 HydrophobicContact CZ-CB 4.31Å
161Y88.6Confident87.4Confident85 Ų8563.2 Ų63.233%0.33333%0.329SS..EExtended strand (participates in β ladder)trans-122.5146.8174.265.2-86000110.8K181Y161-K181 VanDerWaalsContact CD1-O 3.31Å; Y161-K181 WeakPolarHBondContact CD1-O 3.34Å; Y161-K181 HydrophobicContact CE1-CB 4.24Å; Y161-K181 HydrophobicContact CE1-CG 4.23Å; Y161-K181 HydrophobicContact CE2-CB 4.3Å; Y161-K181 PolarHBondContact N-O 3.27Å; Y161-K181 PolarHBondContact O-N 2.93Å; Y161-K181 WeakPolarHBondContact OH-CD 3.13Å
162P90.6Very high86.7Confident49 Ų4964.1 Ų64.132%0.31833%0.334SS..EExtended strand (participates in β ladder)trans-73.6134.6177.930.5-34.2000110.6V91 W178 T179V91-P162 HydrophobicContact CG1-CB 4.13Å; P162-W178 HydrophobicContact CB-CE3 4.1Å; P162-W178 HydrophobicContact CB-CZ3 4.17Å; P162-T179 WeakPolarHBondContact CA-O 3.37Å
163T89.2Confident86.1Confident37 Ų3765.9 Ų65.923%0.22735%0.348CS..EExtended strand (participates in β ladder)trans-142.1150.5177.2-169.20000110.4I165 T179 K181T163-I165 HydrophobicContact CG2-CG2 4.41Å; T163-T179 HydrophobicContact CG2-CG2 3.81Å; T163-T179 PolarHBondContact N-O 3.33Å; T163-T179 PolarHBondContact O-N 3.42Å; T163-K181 HydrophobicContact CG2-CB 3.58Å; T163-K181 HydrophobicContact CG2-CD 4.17Å
164E87.9Confident85.7Confident110 Ų11070.9 Ų70.951%0.51438%0.379SS..EExtended strand (participates in β ladder)trans-88.9130.1173.5-64-176.115900109.4I177 W178E164-I177 WeakPolarHBondContact CA-O 3.44Å; E164-W178 HydrophobicContact CG-CD2 3.76Å; E164-W178 HydrophobicContact CG-CE3 3.91Å; E164-W178 HydrophobicContact CG-CG 4.45Å; E164-W178 HydrophobicContact CG-CH2 3.72Å; E164-W178 HydrophobicContact CG-CZ2 3.57Å; E164-W178 HydrophobicContact CG-CZ3 3.89Å; E164-W178 WeakPolarHBondContact OE1-CZ2 3.36Å; E164-W178 PolarHBondContact OE1-NE1 3.46Å
165I86.1Confident85.1Confident68 Ų6870.9 Ų70.935%0.34938%0.376SS..EExtended strand (participates in β ladder)trans-120142.5170.958.9167.1000109.3T163 I167 T176 I177 T179T163-I165 HydrophobicContact CG2-CG2 4.41Å; I165-I167 HydrophobicContact CD1-CG2 4.13Å; I165-T176 WeakPolarHBondContact O-CA 3.28Å; I165-I177 HydrophobicContact CD1-CD1 4.21Å; I165-I177 HydrophobicContact CD1-CG1 4.18Å; I165-I177 HydrophobicContact CG1-CD1 4.28Å; I165-I177 HydrophobicContact CG1-CG1 3.7Å; I165-I177 PolarHBondContact N-O 2.82Å; I165-I177 PolarHBondContact O-N 3.17Å; I165-T179 HydrophobicContact CB-CG2 4.36Å; I165-T179 HydrophobicContact CD1-CG2 3.76Å; I165-T179 HydrophobicContact CG1-CG2 3.72Å; I165-T179 HydrophobicContact CG2-CG2 3.78Å
166T85.8Confident84.7Confident92 Ų9273.8 Ų73.856%0.56440%0.396SS*.EExtended strand (participates in β ladder)trans-94.9117.4173.3-47.50000108.4T174 L175 T176T166-T174 HydrophobicContact CG2-CG2 4.14Å; T166-L175 WeakPolarHBondContact CA-O 3.43Å; T166-T176 HydrophobicContact CG2-CG2 4.34Å
167I81.7Confident84.3Confident49 Ų4974 Ų7425%0.25140%0.398SS..EExtended strand (participates in β ladder)trans-105136.9173.253.4168000109.4I165 L175 I177I165-I167 HydrophobicContact CD1-CG2 4.13Å; I167-L175 HydrophobicContact CG1-CB 4.23Å; I167-L175 WeakPolarHBondContact CG1-O 3.43Å; I167-L175 PolarHBondContact N-O 2.71Å; I167-L175 PolarHBondContact O-N 3.02Å; I167-I177 HydrophobicContact CD1-CD1 3.78Å; I167-I177 HydrophobicContact CD1-CG1 4.25Å; I167-I177 HydrophobicContact CD1-CG2 4.21Å; I167-I177 HydrophobicContact CG1-CD1 4.32Å; I167-I177 HydrophobicContact CG1-CG1 4.32Å; I167-I177 HydrophobicContact CG1-CG2 4.47Å; I167-I177 HydrophobicContact CG2-CD1 4.45Å
168T81.5Confident84Confident99 Ų9974 Ų7461%0.60740%0.395SS*.EExtended strand (participates in β ladder)trans-81.3117.5167.9-49.70000107.5
169T77.9Confident83.8Confident20 Ų2070.6 Ų70.612%0.12338%0.383CS..  trans-69.1161.6175.160.10000110.6C171 N172 S173 L175T169-C171 PolarHBondContact O-N 3.17Å; T169-C171 PolarHBondContact OG1-N 3.35Å; T169-N172 PolarHBondContact O-N 2.66Å; T169-S173 WeakPolarHBondContact CB-O 3.39Å; T169-S173 WeakPolarHBondContact CG2-O 3.15Å; T169-S173 PolarHBondContact N-O 3.2Å; T169-S173 WeakPolarHBondContact OG1-CB 3.49Å; T169-S173 PolarHBondContact OG1-N 3.36Å; T169-S173 VanDerWaalsContact OG1-N 3.12Å; T169-S173 PolarHBondContact OG1-O 3.4Å; T169-L175 HydrophobicContact CG2-CB 4Å
170N74.6Confident83.8Confident142 Ų14268.7 Ų68.776%0.75938%0.378SS*.THydrogen-bonded Turntrans-54.2-21.2170.4-65.7-22.8000112.7N172N170-N172 VanDerWaalsContact C-N 3.27Å; N170-N172 PolarHBondContact O-N 3.09Å
171C78.2Confident83.8Confident63 Ų6370.6 Ų70.643%0.42639%0.386SS..THydrogen-bonded Turntrans-89.818.1-178.6-45.80000111.5C3 T169 S173C3-C171 HydrophobicContact CB-CB 4.35Å; C3-C171 WeakPolarHBondContact CB-SG 3.42Å; C3-C171 WeakPolarHBondContact SG-CB 3.46Å; C3-C171 CovalentContact SG-SG 2.1Å; C3-C171 PolarHBondContact SG-SG 2.88Å; T169-C171 PolarHBondContact O-N 3.17Å; T169-C171 PolarHBondContact OG1-N 3.35Å; C171-S173 PolarHBondContact O-N 3.2Å; C171-S173 PolarHBondContact O-OG 3.04Å
172N79.4Confident83.8Confident148 Ų14868.6 Ų68.679%0.79139%0.387SS*.SBendtrans51.716.8-174.2-80.8-18.1000115.1T169 N170T169-N172 PolarHBondContact O-N 2.66Å; N170-N172 VanDerWaalsContact C-N 3.27Å; N170-N172 PolarHBondContact O-N 3.09Å
173S81.1Confident83.8Confident69 Ų6966.8 Ų66.848%0.48338%0.375SS..  trans-95.6138.8178.3-58.90000109.7T169 C171T169-S173 WeakPolarHBondContact CB-O 3.39Å; T169-S173 WeakPolarHBondContact CG2-O 3.15Å; T169-S173 PolarHBondContact N-O 3.2Å; T169-S173 WeakPolarHBondContact OG1-CB 3.49Å; T169-S173 PolarHBondContact OG1-N 3.36Å; T169-S173 VanDerWaalsContact OG1-N 3.12Å; T169-S173 PolarHBondContact OG1-O 3.4Å; C171-S173 PolarHBondContact O-N 3.2Å; C171-S173 PolarHBondContact O-OG 3.04Å
174T82.6Confident83.8Confident107 Ų10768.5 Ų68.566%0.65638%0.383SS*.EExtended strand (participates in β ladder)trans-83.7123.4174.948.20000109.9T166T166-T174 HydrophobicContact CG2-CG2 4.14Å
175L82.3Confident83.9Confident19 Ų1970 Ų7010%0.09938%0.384CS..EExtended strand (participates in β ladder)trans-117.3128.6176-178.368000109.4T166 I167 T169 I177T166-L175 WeakPolarHBondContact CA-O 3.43Å; I167-L175 HydrophobicContact CG1-CB 4.23Å; I167-L175 WeakPolarHBondContact CG1-O 3.43Å; I167-L175 PolarHBondContact N-O 2.71Å; I167-L175 PolarHBondContact O-N 3.02Å; T169-L175 HydrophobicContact CG2-CB 4Å; L175-I177 HydrophobicContact CD2-CG2 3.73Å; L175-I177 HydrophobicContact CG-CG2 3.85Å
176T81.6Confident84.1Confident83 Ų8372.6 Ų72.651%0.50940%0.403SS..EExtended strand (participates in β ladder)trans-89120.3171.550.90000109.8I165 T166I165-T176 WeakPolarHBondContact O-CA 3.28Å; T166-T176 HydrophobicContact CG2-CG2 4.34Å
177I82Confident84.2Confident9 Ų971.5 Ų71.55%0.04640%0.404CS..EExtended strand (participates in β ladder)trans-121.5147177.364.2166.8000111.1Y8 E164 I165 I167 L175Y8-I177 HydrophobicContact CE1-CG2 4.26Å; E164-I177 WeakPolarHBondContact CA-O 3.44Å; I165-I177 HydrophobicContact CD1-CD1 4.21Å; I165-I177 HydrophobicContact CD1-CG1 4.18Å; I165-I177 HydrophobicContact CG1-CD1 4.28Å; I165-I177 HydrophobicContact CG1-CG1 3.7Å; I165-I177 PolarHBondContact N-O 2.82Å; I165-I177 PolarHBondContact O-N 3.17Å; I167-I177 HydrophobicContact CD1-CD1 3.78Å; I167-I177 HydrophobicContact CD1-CG1 4.25Å; I167-I177 HydrophobicContact CD1-CG2 4.21Å; I167-I177 HydrophobicContact CG1-CD1 4.32Å; I167-I177 HydrophobicContact CG1-CG1 4.32Å; I167-I177 HydrophobicContact CG1-CG2 4.47Å; I167-I177 HydrophobicContact CG2-CD1 4.45Å; L175-I177 HydrophobicContact CD2-CG2 3.73Å; L175-I177 HydrophobicContact CG-CG2 3.85Å
178W84.4Confident84.6Confident67 Ų6773.9 Ų73.925%0.25441%0.414SS..EExtended strand (participates in β ladder)trans-78.9129.8170.4-75.490.2000109.8F87 V91 P162 E164F87-W178 WeakPolarHBondContact CE1-O 3.2Å; V91-W178 HydrophobicContact CB-CB 4.16Å; V91-W178 HydrophobicContact CG1-CB 3.93Å; V91-W178 HydrophobicContact CG2-CB 4.32Å; P162-W178 HydrophobicContact CB-CE3 4.1Å; P162-W178 HydrophobicContact CB-CZ3 4.17Å; E164-W178 HydrophobicContact CG-CD2 3.76Å; E164-W178 HydrophobicContact CG-CE3 3.91Å; E164-W178 HydrophobicContact CG-CG 4.45Å; E164-W178 HydrophobicContact CG-CH2 3.72Å; E164-W178 HydrophobicContact CG-CZ2 3.57Å; E164-W178 HydrophobicContact CG-CZ3 3.89Å; E164-W178 WeakPolarHBondContact OE1-CZ2 3.36Å; E164-W178 PolarHBondContact OE1-NE1 3.46Å
179T86.4Confident85.1Confident24 Ų2473 Ų7315%0.14741%0.41CS..EExtended strand (participates in β ladder)trans-135.6166.2174.7-168.30000111P162 T163 I165P162-T179 WeakPolarHBondContact CA-O 3.37Å; T163-T179 HydrophobicContact CG2-CG2 3.81Å; T163-T179 PolarHBondContact N-O 3.33Å; T163-T179 PolarHBondContact O-N 3.42Å; I165-T179 HydrophobicContact CB-CG2 4.36Å; I165-T179 HydrophobicContact CD1-CG2 3.76Å; I165-T179 HydrophobicContact CG1-CG2 3.72Å; I165-T179 HydrophobicContact CG2-CG2 3.78Å
180L88.5Confident85.7Confident39 Ų3977.6 Ų77.620%0.20444%0.438CS..EExtended strand (participates in β ladder)trans-97.6123172.6-76.7136.9000109.5V91 K94 F160V91-L180 HydrophobicContact CG1-CD1 4.49Å; V91-L180 HydrophobicContact CG1-CG 4.17Å; K94-L180 HydrophobicContact CB-CD1 4.32Å; K94-L180 HydrophobicContact CD-CD1 3.35Å; K94-L180 HydrophobicContact CG-CD1 4.43Å; F160-L180 HydrophobicContact CB-CB 4.34Å; F160-L180 HydrophobicContact CB-CD2 3.74Å; F160-L180 HydrophobicContact CD1-CB 4.26Å
181K89.4Confident86.5Confident104 Ų10473.9 Ų73.945%0.45242%0.417SS..EExtended strand (participates in β ladder)trans-107.3132.4174.2-175.7166.6175.81790109.6F160 Y161 T163F160-K181 WeakPolarHBondContact CA-O 3.28Å; Y161-K181 VanDerWaalsContact CD1-O 3.31Å; Y161-K181 WeakPolarHBondContact CD1-O 3.34Å; Y161-K181 HydrophobicContact CE1-CB 4.24Å; Y161-K181 HydrophobicContact CE1-CG 4.23Å; Y161-K181 HydrophobicContact CE2-CB 4.3Å; Y161-K181 PolarHBondContact N-O 3.27Å; Y161-K181 PolarHBondContact O-N 2.93Å; Y161-K181 WeakPolarHBondContact OH-CD 3.13Å; T163-K181 HydrophobicContact CG2-CB 3.58Å; T163-K181 HydrophobicContact CG2-CD 4.17Å
182A89.2Confident87.2Confident42 Ų4274.2 Ų74.235%0.34741%0.41SS..EExtended strand (participates in β ladder)trans-68.5146.817400000110.1F160 N184F160-A182 HydrophobicContact CD1-CB 3.95Å; F160-A182 HydrophobicContact CE1-CB 3.64Å; F160-A182 HydrophobicContact CZ-CB 4.31Å; A182-N184 PolarHBondContact O-N 2.77Å
183V89.9Confident87.9Confident11 Ų1171.6 Ų71.67%0.06739%0.393CS..  trans-54.6131.7169.764.30000109.9W159 Q188 M191 Y192 V195W159-V183 PolarHBondContact O-N 3.27Å; V183-Q188 HydrophobicContact CG2-CB 4.18Å; V183-M191 HydrophobicContact CG2-CB 4.04Å; V183-Y192 HydrophobicContact CG1-CD2 4.42Å; V183-Y192 WeakPolarHBondContact O-CD2 3.01Å; V183-V195 HydrophobicContact CG1-CB 4.17Å; V183-V195 HydrophobicContact CG1-CG1 4.25Å; V183-V195 HydrophobicContact CG1-CG2 4.19Å
184N89.8Confident88.4Confident74 Ų7472.9 Ų72.940%0.39639%0.387SS..  trans-110.9139.3-178-167.86.1000110.6A182 T186 A187 Q188A182-N184 PolarHBondContact O-N 2.77Å; N184-T186 VanDerWaalsContact C-N 3.25Å; N184-T186 PolarHBondContact ND2-OG1 3.34Å; N184-T186 PolarHBondContact O-N 3.2Å; N184-A187 PolarHBondContact O-N 3.19Å; N184-Q188 PolarHBondContact O-N 3.33Å; N184-Q188 VanDerWaalsContact O-N 3.07Å
185R90Very high88.9Confident141 Ų14168 Ų6853%0.53236%0.357SS..THydrogen-bonded Turntrans-56.9-36.9-178.7-176.6-179.7-79.7-176.6-10.5112.7P189 Y192R185-P189 WeakPolarHBondContact O-CA 3.45Å; R185-Y192 HydrophobicContact CB-CD1 3.79Å; R185-Y192 HydrophobicContact CB-CD2 4.01Å; R185-Y192 HydrophobicContact CB-CE1 4.08Å; R185-Y192 HydrophobicContact CB-CE2 4.26Å; R185-Y192 HydrophobicContact CB-CG 3.76Å; R185-Y192 HydrophobicContact CG-CD1 4.03Å; R185-Y192 HydrophobicContact CG-CE1 4.39Å; R185-Y192 HydrophobicContact CG-CG 4.38Å; R185-Y192 VanDerWaalsContact NE-CE1 3.33Å
186T89.4Confident89.3Confident122 Ų12268 Ų6875%0.74836%0.359SS*.THydrogen-bonded Turntrans-71.8-36.9-178.154.50000113.2N184N184-T186 VanDerWaalsContact C-N 3.25Å; N184-T186 PolarHBondContact ND2-OG1 3.34Å; N184-T186 PolarHBondContact O-N 3.2Å
187A88.5Confident89.7Confident70 Ų7067.1 Ų67.158%0.57935%0.354SS*.THydrogen-bonded Turntrans-81.7-40.1-177.600000112.1N184N184-A187 PolarHBondContact O-N 3.19Å
