A0A3Q0KUU0_SCHMA Loading...

DUF4372 domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KUU0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 74 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
1M48Very low63Low154 Ų154100.5 Ų100.576%0.75951%0.512SS*.  0105.60-145.6149179.400106.8F3 L22 Q26M1-F3 HydrophobicContact CB-CE2 4.42Å; M1-L22 HydrophobicContact CE-CD2 4.44Å; M1-L22 HydrophobicContact SD-CD2 4.37Å; M1-Q26 PolarHBondContact SD-OE1 3.32Å
2N50.3Low63.5Low156 Ų15692.2 Ų92.283%0.83447%0.471SS*.  trans-89.5112.4173.9-88.1-10.1000107I4N2-I4 PolarHBondContact O-N 2.95Å
3F57.4Low64.3Low48 Ų4894.5 Ų94.521%0.21148%0.479CS..  trans-76.1103.9172.5-65.3-90000107.7M1 F5 H18 L22 M30M1-F3 HydrophobicContact CB-CE2 4.42Å; F3-F5 HydrophobicContact CB-CD2 4.28Å; F3-F5 HydrophobicContact CB-CE2 3.49Å; F3-F5 VanDerWaalsContact CB-CE2 3.49Å; F3-F5 HydrophobicContact CB-CZ 3.61Å; F3-F5 HydrophobicContact CD1-CZ 4.26Å; F3-F5 HydrophobicContact CG-CE2 4.45Å; F3-F5 HydrophobicContact CG-CZ 4.2Å; F3-H18 HydrophobicContact CD1-CB 4.34Å; F3-H18 AromaticContact CD1-CD2 3.47Å; F3-H18 VanDerWaalsContact CD1-CD2 3.47Å; F3-H18 WeakPolarHBondContact CD1-CD2 3.08Å; F3-H18 HydrophobicContact CE1-CB 4.06Å; F3-H18 AromaticContact CE1-CD2 3.46Å; F3-H18 VanDerWaalsContact CE1-CD2 3.46Å; F3-H18 WeakPolarHBondContact CE1-CD2 3.29Å; F3-L22 HydrophobicContact CE1-CD1 4.41Å; F3-L22 HydrophobicContact CZ-CD1 4.19Å; F3-M30 HydrophobicContact CD2-SD 4.27Å; F3-M30 HydrophobicContact CE1-SD 4.04Å; F3-M30 HydrophobicContact CE2-CG 3.97Å; F3-M30 HydrophobicContact CE2-SD 3.38Å; F3-M30 WeakPolarHBondContact CE2-SD 3.39Å; F3-M30 HydrophobicContact CZ-CG 4.29Å; F3-M30 HydrophobicContact CZ-SD 3.25Å; F3-M30 WeakPolarHBondContact CZ-SD 3.47Å
4I58.5Low65Low149 Ų14990.4 Ų90.476%0.76446%0.456SS*.  trans-91.5107173.3-58178.1000106N2N2-I4 PolarHBondContact O-N 2.95Å
5F62.1Low65.6Low36 Ų3685.2 Ų85.216%0.15843%0.43CS..  trans-89.9127.9175.1-65.1-71.6000109.3F3 F7 V11 Q14 L15F3-F5 HydrophobicContact CB-CD2 4.28Å; F3-F5 HydrophobicContact CB-CE2 3.49Å; F3-F5 VanDerWaalsContact CB-CE2 3.49Å; F3-F5 HydrophobicContact CB-CZ 3.61Å; F3-F5 HydrophobicContact CD1-CZ 4.26Å; F3-F5 HydrophobicContact CG-CE2 4.45Å; F3-F5 HydrophobicContact CG-CZ 4.2Å; F5-F7 HydrophobicContact CB-CE1 4.45Å; F5-F7 HydrophobicContact CB-CZ 4.48Å; F5-F7 PolarHBondContact O-N 2.88Å; F5-V11 HydrophobicContact CD1-CG1 4.22Å; F5-V11 HydrophobicContact CG-CG1 4.32Å; F5-Q14 HydrophobicContact CD1-CB 4.18Å; F5-L15 HydrophobicContact CE1-CB 4.14Å; F5-L15 HydrophobicContact CE1-CD1 3.57Å; F5-L15 HydrophobicContact CE1-CG 4.11Å; F5-L15 HydrophobicContact CE2-CD1 4.04Å; F5-L15 HydrophobicContact CZ-CD1 3.26Å; F5-L15 HydrophobicContact CZ-CG 4.07Å
6D66.9Low66.2Low63 Ų6380.5 Ų80.534%0.33741%0.41SS..  trans-76.5103.7166.4-176.1-5.5000108.1S8 K9 Q14D6-S8 PolarHBondContact O-N 3.33Å; D6-S8 VanDerWaalsContact OD1-CB 3.31Å; D6-S8 WeakPolarHBondContact OD1-CB 3.45Å; D6-S8 PolarHBondContact OD1-N 3.19Å; D6-S8 PolarHBondContact OD1-OG 3.49Å; D6-S8 PolarHBondContact OD2-OG 3.39Å; D6-K9 HydrophobicContact CB-CD 4.45Å; D6-K9 PolarHBondContact O-N 3.43Å; D6-K9 VanDerWaalsContact O-N 3.1Å; D6-K9 WeakPolarHBondContact OD2-CE 3.49Å; D6-Q14 PolarHBondContact O-NE2 3.48Å
7F66.6Low66.9Low149 Ų14982.2 Ų82.265%0.65442%0.416SS*.THydrogen-bonded Turntrans-69.3-8.7-179.6-64.4-73.3000113.4F5 K9 V11F5-F7 HydrophobicContact CB-CE1 4.45Å; F5-F7 HydrophobicContact CB-CZ 4.48Å; F5-F7 PolarHBondContact O-N 2.88Å; F7-K9 VanDerWaalsContact C-N 3.26Å; F7-V11 HydrophobicContact CD1-CG2 4.08Å
8S71.4Confident67.4Low102 Ų10282.2 Ų82.271%0.71341%0.414SS*.THydrogen-bonded Turntrans-78.7-11171.374.90000113.2D6D6-S8 PolarHBondContact O-N 3.33Å; D6-S8 VanDerWaalsContact OD1-CB 3.31Å; D6-S8 WeakPolarHBondContact OD1-CB 3.45Å; D6-S8 PolarHBondContact OD1-N 3.19Å; D6-S8 PolarHBondContact OD1-OG 3.49Å; D6-S8 PolarHBondContact OD2-OG 3.39Å
9K69.5Low67.8Low136 Ų13678 Ų7859%0.59139%0.393SS*.SBendtrans-114.3164.9179.1-67.3-179.5-171.9177.80111D6 F7 V11 Q14D6-K9 HydrophobicContact CB-CD 4.45Å; D6-K9 PolarHBondContact O-N 3.43Å; D6-K9 VanDerWaalsContact O-N 3.1Å; D6-K9 WeakPolarHBondContact OD2-CE 3.49Å; F7-K9 VanDerWaalsContact C-N 3.26Å; K9-V11 PolarHBondContact O-N 3.31Å; K9-Q14 VanDerWaalsContact CB-NE2 3.33Å