188Q89.2Confident90.2Very high99 Ų9967.3 Ų67.346%0.46336%0.356SS..  trans-144.481.9-175.5-65.9-175-21.500110.7V183 N184 T190 M191 Y192V183-Q188 HydrophobicContact CG2-CB 4.18Å; N184-Q188 PolarHBondContact O-N 3.33Å; N184-Q188 VanDerWaalsContact O-N 3.07Å; Q188-T190 PolarHBondContact O-N 2.92Å; Q188-M191 HydrophobicContact CB-CB 4.11Å; Q188-Y192 VanDerWaalsContact O-CB 3.31Å; Q188-Y192 WeakPolarHBondContact O-CB 3.5Å; Q188-Y192 PolarHBondContact O-N 2.96Å
189P91.8Very high90.3Very high80 Ų8067 Ų6752%0.51936%0.359SS..Hα-helixtrans-64.9-39.9-171.723.2-33.3000113.5R185 Y192 E193R185-P189 WeakPolarHBondContact O-CA 3.45Å; P189-Y192 PolarHBondContact O-N 2.99Å; P189-E193 PolarHBondContact O-N 3.1Å
190T92.4Very high90.4Very high116 Ų11672.8 Ų72.871%0.71238%0.382SS*.Hα-helixtrans-67-46-17951.80000112.2Q188 E193 Y194Q188-T190 PolarHBondContact O-N 2.92Å; T190-E193 PolarHBondContact O-N 3.32Å; T190-Y194 PolarHBondContact O-N 3.05Å
191M91.1Very high90.4Very high65 Ų6574.3 Ų74.332%0.3239%0.392SS..Hα-helixtrans-64.4-42175.8-72.4-65.6-146.100111.5F158 V183 Q188 E193 Y194 V195F158-M191 HydrophobicContact CB-SD 4.46Å; F158-M191 HydrophobicContact CD1-CE 3.61Å; F158-M191 HydrophobicContact CD1-SD 4.4Å; F158-M191 HydrophobicContact CE1-CE 3.89Å; F158-M191 HydrophobicContact CG-CE 4.13Å; F158-M191 HydrophobicContact CG-SD 4.34Å; V183-M191 HydrophobicContact CG2-CB 4.04Å; Q188-M191 HydrophobicContact CB-CB 4.11Å; M191-E193 VanDerWaalsContact C-N 3.34Å; M191-E193 PolarHBondContact O-N 3.24Å; M191-Y194 PolarHBondContact O-N 3.44Å; M191-V195 WeakPolarHBondContact O-CG2 3.4Å; M191-V195 PolarHBondContact O-N 2.79Å
192Y92.9Very high90.3Very high70 Ų7070.1 Ų70.128%0.27538%0.375SS..Hα-helixtrans-58.6-46.2175.7178.7-87.1000111.5V183 R185 Q188 P189 V195 S196V183-Y192 HydrophobicContact CG1-CD2 4.42Å; V183-Y192 WeakPolarHBondContact O-CD2 3.01Å; R185-Y192 HydrophobicContact CB-CD1 3.79Å; R185-Y192 HydrophobicContact CB-CD2 4.01Å; R185-Y192 HydrophobicContact CB-CE1 4.08Å; R185-Y192 HydrophobicContact CB-CE2 4.26Å; R185-Y192 HydrophobicContact CB-CG 3.76Å; R185-Y192 HydrophobicContact CG-CD1 4.03Å; R185-Y192 HydrophobicContact CG-CE1 4.39Å; R185-Y192 HydrophobicContact CG-CG 4.38Å; R185-Y192 VanDerWaalsContact NE-CE1 3.33Å; Q188-Y192 VanDerWaalsContact O-CB 3.31Å; Q188-Y192 WeakPolarHBondContact O-CB 3.5Å; Q188-Y192 PolarHBondContact O-N 2.96Å; P189-Y192 PolarHBondContact O-N 2.99Å; Y192-V195 PolarHBondContact O-N 3.41Å; Y192-S196 WeakPolarHBondContact O-CB 3.13Å; Y192-S196 PolarHBondContact O-N 2.81Å
193E93.1Very high90.1Very high93 Ų9370.6 Ų70.644%0.43537%0.374SS..Hα-helixtrans-67.1-39.3-178.7-166.858.2-154.600112.2P189 T190 M191 T197P189-E193 PolarHBondContact O-N 3.1Å; T190-E193 PolarHBondContact O-N 3.32Å; M191-E193 VanDerWaalsContact C-N 3.34Å; M191-E193 PolarHBondContact O-N 3.24Å; E193-T197 VanDerWaalsContact O-CB 3.24Å; E193-T197 WeakPolarHBondContact O-CB 3.14Å; E193-T197 PolarHBondContact O-N 3.44Å; E193-T197 PolarHBondContact O-OG1 2.9Å
194Y92.8Very high89.9Confident96 Ų9675.1 Ų75.138%0.37640%0.395SS..Hα-helixtrans-59.6-48.9173172.8-116.8000111.9Y155 F158 T190 M191 S198Y155-Y194 PolarHBondContact N-OH 2.95Å; F158-Y194 HydrophobicContact CD2-CE1 4.33Å; T190-Y194 PolarHBondContact O-N 3.05Å; M191-Y194 PolarHBondContact O-N 3.44Å; Y194-S198 WeakPolarHBondContact O-CB 3.24Å; Y194-S198 PolarHBondContact O-N 3.5Å; Y194-S198 PolarHBondContact O-OG 2.92Å
195V91.4Very high89.8Confident3 Ų374.4 Ų74.42%0.01839%0.39CS..Hα-helixtrans-66.8-46.2179.2171.40000111.2F158 W159 V183 M191 Y192 T197 S198 L199F158-V195 HydrophobicContact CB-CG2 4.32Å; W159-V195 HydrophobicContact CB-CG1 4.04Å; W159-V195 HydrophobicContact CG-CG1 3.84Å; V183-V195 HydrophobicContact CG1-CB 4.17Å; V183-V195 HydrophobicContact CG1-CG1 4.25Å; V183-V195 HydrophobicContact CG1-CG2 4.19Å; M191-V195 WeakPolarHBondContact O-CG2 3.4Å; M191-V195 PolarHBondContact O-N 2.79Å; Y192-V195 PolarHBondContact O-N 3.41Å; V195-T197 PolarHBondContact O-N 2.79Å; V195-S198 PolarHBondContact O-N 3.3Å; V195-L199 HydrophobicContact CG1-CD1 3.87Å; V195-L199 HydrophobicContact CG1-CG 4.28Å; V195-L199 WeakPolarHBondContact O-CB 3.41Å; V195-L199 VanDerWaalsContact O-CG 3.28Å; V195-L199 WeakPolarHBondContact O-CG 3.23Å; V195-L199 PolarHBondContact O-N 3.31Å
196S90.8Very high89.5Confident21 Ų2168.3 Ų68.315%0.14737%0.369CS..Hα-helixtrans-59-45.3178.7172.30000112Y192Y192-S196 WeakPolarHBondContact O-CB 3.13Å; Y192-S196 PolarHBondContact O-N 2.81Å
197T91.4Very high89Confident64 Ų6465.3 Ų65.339%0.39335%0.348SS..Hα-helixtrans-66.8-43.5176-60.60000111.2E193 V195 L199 K200 V201E193-T197 VanDerWaalsContact O-CB 3.24Å; E193-T197 WeakPolarHBondContact O-CB 3.14Å; E193-T197 PolarHBondContact O-N 3.44Å; E193-T197 PolarHBondContact O-OG1 2.9Å; V195-T197 PolarHBondContact O-N 2.79Å; T197-L199 PolarHBondContact O-N 2.82Å; T197-K200 PolarHBondContact O-N 3.12Å; T197-V201 HydrophobicContact CG2-CG2 4.35Å; T197-V201 WeakPolarHBondContact O-CG2 3.38Å; T197-V201 PolarHBondContact O-N 2.87Å; T197-V201 VanDerWaalsContact O-N 3.07Å
198S91.4Very high88.7Confident12 Ų1265.1 Ų65.18%0.08434%0.339CS..Hα-helixtrans-61.5-43.1178.2-62.50000111.9Y194 V195 K200 V201 I202Y194-S198 WeakPolarHBondContact O-CB 3.24Å; Y194-S198 PolarHBondContact O-N 3.5Å; Y194-S198 PolarHBondContact O-OG 2.92Å; V195-S198 PolarHBondContact O-N 3.3Å; S198-K200 PolarHBondContact O-N 3.34Å; S198-K200 VanDerWaalsContact O-N 3.14Å; S198-V201 PolarHBondContact O-N 2.73Å; S198-I202 WeakPolarHBondContact O-CB 3.15Å; S198-I202 WeakPolarHBondContact O-CG1 3.27Å; S198-I202 PolarHBondContact O-N 3.03Å
199L87.6Confident88.5Confident61 Ų6164.2 Ų64.232%0.31934%0.337SS..Hα-helixtrans-59.7-27.5178.3-74.6169.2000113.2Y155 W159 V195 T197 P203Y155-L199 HydrophobicContact CE2-CD2 3.75Å; Y155-L199 HydrophobicContact CE2-CG 4.25Å; W159-L199 HydrophobicContact CD2-CD1 4.43Å; W159-L199 HydrophobicContact CD2-CD2 4.22Å; W159-L199 HydrophobicContact CE3-CD2 4.1Å; W159-L199 HydrophobicContact CH2-CD2 3.79Å; W159-L199 HydrophobicContact CZ2-CD1 4.01Å; W159-L199 HydrophobicContact CZ2-CD2 3.9Å; W159-L199 HydrophobicContact CZ3-CD2 3.89Å; V195-L199 HydrophobicContact CG1-CD1 3.87Å; V195-L199 HydrophobicContact CG1-CG 4.28Å; V195-L199 WeakPolarHBondContact O-CB 3.41Å; V195-L199 VanDerWaalsContact O-CG 3.28Å; V195-L199 WeakPolarHBondContact O-CG 3.23Å; V195-L199 PolarHBondContact O-N 3.31Å; T197-L199 PolarHBondContact O-N 2.82Å; L199-P203 WeakPolarHBondContact O-CD 3.26Å; L199-P203 WeakPolarHBondContact O-CG 3.41Å
200K87.5Confident88.2Confident145 Ų14560.4 Ų60.463%0.6331%0.312SS*.Hα-helixtrans-82.6-44.4175.9-64.2172.4-174.5174.60112.3T197 S198 H204T197-K200 PolarHBondContact O-N 3.12Å; S198-K200 PolarHBondContact O-N 3.34Å; S198-K200 VanDerWaalsContact O-N 3.14Å; K200-H204 PolarHBondContact O-CD2 3.45Å
201V88.9Confident87.6Confident71 Ų7156.1 Ų56.143%0.4329%0.285SS..Hα-helixtrans-88.6-39.7-170.2179.10000112.6T197 S198 H204 I205T197-V201 HydrophobicContact CG2-CG2 4.35Å; T197-V201 WeakPolarHBondContact O-CG2 3.38Å; T197-V201 PolarHBondContact O-N 2.87Å; T197-V201 VanDerWaalsContact O-N 3.07Å; S198-V201 PolarHBondContact O-N 2.73Å; V201-H204 WeakPolarHBondContact O-CB 3.29Å; V201-H204 PolarHBondContact O-N 3.37Å; V201-H204 VanDerWaalsContact O-N 3.08Å; V201-I205 HydrophobicContact CG1-CD1 3.71Å; V201-I205 HydrophobicContact CG1-CG1 4.18Å; V201-I205 PolarHBondContact O-N 3.37Å
202I87.9Confident87.1Confident16 Ų1659.4 Ų59.48%0.08230%0.298CS..Hα-helixtrans-60-42.6-171.9-64.2-60.9000113.2V152 Y155 S198 H204 I205 T206V152-I202 HydrophobicContact CG1-CD1 3.76Å; V152-I202 HydrophobicContact CG1-CG2 4.28Å; V152-I202 WeakPolarHBondContact O-CD1 3.29Å; Y155-I202 HydrophobicContact CD1-CG1 3.98Å; Y155-I202 HydrophobicContact CE1-CB 4.07Å; Y155-I202 HydrophobicContact CE1-CG1 3.89Å; Y155-I202 HydrophobicContact CE1-CG2 3.76Å; S198-I202 WeakPolarHBondContact O-CB 3.15Å; S198-I202 WeakPolarHBondContact O-CG1 3.27Å; S198-I202 PolarHBondContact O-N 3.03Å; I202-H204 PolarHBondContact O-N 3.08Å; I202-H204 VanDerWaalsContact O-N 3.12Å; I202-I205 PolarHBondContact O-N 3.27Å; I202-T206 HydrophobicContact CG2-CG2 3.55Å; I202-T206 PolarHBondContact O-N 3.48Å; I202-T206 PolarHBondContact O-OG1 3.12Å
203P84.2Confident86.8Confident52 Ų5260.3 Ų60.334%0.33831%0.305SS..Hα-helixtrans-54.4-34.1176.6-26.935.9000113L199 L207 T208L199-P203 WeakPolarHBondContact O-CD 3.26Å; L199-P203 WeakPolarHBondContact O-CG 3.41Å; P203-L207 WeakPolarHBondContact O-CA 3.3Å; P203-L207 VanDerWaalsContact O-CB 3.24Å; P203-L207 WeakPolarHBondContact O-CB 3.47Å; P203-L207 PolarHBondContact O-N 3.05Å; P203-T208 PolarHBondContact O-N 3.14Å
204H85.2Confident86.3Confident107 Ų10756.7 Ų56.750%0.49529%0.289SS..Iπ-helixtrans-70.6-40.7175.5-60.7-55.1000112.5K200 V201 I202 T208 I209K200-H204 PolarHBondContact O-CD2 3.45Å; V201-H204 WeakPolarHBondContact O-CB 3.29Å; V201-H204 PolarHBondContact O-N 3.37Å; V201-H204 VanDerWaalsContact O-N 3.08Å; I202-H204 PolarHBondContact O-N 3.08Å; I202-H204 VanDerWaalsContact O-N 3.12Å; H204-T208 PolarHBondContact ND1-OG1 3.33Å; H204-T208 PolarHBondContact O-N 3.12Å; H204-I209 WeakPolarHBondContact O-CG1 3.26Å; H204-I209 PolarHBondContact O-N 3.44Å
205I87.7Confident85.5Confident58 Ų5853.8 Ų53.830%0.29728%0.281SS..Iπ-helixtrans-71.3-38179.3-63.6179.2000112.1V152 V201 I202 P210V152-I205 HydrophobicContact CG1-CG2 3.95Å; V152-I205 HydrophobicContact CG2-CG2 4.42Å; V201-I205 HydrophobicContact CG1-CD1 3.71Å; V201-I205 HydrophobicContact CG1-CG1 4.18Å; V201-I205 PolarHBondContact O-N 3.37Å; I202-I205 PolarHBondContact O-N 3.27Å; I205-P210 WeakPolarHBondContact O-CD 3.21Å; I205-P210 WeakPolarHBondContact O-CG 3.48Å
206T85.3Confident85.2Confident13 Ų1357 Ų578%0.0830%0.301CS..Iπ-helixtrans-91.2-24.7-17456.90000113.1V106 V152 V153 I202V106-T206 HydrophobicContact CG1-CG2 4.07Å; V106-T206 HydrophobicContact CG2-CG2 3.61Å; V152-T206 HydrophobicContact CG1-CG2 3.63Å; V153-T206 HydrophobicContact CG1-CG2 4.38Å; I202-T206 HydrophobicContact CG2-CG2 3.55Å; I202-T206 PolarHBondContact O-N 3.48Å; I202-T206 PolarHBondContact O-OG1 3.12Å
207L79Confident84.9Confident59 Ų5957.5 Ų57.531%0.30930%0.302SS..Iπ-helixtrans-120.7-67.8-178.1-56.9172.2000111.2I109 P203 I209 P210 L211I109-L207 HydrophobicContact CD1-CD2 4.32Å; P203-L207 WeakPolarHBondContact O-CA 3.3Å; P203-L207 VanDerWaalsContact O-CB 3.24Å; P203-L207 WeakPolarHBondContact O-CB 3.47Å; P203-L207 PolarHBondContact O-N 3.05Å; L207-I209 PolarHBondContact O-N 3.44Å; L207-P210 WeakPolarHBondContact O-CD 3.43Å; L207-L211 HydrophobicContact CB-CD1 3.91Å; L207-L211 WeakPolarHBondContact O-CB 3.21Å; L207-L211 WeakPolarHBondContact O-CD1 3.49Å; L207-L211 WeakPolarHBondContact O-CG 3.39Å; L207-L211 PolarHBondContact O-N 2.83Å
208T80.5Confident84.3Confident66 Ų6654.8 Ų54.841%0.40529%0.285SS..Iπ-helixtrans-55.7-50.2-169.2-48.80000113.4P203 H204 F212P203-T208 PolarHBondContact O-N 3.14Å; H204-T208 PolarHBondContact ND1-OG1 3.33Å; H204-T208 PolarHBondContact O-N 3.12Å; T208-F212 WeakPolarHBondContact O-CB 3.31Å; T208-F212 PolarHBondContact O-N 2.67Å
209I86.3Confident83.8Confident80 Ų8057.5 Ų57.541%0.4130%0.304SS..Hα-helixtrans-68.4-53.5-177.8-67.2168.6000111.9H204 L207 L211 F212 M213H204-I209 WeakPolarHBondContact O-CG1 3.26Å; H204-I209 PolarHBondContact O-N 3.44Å; L207-I209 PolarHBondContact O-N 3.44Å; I209-L211 PolarHBondContact O-N 3.45Å; I209-F212 PolarHBondContact O-N 3.4Å; I209-M213 HydrophobicContact CG2-CG 4.49Å; I209-M213 WeakPolarHBondContact O-CG 3.36Å; I209-M213 PolarHBondContact O-N 2.87Å
210P85.9Confident83.6Confident0 Ų055.8 Ų55.80%030%0.298CS..Hα-helixtrans-56.1-37.1177.4-29.136.4000112.6I109 W110 I113 I205 L207 M213 L214I109-P210 HydrophobicContact CG2-CB 3.6Å; I109-P210 HydrophobicContact CG2-CG 4.47Å; W110-P210 HydrophobicContact CH2-CG 4.4Å; W110-P210 HydrophobicContact CZ2-CG 3.71Å; I113-P210 HydrophobicContact CD1-CB 3.69Å; I113-P210 WeakPolarHBondContact CD1-O 3.4Å; I205-P210 WeakPolarHBondContact O-CD 3.21Å; I205-P210 WeakPolarHBondContact O-CG 3.48Å; L207-P210 WeakPolarHBondContact O-CD 3.43Å; P210-M213 PolarHBondContact O-N 3.28Å; P210-L214 VanDerWaalsContact O-CB 3.23Å; P210-L214 WeakPolarHBondContact O-CB 3.31Å; P210-L214 PolarHBondContact O-N 3.19Å
211L78Confident83.2Confident27 Ų2749.3 Ų49.314%0.14127%0.271CS..Hα-helixtrans-70.5-44.2-179.2-68.4165.8000112.1L207 I209 M213 L214 T215 F259L207-L211 HydrophobicContact CB-CD1 3.91Å; L207-L211 WeakPolarHBondContact O-CB 3.21Å; L207-L211 WeakPolarHBondContact O-CD1 3.49Å; L207-L211 WeakPolarHBondContact O-CG 3.39Å; L207-L211 PolarHBondContact O-N 2.83Å; I209-L211 PolarHBondContact O-N 3.45Å; L211-M213 VanDerWaalsContact C-N 3.31Å; L211-M213 PolarHBondContact O-N 3.25Å; L211-L214 PolarHBondContact O-N 3.38Å; L211-T215 WeakPolarHBondContact O-CG2 3.28Å; L211-T215 PolarHBondContact O-N 2.9Å; L211-T215 PolarHBondContact O-OG1 2.87Å; L211-F259 HydrophobicContact CB-CD2 3.86Å; L211-F259 HydrophobicContact CB-CE2 3.22Å; L211-F259 HydrophobicContact CB-CZ 3.72Å; L211-F259 HydrophobicContact CD1-CD2 3.6Å; L211-F259 HydrophobicContact CD1-CE2 3.3Å; L211-F259 HydrophobicContact CD1-CZ 4.49Å; L211-F259 HydrophobicContact CD2-CD2 3.37Å; L211-F259 HydrophobicContact CD2-CE2 3.71Å; L211-F259 HydrophobicContact CD2-CG 4.23Å; L211-F259 HydrophobicContact CG-CD2 3.73Å; L211-F259 HydrophobicContact CG-CE2 3.51Å; L211-F259 HydrophobicContact CG-CZ 4.47Å
212F82.2Confident82.7Confident133 Ų13348.5 Ų48.558%0.58326%0.262SS*.Hα-helixtrans-58.9-43.4171.7179-98.9000111.7T208 I209 L214 T215 V216T208-F212 WeakPolarHBondContact O-CB 3.31Å; T208-F212 PolarHBondContact O-N 2.67Å; I209-F212 PolarHBondContact O-N 3.4Å; F212-L214 VanDerWaalsContact C-N 3.34Å; F212-L214 PolarHBondContact O-N 3.45Å; F212-T215 PolarHBondContact O-N 3.24Å; F212-T215 PolarHBondContact O-OG1 3.34Å; F212-V216 HydrophobicContact CD1-CG2 4.45Å; F212-V216 HydrophobicContact CE1-CG2 4.08Å; F212-V216 HydrophobicContact CE2-CG2 4.25Å; F212-V216 HydrophobicContact CZ-CG2 3.98Å; F212-V216 VanDerWaalsContact O-CG2 3.29Å; F212-V216 WeakPolarHBondContact O-CG2 3.5Å; F212-V216 PolarHBondContact O-N 2.93Å; F212-V216 VanDerWaalsContact O-N 3.1Å
213M86.4Confident82.4Confident89 Ų8953.9 Ų53.944%0.43828%0.282SS..Hα-helixtrans-62-43.4175.7-71.6-66.317900111.6I113 I209 P210 L211 V216 L217I113-M213 HydrophobicContact CD1-CB 4.23Å; I209-M213 HydrophobicContact CG2-CG 4.49Å; I209-M213 WeakPolarHBondContact O-CG 3.36Å; I209-M213 PolarHBondContact O-N 2.87Å; P210-M213 PolarHBondContact O-N 3.28Å; L211-M213 VanDerWaalsContact C-N 3.31Å; L211-M213 PolarHBondContact O-N 3.25Å; M213-V216 PolarHBondContact O-N 2.92Å; M213-L217 VanDerWaalsContact O-CB 3.27Å; M213-L217 WeakPolarHBondContact O-CB 3.4Å; M213-L217 WeakPolarHBondContact O-CG 3.42Å; M213-L217 PolarHBondContact O-N 3.37Å
214L81.3Confident82.4Confident17 Ų1754.4 Ų54.49%0.08928%0.277CS..Hα-helixtrans-67.6-38.6-178.3-169.664.7000112I113 T116 P210 L211 F212 N218 I255I113-L214 HydrophobicContact CG1-CB 4.24Å; I113-L214 HydrophobicContact CG1-CD1 4.05Å; T116-L214 HydrophobicContact CG2-CD1 3.9Å; P210-L214 VanDerWaalsContact O-CB 3.23Å; P210-L214 WeakPolarHBondContact O-CB 3.31Å; P210-L214 PolarHBondContact O-N 3.19Å; L211-L214 PolarHBondContact O-N 3.38Å; F212-L214 VanDerWaalsContact C-N 3.34Å; F212-L214 PolarHBondContact O-N 3.45Å; L214-N218 VanDerWaalsContact CD1-ND2 3.27Å; L214-N218 WeakPolarHBondContact CD1-ND2 3.42Å; L214-N218 WeakPolarHBondContact CG-ND2 3.01Å; L214-N218 VanDerWaalsContact O-CB 3.3Å; L214-N218 WeakPolarHBondContact O-CB 3.19Å; L214-N218 PolarHBondContact O-N 3.35Å; L214-N218 PolarHBondContact O-ND2 2.94Å; L214-I255 HydrophobicContact CD2-CG2 3.54Å; L214-I255 HydrophobicContact CG-CG2 3.84Å
215T77.2Confident82Confident36 Ų3652.2 Ų52.222%0.22127%0.269CS..Hα-helixtrans-66.3-44.6175.655.30000111.3L211 F212 S219 F259L211-T215 WeakPolarHBondContact O-CG2 3.28Å; L211-T215 PolarHBondContact O-N 2.9Å; L211-T215 PolarHBondContact O-OG1 2.87Å; F212-T215 PolarHBondContact O-N 3.24Å; F212-T215 PolarHBondContact O-OG1 3.34Å; T215-S219 VanDerWaalsContact O-CB 3.3Å; T215-S219 WeakPolarHBondContact O-CB 3.24Å; T215-S219 PolarHBondContact O-N 2.95Å; T215-S219 PolarHBondContact O-OG 3.18Å; T215-F259 HydrophobicContact CG2-CD1 4.04Å; T215-F259 HydrophobicContact CG2-CE1 3.74Å; T215-F259 HydrophobicContact CG2-CZ 4.45Å
216V84.5Confident81.6Confident71 Ų7156 Ų5643%0.4328%0.279SS..Hα-helixtrans-62.3-48.4176.2171.80000111F212 M213 N218 S219 A220F212-V216 HydrophobicContact CD1-CG2 4.45Å; F212-V216 HydrophobicContact CE1-CG2 4.08Å; F212-V216 HydrophobicContact CE2-CG2 4.25Å; F212-V216 HydrophobicContact CZ-CG2 3.98Å; F212-V216 VanDerWaalsContact O-CG2 3.29Å; F212-V216 WeakPolarHBondContact O-CG2 3.5Å; F212-V216 PolarHBondContact O-N 2.93Å; F212-V216 VanDerWaalsContact O-N 3.1Å; M213-V216 PolarHBondContact O-N 2.92Å; V216-N218 PolarHBondContact O-N 3.09Å; V216-S219 PolarHBondContact O-N 2.9Å; V216-A220 WeakPolarHBondContact O-CB 3.23Å; V216-A220 PolarHBondContact O-N 3.48Å
217L85Confident81.5Confident30 Ų3060.8 Ų60.816%0.15730%0.299CS..Hα-helixtrans-65.8-39.9-179-70.6171000112.3I113 F117 L120 M213 A220 L221I113-L217 HydrophobicContact CG2-CD1 3.68Å; F117-L217 HydrophobicContact CD2-CD2 4.39Å; L120-L217 HydrophobicContact CD1-CB 4.25Å; L120-L217 HydrophobicContact CD1-CD2 3.65Å; M213-L217 VanDerWaalsContact O-CB 3.27Å; M213-L217 WeakPolarHBondContact O-CB 3.4Å; M213-L217 WeakPolarHBondContact O-CG 3.42Å; M213-L217 PolarHBondContact O-N 3.37Å; L217-A220 PolarHBondContact O-N 3.42Å; L217-L221 VanDerWaalsContact O-CB 3.31Å; L217-L221 WeakPolarHBondContact O-CB 3.39Å; L217-L221 PolarHBondContact O-N 2.9Å
218N77.7Confident81.4Confident7 Ų760.3 Ų60.34%0.03730%0.304CS..Hα-helixtrans-71.6-34.2176.2-76.6-61.1000112.8T116 L214 V216 L221 F222 I255T116-N218 WeakPolarHBondContact CG2-OD1 3.37Å; L214-N218 VanDerWaalsContact CD1-ND2 3.27Å; L214-N218 WeakPolarHBondContact CD1-ND2 3.42Å; L214-N218 WeakPolarHBondContact CG-ND2 3.01Å; L214-N218 VanDerWaalsContact O-CB 3.3Å; L214-N218 WeakPolarHBondContact O-CB 3.19Å; L214-N218 PolarHBondContact O-N 3.35Å; L214-N218 PolarHBondContact O-ND2 2.94Å; V216-N218 PolarHBondContact O-N 3.09Å; N218-L221 PolarHBondContact O-N 3.4Å; N218-F222 WeakPolarHBondContact O-CB 3.33Å; N218-F222 PolarHBondContact O-N 3.48Å; N218-I255 WeakPolarHBondContact ND2-CD1 3.37Å
219S80.4Confident81.1Confident69 Ų6959.3 Ų59.348%0.48329%0.294SS..Hα-helixtrans-63.4-44.7172.5-59.10000110.7T215 V216 F222 Y223T215-S219 VanDerWaalsContact O-CB 3.3Å; T215-S219 WeakPolarHBondContact O-CB 3.24Å; T215-S219 PolarHBondContact O-N 2.95Å; T215-S219 PolarHBondContact O-OG 3.18Å; V216-S219 PolarHBondContact O-N 2.9Å; S219-F222 PolarHBondContact O-N 2.9Å; S219-Y223 WeakPolarHBondContact O-CB 3.23Å; S219-Y223 PolarHBondContact O-N 2.96Å
220A84.7Confident80.8Confident25 Ų2562 Ų6221%0.20730%0.303CS..Hα-helixtrans-60.4-47.7172.200000111L120 V216 L217 F222 Y223 Y224L120-A220 HydrophobicContact CD1-CB 4.32Å; L120-A220 HydrophobicContact CD2-CB 4.25Å; V216-A220 WeakPolarHBondContact O-CB 3.23Å; V216-A220 PolarHBondContact O-N 3.48Å; L217-A220 PolarHBondContact O-N 3.42Å; A220-F222 VanDerWaalsContact C-N 3.3Å; A220-F222 PolarHBondContact O-N 3.44Å; A220-Y223 WeakPolarHBondContact O-CB 3.48Å; A220-Y223 PolarHBondContact O-N 3.46Å; A220-Y223 VanDerWaalsContact O-N 3.13Å; A220-Y224 HydrophobicContact CB-CD2 4.47Å; A220-Y224 WeakPolarHBondContact O-CD2 3.38Å; A220-Y224 PolarHBondContact O-N 2.8Å
221L80Confident80.6Confident9 Ų967.5 Ų67.55%0.04733%0.33CS..Hα-helixtrans-57.7-45.4-180178.461.5000111R119 L120 I123 L217 N218 Y224 L225R119-L221 HydrophobicContact CB-CD1 4.17Å; L120-L221 HydrophobicContact CD2-CB 4Å; L120-L221 HydrophobicContact CD2-CD1 4.18Å; L120-L221 HydrophobicContact CG-CB 4.24Å; L120-L221 HydrophobicContact CG-CD1 4.34Å; I123-L221 HydrophobicContact CD1-CD1 3.49Å; I123-L221 VanDerWaalsContact CD1-CD1 3.49Å; L217-L221 VanDerWaalsContact O-CB 3.31Å; L217-L221 WeakPolarHBondContact O-CB 3.39Å; L217-L221 PolarHBondContact O-N 2.9Å; N218-L221 PolarHBondContact O-N 3.4Å; L221-Y224 PolarHBondContact O-N 2.93Å; L221-L225 HydrophobicContact CD1-CD1 3.87Å; L221-L225 HydrophobicContact CD1-CG 4.07Å; L221-L225 HydrophobicContact CG-CD1 3.84Å; L221-L225 HydrophobicContact CG-CG 4.44Å; L221-L225 VanDerWaalsContact O-CB 3.29Å; L221-L225 WeakPolarHBondContact O-CB 3.27Å; L221-L225 WeakPolarHBondContact O-CG 3.2Å; L221-L225 PolarHBondContact O-N 2.92Å
222F77Confident80.4Confident55 Ų5569.1 Ų69.124%0.24134%0.344CS..Hα-helixtrans-59.2-47.6175.1177.7-93.8000112.2N218 S219 A220 L225 R226 V248 V252N218-F222 WeakPolarHBondContact O-CB 3.33Å; N218-F222 PolarHBondContact O-N 3.48Å; S219-F222 PolarHBondContact O-N 2.9Å; A220-F222 VanDerWaalsContact C-N 3.3Å; A220-F222 PolarHBondContact O-N 3.44Å; F222-L225 PolarHBondContact O-N 3.03Å; F222-R226 HydrophobicContact CE1-CG 4.39Å; F222-R226 VanDerWaalsContact CE1-NE 3.29Å; F222-R226 VanDerWaalsContact CZ-NH2 3.28Å; F222-R226 PolarHBondContact O-N 3.21Å; F222-V248 HydrophobicContact CB-CG1 4.05Å; F222-V248 HydrophobicContact CD2-CB 3.99Å; F222-V248 HydrophobicContact CD2-CG1 3.5Å; F222-V248 HydrophobicContact CE2-CG1 4.45Å; F222-V248 HydrophobicContact CG-CG1 4.22Å; F222-V252 HydrophobicContact CB-CG2 4.25Å; F222-V252 HydrophobicContact CD2-CG2 4.3Å
223Y82.7Confident80Confident129 Ų12964.8 Ų64.851%0.50633%0.327SS..Hα-helixtrans-59-50.5177.1172.9-93000112.2S219 A220 L225 R226 K227S219-Y223 WeakPolarHBondContact O-CB 3.23Å; S219-Y223 PolarHBondContact O-N 2.96Å; A220-Y223 WeakPolarHBondContact O-CB 3.48Å; A220-Y223 PolarHBondContact O-N 3.46Å; A220-Y223 VanDerWaalsContact O-N 3.13Å; Y223-L225 PolarHBondContact O-N 3.45Å; Y223-R226 PolarHBondContact O-N 3.15Å; Y223-K227 HydrophobicContact CE1-CD 4.41Å; Y223-K227 PolarHBondContact O-N 2.71Å
224Y82.8Confident79.6Confident63 Ų6367.4 Ų67.425%0.24734%0.339CS..Hα-helixtrans-67.8-35.9-178.3-77.9-75.4000112.5L120 R124 A220 L221 K227 A228L120-Y224 HydrophobicContact CD2-CD2 4.11Å; R124-Y224 HydrophobicContact CG-CD1 4.23Å; R124-Y224 HydrophobicContact CG-CE1 4.27Å; R124-Y224 VanDerWaalsContact NE-CE1 3.35Å; R124-Y224 PolarHBondContact NE-OH 3.39Å; R124-Y224 PolarHBondContact NH2-OH 3.22Å; A220-Y224 HydrophobicContact CB-CD2 4.47Å; A220-Y224 WeakPolarHBondContact O-CD2 3.38Å; A220-Y224 PolarHBondContact O-N 2.8Å; L221-Y224 PolarHBondContact O-N 2.93Å; Y224-K227 PolarHBondContact O-N 3.37Å; Y224-A228 WeakPolarHBondContact O-CB 3.22Å; Y224-A228 PolarHBondContact O-N 2.84Å
225L77.3Confident79.5Confident60 Ų6073.3 Ų73.331%0.31437%0.37SS..Hα-helixtrans-63.3-44.6172.8-75.1172000111.4I123 L221 F222 Y223 K227 A228 H229 V248I123-L225 HydrophobicContact CD1-CD2 3.6Å; I123-L225 HydrophobicContact CD1-CG 3.94Å; I123-L225 HydrophobicContact CG1-CD2 4.49Å; L221-L225 HydrophobicContact CD1-CD1 3.87Å; L221-L225 HydrophobicContact CD1-CG 4.07Å; L221-L225 HydrophobicContact CG-CD1 3.84Å; L221-L225 HydrophobicContact CG-CG 4.44Å; L221-L225 VanDerWaalsContact O-CB 3.29Å; L221-L225 WeakPolarHBondContact O-CB 3.27Å; L221-L225 WeakPolarHBondContact O-CG 3.2Å; L221-L225 PolarHBondContact O-N 2.92Å; F222-L225 PolarHBondContact O-N 3.03Å; Y223-L225 PolarHBondContact O-N 3.45Å; L225-K227 PolarHBondContact O-N 2.99Å; L225-A228 PolarHBondContact O-N 3.02Å; L225-H229 VanDerWaalsContact O-CB 3.25Å; L225-H229 WeakPolarHBondContact O-CB 3.18Å; L225-H229 PolarHBondContact O-N 3.1Å; L225-V248 HydrophobicContact CD1-CG1 3.82Å; L225-V248 HydrophobicContact CD1-CG2 3.79Å
226R78.7Confident79.4Confident137 Ų13775.6 Ų75.652%0.51738%0.384SS..Hα-helixtrans-62.1-42175-79.4-164.8173.2-156.2-1.3112.2F222 Y223 H229 K230F222-R226 HydrophobicContact CE1-CG 4.39Å; F222-R226 VanDerWaalsContact CE1-NE 3.29Å; F222-R226 VanDerWaalsContact CZ-NH2 3.28Å; F222-R226 PolarHBondContact O-N 3.21Å; Y223-R226 PolarHBondContact O-N 3.15Å; R226-H229 PolarHBondContact O-N 3.13Å; R226-K230 WeakPolarHBondContact O-CB 3.39Å; R226-K230 PolarHBondContact O-N 3.34Å
227K83.3Confident78.6Confident115 Ų11575.6 Ų75.650%0.540%0.398SS..Hα-helixtrans-62.8-48.6177-174.7175.3-179.7176.10111.7Y223 Y224 L225 H229 K230 M231Y223-K227 HydrophobicContact CE1-CD 4.41Å; Y223-K227 PolarHBondContact O-N 2.71Å; Y224-K227 PolarHBondContact O-N 3.37Å; L225-K227 PolarHBondContact O-N 2.99Å; K227-H229 VanDerWaalsContact C-N 3.26Å; K227-H229 PolarHBondContact O-N 3.41Å; K227-K230 PolarHBondContact O-N 3.06Å; K227-M231 PolarHBondContact O-N 3.28Å
228A78.1Confident77.7Confident49 Ų4978.2 Ų78.241%0.40542%0.416SS..Hα-helixtrans-60.7-38.6176.700000111.5Y224 L225 M231 S232Y224-A228 WeakPolarHBondContact O-CB 3.22Å; Y224-A228 PolarHBondContact O-N 2.84Å; L225-A228 PolarHBondContact O-N 3.02Å; A228-M231 PolarHBondContact O-N 2.88Å; A228-S232 PolarHBondContact O-N 2.94Å