10D71.9Confident68.2Low89 Ų8978 Ų7848%0.47640%0.399SS..  trans-60.3108.1175.6-167.8-66.9000110G12 Q13 Q14D10-G12 PolarHBondContact O-N 3.33Å; D10-G12 VanDerWaalsContact OD1-CA 3.3Å; D10-G12 WeakPolarHBondContact OD1-CA 3.28Å; D10-G12 PolarHBondContact OD1-N 2.94Å; D10-Q13 HydrophobicContact CB-CB 4.02Å; D10-Q13 PolarHBondContact O-N 2.95Å; D10-Q13 PolarHBondContact OD1-N 3.15Å; D10-Q14 PolarHBondContact O-N 3.22Å; D10-Q14 VanDerWaalsContact O-N 3.14Å
11V69.8Low68.7Low23 Ų2382.3 Ų82.314%0.13942%0.415CS..Hα-helixtrans-63.2-35.4-177.2175.70000110F5 F7 K9 Q14 L15F5-V11 HydrophobicContact CD1-CG1 4.22Å; F5-V11 HydrophobicContact CG-CG1 4.32Å; F7-V11 HydrophobicContact CD1-CG2 4.08Å; K9-V11 PolarHBondContact O-N 3.31Å; V11-Q14 PolarHBondContact O-N 2.95Å; V11-L15 VanDerWaalsContact O-CB 3.27Å; V11-L15 WeakPolarHBondContact O-CB 3.2Å; V11-L15 PolarHBondContact O-N 3.43Å
12G69.6Low70Confident1 Ų175.3 Ų75.31%0.0138%0.381CS..Hα-helixtrans-64.2-42.2177.600000112.4D10 L15 G16 T50 L54D10-G12 PolarHBondContact O-N 3.33Å; D10-G12 VanDerWaalsContact OD1-CA 3.3Å; D10-G12 WeakPolarHBondContact OD1-CA 3.28Å; D10-G12 PolarHBondContact OD1-N 2.94Å; G12-L15 PolarHBondContact O-N 3.22Å; G12-G16 PolarHBondContact O-N 3.18Å; G12-T50 VanDerWaalsContact CA-CG2 3.44Å; G12-L54 WeakPolarHBondContact O-CD2 3.3Å
13Q74.1Confident71.4Confident123 Ų12370.9 Ų70.958%0.57536%0.357SS*.Hα-helixtrans-67.1-41.2177.8-156.2179.616.800112.1D10 G16 Q17D10-Q13 HydrophobicContact CB-CB 4.02Å; D10-Q13 PolarHBondContact O-N 2.95Å; D10-Q13 PolarHBondContact OD1-N 3.15Å; Q13-G16 PolarHBondContact O-N 3.14Å; Q13-Q17 WeakPolarHBondContact O-CG 3.36Å; Q13-Q17 PolarHBondContact O-N 3.23Å
14Q74.5Confident72.2Confident36 Ų3670.9 Ų70.917%0.16836%0.362CS..Hα-helixtrans-62.8-43.5174.1-77.4175.177.600112.2F5 D6 K9 D10 V11 G16 Q17 H18F5-Q14 HydrophobicContact CD1-CB 4.18Å; D6-Q14 PolarHBondContact O-NE2 3.48Å; K9-Q14 VanDerWaalsContact CB-NE2 3.33Å; D10-Q14 PolarHBondContact O-N 3.22Å; D10-Q14 VanDerWaalsContact O-N 3.14Å; V11-Q14 PolarHBondContact O-N 2.95Å; Q14-G16 VanDerWaalsContact C-N 3.32Å; Q14-Q17 PolarHBondContact O-N 3.43Å; Q14-H18 PolarHBondContact O-N 3.04Å; Q14-H18 PolarHBondContact O-ND1 3.23Å
15L74Confident73.1Confident13 Ų1370.7 Ų70.77%0.06836%0.356CS..Hα-helixtrans-65.1-40179.1-148.9121.6000110.7F5 V11 G12 H18 L19 F42 L46F5-L15 HydrophobicContact CE1-CB 4.14Å; F5-L15 HydrophobicContact CE1-CD1 3.57Å; F5-L15 HydrophobicContact CE1-CG 4.11Å; F5-L15 HydrophobicContact CE2-CD1 4.04Å; F5-L15 HydrophobicContact CZ-CD1 3.26Å; F5-L15 HydrophobicContact CZ-CG 4.07Å; V11-L15 VanDerWaalsContact O-CB 3.27Å; V11-L15 WeakPolarHBondContact O-CB 3.2Å; V11-L15 PolarHBondContact O-N 3.43Å; G12-L15 PolarHBondContact O-N 3.22Å; L15-H18 PolarHBondContact O-N 3.39Å; L15-L19 HydrophobicContact CD2-CD1 3.84Å; L15-L19 WeakPolarHBondContact O-CB 3.34Å; L15-L19 VanDerWaalsContact O-CG 3.32Å; L15-L19 WeakPolarHBondContact O-CG 3.47Å; L15-L19 PolarHBondContact O-N 3.32Å; L15-F42 HydrophobicContact CD2-CE2 4.37Å; L15-F42 HydrophobicContact CD2-CZ 3.83Å; L15-L46 HydrophobicContact CD2-CD2 3.2Å; L15-L46 HydrophobicContact CD2-CG 3.81Å
16G74.1Confident73.9Confident10 Ų1072.7 Ų72.710%0.10337%0.366CS..Hα-helixtrans-62.8-44.9173.300000113.7G12 Q13 Q14 H18 L19 C20G12-G16 PolarHBondContact O-N 3.18Å; Q13-G16 PolarHBondContact O-N 3.14Å; Q14-G16 VanDerWaalsContact C-N 3.32Å; G16-H18 VanDerWaalsContact C-N 3.3Å; G16-H18 PolarHBondContact O-N 2.96Å; G16-L19 PolarHBondContact O-N 3.49Å; G16-C20 PolarHBondContact O-N 3.07Å; G16-C20 PolarHBondContact O-SG 3.44Å; G16-C20 VanDerWaalsContact O-SG 3.35Å
17Q78.1Confident74.4Confident110 Ų11069.8 Ų69.851%0.51435%0.35SS..Hα-helixtrans-62.6-38.1175-75.1-176.3-100112.6Q13 Q14 K21Q13-Q17 WeakPolarHBondContact O-CG 3.36Å; Q13-Q17 PolarHBondContact O-N 3.23Å; Q14-Q17 PolarHBondContact O-N 3.43Å; Q17-K21 WeakPolarHBondContact O-CG 3.35Å; Q17-K21 PolarHBondContact O-N 3.22Å
18H76.7Confident74.8Confident82 Ų8265.9 Ų65.938%0.3833%0.334SS..Hα-helixtrans-66.8-44.1174.3-92.766.3000111.3F3 Q14 L15 G16 C20 K21 L22F3-H18 HydrophobicContact CD1-CB 4.34Å; F3-H18 AromaticContact CD1-CD2 3.47Å; F3-H18 VanDerWaalsContact CD1-CD2 3.47Å; F3-H18 WeakPolarHBondContact CD1-CD2 3.08Å; F3-H18 HydrophobicContact CE1-CB 4.06Å; F3-H18 AromaticContact CE1-CD2 3.46Å; F3-H18 VanDerWaalsContact CE1-CD2 3.46Å; F3-H18 WeakPolarHBondContact CE1-CD2 3.29Å; Q14-H18 PolarHBondContact O-N 3.04Å; Q14-H18 PolarHBondContact O-ND1 3.23Å; L15-H18 PolarHBondContact O-N 3.39Å; G16-H18 VanDerWaalsContact C-N 3.3Å; G16-H18 PolarHBondContact O-N 2.96Å; H18-C20 PolarHBondContact O-N 3.28Å; H18-K21 PolarHBondContact O-N 3.14Å; H18-L22 WeakPolarHBondContact O-CG 3.3Å; H18-L22 PolarHBondContact O-N 3.09Å; H18-L22 VanDerWaalsContact O-N 3.14Å