229H74.4Confident76.8Confident44 Ų4484.5 Ų84.520%0.20445%0.449CS..Hα-helixtrans-67.7-48176.6-172.6-95.4000112.7L225 R226 K227 M231 S232 L233 Q241L225-H229 VanDerWaalsContact O-CB 3.25Å; L225-H229 WeakPolarHBondContact O-CB 3.18Å; L225-H229 PolarHBondContact O-N 3.1Å; R226-H229 PolarHBondContact O-N 3.13Å; K227-H229 VanDerWaalsContact C-N 3.26Å; K227-H229 PolarHBondContact O-N 3.41Å; H229-M231 PolarHBondContact O-N 3.38Å; H229-S232 CarbonylContact O-C 3.58Å; H229-S232 WeakPolarHBondContact O-CA 3.47Å; H229-S232 WeakPolarHBondContact O-CB 3.24Å; H229-S232 PolarHBondContact O-N 3.32Å; H229-L233 VanDerWaalsContact CE1-CD1 3.48Å; H229-L233 WeakPolarHBondContact CE1-CD1 3.1Å; H229-L233 WeakPolarHBondContact ND1-CD1 3.24Å; H229-L233 WeakPolarHBondContact O-CG 3.34Å; H229-L233 PolarHBondContact O-N 3.44Å; H229-Q241 PolarHBondContact CE1-OE1 3.01Å; H229-Q241 VanDerWaalsContact CE1-OE1 3.29Å
230K80Confident75.7Confident137 Ų13788.2 Ų88.260%0.59646%0.459SS*.Hα-helixtrans-55.1-41.9175.6-174.3178.6179179.60111R226 K227 L233 M234R226-K230 WeakPolarHBondContact O-CB 3.39Å; R226-K230 PolarHBondContact O-N 3.34Å; K227-K230 PolarHBondContact O-N 3.06Å; K230-L233 PolarHBondContact O-N 3.46Å; K230-M234 HydrophobicContact CD-CE 4.5Å; K230-M234 HydrophobicContact CG-CE 4.26Å; K230-M234 WeakPolarHBondContact O-CG 2.94Å; K230-M234 PolarHBondContact O-N 2.84Å; K230-M234 VanDerWaalsContact O-N 3.08Å
231M80.5Confident74.2Confident116 Ų11689.3 Ų89.357%0.57146%0.46SS*.Hα-helixtrans-63.4-45.2173.7-176.1175.9-79.400111.8K227 A228 H229 L233 M234 L235K227-M231 PolarHBondContact O-N 3.28Å; A228-M231 PolarHBondContact O-N 2.88Å; H229-M231 PolarHBondContact O-N 3.38Å; M231-L233 VanDerWaalsContact C-N 3.33Å; M231-L233 PolarHBondContact O-N 3.23Å; M231-M234 PolarHBondContact O-N 3.43Å; M231-L235 HydrophobicContact CG-CD1 4.14Å; M231-L235 WeakPolarHBondContact O-CD1 3.14Å; M231-L235 PolarHBondContact O-N 3.45Å; M231-L235 VanDerWaalsContact O-N 3.11Å
232S75.1Confident72.7Confident61 Ų6197.6 Ų97.643%0.42750%0.496SS..Hα-helixtrans-61.2-38.6176.1-168.60000113.1A228 H229 L235 T236A228-S232 PolarHBondContact O-N 2.94Å; H229-S232 CarbonylContact O-C 3.58Å; H229-S232 WeakPolarHBondContact O-CA 3.47Å; H229-S232 WeakPolarHBondContact O-CB 3.24Å; H229-S232 PolarHBondContact O-N 3.32Å; S232-L235 PolarHBondContact O-N 3.1Å; S232-T236 WeakPolarHBondContact O-CB 3.37Å; S232-T236 PolarHBondContact O-N 3.04Å; S232-T236 PolarHBondContact O-OG1 3.18Å
233L73.4Confident71.5Confident42 Ų4298.7 Ų98.722%0.2251%0.507CS..Hα-helixtrans-65.2-43.4176-70.3172.7000111.7H229 K230 M231 L235 T236 G237 V238 Q241H229-L233 VanDerWaalsContact CE1-CD1 3.48Å; H229-L233 WeakPolarHBondContact CE1-CD1 3.1Å; H229-L233 WeakPolarHBondContact ND1-CD1 3.24Å; H229-L233 WeakPolarHBondContact O-CG 3.34Å; H229-L233 PolarHBondContact O-N 3.44Å; K230-L233 PolarHBondContact O-N 3.46Å; M231-L233 VanDerWaalsContact C-N 3.33Å; M231-L233 PolarHBondContact O-N 3.23Å; L233-L235 PolarHBondContact O-N 3.46Å; L233-T236 PolarHBondContact O-N 2.83Å; L233-G237 PolarHBondContact O-N 3.15Å; L233-V238 WeakPolarHBondContact CD2-O 3.49Å; L233-Q241 VanDerWaalsContact CD1-OE1 3.26Å
234M78.2Confident70.1Confident143 Ų14395 Ų9570%0.70450%0.498SS*.Hα-helixtrans-59.7-34.6175.8-73.4171.8164.100112.1K230 M231K230-M234 HydrophobicContact CD-CE 4.5Å; K230-M234 HydrophobicContact CG-CE 4.26Å; K230-M234 WeakPolarHBondContact O-CG 2.94Å; K230-M234 PolarHBondContact O-N 2.84Å; K230-M234 VanDerWaalsContact O-N 3.08Å; M231-M234 PolarHBondContact O-N 3.43Å
235L79.6Confident68.7Low141 Ų14195.8 Ų95.874%0.73850%0.504SS*.Hα-helixtrans-83-32.9-179.8-9073.3000113.8M231 S232 L233M231-L235 HydrophobicContact CG-CD1 4.14Å; M231-L235 WeakPolarHBondContact O-CD1 3.14Å; M231-L235 PolarHBondContact O-N 3.45Å; M231-L235 VanDerWaalsContact O-N 3.11Å; S232-L235 PolarHBondContact O-N 3.1Å; L233-L235 PolarHBondContact O-N 3.46Å
236T74.6Confident67.5Low84 Ų8498.1 Ų98.152%0.51552%0.516SS..Hα-helixtrans-110.4-18.3-169.2590000114.5S232 L233 V238S232-T236 WeakPolarHBondContact O-CB 3.37Å; S232-T236 PolarHBondContact O-N 3.04Å; S232-T236 PolarHBondContact O-OG1 3.18Å; L233-T236 PolarHBondContact O-N 2.83Å; T236-V238 WeakPolarHBondContact O-CG2 3.25Å; T236-V238 PolarHBondContact O-N 2.99Å
237G67.2Low66.5Low71 Ų7195.3 Ų95.373%0.73251%0.505SS*.  trans65.13.3179.200000115.9L233L233-G237 PolarHBondContact O-N 3.15Å
238V66Low65.2Low86 Ų8690.9 Ų90.952%0.52149%0.488SS..  trans-98.6122.2-174.4-177.50000112.5L233 T236 Q240L233-V238 WeakPolarHBondContact CD2-O 3.49Å; T236-V238 WeakPolarHBondContact O-CG2 3.25Å; T236-V238 PolarHBondContact O-N 2.99Å; V238-Q240 HydrophobicContact CG1-CG 4.17Å; V238-Q240 PolarHBondContact O-N 3.04Å
239N58.9Low64Low138 Ų13890.4 Ų90.474%0.73848%0.483SS*.  trans-78.361.5178.7-108.7-8.3000113.7Q241N239-Q241 PolarHBondContact O-N 3.08Å
240Q57.3Low63.1Low148 Ų14890.9 Ų90.969%0.69249%0.487SS*.  trans-75.624.1167.7-76.9-161.1-2.400113.6V238 K242V238-Q240 HydrophobicContact CG1-CG 4.17Å; V238-Q240 PolarHBondContact O-N 3.04Å; Q240-K242 PolarHBondContact O-N 3.3Å
241Q52.8Low62.1Low47 Ų4786 Ų8622%0.2247%0.469CS..THydrogen-bonded Turntrans-59.1-45.2-154.6-163.873.613.300115.9H229 L233 N239 T243 E245H229-Q241 PolarHBondContact CE1-OE1 3.01Å; H229-Q241 VanDerWaalsContact CE1-OE1 3.29Å; L233-Q241 VanDerWaalsContact CD1-OE1 3.26Å; N239-Q241 PolarHBondContact O-N 3.08Å; Q241-T243 PolarHBondContact O-N 3.32Å; Q241-E245 PolarHBondContact NE2-OE1 3.04Å
242K49.2Very low60.9Low184 Ų18481.9 Ų81.980%0.845%0.45SS*.Hα-helixtrans-74.7-27.4-165.1-68.8-176.5178.9178.40114Q240Q240-K242 PolarHBondContact O-N 3.3Å
243T51Low59.8Low78 Ų7883.4 Ų83.448%0.47946%0.457SS..Hα-helixtrans-84.2-17.1-170.174.60000114Q241 R247Q241-T243 PolarHBondContact O-N 3.32Å; T243-R247 WeakPolarHBondContact O-CD 3.17Å; T243-R247 WeakPolarHBondContact O-CG 3.06Å; T243-R247 PolarHBondContact O-NE 3.49Å; T243-R247 PolarHBondContact OG1-NH2 2.95Å; T243-R247 VanDerWaalsContact OG1-NH2 3.07Å
244V54Low59.3Low51 Ų5182.3 Ų82.331%0.30945%0.453SS..Hα-helixtrans-96.9-41-176.5179.20000111.4L246 R247 V248V244-L246 VanDerWaalsContact C-N 3.28Å; V244-L246 PolarHBondContact O-N 3.5Å; V244-R247 WeakPolarHBondContact O-CB 3.42Å; V244-R247 PolarHBondContact O-N 2.71Å; V244-V248 PolarHBondContact O-N 3.18Å
245E53.8Low58.5Low80 Ų8077.3 Ų77.337%0.37443%0.429SS..Hα-helixtrans-58.1-40.5177-67-178.6166.100111.9Q241 R247 A249Q241-E245 PolarHBondContact NE2-OE1 3.04Å; E245-R247 VanDerWaalsContact C-N 3.32Å; E245-R247 PolarHBondContact O-N 3.41Å; E245-A249 WeakPolarHBondContact O-CB 3.45Å; E245-A249 PolarHBondContact O-N 3.07Å; E245-A249 VanDerWaalsContact O-N 3.07Å
246L51.6Low57.2Low109 Ų10973.8 Ų73.857%0.57141%0.409SS*.Hα-helixtrans-63.2-33.1173.7-175.662.8000112.6V244 L250V244-L246 VanDerWaalsContact C-N 3.28Å; V244-L246 PolarHBondContact O-N 3.5Å; L246-L250 HydrophobicContact CD1-CD1 4.12Å; L246-L250 HydrophobicContact CD1-CG 4.13Å; L246-L250 HydrophobicContact CG-CD1 3.87Å; L246-L250 HydrophobicContact CG-CG 4.33Å; L246-L250 VanDerWaalsContact O-CB 3.23Å; L246-L250 WeakPolarHBondContact O-CB 3.44Å; L246-L250 WeakPolarHBondContact O-CD1 3.34Å; L246-L250 WeakPolarHBondContact O-CG 3.36Å; L246-L250 PolarHBondContact O-N 3.4Å
247R58.2Low56.5Low78 Ų7871.3 Ų71.329%0.29440%0.401SS..Hα-helixtrans-68.4-41.3-177.4-48.3-175.9-172.7169.34.3111.7T243 V244 E245 V251 S289T243-R247 WeakPolarHBondContact O-CD 3.17Å; T243-R247 WeakPolarHBondContact O-CG 3.06Å; T243-R247 PolarHBondContact O-NE 3.49Å; T243-R247 PolarHBondContact OG1-NH2 2.95Å; T243-R247 VanDerWaalsContact OG1-NH2 3.07Å; V244-R247 WeakPolarHBondContact O-CB 3.42Å; V244-R247 PolarHBondContact O-N 2.71Å; E245-R247 VanDerWaalsContact C-N 3.32Å; E245-R247 PolarHBondContact O-N 3.41Å; R247-V251 WeakPolarHBondContact O-CG2 3.25Å; R247-V251 PolarHBondContact O-N 2.98Å; R247-S289 WeakPolarHBondContact CB-O 3.39Å; R247-S289 WeakPolarHBondContact CD-O 3.35Å; R247-S289 VanDerWaalsContact CG-O 3.23Å; R247-S289 WeakPolarHBondContact CG-O 3.28Å; R247-S289 PolarHBondContact O-OG 3.11Å; R247-S289 VanDerWaalsContact O-OG 3.05Å
248V54.5Low56.1Low22 Ų2270.4 Ų70.413%0.13338%0.381CS..Hα-helixtrans-78.8-42.5-178.7-161.50000110.4F222 L225 V244 L250 V251 V252F222-V248 HydrophobicContact CB-CG1 4.05Å; F222-V248 HydrophobicContact CD2-CB 3.99Å; F222-V248 HydrophobicContact CD2-CG1 3.5Å; F222-V248 HydrophobicContact CE2-CG1 4.45Å; F222-V248 HydrophobicContact CG-CG1 4.22Å; L225-V248 HydrophobicContact CD1-CG1 3.82Å; L225-V248 HydrophobicContact CD1-CG2 3.79Å; V244-V248 PolarHBondContact O-N 3.18Å; V248-L250 PolarHBondContact O-N 2.9Å; V248-V251 PolarHBondContact O-N 3.14Å; V248-V251 VanDerWaalsContact O-N 3.16Å; V248-V252 WeakPolarHBondContact O-CG2 3.27Å; V248-V252 PolarHBondContact O-N 3.39Å
249A53.2Low55.7Low38 Ų3867.8 Ų67.831%0.31436%0.363SS..Hα-helixtrans-55.9-39.9171.700000111.1E245 V252 V253E245-A249 WeakPolarHBondContact O-CB 3.45Å; E245-A249 PolarHBondContact O-N 3.07Å; E245-A249 VanDerWaalsContact O-N 3.07Å; A249-V252 PolarHBondContact O-N 3.04Å; A249-V253 WeakPolarHBondContact O-CB 3.46Å; A249-V253 WeakPolarHBondContact O-CG2 3.48Å; A249-V253 PolarHBondContact O-N 2.95Å
250L56Low55.6Low54 Ų5465.8 Ų65.828%0.28335%0.352SS..Hα-helixtrans-69-34176.4-77.4170.9000114.4L246 V248 S254L246-L250 HydrophobicContact CD1-CD1 4.12Å; L246-L250 HydrophobicContact CD1-CG 4.13Å; L246-L250 HydrophobicContact CG-CD1 3.87Å; L246-L250 HydrophobicContact CG-CG 4.33Å; L246-L250 VanDerWaalsContact O-CB 3.23Å; L246-L250 WeakPolarHBondContact O-CB 3.44Å; L246-L250 WeakPolarHBondContact O-CD1 3.34Å; L246-L250 WeakPolarHBondContact O-CG 3.36Å; L246-L250 PolarHBondContact O-N 3.4Å; V248-L250 PolarHBondContact O-N 2.9Å; L250-S254 WeakPolarHBondContact O-CA 3.39Å; L250-S254 WeakPolarHBondContact O-CB 3.27Å; L250-S254 PolarHBondContact O-N 3.34Å
251V60.1Low55.5Low36 Ų3662.5 Ų62.522%0.21834%0.342CS..Hα-helixtrans-67.4-43.6172.9171.90000109.9R247 V248 S254 I255R247-V251 WeakPolarHBondContact O-CG2 3.25Å; R247-V251 PolarHBondContact O-N 2.98Å; V248-V251 PolarHBondContact O-N 3.14Å; V248-V251 VanDerWaalsContact O-N 3.16Å; V251-S254 PolarHBondContact O-N 3.01Å; V251-I255 HydrophobicContact CG1-CD1 3.7Å; V251-I255 WeakPolarHBondContact O-CB 3.3Å; V251-I255 WeakPolarHBondContact O-CG1 3.49Å; V251-I255 PolarHBondContact O-N 2.9Å
252V53.4Low55.7Low28 Ų2861.6 Ų61.617%0.1734%0.34CS..Hα-helixtrans-65.3-45.7177.91730000110.9F222 V248 A249 I255 I256F222-V252 HydrophobicContact CB-CG2 4.25Å; F222-V252 HydrophobicContact CD2-CG2 4.3Å; V248-V252 WeakPolarHBondContact O-CG2 3.27Å; V248-V252 PolarHBondContact O-N 3.39Å; A249-V252 PolarHBondContact O-N 3.04Å; V252-I255 PolarHBondContact O-N 3.38Å; V252-I256 HydrophobicContact CG1-CD1 3.44Å; V252-I256 VanDerWaalsContact CG1-CD1 3.44Å; V252-I256 HydrophobicContact CG1-CG1 4.31Å; V252-I256 WeakPolarHBondContact O-CB 3.45Å; V252-I256 WeakPolarHBondContact O-CG1 3.28Å; V252-I256 PolarHBondContact O-N 3.39Å
253V53.4Low55.9Low93 Ų9358.1 Ų58.156%0.56433%0.327SS*.Hα-helixtrans-69.3-36.3176.7169.60000111.9A249 G257A249-V253 WeakPolarHBondContact O-CB 3.46Å; A249-V253 WeakPolarHBondContact O-CG2 3.48Å; A249-V253 PolarHBondContact O-N 2.95Å; V253-G257 WeakPolarHBondContact O-CA 3.32Å; V253-G257 PolarHBondContact O-N 3.43Å
254S61.6Low56Low20 Ų2060.8 Ų60.814%0.1434%0.337CS..Hα-helixtrans-67.2-42.31751670000111.6L250 V251 T258 V285L250-S254 WeakPolarHBondContact O-CA 3.39Å; L250-S254 WeakPolarHBondContact O-CB 3.27Å; L250-S254 PolarHBondContact O-N 3.34Å; V251-S254 PolarHBondContact O-N 3.01Å; S254-T258 VanDerWaalsContact O-CB 3.27Å; S254-T258 WeakPolarHBondContact O-CB 3.45Å; S254-T258 PolarHBondContact O-N 3.21Å; S254-T258 PolarHBondContact O-OG1 3.29Å; S254-V285 VanDerWaalsContact OG-CG1 3.31Å; S254-V285 WeakPolarHBondContact OG-CG1 3.36Å; S254-V285 WeakPolarHBondContact OG-CG2 3.29Å
255I62.1Low55.8Low38 Ų3860.6 Ų60.620%0.19534%0.336CS..Hα-helixtrans-71.5-48.8179.4-68.3172.1000109.9L214 N218 V251 V252 F259L214-I255 HydrophobicContact CD2-CG2 3.54Å; L214-I255 HydrophobicContact CG-CG2 3.84Å; N218-I255 WeakPolarHBondContact ND2-CD1 3.37Å; V251-I255 HydrophobicContact CG1-CD1 3.7Å; V251-I255 WeakPolarHBondContact O-CB 3.3Å; V251-I255 WeakPolarHBondContact O-CG1 3.49Å; V251-I255 PolarHBondContact O-N 2.9Å; V252-I255 PolarHBondContact O-N 3.38Å; I255-F259 WeakPolarHBondContact O-CB 3.38Å; I255-F259 PolarHBondContact O-N 3.32Å