19L74.7Confident75.1Confident2 Ų269.8 Ų69.81%0.0133%0.333CS..Hα-helixtrans-59.7-42.7177.6-79.2167.9000112.8L15 G16 K21 L22 F27 M30 F42 L46 L58L15-L19 HydrophobicContact CD2-CD1 3.84Å; L15-L19 WeakPolarHBondContact O-CB 3.34Å; L15-L19 VanDerWaalsContact O-CG 3.32Å; L15-L19 WeakPolarHBondContact O-CG 3.47Å; L15-L19 PolarHBondContact O-N 3.32Å; G16-L19 PolarHBondContact O-N 3.49Å; L19-K21 PolarHBondContact O-N 3.41Å; L19-L22 HydrophobicContact CD2-CD1 4.17Å; L19-L22 PolarHBondContact O-N 3.02Å; L19-F27 HydrophobicContact CD2-CD2 3.54Å; L19-F27 HydrophobicContact CD2-CE2 3.38Å; L19-M30 HydrophobicContact CD2-CE 3.7Å; L19-F42 HydrophobicContact CD1-CE1 4.08Å; L19-F42 HydrophobicContact CD1-CZ 4.09Å; L19-F42 HydrophobicContact CD2-CE1 3.78Å; L19-F42 HydrophobicContact CD2-CZ 3.94Å; L19-F42 HydrophobicContact CG-CE1 4.46Å; L19-F42 HydrophobicContact CG-CZ 4.33Å; L19-L46 HydrophobicContact CD1-CD1 4.5Å; L19-L58 HydrophobicContact CD1-CB 4.39Å; L19-L58 HydrophobicContact CD1-CD2 3.57Å; L19-L58 HydrophobicContact CD1-CG 4.49Å
20C76Confident75.4Confident77 Ų7763.9 Ų63.952%0.5231%0.307SS..Hα-helixtrans-64.8-19.8175.4-68.20000114G16 H18 M61G16-C20 PolarHBondContact O-N 3.07Å; G16-C20 PolarHBondContact O-SG 3.44Å; G16-C20 VanDerWaalsContact O-SG 3.35Å; H18-C20 PolarHBondContact O-N 3.28Å; C20-M61 PolarHBondContact SG-SD 2.83Å
21K79.1Confident75.5Confident170 Ų17060.6 Ų60.674%0.73929%0.29SS*.Hα-helixtrans-97-10179.2-69.8177.4-177.6-177.80113.1Q17 H18 L19Q17-K21 WeakPolarHBondContact O-CG 3.35Å; Q17-K21 PolarHBondContact O-N 3.22Å; H18-K21 PolarHBondContact O-N 3.14Å; L19-K21 PolarHBondContact O-N 3.41Å
22L74.6Confident75.7Confident7 Ų764 Ų644%0.03731%0.306CS..  trans-79.1131.6-179.9-75.1166.2000109.8M1 F3 H18 L19 Q26 F27 M30 Y65M1-L22 HydrophobicContact CE-CD2 4.44Å; M1-L22 HydrophobicContact SD-CD2 4.37Å; F3-L22 HydrophobicContact CE1-CD1 4.41Å; F3-L22 HydrophobicContact CZ-CD1 4.19Å; H18-L22 WeakPolarHBondContact O-CG 3.3Å; H18-L22 PolarHBondContact O-N 3.09Å; H18-L22 VanDerWaalsContact O-N 3.14Å; L19-L22 HydrophobicContact CD2-CD1 4.17Å; L19-L22 PolarHBondContact O-N 3.02Å; L22-Q26 HydrophobicContact CD2-CB 3.55Å; L22-F27 HydrophobicContact CB-CB 4.49Å; L22-M30 HydrophobicContact CD1-CE 3.71Å; L22-M30 HydrophobicContact CD1-SD 4.09Å; L22-Y65 WeakPolarHBondContact O-CE1 3.27Å; L22-Y65 PolarHBondContact O-OH 3.35Å
23D79.2Confident75.9Confident62 Ų6268.2 Ų68.233%0.33233%0.327SS..  trans-73.7161.3164.672.577.4000110.3F25 Q26 F27D23-F25 VanDerWaalsContact C-N 3.27Å; D23-F25 PolarHBondContact O-N 3.02Å; D23-F25 WeakPolarHBondContact OD1-CA 3.48Å; D23-F25 VanDerWaalsContact OD1-CB 3.29Å; D23-F25 WeakPolarHBondContact OD1-CB 3.38Å; D23-F25 PolarHBondContact OD1-N 3.36Å; D23-Q26 PolarHBondContact O-N 3.21Å; D23-Q26 VanDerWaalsContact O-N 3.15Å; D23-Q26 PolarHBondContact OD1-N 2.9Å; D23-Q26 VanDerWaalsContact OD2-CD 3.27Å; D23-Q26 WeakPolarHBondContact OD2-CG 3.36Å; D23-Q26 PolarHBondContact OD2-NE2 2.93Å; D23-F27 PolarHBondContact O-N 3.29Å
24P73.9Confident75.6Confident48 Ų4864.9 Ų64.931%0.31231%0.309SS..Hα-helixtrans-56.3-37.4-176.6-23.732.9000113.8F27 Q28 Y65 I69P24-F27 PolarHBondContact O-N 3.2Å; P24-Q28 PolarHBondContact O-N 2.89Å; P24-Y65 HydrophobicContact CB-CD1 4.28Å; P24-Y65 HydrophobicContact CG-CD1 4.15Å; P24-Y65 HydrophobicContact CG-CE1 4.26Å; P24-I69 HydrophobicContact CB-CD1 4.19Å; P24-I69 HydrophobicContact CB-CG1 3.62Å; P24-I69 VanDerWaalsContact O-CD1 3.28Å; P24-I69 WeakPolarHBondContact O-CD1 3.25Å
25F78.2Confident75.3Confident146 Ų14669.4 Ų69.464%0.6433%0.329SS*.Hα-helixtrans-70-41.6179.3-68.3-82.7000111.6D23 F27 Q28 R29D23-F25 VanDerWaalsContact C-N 3.27Å; D23-F25 PolarHBondContact O-N 3.02Å; D23-F25 WeakPolarHBondContact OD1-CA 3.48Å; D23-F25 VanDerWaalsContact OD1-CB 3.29Å; D23-F25 WeakPolarHBondContact OD1-CB 3.38Å; D23-F25 PolarHBondContact OD1-N 3.36Å; F25-F27 VanDerWaalsContact C-N 3.34Å; F25-Q28 PolarHBondContact O-N 3.47Å; F25-R29 WeakPolarHBondContact O-CB 3.46Å; F25-R29 PolarHBondContact O-N 3.22Å
26Q79.2Confident75.1Confident77 Ų7779 Ų7936%0.3636%0.364SS..Hα-helixtrans-65.5-38.4175.1-74.4-169.127.200112.4M1 L22 D23 R29 M30M1-Q26 PolarHBondContact SD-OE1 3.32Å; L22-Q26 HydrophobicContact CD2-CB 3.55Å; D23-Q26 PolarHBondContact O-N 3.21Å; D23-Q26 VanDerWaalsContact O-N 3.15Å; D23-Q26 PolarHBondContact OD1-N 2.9Å; D23-Q26 VanDerWaalsContact OD2-CD 3.27Å; D23-Q26 WeakPolarHBondContact OD2-CG 3.36Å; D23-Q26 PolarHBondContact OD2-NE2 2.93Å; Q26-R29 PolarHBondContact O-N 3.34Å; Q26-M30 WeakPolarHBondContact O-CB 3.46Å; Q26-M30 PolarHBondContact O-N 2.97Å
27F77.5Confident74.4Confident3 Ų384.8 Ų84.81%0.01339%0.386CS..Hα-helixtrans-61.1-45.5173-176.8-92.5000111.6L19 L22 D23 P24 F25 R29 M30 N31 F42 C62 Y65 Q66L19-F27 HydrophobicContact CD2-CD2 3.54Å; L19-F27 HydrophobicContact CD2-CE2 3.38Å; L22-F27 HydrophobicContact CB-CB 4.49Å; D23-F27 PolarHBondContact O-N 3.29Å; P24-F27 PolarHBondContact O-N 3.2Å; F25-F27 VanDerWaalsContact C-N 3.34Å; F27-R29 VanDerWaalsContact C-N 3.31Å; F27-R29 PolarHBondContact O-N 3.26Å; F27-M30 HydrophobicContact CD2-CE 3.86Å; F27-M30 HydrophobicContact CE2-CE 3.97Å; F27-M30 WeakPolarHBondContact O-CB 3.41Å; F27-M30 PolarHBondContact O-N 3.5Å; F27-N31 PolarHBondContact O-N 3.24Å; F27-F42 HydrophobicContact CE2-CD1 4.1Å; F27-F42 AromaticContact CE2-CE1 3.86Å; F27-F42 HydrophobicContact CE2-CE1 3.86Å; F27-F42 HydrophobicContact CZ-CD1 4.18Å; F27-F42 HydrophobicContact CZ-CE1 4.37Å; F27-C62 HydrophobicContact CE2-CB 4.35Å; F27-C62 VanDerWaalsContact CE2-SG 3.52Å; F27-C62 HydrophobicContact CZ-CB 3.75Å; F27-C62 WeakPolarHBondContact CZ-SG 3.47Å; F27-Y65 HydrophobicContact CD1-CG 4.48Å; F27-Y65 HydrophobicContact CG-CG 4.3Å; F27-Q66 HydrophobicContact CE1-CG 4.27Å
28Q75.3Confident73.5Confident66 Ų6685.9 Ų85.931%0.30840%0.403SS..Hα-helixtrans-60.2-42.4177-156.1-177.23.200112P24 F25 M30 N31 M32 I69P24-Q28 PolarHBondContact O-N 2.89Å; F25-Q28 PolarHBondContact O-N 3.47Å; Q28-M30 VanDerWaalsContact C-N 3.34Å; Q28-N31 PolarHBondContact O-N 2.85Å; Q28-M32 HydrophobicContact CG-CE 4.19Å; Q28-M32 PolarHBondContact O-N 2.93Å; Q28-I69 HydrophobicContact CB-CD1 3.9Å; Q28-I69 HydrophobicContact CG-CD1 4.19Å
29R77.9Confident72.5Confident185 Ų18586.8 Ų86.870%0.69841%0.414SS*.Hα-helixtrans-62.7-43.2177.4-153.9179.9-153178.16.9111.1F25 Q26 F27 M32 I33F25-R29 WeakPolarHBondContact O-CB 3.46Å; F25-R29 PolarHBondContact O-N 3.22Å; Q26-R29 PolarHBondContact O-N 3.34Å; F27-R29 VanDerWaalsContact C-N 3.31Å; F27-R29 PolarHBondContact O-N 3.26Å; R29-M32 PolarHBondContact O-N 3.43Å; R29-I33 VanDerWaalsContact O-CG1 3.3Å; R29-I33 WeakPolarHBondContact O-CG1 3.39Å; R29-I33 PolarHBondContact O-N 3.4Å
30M75.3Confident71.7Confident11 Ų1193.9 Ų93.95%0.05444%0.441CS..Hα-helixtrans-60.8-47.9174.6-173.9173.965.500110.9F3 L19 L22 Q26 F27 Q28 M32 I33 Y34 F42F3-M30 HydrophobicContact CD2-SD 4.27Å; F3-M30 HydrophobicContact CE1-SD 4.04Å; F3-M30 HydrophobicContact CE2-CG 3.97Å; F3-M30 HydrophobicContact CE2-SD 3.38Å; F3-M30 WeakPolarHBondContact CE2-SD 3.39Å; F3-M30 HydrophobicContact CZ-CG 4.29Å; F3-M30 HydrophobicContact CZ-SD 3.25Å; F3-M30 WeakPolarHBondContact CZ-SD 3.47Å; L19-M30 HydrophobicContact CD2-CE 3.7Å; L22-M30 HydrophobicContact CD1-CE 3.71Å; L22-M30 HydrophobicContact CD1-SD 4.09Å; Q26-M30 WeakPolarHBondContact O-CB 3.46Å; Q26-M30 PolarHBondContact O-N 2.97Å; F27-M30 HydrophobicContact CD2-CE 3.86Å; F27-M30 HydrophobicContact CE2-CE 3.97Å; F27-M30 WeakPolarHBondContact O-CB 3.41Å; F27-M30 PolarHBondContact O-N 3.5Å; Q28-M30 VanDerWaalsContact C-N 3.34Å; M30-M32 VanDerWaalsContact C-N 3.3Å; M30-M32 PolarHBondContact O-N 3.33Å; M30-I33 WeakPolarHBondContact O-CB 3.39Å; M30-I33 PolarHBondContact O-N 3.37Å; M30-I33 VanDerWaalsContact O-N 3.09Å; M30-Y34 HydrophobicContact CG-CD2 3.92Å; M30-Y34 HydrophobicContact CG-CE2 3.88Å; M30-Y34 WeakPolarHBondContact O-CD2 3.32Å; M30-Y34 PolarHBondContact O-N 3.46Å; M30-Y34 HydrophobicContact SD-CE2 4.47Å; M30-F42 HydrophobicContact CE-CD1 4.15Å; M30-F42 HydrophobicContact CE-CD2 4.13Å; M30-F42 HydrophobicContact CE-CE1 3.57Å; M30-F42 HydrophobicContact CE-CE2 3.54Å; M30-F42 HydrophobicContact CE-CG 4.4Å; M30-F42 HydrophobicContact CE-CZ 3.23Å; M30-F42 HydrophobicContact CG-CD2 4.5Å; M30-F42 HydrophobicContact CG-CE2 4.45Å; M30-F42 HydrophobicContact SD-CD2 4.43Å; M30-F42 HydrophobicContact SD-CE2 3.82Å; M30-F42 HydrophobicContact SD-CZ 4.07Å
31N73.2Confident71.2Confident21 Ų2195.2 Ų95.211%0.11244%0.439CS..Hα-helixtrans-61.4-38.7179-162.221.6000112.2F27 Q28 Y34 K35 Q66F27-N31 PolarHBondContact O-N 3.24Å; Q28-N31 PolarHBondContact O-N 2.85Å; N31-Y34 PolarHBondContact O-N 3.44Å; N31-K35 PolarHBondContact O-N 2.92Å; N31-Q66 PolarHBondContact ND2-NE2 3.29Å