256I52.7Low55.5Low66 Ų6662.9 Ų62.934%0.33836%0.362SS..Hα-helixtrans-65.6-41.1177.7-67173.4000111.6V252 F259 L260V252-I256 HydrophobicContact CG1-CD1 3.44Å; V252-I256 VanDerWaalsContact CG1-CD1 3.44Å; V252-I256 HydrophobicContact CG1-CG1 4.31Å; V252-I256 WeakPolarHBondContact O-CB 3.45Å; V252-I256 WeakPolarHBondContact O-CG1 3.28Å; V252-I256 PolarHBondContact O-N 3.39Å; I256-F259 WeakPolarHBondContact O-CB 3.24Å; I256-F259 PolarHBondContact O-N 2.9Å; I256-L260 HydrophobicContact CG2-CD1 3.72Å; I256-L260 HydrophobicContact CG2-CG 4.05Å; I256-L260 WeakPolarHBondContact O-CB 3.48Å; I256-L260 WeakPolarHBondContact O-CG 3.34Å; I256-L260 PolarHBondContact O-N 3.29Å
257G59.7Low55.2Low33 Ų3359.6 Ų59.634%0.3435%0.35SS..Hα-helixtrans-67.8-42.9179.800000112.3V253 F259 V261V253-G257 WeakPolarHBondContact O-CA 3.32Å; V253-G257 PolarHBondContact O-N 3.43Å; G257-F259 PolarHBondContact O-N 3.12Å; G257-V261 WeakPolarHBondContact O-CG2 3.48Å; G257-V261 PolarHBondContact O-N 3.24Å
258T59.4Low54.9Low52 Ų5261.4 Ų61.432%0.31937%0.369SS..Hα-helixtrans-62.9-36.2171.5-52.50000110.6S254 C262S254-T258 VanDerWaalsContact O-CB 3.27Å; S254-T258 WeakPolarHBondContact O-CB 3.45Å; S254-T258 PolarHBondContact O-N 3.21Å; S254-T258 PolarHBondContact O-OG1 3.29Å; T258-C262 PolarHBondContact O-N 3.14Å; T258-C262 PolarHBondContact O-SG 3.38Å
259F57.5Low54.7Low31 Ų3164.3 Ų64.314%0.13639%0.391CS..Hα-helixtrans-77.3-44.9-173.9171.5-124000115.3L211 T215 I255 I256 G257 V261 C262 Q263L211-F259 HydrophobicContact CB-CD2 3.86Å; L211-F259 HydrophobicContact CB-CE2 3.22Å; L211-F259 HydrophobicContact CB-CZ 3.72Å; L211-F259 HydrophobicContact CD1-CD2 3.6Å; L211-F259 HydrophobicContact CD1-CE2 3.3Å; L211-F259 HydrophobicContact CD1-CZ 4.49Å; L211-F259 HydrophobicContact CD2-CD2 3.37Å; L211-F259 HydrophobicContact CD2-CE2 3.71Å; L211-F259 HydrophobicContact CD2-CG 4.23Å; L211-F259 HydrophobicContact CG-CD2 3.73Å; L211-F259 HydrophobicContact CG-CE2 3.51Å; L211-F259 HydrophobicContact CG-CZ 4.47Å; T215-F259 HydrophobicContact CG2-CD1 4.04Å; T215-F259 HydrophobicContact CG2-CE1 3.74Å; T215-F259 HydrophobicContact CG2-CZ 4.45Å; I255-F259 WeakPolarHBondContact O-CB 3.38Å; I255-F259 PolarHBondContact O-N 3.32Å; I256-F259 WeakPolarHBondContact O-CB 3.24Å; I256-F259 PolarHBondContact O-N 2.9Å; G257-F259 PolarHBondContact O-N 3.12Å; F259-V261 VanDerWaalsContact C-N 3.29Å; F259-V261 PolarHBondContact O-N 2.84Å; F259-C262 PolarHBondContact O-N 3.46Å; F259-C262 VanDerWaalsContact O-N 3.16Å; F259-Q263 HydrophobicContact CD2-CG 4.11Å; F259-Q263 HydrophobicContact CE2-CG 3.75Å; F259-Q263 HydrophobicContact CZ-CG 4.44Å; F259-Q263 PolarHBondContact O-N 3.34Å
260L55.4Low54.5Low96 Ų9665.3 Ų65.350%0.50339%0.393SS..Hα-helixtrans-62.2-42.1175.4-74.3173.5000110.4I256 C262 Q263 I264I256-L260 HydrophobicContact CG2-CD1 3.72Å; I256-L260 HydrophobicContact CG2-CG 4.05Å; I256-L260 WeakPolarHBondContact O-CB 3.48Å; I256-L260 WeakPolarHBondContact O-CG 3.34Å; I256-L260 PolarHBondContact O-N 3.29Å; L260-C262 PolarHBondContact O-N 2.95Å; L260-Q263 PolarHBondContact O-N 2.98Å; L260-I264 VanDerWaalsContact O-CD1 3.27Å; L260-I264 WeakPolarHBondContact O-CD1 3.45Å; L260-I264 WeakPolarHBondContact O-CG1 3.37Å; L260-I264 PolarHBondContact O-N 2.99Å
261V56.7Low54.5Low79 Ų7963.9 Ų63.948%0.47939%0.387SS..Hα-helixtrans-66-31.9178.8-171.40000109.7G257 F259 P265 L274G257-V261 WeakPolarHBondContact O-CG2 3.48Å; G257-V261 PolarHBondContact O-N 3.24Å; F259-V261 VanDerWaalsContact C-N 3.29Å; F259-V261 PolarHBondContact O-N 2.84Å; V261-P265 WeakPolarHBondContact O-CD 3.1Å; V261-L274 HydrophobicContact CB-CD1 4.06Å; V261-L274 HydrophobicContact CB-CD2 3.47Å; V261-L274 VanDerWaalsContact CB-CD2 3.47Å; V261-L274 HydrophobicContact CB-CG 4.37Å; V261-L274 HydrophobicContact CG1-CD1 3.37Å; V261-L274 HydrophobicContact CG1-CD2 3.38Å; V261-L274 HydrophobicContact CG1-CG 4.02Å; V261-L274 WeakPolarHBondContact O-CD2 3.29Å
262C56Low54.7Low28 Ų2866.5 Ų66.519%0.18940%0.4CS..Hα-helixtrans-71.9-31.6-179.9-77.90000113.3T258 F259 L260 L274T258-C262 PolarHBondContact O-N 3.14Å; T258-C262 PolarHBondContact O-SG 3.38Å; F259-C262 PolarHBondContact O-N 3.46Å; F259-C262 VanDerWaalsContact O-N 3.16Å; L260-C262 PolarHBondContact O-N 2.95Å; C262-L274 HydrophobicContact CB-CD2 3.83Å; C262-L274 WeakPolarHBondContact SG-CD2 3.05Å
263Q53.5Low55.3Low110 Ų11067.4 Ų67.451%0.51440%0.403SS..Hα-helixtrans-88.9-25-174-72.6-141.681.500114.1F259 L260F259-Q263 HydrophobicContact CD2-CG 4.11Å; F259-Q263 HydrophobicContact CE2-CG 3.75Å; F259-Q263 HydrophobicContact CZ-CG 4.44Å; F259-Q263 PolarHBondContact O-N 3.34Å; L260-Q263 PolarHBondContact O-N 2.98Å
264I54Low55.9Low135 Ų13564.5 Ų64.569%0.69239%0.385SS*.SBendtrans-68.5-39.1-169.4-70.5163.5000113.1L260 S266L260-I264 VanDerWaalsContact O-CD1 3.27Å; L260-I264 WeakPolarHBondContact O-CD1 3.45Å; L260-I264 WeakPolarHBondContact O-CG1 3.37Å; L260-I264 PolarHBondContact O-N 2.99Å; I264-S266 PolarHBondContact O-N 2.67Å
265P49.8Very low56.2Low46 Ų4664.7 Ų64.730%0.29939%0.385SS..  trans-93.4109.2179.3-8.328.9000111.2V261 A267 V270V261-P265 WeakPolarHBondContact O-CD 3.1Å; P265-A267 PolarHBondContact O-N 2.97Å; P265-V270 HydrophobicContact CB-CB 3.92Å; P265-V270 HydrophobicContact CB-CG1 3.75Å; P265-V270 HydrophobicContact CB-CG2 4.4Å; P265-V270 HydrophobicContact CG-CB 4.34Å; P265-V270 HydrophobicContact CG-CG1 3.62Å
266S46.6Very low56.6Low129 Ų12963.5 Ų63.590%0.90238%0.379SS*.  trans-61.911.5169.349.10000114.8I264I264-S266 PolarHBondContact O-N 2.67Å
267A45.3Very low57.6Low40 Ų4063.3 Ų63.333%0.33138%0.376SS..  trans-91.6107.4171.700000109.5P265 S269 V270 S271P265-A267 PolarHBondContact O-N 2.97Å; A267-S269 PolarHBondContact O-N 3.29Å; A267-V270 HydrophobicContact CB-CB 4.29Å; A267-V270 HydrophobicContact CB-CG2 3.83Å; A267-V270 PolarHBondContact O-N 2.87Å; A267-S271 PolarHBondContact O-N 3.43Å
268V52.5Low58.1Low115 Ų11562.5 Ų62.570%0.69737%0.368SS*.Hα-helixtrans-46.8-30.7177.3177.80000113
269S49.8Very low58.8Low83 Ų8360.9 Ų60.958%0.5836%0.356SS*.Hα-helixtrans-69.9-39175.146.40000114.1A267A267-S269 PolarHBondContact O-N 3.29Å
270V49.2Very low59.7Low59 Ų5959.4 Ų59.436%0.35835%0.35SS..Hα-helixtrans-72.1-34.8178.6-1780000110.9P265 A267 N272 I273 L274P265-V270 HydrophobicContact CB-CB 3.92Å; P265-V270 HydrophobicContact CB-CG1 3.75Å; P265-V270 HydrophobicContact CB-CG2 4.4Å; P265-V270 HydrophobicContact CG-CB 4.34Å; P265-V270 HydrophobicContact CG-CG1 3.62Å; A267-V270 HydrophobicContact CB-CB 4.29Å; A267-V270 HydrophobicContact CB-CG2 3.83Å; A267-V270 PolarHBondContact O-N 2.87Å; V270-N272 VanDerWaalsContact C-N 3.34Å; V270-N272 PolarHBondContact O-N 3.21Å; V270-I273 PolarHBondContact O-N 2.96Å; V270-L274 PolarHBondContact O-N 2.85Å
271S56Low60.4Low24 Ų2458.8 Ų58.817%0.16834%0.343CS..Hα-helixtrans-55.3-46.5174.5178.90000112.2A267 I273 L274 V275A267-S271 PolarHBondContact O-N 3.43Å; S271-I273 PolarHBondContact O-N 2.81Å; S271-L274 PolarHBondContact O-N 3.36Å; S271-V275 WeakPolarHBondContact O-CG2 3.28Å; S271-V275 PolarHBondContact O-N 3.32Å
272N63.5Low61.1Low91 Ų9156.5 Ų56.549%0.48733%0.329SS..Hα-helixtrans-61-44.5179.1-73.6-14000112.4V270 L274 V275 V276V270-N272 VanDerWaalsContact C-N 3.34Å; V270-N272 PolarHBondContact O-N 3.21Å; N272-L274 VanDerWaalsContact C-N 3.29Å; N272-L274 PolarHBondContact O-N 3.34Å; N272-V275 PolarHBondContact O-N 3.44Å; N272-V276 VanDerWaalsContact O-CG2 3.24Å; N272-V276 WeakPolarHBondContact O-CG2 3.31Å; N272-V276 PolarHBondContact O-N 3.02Å; N272-V276 VanDerWaalsContact O-N 3.13Å
273I66.5Low61.7Low47 Ų4756.2 Ų56.224%0.24132%0.324CS..Hα-helixtrans-56.8-50.1-179.7-63.5167.2000109.4I19 V270 S271 V275 V276 F277I19-I273 HydrophobicContact CD1-CD1 3.35Å; I19-I273 HydrophobicContact CD1-CG1 4.38Å; I19-I273 HydrophobicContact CG1-CD1 4.3Å; I19-I273 HydrophobicContact CG2-CD1 4.31Å; I19-I273 HydrophobicContact CG2-CG1 4.27Å; V270-I273 PolarHBondContact O-N 2.96Å; S271-I273 PolarHBondContact O-N 2.81Å; I273-V275 VanDerWaalsContact C-N 3.34Å; I273-V275 PolarHBondContact O-N 3.33Å; I273-V276 WeakPolarHBondContact O-CB 3.46Å; I273-V276 PolarHBondContact O-N 3.49Å; I273-V276 VanDerWaalsContact O-N 3.1Å; I273-F277 HydrophobicContact CG2-CD2 3.62Å; I273-F277 HydrophobicContact CG2-CE2 3.58Å; I273-F277 WeakPolarHBondContact O-CD2 3.42Å; I273-F277 PolarHBondContact O-N 3.26Å
274L66.8Low62.5Low32 Ų3253.9 Ų53.917%0.16832%0.317CS..Hα-helixtrans-71.2-32.9-173.6-169.176.5000113.2V261 C262 V270 S271 N272 V276 F277 G278V261-L274 HydrophobicContact CB-CD1 4.06Å; V261-L274 HydrophobicContact CB-CD2 3.47Å; V261-L274 VanDerWaalsContact CB-CD2 3.47Å; V261-L274 HydrophobicContact CB-CG 4.37Å; V261-L274 HydrophobicContact CG1-CD1 3.37Å; V261-L274 HydrophobicContact CG1-CD2 3.38Å; V261-L274 HydrophobicContact CG1-CG 4.02Å; V261-L274 WeakPolarHBondContact O-CD2 3.29Å; C262-L274 HydrophobicContact CB-CD2 3.83Å; C262-L274 WeakPolarHBondContact SG-CD2 3.05Å; V270-L274 PolarHBondContact O-N 2.85Å; S271-L274 PolarHBondContact O-N 3.36Å; N272-L274 VanDerWaalsContact C-N 3.29Å; N272-L274 PolarHBondContact O-N 3.34Å; L274-V276 VanDerWaalsContact C-N 3.26Å; L274-V276 PolarHBondContact O-N 3.4Å; L274-F277 HydrophobicContact CD1-CB 4.42Å; L274-F277 PolarHBondContact O-N 3.26Å; L274-G278 PolarHBondContact O-N 3.4Å
275V67.7Low63.2Low25 Ų2549 Ų4915%0.15229%0.294CS..Hα-helixtrans-57.9-43.1170170.80000110.5F65 S271 N272 I273 G278 K279F65-V275 HydrophobicContact CZ-CG1 4.4Å; S271-V275 WeakPolarHBondContact O-CG2 3.28Å; S271-V275 PolarHBondContact O-N 3.32Å; N272-V275 PolarHBondContact O-N 3.44Å; I273-V275 VanDerWaalsContact C-N 3.34Å; I273-V275 PolarHBondContact O-N 3.33Å; V275-G278 PolarHBondContact O-N 3.2Å; V275-K279 HydrophobicContact CG1-CD 4.44Å; V275-K279 WeakPolarHBondContact O-CG 3.45Å; V275-K279 PolarHBondContact O-N 3.23Å
276V69.3Low64Low12 Ų1249.6 Ų49.67%0.07329%0.29CS..Hα-helixtrans-63.3-45.1176.9-1750000110.5F24 V27 F65 F66 N272 I273 L274 K279 A280F24-V276 HydrophobicContact CD2-CG1 4.42Å; F24-V276 HydrophobicContact CE2-CG1 4.32Å; V27-V276 HydrophobicContact CG1-CB 4.43Å; V27-V276 HydrophobicContact CG1-CG1 3.51Å; F65-V276 HydrophobicContact CE1-CB 4.35Å; F65-V276 HydrophobicContact CE1-CG1 4.41Å; F65-V276 HydrophobicContact CE1-CG2 3.83Å; F65-V276 HydrophobicContact CZ-CG2 3.67Å; F66-V276 HydrophobicContact CD1-CG1 4.44Å; F66-V276 HydrophobicContact CE1-CG1 3.71Å; N272-V276 VanDerWaalsContact O-CG2 3.24Å; N272-V276 WeakPolarHBondContact O-CG2 3.31Å; N272-V276 PolarHBondContact O-N 3.02Å; N272-V276 VanDerWaalsContact O-N 3.13Å; I273-V276 WeakPolarHBondContact O-CB 3.46Å; I273-V276 PolarHBondContact O-N 3.49Å; I273-V276 VanDerWaalsContact O-N 3.1Å; L274-V276 VanDerWaalsContact C-N 3.26Å; L274-V276 PolarHBondContact O-N 3.4Å; V276-K279 PolarHBondContact O-N 2.88Å; V276-A280 WeakPolarHBondContact O-CB 3.19Å; V276-A280 PolarHBondContact O-N 3.35Å
277F74.1Confident64.9Low62 Ų6244.6 Ų44.627%0.27226%0.255SS..Hα-helixtrans-60.2-49.2175.4-90.2-88.5000112.4I23 V27 I273 L274 K279 A280 F281I23-F277 HydrophobicContact CG2-CE1 4.35Å; I23-F277 HydrophobicContact CG2-CE2 3.4Å; I23-F277 HydrophobicContact CG2-CZ 3.22Å; V27-F277 HydrophobicContact CG2-CD1 4.02Å; V27-F277 HydrophobicContact CG2-CD2 4.39Å; V27-F277 HydrophobicContact CG2-CE1 3.72Å; V27-F277 HydrophobicContact CG2-CE2 4.14Å; V27-F277 HydrophobicContact CG2-CG 4.35Å; V27-F277 HydrophobicContact CG2-CZ 3.82Å; I273-F277 HydrophobicContact CG2-CD2 3.62Å; I273-F277 HydrophobicContact CG2-CE2 3.58Å; I273-F277 WeakPolarHBondContact O-CD2 3.42Å; I273-F277 PolarHBondContact O-N 3.26Å; L274-F277 HydrophobicContact CD1-CB 4.42Å; L274-F277 PolarHBondContact O-N 3.26Å; F277-K279 VanDerWaalsContact C-N 3.28Å; F277-K279 PolarHBondContact O-N 3.18Å; F277-A280 PolarHBondContact O-N 3.32Å; F277-A280 VanDerWaalsContact O-N 3.1Å; F277-F281 HydrophobicContact CD1-CD2 4.12Å; F277-F281 AromaticContact CD1-CE2 3.71Å; F277-F281 HydrophobicContact CD1-CE2 3.71Å; F277-F281 HydrophobicContact CE1-CE2 4.19Å; F277-F281 WeakPolarHBondContact O-CD2 3.26Å; F277-F281 PolarHBondContact O-N 3.41Å
278G71Confident65.7Low16 Ų1645.3 Ų45.317%0.16526%0.261CS..Hα-helixtrans-55.8-44178.600000112L274 V275 N282L274-G278 PolarHBondContact O-N 3.4Å; V275-G278 PolarHBondContact O-N 3.2Å; G278-N282 PolarHBondContact O-N 2.97Å; G278-N282 VanDerWaalsContact O-N 3.13Å
279K74.4Confident66.1Low18 Ų1840.5 Ų40.58%0.07823%0.232CC..Hα-helixtrans-65.7-39.7175.7-73-176.4-179-62.20112.9D62 F65 F66 S105 S108 V275 V276 F277D62-K279 IonicContact OD1-NZ 3.41Å; D62-K279 PolarHBondContact OD1-NZ 3.16Å; F65-K279 HydrophobicContact CD1-CD 3.61Å; F65-K279 HydrophobicContact CE1-CD 3.78Å; F65-K279 HydrophobicContact CG-CD 4.11Å; F65-K279 HydrophobicContact CZ-CD 4.39Å; F66-K279 HydrophobicContact CE2-CB 4.26Å; F66-K279 HydrophobicContact CZ-CB 4.06Å; S105-K279 WeakPolarHBondContact OG-CE 3.39Å; S108-K279 PolarHBondContact OG-NZ 3.47Å; V275-K279 HydrophobicContact CG1-CD 4.44Å; V275-K279 WeakPolarHBondContact O-CG 3.45Å; V275-K279 PolarHBondContact O-N 3.23Å; V276-K279 PolarHBondContact O-N 2.88Å; F277-K279 VanDerWaalsContact C-N 3.28Å; F277-K279 PolarHBondContact O-N 3.18Å
280A74.7Confident66.6Low0 Ų038.4 Ų38.40%022%0.218CC..Hα-helixtrans-68-39.718000000113V27 F66 V276 F277V27-A280 HydrophobicContact CB-CB 4.44Å; V27-A280 HydrophobicContact CG1-CB 3.43Å; V27-A280 VanDerWaalsContact CG1-CB 3.43Å; V27-A280 WeakPolarHBondContact O-CB 3.5Å; F66-A280 HydrophobicContact CZ-CB 4.02Å; V276-A280 WeakPolarHBondContact O-CB 3.19Å; V276-A280 PolarHBondContact O-N 3.35Å; F277-A280 PolarHBondContact O-N 3.32Å; F277-A280 VanDerWaalsContact O-N 3.1Å
281F71.4Confident67.2Low83 Ų8337 Ų3736%0.36421%0.211SC..Hα-helixtrans-86.4-9.1-177.5-77.4-89.3000113.9F26 F277 F283 V284 V285F26-F281 HydrophobicContact CE1-CZ 4.18Å; F277-F281 HydrophobicContact CD1-CD2 4.12Å; F277-F281 AromaticContact CD1-CE2 3.71Å; F277-F281 HydrophobicContact CD1-CE2 3.71Å; F277-F281 HydrophobicContact CE1-CE2 4.19Å; F277-F281 WeakPolarHBondContact O-CD2 3.26Å; F277-F281 PolarHBondContact O-N 3.41Å; F281-F283 PolarHBondContact O-N 3.22Å; F281-V284 HydrophobicContact CD1-CB 4.42Å; F281-V284 HydrophobicContact CD1-CG2 4.17Å; F281-V284 WeakPolarHBondContact O-CB 3.42Å; F281-V284 PolarHBondContact O-N 3.05Å; F281-V285 PolarHBondContact O-N 3.33Å
282N70.3Confident67.6Low32 Ų3239.1 Ų39.117%0.17123%0.226CC..Hα-helixtrans-55.4-38.9177.5-164.812.1000112.2G278 V284 V285 Y286G278-N282 PolarHBondContact O-N 2.97Å; G278-N282 VanDerWaalsContact O-N 3.13Å; N282-V284 PolarHBondContact O-N 3.25Å; N282-V285 WeakPolarHBondContact O-CB 2.94Å; N282-V285 PolarHBondContact O-N 3.23Å; N282-Y286 HydrophobicContact CB-CE2 4.34Å; N282-Y286 WeakPolarHBondContact ND2-CE2 3.43Å; N282-Y286 PolarHBondContact ND2-OH 3.28Å; N282-Y286 WeakPolarHBondContact O-CD2 2.81Å; N282-Y286 PolarHBondContact O-N 2.97Å; N282-Y286 WeakPolarHBondContact OD1-CE2 3.37Å
283F70.2Confident67.7Low21 Ų2135.8 Ų35.89%0.09221%0.207CC..Hα-helixtrans-60.3-45.9173.1170.1-102.2000113.2M30 G34 L37 I38 F281 V285 Y286 C287 F293M30-F283 HydrophobicContact CE-CD1 3.56Å; M30-F283 HydrophobicContact CE-CE1 4.16Å; M30-F283 HydrophobicContact CE-CG 4.47Å; G34-F283 VanDerWaalsContact CA-CB 3.45Å; G34-F283 VanDerWaalsContact O-CD2 3.25Å; G34-F283 WeakPolarHBondContact O-CD2 3.34Å; L37-F283 HydrophobicContact CB-CD2 4.23Å; L37-F283 HydrophobicContact CB-CE2 3.51Å; L37-F283 HydrophobicContact CB-CZ 3.89Å; L37-F283 HydrophobicContact CD1-CE1 3.88Å; L37-F283 HydrophobicContact CD1-CE2 3.91Å; L37-F283 HydrophobicContact CD1-CZ 3.34Å; L37-F283 HydrophobicContact CG-CE2 4.37Å; L37-F283 HydrophobicContact CG-CZ 4.26Å; I38-F283 HydrophobicContact CD1-CB 4.35Å; I38-F283 HydrophobicContact CD1-CD2 4.33Å; I38-F283 HydrophobicContact CG1-CD2 3.93Å; F281-F283 PolarHBondContact O-N 3.22Å; F283-V285 PolarHBondContact O-N 3.29Å; F283-Y286 PolarHBondContact O-N 2.95Å; F283-Y286 VanDerWaalsContact O-N 3.09Å; F283-C287 VanDerWaalsContact CE2-SG 3.54Å; F283-C287 WeakPolarHBondContact CZ-SG 3.43Å; F283-C287 PolarHBondContact O-N 3.4Å; F283-F293 HydrophobicContact CD2-CE1 4.05Å; F283-F293 HydrophobicContact CD2-CZ 4.28Å; F283-F293 AromaticContact CE2-CE1 3.67Å; F283-F293 HydrophobicContact CE2-CE1 3.67Å; F283-F293 HydrophobicContact CE2-CZ 4.01Å
284V70.2Confident68Low61 Ų6139.1 Ų39.137%0.3722%0.216SC..Hα-helixtrans-60-41.1178.9179.70000109.6M30 F281 N282 C287 A288M30-V284 HydrophobicContact CE-CG2 4.3Å; M30-V284 HydrophobicContact SD-CG2 4.23Å; F281-V284 HydrophobicContact CD1-CB 4.42Å; F281-V284 HydrophobicContact CD1-CG2 4.17Å; F281-V284 WeakPolarHBondContact O-CB 3.42Å; F281-V284 PolarHBondContact O-N 3.05Å; N282-V284 PolarHBondContact O-N 3.25Å; V284-C287 PolarHBondContact O-N 3.03Å; V284-A288 WeakPolarHBondContact O-CB 3.27Å; V284-A288 PolarHBondContact O-N 3.08Å
285V67.4Low68.3Low34 Ų3444.5 Ų44.521%0.20624%0.238CC..Hα-helixtrans-62.6-46.2173.6173.50000111.3S254 F281 N282 F283 C287 A288 S289S254-V285 VanDerWaalsContact OG-CG1 3.31Å; S254-V285 WeakPolarHBondContact OG-CG1 3.36Å; S254-V285 WeakPolarHBondContact OG-CG2 3.29Å; F281-V285 PolarHBondContact O-N 3.33Å; N282-V285 WeakPolarHBondContact O-CB 2.94Å; N282-V285 PolarHBondContact O-N 3.23Å; F283-V285 PolarHBondContact O-N 3.29Å; V285-C287 VanDerWaalsContact C-N 3.29Å; V285-C287 PolarHBondContact O-N 2.9Å; V285-A288 PolarHBondContact O-N 3.16Å; V285-S289 WeakPolarHBondContact O-CB 3.46Å; V285-S289 PolarHBondContact O-N 3.15Å
286Y66.6Low68.4Low57 Ų5746.3 Ų46.322%0.22424%0.244CC..Hα-helixtrans-59.6-40.5177.2-73.7-56.4000112I38 N282 F283 S290I38-Y286 HydrophobicContact CD1-CD2 3.76Å; I38-Y286 HydrophobicContact CD1-CE2 4Å; N282-Y286 HydrophobicContact CB-CE2 4.34Å; N282-Y286 WeakPolarHBondContact ND2-CE2 3.43Å; N282-Y286 PolarHBondContact ND2-OH 3.28Å; N282-Y286 WeakPolarHBondContact O-CD2 2.81Å; N282-Y286 PolarHBondContact O-N 2.97Å; N282-Y286 WeakPolarHBondContact OD1-CE2 3.37Å; F283-Y286 PolarHBondContact O-N 2.95Å; F283-Y286 VanDerWaalsContact O-N 3.09Å; Y286-S290 WeakPolarHBondContact O-CB 3.42Å; Y286-S290 PolarHBondContact O-N 3.4Å
287C65.7Low68.7Low25 Ų2546.4 Ų46.417%0.16925%0.245CC..Hα-helixtrans-63.9-48.8172.6-77.60000112.1F283 V284 V285 S289 R294F283-C287 VanDerWaalsContact CE2-SG 3.54Å; F283-C287 WeakPolarHBondContact CZ-SG 3.43Å; F283-C287 PolarHBondContact O-N 3.4Å; V284-C287 PolarHBondContact O-N 3.03Å; V285-C287 VanDerWaalsContact C-N 3.29Å; V285-C287 PolarHBondContact O-N 2.9Å; C287-S289 VanDerWaalsContact C-N 3.34Å; C287-S289 PolarHBondContact O-N 2.87Å; C287-R294 HydrophobicContact CB-CG 4.47Å; C287-R294 WeakPolarHBondContact O-CD 3.21Å; C287-R294 WeakPolarHBondContact O-CG 3.1Å; C287-R294 PolarHBondContact O-NE 3.33Å; C287-R294 VanDerWaalsContact O-NE 3.11Å
288A63.3Low68.8Low55 Ų5548.1 Ų48.146%0.45525%0.254SS..Hα-helixtrans-62.2-42.4179.500000111.7V284 V285V284-A288 WeakPolarHBondContact O-CB 3.27Å; V284-A288 PolarHBondContact O-N 3.08Å; V285-A288 PolarHBondContact O-N 3.16Å
289S59.1Low69Low13 Ų1356.1 Ų56.19%0.09128%0.279CS..Hα-helixtrans-76.1-38-174.2178.50000113.4R247 V285 C287R247-S289 WeakPolarHBondContact CB-O 3.39Å; R247-S289 WeakPolarHBondContact CD-O 3.35Å; R247-S289 VanDerWaalsContact CG-O 3.23Å; R247-S289 WeakPolarHBondContact CG-O 3.28Å; R247-S289 PolarHBondContact O-OG 3.11Å; R247-S289 VanDerWaalsContact O-OG 3.05Å; V285-S289 WeakPolarHBondContact O-CB 3.46Å; V285-S289 PolarHBondContact O-N 3.15Å; C287-S289 VanDerWaalsContact C-N 3.34Å; C287-S289 PolarHBondContact O-N 2.87Å
290S62.1Low69Low39 Ų3956.5 Ų56.527%0.27328%0.282SS..  trans-115109.4-169.3-179.90000113.3Y286 S292 F293 R294Y286-S290 WeakPolarHBondContact O-CB 3.42Å; Y286-S290 PolarHBondContact O-N 3.4Å; S290-S292 VanDerWaalsContact C-N 3.29Å; S290-S292 PolarHBondContact O-N 3.34Å; S290-F293 PolarHBondContact O-N 3.46Å; S290-F293 WeakPolarHBondContact OG-CB 3.42Å; S290-F293 PolarHBondContact OG-N 3.38Å; S290-R294 WeakPolarHBondContact O-CG 3.13Å; S290-R294 PolarHBondContact O-N 2.94Å
291S61.4Low69.2Low30 Ų3060.6 Ų60.621%0.2130%0.303CS..Hα-helixtrans-63-36.1170.8600000111.9F293 R294 K295S291-F293 VanDerWaalsContact C-N 3.34Å; S291-R294 PolarHBondContact O-N 2.85Å; S291-K295 WeakPolarHBondContact O-CB 3.16Å; S291-K295 WeakPolarHBondContact O-CG 3.44Å; S291-K295 PolarHBondContact O-N 3.49Å
292S63.3Low69.3Low69 Ų6963 Ų6348%0.48331%0.313SS..Hα-helixtrans-64.8-38.1174.8-56.20000111.9S290 K296S290-S292 VanDerWaalsContact C-N 3.29Å; S290-S292 PolarHBondContact O-N 3.34Å; S292-K296 VanDerWaalsContact O-CG 3.27Å; S292-K296 WeakPolarHBondContact O-CG 3.49Å; S292-K296 PolarHBondContact O-N 3.01Å
293F65.8Low69.1Low21 Ų2166.4 Ų66.49%0.09233%0.332CS..Hα-helixtrans-70-44.1174-172.4-103000111.2I38 A41 F283 S290 S291 K295 K296 V297I38-F293 HydrophobicContact CB-CZ 4.49Å; I38-F293 HydrophobicContact CG1-CE2 4.45Å; I38-F293 HydrophobicContact CG1-CZ 3.85Å; A41-F293 HydrophobicContact CB-CD2 4.34Å; A41-F293 HydrophobicContact CB-CE2 3.67Å; A41-F293 HydrophobicContact CB-CZ 4.12Å; F283-F293 HydrophobicContact CD2-CE1 4.05Å; F283-F293 HydrophobicContact CD2-CZ 4.28Å; F283-F293 AromaticContact CE2-CE1 3.67Å; F283-F293 HydrophobicContact CE2-CE1 3.67Å; F283-F293 HydrophobicContact CE2-CZ 4.01Å; S290-F293 PolarHBondContact O-N 3.46Å; S290-F293 WeakPolarHBondContact OG-CB 3.42Å; S290-F293 PolarHBondContact OG-N 3.38Å; S291-F293 VanDerWaalsContact C-N 3.34Å; F293-K295 VanDerWaalsContact C-N 3.34Å; F293-K295 PolarHBondContact O-N 3.5Å; F293-K296 WeakPolarHBondContact O-CA 3.39Å; F293-K296 WeakPolarHBondContact O-CB 3.48Å; F293-K296 PolarHBondContact O-N 2.78Å; F293-V297 HydrophobicContact CD1-CG2 3.95Å; F293-V297 HydrophobicContact CE1-CG2 3.58Å; F293-V297 HydrophobicContact CE2-CG2 4.47Å; F293-V297 HydrophobicContact CZ-CG2 3.86Å; F293-V297 WeakPolarHBondContact O-CG2 3.41Å; F293-V297 PolarHBondContact O-N 3.27Å
294R74Confident68.5Low116 Ų11673.2 Ų73.244%0.43836%0.356SS..Hα-helixtrans-54.9-47.4173.2-76.7-176-79.1167.7-5.6112.3C287 S290 S291 K296 V297 Q298C287-R294 HydrophobicContact CB-CG 4.47Å; C287-R294 WeakPolarHBondContact O-CD 3.21Å; C287-R294 WeakPolarHBondContact O-CG 3.1Å; C287-R294 PolarHBondContact O-NE 3.33Å; C287-R294 VanDerWaalsContact O-NE 3.11Å; S290-R294 WeakPolarHBondContact O-CG 3.13Å; S290-R294 PolarHBondContact O-N 2.94Å; S291-R294 PolarHBondContact O-N 2.85Å; R294-K296 VanDerWaalsContact C-N 3.27Å; R294-K296 PolarHBondContact O-N 3.44Å; R294-V297 PolarHBondContact O-N 2.89Å; R294-Q298 VanDerWaalsContact O-CB 3.25Å; R294-Q298 WeakPolarHBondContact O-CB 3.48Å; R294-Q298 VanDerWaalsContact O-CG 3.24Å; R294-Q298 WeakPolarHBondContact O-CG 3.49Å; R294-Q298 PolarHBondContact O-N 3.25Å
295K71.7Confident67.9Low145 Ų14574.5 Ų74.563%0.6337%0.365SS*.Hα-helixtrans-59-38176-74.6-179.6-179.6-172.10112S291 F293 R299S291-K295 WeakPolarHBondContact O-CB 3.16Å; S291-K295 WeakPolarHBondContact O-CG 3.44Å; S291-K295 PolarHBondContact O-N 3.49Å; F293-K295 VanDerWaalsContact C-N 3.34Å; F293-K295 PolarHBondContact O-N 3.5Å; K295-R299 VanDerWaalsContact O-CB 3.27Å; K295-R299 WeakPolarHBondContact O-CB 3.48Å; K295-R299 PolarHBondContact O-N 2.66Å
296K71.4Confident67.4Low63 Ų6377.2 Ų77.227%0.27438%0.381SS..Hα-helixtrans-67.6-46.9176-70.4167.6-179.6-1710112.1A41 A45 S292 F293 R294 R299 L300A41-K296 HydrophobicContact CB-CB 4.32Å; A45-K296 HydrophobicContact CB-CD 3.81Å; A45-K296 HydrophobicContact CB-CG 4.42Å; S292-K296 VanDerWaalsContact O-CG 3.27Å; S292-K296 WeakPolarHBondContact O-CG 3.49Å; S292-K296 PolarHBondContact O-N 3.01Å; F293-K296 WeakPolarHBondContact O-CA 3.39Å; F293-K296 WeakPolarHBondContact O-CB 3.48Å; F293-K296 PolarHBondContact O-N 2.78Å; R294-K296 VanDerWaalsContact C-N 3.27Å; R294-K296 PolarHBondContact O-N 3.44Å; K296-R299 PolarHBondContact O-N 2.92Å; K296-L300 WeakPolarHBondContact O-CB 3.39Å; K296-L300 PolarHBondContact O-N 2.92Å
297V74.2Confident66.9Low14 Ų1478.2 Ų78.29%0.08540%0.396CS..Hα-helixtrans-62.6-46.2176.3173.80000110.4A41 F293 R294 R299 L300 L301A41-V297 HydrophobicContact CB-CG2 4.14Å; F293-V297 HydrophobicContact CD1-CG2 3.95Å; F293-V297 HydrophobicContact CE1-CG2 3.58Å; F293-V297 HydrophobicContact CE2-CG2 4.47Å; F293-V297 HydrophobicContact CZ-CG2 3.86Å; F293-V297 WeakPolarHBondContact O-CG2 3.41Å; F293-V297 PolarHBondContact O-N 3.27Å; R294-V297 PolarHBondContact O-N 2.89Å; V297-R299 PolarHBondContact O-N 3.42Å; V297-L300 WeakPolarHBondContact O-CB 2.85Å; V297-L300 PolarHBondContact O-N 3.14Å; V297-L300 VanDerWaalsContact O-N 3.15Å; V297-L301 HydrophobicContact CG1-CD1 3.9Å; V297-L301 HydrophobicContact CG1-CG 4.33Å; V297-L301 WeakPolarHBondContact O-CG 3.43Å; V297-L301 PolarHBondContact O-N 3.23Å