32M75.4Confident70.7Confident94 Ų9487.3 Ų87.346%0.46341%0.405SS..Hα-helixtrans-63.3-40.2173-95.4-168.9-94.100113Q28 R29 M30 Y34 K35 R36Q28-M32 HydrophobicContact CG-CE 4.19Å; Q28-M32 PolarHBondContact O-N 2.93Å; R29-M32 PolarHBondContact O-N 3.43Å; M30-M32 VanDerWaalsContact C-N 3.3Å; M30-M32 PolarHBondContact O-N 3.33Å; M32-Y34 VanDerWaalsContact C-N 3.33Å; M32-K35 PolarHBondContact O-N 2.97Å; M32-R36 WeakPolarHBondContact O-CB 3.49Å; M32-R36 WeakPolarHBondContact O-CG 3.45Å; M32-R36 PolarHBondContact O-N 2.94Å
33I73.7Confident70.3Confident89 Ų8988.5 Ų88.546%0.45642%0.419SS..Hα-helixtrans-62.5-43.6176.1-68.4162.7000110.2R29 M30 R36 K37R29-I33 VanDerWaalsContact O-CG1 3.3Å; R29-I33 WeakPolarHBondContact O-CG1 3.39Å; R29-I33 PolarHBondContact O-N 3.4Å; M30-I33 WeakPolarHBondContact O-CB 3.39Å; M30-I33 PolarHBondContact O-N 3.37Å; M30-I33 VanDerWaalsContact O-N 3.09Å; I33-R36 PolarHBondContact O-N 2.95Å; I33-K37 PolarHBondContact O-N 3.35Å; I33-K37 VanDerWaalsContact O-N 3.16Å
34Y66.4Low69.8Low53 Ų5389.7 Ų89.721%0.20842%0.422CS..Hα-helixtrans-67.7-38.5177.4-83.8-83.2000112.6M30 N31 M32 R36 K37 F42 V45M30-Y34 HydrophobicContact CG-CD2 3.92Å; M30-Y34 HydrophobicContact CG-CE2 3.88Å; M30-Y34 WeakPolarHBondContact O-CD2 3.32Å; M30-Y34 PolarHBondContact O-N 3.46Å; M30-Y34 HydrophobicContact SD-CE2 4.47Å; N31-Y34 PolarHBondContact O-N 3.44Å; M32-Y34 VanDerWaalsContact C-N 3.33Å; Y34-R36 VanDerWaalsContact C-N 3.3Å; Y34-R36 PolarHBondContact O-N 3.13Å; Y34-K37 PolarHBondContact O-N 2.91Å; Y34-K37 VanDerWaalsContact O-O 3.11Å; Y34-F42 HydrophobicContact CD1-CD2 4.46Å; Y34-F42 HydrophobicContact CD2-CB 4.22Å; Y34-F42 AromaticContact CD2-CD2 3.51Å; Y34-F42 HydrophobicContact CD2-CD2 3.51Å; Y34-F42 HydrophobicContact CD2-CE2 4.34Å; Y34-F42 HydrophobicContact CD2-CG 4.27Å; Y34-F42 HydrophobicContact CE1-CD2 4.46Å; Y34-F42 AromaticContact CE2-CD2 3.52Å; Y34-F42 HydrophobicContact CE2-CD2 3.52Å; Y34-F42 AromaticContact CE2-CE2 3.94Å; Y34-F42 HydrophobicContact CE2-CE2 3.94Å; Y34-F42 HydrophobicContact CG-CB 4.1Å; Y34-F42 HydrophobicContact CG-CD2 4.01Å; Y34-V45 HydrophobicContact CD1-CG2 3.9Å; Y34-V45 HydrophobicContact CE1-CB 4.33Å; Y34-V45 HydrophobicContact CE1-CG1 4.15Å; Y34-V45 HydrophobicContact CE1-CG2 3.9Å
35K69.7Low69.5Low132 Ų13288.7 Ų88.757%0.57442%0.415SS*.Hα-helixtrans-63.3-32.6172-79.5-168.3175.3-172.50113.7N31 M32N31-K35 PolarHBondContact O-N 2.92Å; M32-K35 PolarHBondContact O-N 2.97Å
36R68.2Low69.1Low214 Ų21481.8 Ų81.881%0.80839%0.385SS*.Hα-helixtrans-77.1-21.8178.1-78.5-176.3178.7-177-1.2113.1M32 I33 Y34M32-R36 WeakPolarHBondContact O-CB 3.49Å; M32-R36 WeakPolarHBondContact O-CG 3.45Å; M32-R36 PolarHBondContact O-N 2.94Å; I33-R36 PolarHBondContact O-N 2.95Å; Y34-R36 VanDerWaalsContact C-N 3.3Å; Y34-R36 PolarHBondContact O-N 3.13Å
37K60.7Low68.6Low131 Ų13184.1 Ų84.157%0.5740%0.396SS*.SBendtrans-81.4136.8172.4-72.4-165.7176.5-170.80108.6I33 Y34 V39I33-K37 PolarHBondContact O-N 3.35Å; I33-K37 VanDerWaalsContact O-N 3.16Å; Y34-K37 PolarHBondContact O-N 2.91Å; Y34-K37 VanDerWaalsContact O-O 3.11Å; K37-V39 PolarHBondContact O-N 3.16Å
38P58.4Low68.3Low134 Ų13487.4 Ų87.487%0.8742%0.419SS*.SBendtrans-65.3-0.9179.525.2-32.4000113.5
39V55.4Low68Low100 Ų10091.2 Ų91.261%0.60643%0.431SS*.SBendtrans-109.650.6-165.5-160.70000111K37K37-V39 PolarHBondContact O-N 3.16Å
40R57.9Low67.4Low152 Ų15283.3 Ų83.357%0.57440%0.403SS*.  trans87.8148.9166.2-53.9179.3-172.5-176.3-0.5116.9E44 V45R40-E44 VanDerWaalsContact CA-OE2 3.27Å; R40-E44 WeakPolarHBondContact CA-OE2 3.21Å; R40-E44 HydrophobicContact CB-CB 3.8Å; R40-E44 WeakPolarHBondContact CB-OE2 3.42Å; R40-E44 HydrophobicContact CG-CB 4.46Å; R40-V45 HydrophobicContact CB-CG2 4.22Å
41Q65.5Low67.2Low104 Ų10486.4 Ų86.449%0.48643%0.426SS..  trans-66.2152.7175.7-60.9-170.749.500110.1G43 E44 V45Q41-G43 PolarHBondContact O-N 2.98Å; Q41-E44 PolarHBondContact N-OE2 3.29Å; Q41-E44 WeakPolarHBondContact O-CB 3.44Å; Q41-E44 PolarHBondContact O-N 3.4Å; Q41-V45 PolarHBondContact O-N 3.35Å; Q41-V45 VanDerWaalsContact O-N 3.11Å
42F69.5Low67.3Low5 Ų590.1 Ų90.12%0.02245%0.454CS..Hα-helixtrans-53.5-36.4-176.6-177.9-109.8000113L15 L19 F27 M30 Y34 V45 L46 C62L15-F42 HydrophobicContact CD2-CE2 4.37Å; L15-F42 HydrophobicContact CD2-CZ 3.83Å; L19-F42 HydrophobicContact CD1-CE1 4.08Å; L19-F42 HydrophobicContact CD1-CZ 4.09Å; L19-F42 HydrophobicContact CD2-CE1 3.78Å; L19-F42 HydrophobicContact CD2-CZ 3.94Å; L19-F42 HydrophobicContact CG-CE1 4.46Å; L19-F42 HydrophobicContact CG-CZ 4.33Å; F27-F42 HydrophobicContact CE2-CD1 4.1Å; F27-F42 AromaticContact CE2-CE1 3.86Å; F27-F42 HydrophobicContact CE2-CE1 3.86Å; F27-F42 HydrophobicContact CZ-CD1 4.18Å; F27-F42 HydrophobicContact CZ-CE1 4.37Å; M30-F42 HydrophobicContact CE-CD1 4.15Å; M30-F42 HydrophobicContact CE-CD2 4.13Å; M30-F42 HydrophobicContact CE-CE1 3.57Å; M30-F42 HydrophobicContact CE-CE2 3.54Å; M30-F42 HydrophobicContact CE-CG 4.4Å; M30-F42 HydrophobicContact CE-CZ 3.23Å; M30-F42 HydrophobicContact CG-CD2 4.5Å; M30-F42 HydrophobicContact CG-CE2 4.45Å; M30-F42 HydrophobicContact SD-CD2 4.43Å; M30-F42 HydrophobicContact SD-CE2 3.82Å; M30-F42 HydrophobicContact SD-CZ 4.07Å; Y34-F42 HydrophobicContact CD1-CD2 4.46Å; Y34-F42 HydrophobicContact CD2-CB 4.22Å; Y34-F42 AromaticContact CD2-CD2 3.51Å; Y34-F42 HydrophobicContact CD2-CD2 3.51Å; Y34-F42 HydrophobicContact CD2-CE2 4.34Å; Y34-F42 HydrophobicContact CD2-CG 4.27Å; Y34-F42 HydrophobicContact CE1-CD2 4.46Å; Y34-F42 AromaticContact CE2-CD2 3.52Å; Y34-F42 HydrophobicContact CE2-CD2 3.52Å; Y34-F42 AromaticContact CE2-CE2 3.94Å; Y34-F42 HydrophobicContact CE2-CE2 3.94Å; Y34-F42 HydrophobicContact CG-CB 4.1Å; Y34-F42 HydrophobicContact CG-CD2 4.01Å; F42-V45 PolarHBondContact O-N 3.24Å; F42-L46 HydrophobicContact CD1-CD1 3.74Å; F42-L46 HydrophobicContact CE1-CD1 3.38Å; F42-L46 HydrophobicContact CE1-CG 4.09Å; F42-L46 HydrophobicContact CZ-CD1 4Å; F42-L46 HydrophobicContact CZ-CG 4.23Å; F42-L46 WeakPolarHBondContact O-CB 3.42Å; F42-L46 PolarHBondContact O-N 3.27Å; F42-C62 VanDerWaalsContact CE1-SG 3.53Å
43G67Low67Low32 Ų3293.3 Ų93.333%0.3347%0.467SS..Hα-helixtrans-63.1-37.3174.800000114.6Q41 L46 E47Q41-G43 PolarHBondContact O-N 2.98Å; G43-L46 VanDerWaalsContact O-CB 3.25Å; G43-L46 WeakPolarHBondContact O-CB 3.48Å; G43-L46 PolarHBondContact O-N 2.58Å; G43-E47 PolarHBondContact O-N 2.92Å
44E67.5Low66.9Low87 Ų8791.2 Ų91.241%0.40746%0.457SS..Hα-helixtrans-73.5-34.1177-68.4174.314900111.4R40 Q41 L46 E47 S48R40-E44 VanDerWaalsContact CA-OE2 3.27Å; R40-E44 WeakPolarHBondContact CA-OE2 3.21Å; R40-E44 HydrophobicContact CB-CB 3.8Å; R40-E44 WeakPolarHBondContact CB-OE2 3.42Å; R40-E44 HydrophobicContact CG-CB 4.46Å; Q41-E44 PolarHBondContact N-OE2 3.29Å; Q41-E44 WeakPolarHBondContact O-CB 3.44Å; Q41-E44 PolarHBondContact O-N 3.4Å; E44-L46 VanDerWaalsContact C-N 3.32Å; E44-E47 PolarHBondContact O-N 3.39Å; E44-S48 PolarHBondContact O-N 2.9Å; E44-S48 VanDerWaalsContact O-N 3.11Å
45V68.1Low67.1Low26 Ų2690 Ų9016%0.15845%0.453CS..Hα-helixtrans-64.8-42.6172.9177.30000110Y34 R40 Q41 F42 E47 S48 R49Y34-V45 HydrophobicContact CD1-CG2 3.9Å; Y34-V45 HydrophobicContact CE1-CB 4.33Å; Y34-V45 HydrophobicContact CE1-CG1 4.15Å; Y34-V45 HydrophobicContact CE1-CG2 3.9Å; R40-V45 HydrophobicContact CB-CG2 4.22Å; Q41-V45 PolarHBondContact O-N 3.35Å; Q41-V45 VanDerWaalsContact O-N 3.11Å; F42-V45 PolarHBondContact O-N 3.24Å; V45-E47 PolarHBondContact O-N 3.43Å; V45-S48 PolarHBondContact O-N 3.32Å; V45-S48 PolarHBondContact O-OG 2.88Å; V45-R49 HydrophobicContact CG1-CG 4.42Å; V45-R49 WeakPolarHBondContact O-CB 3.31Å; V45-R49 VanDerWaalsContact O-CG 3.24Å; V45-R49 WeakPolarHBondContact O-CG 3.27Å; V45-R49 PolarHBondContact O-N 3.21Å
46L69.2Low67.1Low2 Ų288.8 Ų88.81%0.0145%0.453CS..Hα-helixtrans-55.9-48.2173.1-95.4167.1000112.1L15 L19 F42 G43 E44 S48 R49 T50 L58 C62L15-L46 HydrophobicContact CD2-CD2 3.2Å; L15-L46 HydrophobicContact CD2-CG 3.81Å; L19-L46 HydrophobicContact CD1-CD1 4.5Å; F42-L46 HydrophobicContact CD1-CD1 3.74Å; F42-L46 HydrophobicContact CE1-CD1 3.38Å; F42-L46 HydrophobicContact CE1-CG 4.09Å; F42-L46 HydrophobicContact CZ-CD1 4Å; F42-L46 HydrophobicContact CZ-CG 4.23Å; F42-L46 WeakPolarHBondContact O-CB 3.42Å; F42-L46 PolarHBondContact O-N 3.27Å; G43-L46 VanDerWaalsContact O-CB 3.25Å; G43-L46 WeakPolarHBondContact O-CB 3.48Å; G43-L46 PolarHBondContact O-N 2.58Å; E44-L46 VanDerWaalsContact C-N 3.32Å; L46-S48 VanDerWaalsContact C-N 3.32Å; L46-S48 PolarHBondContact O-N 2.99Å; L46-R49 PolarHBondContact O-N 3.21Å; L46-T50 HydrophobicContact CD2-CG2 4.38Å; L46-T50 PolarHBondContact O-N 3.1Å; L46-T50 PolarHBondContact O-OG1 2.83Å; L46-L58 HydrophobicContact CD1-CB 4.29Å; L46-L58 HydrophobicContact CD2-CB 3.53Å; L46-L58 HydrophobicContact CD2-CD1 3.45Å; L46-L58 VanDerWaalsContact CD2-CD1 3.45Å; L46-L58 HydrophobicContact CD2-CG 4.02Å; L46-C62 VanDerWaalsContact CD1-SG 3.52Å