298Q76.8Confident66.3Low98 Ų9884.9 Ų84.946%0.45842%0.422SS..Hα-helixtrans-57.3-49.6174.3-76.9173.6-20.700110.7R294 L300 L301 F302R294-Q298 VanDerWaalsContact O-CB 3.25Å; R294-Q298 WeakPolarHBondContact O-CB 3.48Å; R294-Q298 VanDerWaalsContact O-CG 3.24Å; R294-Q298 WeakPolarHBondContact O-CG 3.49Å; R294-Q298 PolarHBondContact O-N 3.25Å; Q298-L300 PolarHBondContact O-N 3.27Å; Q298-L301 PolarHBondContact O-N 3.47Å; Q298-L301 VanDerWaalsContact O-N 3.14Å; Q298-F302 HydrophobicContact CB-CD2 4.03Å; Q298-F302 HydrophobicContact CB-CE2 4.24Å; Q298-F302 HydrophobicContact CG-CE2 4.44Å; Q298-F302 VanDerWaalsContact O-CB 3.32Å; Q298-F302 WeakPolarHBondContact O-CB 3.47Å; Q298-F302 WeakPolarHBondContact O-CD2 3.28Å; Q298-F302 PolarHBondContact O-N 3.28Å
299R74.2Confident65.7Low184 Ų18489.2 Ų89.269%0.69443%0.433SS*.Hα-helixtrans-56.7-40.9177-170176.5-174.5172.22.1111.6K295 K296 V297 L303K295-R299 VanDerWaalsContact O-CB 3.27Å; K295-R299 WeakPolarHBondContact O-CB 3.48Å; K295-R299 PolarHBondContact O-N 2.66Å; K296-R299 PolarHBondContact O-N 2.92Å; V297-R299 PolarHBondContact O-N 3.42Å; R299-L303 HydrophobicContact CG-CD1 3.94Å; R299-L303 HydrophobicContact CG-CG 4.33Å; R299-L303 VanDerWaalsContact O-CB 3.23Å; R299-L303 WeakPolarHBondContact O-CB 3.5Å; R299-L303 WeakPolarHBondContact O-CD1 3.44Å; R299-L303 WeakPolarHBondContact O-CG 3.24Å; R299-L303 PolarHBondContact O-N 3.36Å
300L76.2Confident65.5Low27 Ų2795.6 Ų95.614%0.14146%0.46CS..Hα-helixtrans-65.8-42.4177-170.6125.3000112.8L37 L40 A44 K296 V297 Q298 R304L37-L300 HydrophobicContact CD2-CD2 4.35Å; L40-L300 HydrophobicContact CB-CD1 3.73Å; L40-L300 HydrophobicContact CB-CD2 4.35Å; L40-L300 HydrophobicContact CD1-CD2 4.24Å; A44-L300 HydrophobicContact CB-CD1 4.02Å; K296-L300 WeakPolarHBondContact O-CB 3.39Å; K296-L300 PolarHBondContact O-N 2.92Å; V297-L300 WeakPolarHBondContact O-CB 2.85Å; V297-L300 PolarHBondContact O-N 3.14Å; V297-L300 VanDerWaalsContact O-N 3.15Å; Q298-L300 PolarHBondContact O-N 3.27Å; L300-R304 PolarHBondContact O-N 3.07Å
301L78.8Confident65Low85 Ų8599.1 Ų99.145%0.44548%0.475SS..Hα-helixtrans-71.8-44.9178.3-66.4175.5000111.9V297 Q298 R304 T305V297-L301 HydrophobicContact CG1-CD1 3.9Å; V297-L301 HydrophobicContact CG1-CG 4.33Å; V297-L301 WeakPolarHBondContact O-CG 3.43Å; V297-L301 PolarHBondContact O-N 3.23Å; Q298-L301 PolarHBondContact O-N 3.47Å; Q298-L301 VanDerWaalsContact O-N 3.14Å; L301-R304 WeakPolarHBondContact O-CB 3.41Å; L301-R304 PolarHBondContact O-N 2.92Å; L301-T305 PolarHBondContact O-N 3.4Å; L301-T305 VanDerWaalsContact O-N 3.09Å; L301-T305 PolarHBondContact O-OG1 2.94Å
302F73.3Confident64.5Low133 Ų133103.9 Ų103.958%0.58350%0.498SS*.Hα-helixtrans-66.4-38.3177.7-82.6-72.7000112.5Q298 R304 T305 V306Q298-F302 HydrophobicContact CB-CD2 4.03Å; Q298-F302 HydrophobicContact CB-CE2 4.24Å; Q298-F302 HydrophobicContact CG-CE2 4.44Å; Q298-F302 VanDerWaalsContact O-CB 3.32Å; Q298-F302 WeakPolarHBondContact O-CB 3.47Å; Q298-F302 WeakPolarHBondContact O-CD2 3.28Å; Q298-F302 PolarHBondContact O-N 3.28Å; F302-R304 PolarHBondContact O-N 2.86Å; F302-T305 PolarHBondContact O-N 2.92Å; F302-T305 VanDerWaalsContact O-N 3.09Å; F302-V306 WeakPolarHBondContact O-CG2 3.31Å; F302-V306 PolarHBondContact O-N 3.23Å
303L64.8Low64Low105 Ų105102.6 Ų102.655%0.5549%0.489SS..Hα-helixtrans-61-34.5173.4-77.1170.4000111.7R299 S307R299-L303 HydrophobicContact CG-CD1 3.94Å; R299-L303 HydrophobicContact CG-CG 4.33Å; R299-L303 VanDerWaalsContact O-CB 3.23Å; R299-L303 WeakPolarHBondContact O-CB 3.5Å; R299-L303 WeakPolarHBondContact O-CD1 3.44Å; R299-L303 WeakPolarHBondContact O-CG 3.24Å; R299-L303 PolarHBondContact O-N 3.36Å; L303-S307 WeakPolarHBondContact O-CB 3.36Å; L303-S307 PolarHBondContact O-N 3.05Å
304R58.7Low63.3Low163 Ų163104.2 Ų104.262%0.61550%0.503SS*.Hα-helixtrans-68.4-38.5172.3-80.5-177.1170.3178.9-2.7112.3L300 L301 F302 K308L300-R304 PolarHBondContact O-N 3.07Å; L301-R304 WeakPolarHBondContact O-CB 3.41Å; L301-R304 PolarHBondContact O-N 2.92Å; F302-R304 PolarHBondContact O-N 2.86Å; R304-K308 PolarHBondContact O-N 3.49Å; R304-K308 VanDerWaalsContact O-N 3.12Å
305T57Low62.2Low89 Ų89106.1 Ų106.155%0.54652%0.517SS..Hα-helixtrans-68-44.3176.8-510000112L301 F302 K308 H309L301-T305 PolarHBondContact O-N 3.4Å; L301-T305 VanDerWaalsContact O-N 3.09Å; L301-T305 PolarHBondContact O-OG1 2.94Å; F302-T305 PolarHBondContact O-N 2.92Å; F302-T305 VanDerWaalsContact O-N 3.09Å; T305-K308 PolarHBondContact O-N 3.18Å; T305-H309 PolarHBondContact O-N 3.49Å; T305-H309 VanDerWaalsContact O-N 3.14Å
306V56.5Low61.2Low90 Ų90109.6 Ų109.655%0.54553%0.526SS..Hα-helixtrans-69.8-39.8178.3175.40000111.3F302 K308 H309 F310F302-V306 WeakPolarHBondContact O-CG2 3.31Å; F302-V306 PolarHBondContact O-N 3.23Å; V306-K308 VanDerWaalsContact C-N 3.31Å; V306-K308 PolarHBondContact O-N 3.12Å; V306-H309 PolarHBondContact O-N 2.75Å; V306-H309 VanDerWaalsContact O-N 3.09Å; V306-F310 PolarHBondContact O-N 3.09Å
307S55.9Low60.1Low78 Ų78112.6 Ų112.655%0.54554%0.541SS..Hα-helixtrans-61.5-38174.3175.60000112L303 F310 N311L303-S307 WeakPolarHBondContact O-CB 3.36Å; L303-S307 PolarHBondContact O-N 3.05Å; S307-F310 PolarHBondContact O-N 2.83Å; S307-N311 PolarHBondContact O-N 2.95Å
308K52.7Low59Low165 Ų165121.2 Ų121.272%0.71757%0.572SS**Hα-helixtrans-62.7-40171.3-82.9-175.7174.1-174.90112.5R304 T305 V306 N312R304-K308 PolarHBondContact O-N 3.49Å; R304-K308 VanDerWaalsContact O-N 3.12Å; T305-K308 PolarHBondContact O-N 3.18Å; V306-K308 VanDerWaalsContact C-N 3.31Å; V306-K308 PolarHBondContact O-N 3.12Å; K308-N312 PolarHBondContact O-N 2.87Å
309H51.8Low57.8Low147 Ų147124.3 Ų124.368%0.68159%0.586SS**Hα-helixtrans-68.2-40.4177.2-166.178.3000112.2T305 V306 N312 S313T305-H309 PolarHBondContact O-N 3.49Å; T305-H309 VanDerWaalsContact O-N 3.14Å; V306-H309 PolarHBondContact O-N 2.75Å; V306-H309 VanDerWaalsContact O-N 3.09Å; H309-N312 PolarHBondContact O-N 2.96Å; H309-S313 PolarHBondContact O-N 3.07Å; H309-S313 PolarHBondContact O-OG 3.28Å
310F53.9Low56.8Low147 Ų147118.9 Ų118.965%0.64558%0.576SS**Hα-helixtrans-70.3-31.8-179.5-150.7-92.8000113.1V306 S307 N312 S313 S314V306-F310 PolarHBondContact O-N 3.09Å; S307-F310 PolarHBondContact O-N 2.83Å; F310-N312 VanDerWaalsContact C-N 3.33Å; F310-S313 WeakPolarHBondContact CA-OG 3.48Å; F310-S313 PolarHBondContact O-N 3.26Å; F310-S313 PolarHBondContact O-OG 3.5Å; F310-S313 VanDerWaalsContact O-OG 3.07Å; F310-S314 WeakPolarHBondContact O-CB 3.12Å; F310-S314 PolarHBondContact O-N 3.37Å
311N52.1Low55.4Low112 Ų112122.5 Ų122.560%0.59960%0.596SS**Hα-helixtrans-69.4-33.4176.5-139.928.2000111.9S307S307-N311 PolarHBondContact O-N 2.95Å
312N51.8Low54Low131 Ų131123.9 Ų123.970%0.70160%0.604SS**Hα-helixtrans-70.5-30.5172.9-85.96.9000112.9K308 H309 F310K308-N312 PolarHBondContact O-N 2.87Å; H309-N312 PolarHBondContact O-N 2.96Å; F310-N312 VanDerWaalsContact C-N 3.33Å
313S52.2Low53Low41 Ų41121.9 Ų121.929%0.28760%0.602SS.*Hα-helixtrans-84.5-29.9177.447.80000113.9H309 F310 H315 R316 H317H309-S313 PolarHBondContact O-N 3.07Å; H309-S313 PolarHBondContact O-OG 3.28Å; F310-S313 WeakPolarHBondContact CA-OG 3.48Å; F310-S313 PolarHBondContact O-N 3.26Å; F310-S313 PolarHBondContact O-OG 3.5Å; F310-S313 VanDerWaalsContact O-OG 3.07Å; S313-H315 VanDerWaalsContact C-N 3.3Å; S313-H315 PolarHBondContact O-N 3.23Å; S313-R316 PolarHBondContact O-N 3.01Å; S313-H317 PolarHBondContact O-N 2.83Å; S313-H317 VanDerWaalsContact O-N 3.14Å
314S52.1Low52.5Low56 Ų56120.5 Ų120.539%0.39260%0.598SS.*Hα-helixtrans-60.7-36.5175.3-173.90000112.7F310 R316 H317 R318F310-S314 WeakPolarHBondContact O-CB 3.12Å; F310-S314 PolarHBondContact O-N 3.37Å; S314-R316 VanDerWaalsContact C-N 3.25Å; S314-R316 PolarHBondContact O-N 2.92Å; S314-H317 PolarHBondContact O-N 2.96Å; S314-R318 PolarHBondContact O-N 2.89Å; S314-R318 VanDerWaalsContact O-N 3.13Å
315H50.5Low52.1Low155 Ų155116.6 Ų116.672%0.71859%0.593SS**Hα-helixtrans-61.9-30.2173.1-98.2-67.2000113.4S313S313-H315 VanDerWaalsContact C-N 3.3Å; S313-H315 PolarHBondContact O-N 3.23Å
316R50.8Low51.7Low218 Ų218116 Ų11682%0.82359%0.592SS**Hα-helixtrans-78.5-38.6174.8-85.2-177.7171.7179.4-2.9112.6S313 S314S313-R316 PolarHBondContact O-N 3.01Å; S314-R316 VanDerWaalsContact C-N 3.25Å; S314-R316 PolarHBondContact O-N 2.92Å
317H48Very low51.5Low127 Ų127117.9 Ų117.959%0.58860%0.595SS**Hα-helixtrans-73.6-33.9-177.3-90.9-64.6000114.3S313 S314 H319 S320 N321S313-H317 PolarHBondContact O-N 2.83Å; S313-H317 VanDerWaalsContact O-N 3.14Å; S314-H317 PolarHBondContact O-N 2.96Å; H317-H319 PolarHBondContact O-N 3.12Å; H317-S320 PolarHBondContact O-N 2.85Å; H317-N321 PolarHBondContact O-N 3.32Å
318R51.1Low51.3Low194 Ų194119 Ų11973%0.73259%0.594SS**Hα-helixtrans-62.7-26-179.8-164.6173.2177.3178.8-2.1112.9S314 S320S314-R318 PolarHBondContact O-N 2.89Å; S314-R318 VanDerWaalsContact O-N 3.13Å; R318-S320 VanDerWaalsContact C-N 3.34Å
319H51.9Low51.1Low163 Ų163116.6 Ų116.676%0.75559%0.589SS**Hα-helixtrans-74.6-23.4177.2-130.4-50.6000113.5H317H317-H319 PolarHBondContact O-N 3.12Å
320S52.3Low51.6Low71 Ų71113.1 Ų113.150%0.49758%0.582SS.*Hα-helixtrans-91.5-32-176-168.80000113.6H317 R318H317-S320 PolarHBondContact O-N 2.85Å; R318-S320 VanDerWaalsContact C-N 3.34Å
321N47.2Very low52.2Low102 Ų102112 Ų11255%0.54558%0.578SS.*Hα-helixtrans-75.9-31.4-173.7-77.76.3000113.5H317 T323 V324 T325H317-N321 PolarHBondContact O-N 3.32Å; N321-T323 PolarHBondContact O-N 3.08Å; N321-V324 PolarHBondContact O-N 2.7Å; N321-T325 PolarHBondContact O-OG1 3.24Å
322N50.2Low52.8Low115 Ų115112 Ų11262%0.61557%0.574SS**Hα-helixtrans-63.1-24.3-178.8-74.33000113
323T52.5Low53.5Low90 Ų90112.6 Ų112.655%0.55257%0.573SS**Hα-helixtrans-80.6-26.7-178.6-42.20000112.8N321 S326N321-T323 PolarHBondContact O-N 3.08Å; T323-S326 PolarHBondContact O-OG 3Å
324V53.9Low54.4Low77 Ų77114.1 Ų114.147%0.46758%0.583SS.*Hα-helixtrans-85.6-38.2-174.9-179.80000111.6N321 S326 Q327 L328N321-V324 PolarHBondContact O-N 2.7Å; V324-S326 VanDerWaalsContact C-N 3.33Å; V324-S326 PolarHBondContact O-N 3.46Å; V324-Q327 PolarHBondContact O-N 3Å; V324-L328 HydrophobicContact CG1-CD1 4.24Å
325T49.3Very low55.5Low81 Ų81116.6 Ų116.650%0.49759%0.59SS.*Hα-helixtrans-63.2-35.5179.827.30000113.1N321 Q327 L328 D329N321-T325 PolarHBondContact O-OG1 3.24Å; T325-Q327 PolarHBondContact O-N 3.08Å; T325-L328 PolarHBondContact O-N 2.93Å; T325-D329 PolarHBondContact O-N 2.8Å
326S49.9Very low56.3Low76 Ų76113.5 Ų113.553%0.53158%0.579SS.*Hα-helixtrans-66.4-24.7178.757.40000113.8T323 V324T323-S326 PolarHBondContact O-OG 3Å; V324-S326 VanDerWaalsContact C-N 3.33Å; V324-S326 PolarHBondContact O-N 3.46Å
327Q51.5Low57.5Low129 Ų129109.9 Ų109.960%0.60357%0.571SS**Hα-helixtrans-79-42.5178.6-73.4-179.3-44.400111.9V324 T325 D329 S330 E331V324-Q327 PolarHBondContact O-N 3Å; T325-Q327 PolarHBondContact O-N 3.08Å; Q327-D329 PolarHBondContact O-N 3.28Å; Q327-S330 PolarHBondContact O-N 3.3Å; Q327-S330 PolarHBondContact O-OG 2.97Å; Q327-E331 PolarHBondContact O-N 3.42Å
328L50.8Low58.9Low102 Ų102109.2 Ų109.253%0.53457%0.568SS.*Hα-helixtrans-64.2-39.1-178.3-87.2151.1000113.6V324 T325 S330 E331 H332V324-L328 HydrophobicContact CG1-CD1 4.24Å; T325-L328 PolarHBondContact O-N 2.93Å; L328-S330 VanDerWaalsContact C-N 3.29Å; L328-S330 PolarHBondContact O-N 3.3Å; L328-E331 PolarHBondContact O-N 2.94Å; L328-H332 PolarHBondContact O-N 3.46Å; L328-H332 VanDerWaalsContact O-N 3.17Å
329D49.3Very low60.2Low114 Ų114106.5 Ų106.561%0.6156%0.561SS**Hα-helixtrans-64.8-36.3-179.4-69.7-21.9000111.4T325 Q327 H332 E333T325-D329 PolarHBondContact O-N 2.8Å; Q327-D329 PolarHBondContact O-N 3.28Å; D329-H332 PolarHBondContact O-N 3.27Å; D329-E333 PolarHBondContact O-N 3.42Å
330S62.3Low61.3Low75 Ų75102.5 Ų102.552%0.52455%0.549SS..Hα-helixtrans-67.7-36.1178.174.40000113.2Q327 L328Q327-S330 PolarHBondContact O-N 3.3Å; Q327-S330 PolarHBondContact O-OG 2.97Å; L328-S330 VanDerWaalsContact C-N 3.29Å; L328-S330 PolarHBondContact O-N 3.3Å