47E69.6Low67.3Low125 Ų12583.1 Ų83.158%0.58444%0.438SS*.Hα-helixtrans-57.7-43.8177.5-160.6174-177.800112.2G43 E44 V45 R49 H55G43-E47 PolarHBondContact O-N 2.92Å; E44-E47 PolarHBondContact O-N 3.39Å; V45-E47 PolarHBondContact O-N 3.43Å; E47-R49 PolarHBondContact O-N 3.33Å; E47-H55 WeakPolarHBondContact CA-CE1 3.5Å; E47-H55 VanDerWaalsContact CA-ND1 3.27Å; E47-H55 WeakPolarHBondContact CA-ND1 3.39Å; E47-H55 WeakPolarHBondContact CB-CE1 3.23Å; E47-H55 PolarHBondContact N-CE1 3.37Å; E47-H55 PolarHBondContact N-ND1 3.34Å
48S70.5Confident67.9Low73 Ų7377 Ų7751%0.5141%0.411SS..Hα-helixtrans-71-14.6-179.469.80000115.2E44 V45 L46E44-S48 PolarHBondContact O-N 2.9Å; E44-S48 VanDerWaalsContact O-N 3.11Å; V45-S48 PolarHBondContact O-N 3.32Å; V45-S48 PolarHBondContact O-OG 2.88Å; L46-S48 VanDerWaalsContact C-N 3.32Å; L46-S48 PolarHBondContact O-N 2.99Å
49R68.4Low68.6Low145 Ų14572.1 Ų72.155%0.54738%0.379SS..Hα-helixtrans-118.3-5.1-167.5-67.5-81.8-179.7172.7-1.6113.8V45 L46 E47V45-R49 HydrophobicContact CG1-CG 4.42Å; V45-R49 WeakPolarHBondContact O-CB 3.31Å; V45-R49 VanDerWaalsContact O-CG 3.24Å; V45-R49 WeakPolarHBondContact O-CG 3.27Å; V45-R49 PolarHBondContact O-N 3.21Å; L46-R49 PolarHBondContact O-N 3.21Å; E47-R49 PolarHBondContact O-N 3.33Å
50T66.7Low69.5Low19 Ų1970.1 Ų70.112%0.11737%0.373CS..SBendtrans-133.3145.3-171.859.30000112.3G12 L46 H55 L58G12-T50 VanDerWaalsContact CA-CG2 3.44Å; L46-T50 HydrophobicContact CD2-CG2 4.38Å; L46-T50 PolarHBondContact O-N 3.1Å; L46-T50 PolarHBondContact O-OG1 2.83Å; T50-H55 VanDerWaalsContact OG1-CA 3.27Å; T50-H55 WeakPolarHBondContact OG1-CA 3.46Å; T50-H55 VanDerWaalsContact OG1-CB 3.28Å; T50-H55 WeakPolarHBondContact OG1-CB 3.48Å; T50-L58 HydrophobicContact CG2-CD1 3.7Å
51S71.2Confident70.2Confident76 Ų7665.1 Ų65.153%0.53136%0.356SS..  trans-66.2153.617566.50000110.6Q53 L54 H55S51-Q53 PolarHBondContact O-N 3.38Å; S51-L54 PolarHBondContact O-N 3.14Å; S51-H55 WeakPolarHBondContact O-CB 3.48Å; S51-H55 PolarHBondContact O-N 3.38Å
52S73.5Confident70.4Confident100 Ų10060.7 Ų60.770%0.69934%0.337SS*.Hα-helixtrans-52-38.2-168.4-47.50000114.6N56S52-N56 VanDerWaalsContact O-CG 3.22Å; S52-N56 PolarHBondContact O-N 2.9Å; S52-N56 VanDerWaalsContact O-N 3.12Å; S52-N56 PolarHBondContact O-ND2 3.39Å
53Q71.1Confident70.6Confident160 Ų16066.7 Ų66.775%0.74836%0.363SS*.Hα-helixtrans-73.4-41.9-179-150.8172.116.300112S51 N56 I57S51-Q53 PolarHBondContact O-N 3.38Å; Q53-N56 PolarHBondContact O-N 3.29Å; Q53-I57 WeakPolarHBondContact O-CG1 3.43Å; Q53-I57 PolarHBondContact O-N 3.28Å
54L69.9Low70.9Confident45 Ų4573.6 Ų73.624%0.23638%0.381CS..Hα-helixtrans-71.2-37.6178-133.7152.8000110.5G12 S51 N56 I57 L58G12-L54 WeakPolarHBondContact O-CD2 3.3Å; S51-L54 PolarHBondContact O-N 3.14Å; L54-N56 PolarHBondContact O-N 3.39Å; L54-I57 PolarHBondContact O-N 2.87Å; L54-L58 HydrophobicContact CD2-CD1 3.58Å; L54-L58 HydrophobicContact CD2-CG 4.14Å; L54-L58 WeakPolarHBondContact O-CD1 3.45Å; L54-L58 VanDerWaalsContact O-CG 3.23Å; L54-L58 WeakPolarHBondContact O-CG 3.27Å; L54-L58 PolarHBondContact O-N 3Å
55H70.4Confident70.9Confident29 Ų2971.4 Ų71.413%0.13437%0.369CS..Hα-helixtrans-55.4-50.7171.6179.261.6000111.7E47 T50 S51 I57 L58 V59E47-H55 WeakPolarHBondContact CA-CE1 3.5Å; E47-H55 VanDerWaalsContact CA-ND1 3.27Å; E47-H55 WeakPolarHBondContact CA-ND1 3.39Å; E47-H55 WeakPolarHBondContact CB-CE1 3.23Å; E47-H55 PolarHBondContact N-CE1 3.37Å; E47-H55 PolarHBondContact N-ND1 3.34Å; T50-H55 VanDerWaalsContact OG1-CA 3.27Å; T50-H55 WeakPolarHBondContact OG1-CA 3.46Å; T50-H55 VanDerWaalsContact OG1-CB 3.28Å; T50-H55 WeakPolarHBondContact OG1-CB 3.48Å; S51-H55 WeakPolarHBondContact O-CB 3.48Å; S51-H55 PolarHBondContact O-N 3.38Å; H55-I57 VanDerWaalsContact C-N 3.31Å; H55-I57 PolarHBondContact O-N 2.88Å; H55-L58 PolarHBondContact O-N 3.49Å; H55-L58 VanDerWaalsContact O-N 3.16Å; H55-V59 WeakPolarHBondContact CE1-CG2 3.4Å; H55-V59 WeakPolarHBondContact NE2-CG2 3.43Å; H55-V59 WeakPolarHBondContact O-CB 3.44Å; H55-V59 WeakPolarHBondContact O-CG2 3.24Å; H55-V59 PolarHBondContact O-N 3.34Å
56N71.2Confident70.9Confident105 Ų10574.2 Ų74.256%0.56138%0.38SS*.Hα-helixtrans-59.6-42-179.9-75.1-19.1000112.3S52 Q53 L54 A60S52-N56 VanDerWaalsContact O-CG 3.22Å; S52-N56 PolarHBondContact O-N 2.9Å; S52-N56 VanDerWaalsContact O-N 3.12Å; S52-N56 PolarHBondContact O-ND2 3.39Å; Q53-N56 PolarHBondContact O-N 3.29Å; L54-N56 PolarHBondContact O-N 3.39Å; N56-A60 WeakPolarHBondContact O-CB 3.49Å; N56-A60 PolarHBondContact O-N 2.93Å