331E67.1Low62.7Low124 Ų124106.2 Ų106.258%0.57956%0.556SS**Hα-helixtrans-71.9-38.1178-70.5-177159.600111.4Q327 L328 S334 M335Q327-E331 PolarHBondContact O-N 3.42Å; L328-E331 PolarHBondContact O-N 2.94Å; E331-S334 PolarHBondContact O-N 2.97Å; E331-S334 PolarHBondContact O-OG 2.75Å; E331-M335 PolarHBondContact O-N 3.08Å
332H64.2Low64.2Low111 Ų111108.8 Ų108.851%0.51456%0.558SS.*Hα-helixtrans-65.7-41.1-177.8-168.352.8000113.1L328 D329 S334 M335 L336L328-H332 PolarHBondContact O-N 3.46Å; L328-H332 VanDerWaalsContact O-N 3.17Å; D329-H332 PolarHBondContact O-N 3.27Å; H332-S334 VanDerWaalsContact C-N 3.3Å; H332-S334 PolarHBondContact O-N 2.99Å; H332-M335 PolarHBondContact O-N 3.16Å; H332-L336 PolarHBondContact O-N 3.38Å
333E66.9Low65.3Low144 Ų144108.6 Ų108.667%0.67356%0.557SS**Hα-helixtrans-63.1-36.5177.2-74.7-167.8153.300112.3D329 L336 Q337D329-E333 PolarHBondContact O-N 3.42Å; E333-L336 PolarHBondContact O-N 3.36Å; E333-Q337 WeakPolarHBondContact O-CG 3.4Å; E333-Q337 PolarHBondContact O-N 3.36Å
334S70.3Confident66.6Low72 Ų72113 Ų11350%0.50356%0.563SS.*Hα-helixtrans-64.7-40.8178.977.70000112.6E331 H332 E338E331-S334 PolarHBondContact O-N 2.97Å; E331-S334 PolarHBondContact O-OG 2.75Å; H332-S334 VanDerWaalsContact C-N 3.3Å; H332-S334 PolarHBondContact O-N 2.99Å; S334-E338 PolarHBondContact O-N 2.1Å
335M74.5Confident67.8Low108 Ų108114.4 Ų114.453%0.53257%0.567SS.*Hα-helixtrans-68.8-35.1178.4-73.5-157.1-61.100113E331 H332 E338 K339E331-M335 PolarHBondContact O-N 3.08Å; H332-M335 PolarHBondContact O-N 3.16Å; M335-E338 PolarHBondContact O-N 3.07Å; M335-K339 PolarHBondContact O-N 3.23Å
336L69.3Low69.1Low91 Ų91112.1 Ų112.148%0.47656%0.56SS.*Hα-helixtrans-65.4-43.4178.3-94156.1000111.5H332 E333 E338 K339 V340H332-L336 PolarHBondContact O-N 3.38Å; E333-L336 PolarHBondContact O-N 3.36Å; L336-E338 VanDerWaalsContact C-N 3.28Å; L336-E338 PolarHBondContact O-N 3.45Å; L336-K339 PolarHBondContact O-N 2.87Å; L336-V340 WeakPolarHBondContact O-CG2 3.31Å; L336-V340 PolarHBondContact O-N 2.81Å
337Q74.3Confident70.3Confident142 Ų142113.4 Ų113.466%0.66456%0.56SS**Hα-helixtrans-58.8-39.6176-74.1-91.8-25.100112.1E333 K341E333-Q337 WeakPolarHBondContact O-CG 3.4Å; E333-Q337 PolarHBondContact O-N 3.36Å; Q337-K341 PolarHBondContact O-N 2.99Å
338E79.1Confident71.4Confident113 Ų113112.8 Ų112.853%0.52856%0.561SS.*Hα-helixtrans-70.4-40.1-178.9-160.1-171.7152.800112.8S334 M335 L336 V340 K341 R342S334-E338 PolarHBondContact O-N 2.1Å; M335-E338 PolarHBondContact O-N 3.07Å; L336-E338 VanDerWaalsContact C-N 3.28Å; L336-E338 PolarHBondContact O-N 3.45Å; E338-V340 PolarHBondContact O-N 2.84Å; E338-K341 PolarHBondContact O-N 3.48Å; E338-R342 PolarHBondContact O-N 3.07Å; E338-R342 VanDerWaalsContact O-N 3.16Å; E338-R342 IonicContact OE1-NH2 2.71Å; E338-R342 PolarHBondContact OE1-NH2 3.26Å
339K78Confident72.7Confident136 Ų136112.9 Ų112.959%0.59156%0.561SS**Hα-helixtrans-62.4-42.1175.3-78.9-177.2177.4178.10112.2M335 L336 K341 R342 N343M335-K339 PolarHBondContact O-N 3.23Å; L336-K339 PolarHBondContact O-N 2.87Å; K339-K341 VanDerWaalsContact C-N 3.34Å; K339-K341 PolarHBondContact O-N 3.23Å; K339-R342 PolarHBondContact O-N 3.07Å; K339-N343 PolarHBondContact O-N 2.88Å; K339-N343 VanDerWaalsContact O-N 3.15Å
340V74.8Confident73.9Confident80 Ų80113.3 Ų113.349%0.48556%0.56SS.*Hα-helixtrans-63.8-39.4179173.80000111.4L336 E338 R344L336-V340 WeakPolarHBondContact O-CG2 3.31Å; L336-V340 PolarHBondContact O-N 2.81Å; E338-V340 PolarHBondContact O-N 2.84Å; V340-R344 PolarHBondContact O-N 3.4Å
341K82Confident74.4Confident148 Ų148116.4 Ų116.464%0.64357%0.568SS**Hα-helixtrans-62.4-45.1174.7-88.3-177.1176.9176.40112.4Q337 E338 K339 N343 R344 I345Q337-K341 PolarHBondContact O-N 2.99Å; E338-K341 PolarHBondContact O-N 3.48Å; K339-K341 VanDerWaalsContact C-N 3.34Å; K339-K341 PolarHBondContact O-N 3.23Å; K341-N343 PolarHBondContact O-N 3.08Å; K341-R344 PolarHBondContact O-N 2.7Å; K341-I345 PolarHBondContact O-N 2.98Å
342R78.3Confident74.9Confident156 Ų156117.9 Ų117.959%0.58957%0.572SS**Hα-helixtrans-60.8-43.8179-96.2-169-80.9-158.7-10.5112.7E338 K339 R344 I345 G346E338-R342 PolarHBondContact O-N 3.07Å; E338-R342 VanDerWaalsContact O-N 3.16Å; E338-R342 IonicContact OE1-NH2 2.71Å; E338-R342 PolarHBondContact OE1-NH2 3.26Å; K339-R342 PolarHBondContact O-N 3.07Å; R342-R344 VanDerWaalsContact C-N 3.33Å; R342-R344 PolarHBondContact O-N 3.47Å; R342-I345 PolarHBondContact O-N 3.12Å; R342-G346 PolarHBondContact O-N 2.86Å; R342-G346 VanDerWaalsContact O-N 3.11Å
343N74.1Confident75.4Confident111 Ų111119.3 Ų119.359%0.59458%0.579SS**Hα-helixtrans-63.7-37.1179.8-73.70000112.6K339 K341 I345 G346 N347K339-N343 PolarHBondContact O-N 2.88Å; K339-N343 VanDerWaalsContact O-N 3.15Å; K341-N343 PolarHBondContact O-N 3.08Å; N343-I345 VanDerWaalsContact C-N 3.34Å; N343-I345 PolarHBondContact O-N 2.81Å; N343-G346 PolarHBondContact O-N 2.87Å; N343-N347 PolarHBondContact O-N 2.81Å; N343-N347 PolarHBondContact O-OD1 3.24Å
344R78.5Confident75.6Confident182 Ų182118.2 Ų118.269%0.68758%0.577SS**Hα-helixtrans-64.1-38175.4-79.5-172.7-169.2178.63.9112.9V340 K341 R342 L348V340-R344 PolarHBondContact O-N 3.4Å; K341-R344 PolarHBondContact O-N 2.7Å; R342-R344 VanDerWaalsContact C-N 3.33Å; R342-R344 PolarHBondContact O-N 3.47Å; R344-L348 PolarHBondContact O-N 3.46Å
345I80.3Confident75.6Confident107 Ų107122.2 Ų122.255%0.54959%0.587SS.*Hα-helixtrans-68.6-42.2179.7-65.3167.8000110.5K341 R342 N343 L348 L349K341-I345 PolarHBondContact O-N 2.98Å; R342-I345 PolarHBondContact O-N 3.12Å; N343-I345 VanDerWaalsContact C-N 3.34Å; N343-I345 PolarHBondContact O-N 2.81Å; I345-L348 PolarHBondContact O-N 3.18Å; I345-L349 HydrophobicContact CG2-CD1 4.16Å; I345-L349 PolarHBondContact O-N 3.14Å
346G76.6Confident75.4Confident33 Ų33118.7 Ų118.734%0.3458%0.579SS.*Hα-helixtrans-57.6-50.7176.400000112.6R342 N343 L348 L349 E350R342-G346 PolarHBondContact O-N 2.86Å; R342-G346 VanDerWaalsContact O-N 3.11Å; N343-G346 PolarHBondContact O-N 2.87Å; G346-L348 VanDerWaalsContact C-N 3.28Å; G346-L348 PolarHBondContact O-N 2.92Å; G346-L349 PolarHBondContact O-N 2.97Å; G346-L349 VanDerWaalsContact O-N 3.1Å; G346-E350 PolarHBondContact O-N 2.99Å; G346-E350 VanDerWaalsContact O-N 3.14Å
347N73.7Confident75.2Confident103 Ų103120.2 Ų120.255%0.55159%0.587SS**Hα-helixtrans-63.5-32.3-179.2-65.63.5000113N343 L349 M351N343-N347 PolarHBondContact O-N 2.81Å; N343-N347 PolarHBondContact O-OD1 3.24Å; N347-L349 VanDerWaalsContact C-N 3.35Å; N347-M351 PolarHBondContact O-N 3.46Å
348L75.8Confident74.5Confident116 Ų116116.1 Ų116.161%0.60758%0.578SS**Hα-helixtrans-70.2-30.4176.5-97.4156.2000112.8R344 I345 G346 K352R344-L348 PolarHBondContact O-N 3.46Å; I345-L348 PolarHBondContact O-N 3.18Å; G346-L348 VanDerWaalsContact C-N 3.28Å; G346-L348 PolarHBondContact O-N 2.92Å; L348-K352 PolarHBondContact O-N 2.92Å
349L77.6Confident73.5Confident105 Ų105114.3 Ų114.355%0.5558%0.577SS.*Hα-helixtrans-75.2-45.8176.3-74.7163.4000111.1I345 G346 N347 M351 K352 E353I345-L349 HydrophobicContact CG2-CD1 4.16Å; I345-L349 PolarHBondContact O-N 3.14Å; G346-L349 PolarHBondContact O-N 2.97Å; G346-L349 VanDerWaalsContact O-N 3.1Å; N347-L349 VanDerWaalsContact C-N 3.35Å; L349-M351 VanDerWaalsContact C-N 3.3Å; L349-M351 PolarHBondContact O-N 2.91Å; L349-K352 PolarHBondContact O-N 2.95Å; L349-E353 PolarHBondContact O-N 2.96Å; L349-E353 VanDerWaalsContact O-N 3.1Å
350E75.1Confident72.5Confident123 Ų123114.5 Ų114.558%0.57558%0.58SS**Hα-helixtrans-57.8-41.2175.8-79.2-175.2153.100112G346 K352 E353 L354G346-E350 PolarHBondContact O-N 2.99Å; G346-E350 VanDerWaalsContact O-N 3.14Å; E350-K352 VanDerWaalsContact C-N 3.28Å; E350-K352 PolarHBondContact O-N 3.39Å; E350-E353 PolarHBondContact O-N 2.99Å; E350-L354 WeakPolarHBondContact O-CG 3.35Å; E350-L354 PolarHBondContact O-N 3.05Å; E350-L354 VanDerWaalsContact O-N 3.09Å
351M71.8Confident71.5Confident140 Ų140115 Ų11569%0.6959%0.587SS**Hα-helixtrans-64.1-30.6176.6-80.2-161.8166.500113.6N347 L349 H355N347-M351 PolarHBondContact O-N 3.46Å; L349-M351 VanDerWaalsContact C-N 3.3Å; L349-M351 PolarHBondContact O-N 2.91Å; M351-H355 PolarHBondContact O-N 3.43Å
352K77.2Confident70.3Confident155 Ų155113.8 Ų113.867%0.67459%0.591SS**Hα-helixtrans-75.3-38.9176.5-80.2-176.3174.7-174.90112L348 L349 E350 H355 G356L348-K352 PolarHBondContact O-N 2.92Å; L349-K352 PolarHBondContact O-N 2.95Å; E350-K352 VanDerWaalsContact C-N 3.28Å; E350-K352 PolarHBondContact O-N 3.39Å; K352-H355 PolarHBondContact O-N 3.24Å; K352-G356 PolarHBondContact O-N 3.37Å; K352-G356 VanDerWaalsContact O-N 3.14Å
353E74.8Confident69Low140 Ų140114 Ų11465%0.65460%0.599SS**Hα-helixtrans-64.8-41.7176.9-72.7-174162.400111.7L349 E350 H355 G356 L357L349-E353 PolarHBondContact O-N 2.96Å; L349-E353 VanDerWaalsContact O-N 3.1Å; E350-E353 PolarHBondContact O-N 2.99Å; E353-H355 VanDerWaalsContact C-N 3.34Å; E353-H355 PolarHBondContact O-N 2.83Å; E353-G356 PolarHBondContact O-N 2.89Å; E353-L357 PolarHBondContact O-N 2.98Å; E353-L357 VanDerWaalsContact O-N 3.12Å
354L72.4Confident67.8Low122 Ų122116 Ų11664%0.63961%0.61SS**Hα-helixtrans-62.4-38.7176.8-71.6171.1000112.7E350 A358E350-L354 WeakPolarHBondContact O-CG 3.35Å; E350-L354 PolarHBondContact O-N 3.05Å; E350-L354 VanDerWaalsContact O-N 3.09Å; L354-A358 PolarHBondContact O-N 2.93Å
355H69.2Low66.5Low155 Ų155111.7 Ų111.772%0.71861%0.614SS**Hα-helixtrans-68.7-36.6175.6-98.9156000112.9M351 K352 E353 A358 S359M351-H355 PolarHBondContact O-N 3.43Å; K352-H355 PolarHBondContact O-N 3.24Å; E353-H355 VanDerWaalsContact C-N 3.34Å; E353-H355 PolarHBondContact O-N 2.83Å; H355-A358 PolarHBondContact O-N 3.35Å; H355-S359 PolarHBondContact O-N 2.99Å; H355-S359 PolarHBondContact O-OG 3.46Å
356G69.7Low64.6Low34 Ų34114.4 Ų114.435%0.35163%0.629SS.*Hα-helixtrans-68-34.6177.700000113.5K352 E353 S359K352-G356 PolarHBondContact O-N 3.37Å; K352-G356 VanDerWaalsContact O-N 3.14Å; E353-G356 PolarHBondContact O-N 2.89Å; G356-S359 PolarHBondContact O-OG 3.44Å
357L66.9Low63.3Low123 Ų123117.3 Ų117.364%0.64464%0.642SS**Hα-helixtrans-70.1-36.9176.7-72.3168.9000112.4E353 S359 H360 S361E353-L357 PolarHBondContact O-N 2.98Å; E353-L357 VanDerWaalsContact O-N 3.12Å; L357-S359 VanDerWaalsContact C-N 3.34Å; L357-S359 PolarHBondContact O-N 3.25Å; L357-H360 PolarHBondContact O-N 3.07Å; L357-S361 PolarHBondContact O-N 3.25Å
358A59Low61.7Low57 Ų57124.1 Ų124.147%0.47166%0.66SS.*Hα-helixtrans-68.2-30.917900000113.2L354 H355 S361L354-A358 PolarHBondContact O-N 2.93Å; H355-A358 PolarHBondContact O-N 3.35Å; A358-S361 PolarHBondContact O-OG 3.37Å
359S58.4Low60.1Low75 Ų75131.6 Ų131.652%0.52469%0.692SS.*Hα-helixtrans-72.2-32.6176.145.90000113.2H355 G356 L357H355-S359 PolarHBondContact O-N 2.99Å; H355-S359 PolarHBondContact O-OG 3.46Å; G356-S359 PolarHBondContact O-OG 3.44Å; L357-S359 VanDerWaalsContact C-N 3.34Å; L357-S359 PolarHBondContact O-N 3.25Å
360H56.4Low59.2Low140 Ų140133 Ų13365%0.64870%0.699SS**Hα-helixtrans-78.6-21.8-178.1-85.9-58.5000114.1L357 V362L357-H360 PolarHBondContact O-N 3.07Å; H360-V362 VanDerWaalsContact C-N 3.33Å; H360-V362 PolarHBondContact O-N 3.19Å
361S54.5Low58.4Low89 Ų89133.5 Ų133.562%0.62271%0.706SS**THydrogen-bonded Turntrans-77.7-13.6179.558.40000114.5L357 A358L357-S361 PolarHBondContact O-N 3.25Å; A358-S361 PolarHBondContact O-OG 3.37Å
362V55.2Low57.7Low123 Ų123133.1 Ų133.175%0.74571%0.707SS**SBendtrans-87.9-21.1-177.6-179.20000112.4H360H360-V362 VanDerWaalsContact C-N 3.33Å; H360-V362 PolarHBondContact O-N 3.19Å
363E51.8Low56.5Low160 Ų160131.8 Ų131.875%0.74871%0.709SS**SBendtrans-87.9-14.5-172-126.5165.7-170.100114.6
364N48.2Very low55.4Low153 Ų153131.3 Ų131.382%0.81871%0.712SS**SBendtrans-118.163.7-174.7-77.7-20.3000113.2
365A51.8Low54.2Low93 Ų93131.9 Ų131.977%0.76972%0.717SS**  trans-156.586.4161.200000111
366N40.9Very low53.2Low163 Ų163130.3 Ų130.387%0.87272%0.717SS**  trans-130.9137.5166-140.56.5000109.9
367P50Low51.9Low95 Ų95137.7 Ų137.762%0.61775%0.745SS**  trans-96.8160.8-166.136.9-29.7000113.1
368W39.9Very low50.6Low246 Ų246138.9 Ų138.993%0.93275%0.754SS**  trans90.263.4179.8-49.1102.5000117.2
369Q41.7Very low49.9Very low273 Ų273146.4 Ų146.4100%1.27678%0.779SS**  trans-141.90137.9-81.1-174.4-33.800107.1

Retrieved 369 of 369 residues in 103.8 ms (Link to these results)

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