57I72.4Confident70.8Confident96 Ų9677.6 Ų77.649%0.49240%0.404SS..Hα-helixtrans-63.4-44.4177.4-66.4168.1000110.5Q53 L54 H55 A60 M61Q53-I57 WeakPolarHBondContact O-CG1 3.43Å; Q53-I57 PolarHBondContact O-N 3.28Å; L54-I57 PolarHBondContact O-N 2.87Å; H55-I57 VanDerWaalsContact C-N 3.31Å; H55-I57 PolarHBondContact O-N 2.88Å; I57-A60 PolarHBondContact O-N 2.83Å; I57-M61 HydrophobicContact CG2-CE 3.55Å; I57-M61 PolarHBondContact O-N 3.16Å
58L71.8Confident70.3Confident1 Ų172.9 Ų72.91%0.00539%0.389CS..Hα-helixtrans-70.4-37.7-178.8-65.6166.9000112.4L19 L46 T50 L54 H55 M61 C62L19-L58 HydrophobicContact CD1-CB 4.39Å; L19-L58 HydrophobicContact CD1-CD2 3.57Å; L19-L58 HydrophobicContact CD1-CG 4.49Å; L46-L58 HydrophobicContact CD1-CB 4.29Å; L46-L58 HydrophobicContact CD2-CB 3.53Å; L46-L58 HydrophobicContact CD2-CD1 3.45Å; L46-L58 VanDerWaalsContact CD2-CD1 3.45Å; L46-L58 HydrophobicContact CD2-CG 4.02Å; T50-L58 HydrophobicContact CG2-CD1 3.7Å; L54-L58 HydrophobicContact CD2-CD1 3.58Å; L54-L58 HydrophobicContact CD2-CG 4.14Å; L54-L58 WeakPolarHBondContact O-CD1 3.45Å; L54-L58 VanDerWaalsContact O-CG 3.23Å; L54-L58 WeakPolarHBondContact O-CG 3.27Å; L54-L58 PolarHBondContact O-N 3Å; H55-L58 PolarHBondContact O-N 3.49Å; H55-L58 VanDerWaalsContact O-N 3.16Å; L58-M61 HydrophobicContact CD2-CE 4.19Å; L58-M61 PolarHBondContact O-N 3Å; L58-C62 WeakPolarHBondContact O-CB 3.25Å; L58-C62 PolarHBondContact O-N 2.92Å; L58-C62 PolarHBondContact O-SG 2.9Å; L58-C62 VanDerWaalsContact O-SG 3.34Å
59V73.8Confident69.5Low33 Ų3370.3 Ų70.320%0.237%0.369CS..Hα-helixtrans-64.2-41.9172.7169.70000110.8H55 M61 C62 K63H55-V59 WeakPolarHBondContact CE1-CG2 3.4Å; H55-V59 WeakPolarHBondContact NE2-CG2 3.43Å; H55-V59 WeakPolarHBondContact O-CB 3.44Å; H55-V59 WeakPolarHBondContact O-CG2 3.24Å; H55-V59 PolarHBondContact O-N 3.34Å; V59-M61 VanDerWaalsContact C-N 3.35Å; V59-M61 PolarHBondContact O-N 2.89Å; V59-C62 WeakPolarHBondContact O-CB 3.36Å; V59-C62 PolarHBondContact O-N 3.35Å; V59-K63 HydrophobicContact CG1-CD 4.2Å; V59-K63 HydrophobicContact CG1-CG 4.41Å; V59-K63 WeakPolarHBondContact O-CB 3.28Å; V59-K63 WeakPolarHBondContact O-CG 3.28Å; V59-K63 PolarHBondContact O-N 3.07Å
60A73.7Confident68.4Low58 Ų5869.5 Ų69.548%0.47937%0.374SS..Hα-helixtrans-60.8-44.2175.900000111.5N56 I57 K63 Y64N56-A60 WeakPolarHBondContact O-CB 3.49Å; N56-A60 PolarHBondContact O-N 2.93Å; I57-A60 PolarHBondContact O-N 2.83Å; A60-K63 PolarHBondContact O-N 2.99Å; A60-Y64 WeakPolarHBondContact O-CB 3.3Å; A60-Y64 PolarHBondContact O-N 3.19Å
61M72.8Confident67.3Low46 Ų4677.1 Ų77.123%0.22741%0.406CS..Hα-helixtrans-60.6-48.7173.2-73.9-165.6-11600111.8C20 I57 L58 V59 K63 Y64 Y65C20-M61 PolarHBondContact SG-SD 2.83Å; I57-M61 HydrophobicContact CG2-CE 3.55Å; I57-M61 PolarHBondContact O-N 3.16Å; L58-M61 HydrophobicContact CD2-CE 4.19Å; L58-M61 PolarHBondContact O-N 3Å; V59-M61 VanDerWaalsContact C-N 3.35Å; V59-M61 PolarHBondContact O-N 2.89Å; M61-K63 VanDerWaalsContact C-N 3.3Å; M61-K63 PolarHBondContact O-N 3.5Å; M61-Y64 WeakPolarHBondContact O-CB 3.28Å; M61-Y64 PolarHBondContact O-N 3.41Å; M61-Y64 VanDerWaalsContact O-N 3.13Å; M61-Y65 WeakPolarHBondContact O-CD2 3.34Å; M61-Y65 PolarHBondContact O-N 2.68Å
62C71Confident65.6Low12 Ų1281.8 Ų81.88%0.08142%0.417CS..Hα-helixtrans-54.8-45.3176.5-78.40000112.6F27 F42 L46 L58 V59 Y65 Q66F27-C62 HydrophobicContact CE2-CB 4.35Å; F27-C62 VanDerWaalsContact CE2-SG 3.52Å; F27-C62 HydrophobicContact CZ-CB 3.75Å; F27-C62 WeakPolarHBondContact CZ-SG 3.47Å; F42-C62 VanDerWaalsContact CE1-SG 3.53Å; L46-C62 VanDerWaalsContact CD1-SG 3.52Å; L58-C62 WeakPolarHBondContact O-CB 3.25Å; L58-C62 PolarHBondContact O-N 2.92Å; L58-C62 PolarHBondContact O-SG 2.9Å; L58-C62 VanDerWaalsContact O-SG 3.34Å; V59-C62 WeakPolarHBondContact O-CB 3.36Å; V59-C62 PolarHBondContact O-N 3.35Å; C62-Y65 PolarHBondContact O-N 3.11Å; C62-Q66 WeakPolarHBondContact O-CG 3.36Å; C62-Q66 PolarHBondContact O-N 3.21Å
63K73.7Confident64Low130 Ų13083 Ų8357%0.56542%0.415SS*.Hα-helixtrans-64.1-43.4177-74.9-179179.3-178.80111.4V59 A60 M61 Y65 Q66 S67V59-K63 HydrophobicContact CG1-CD 4.2Å; V59-K63 HydrophobicContact CG1-CG 4.41Å; V59-K63 WeakPolarHBondContact O-CB 3.28Å; V59-K63 WeakPolarHBondContact O-CG 3.28Å; V59-K63 PolarHBondContact O-N 3.07Å; A60-K63 PolarHBondContact O-N 2.99Å; M61-K63 VanDerWaalsContact C-N 3.3Å; M61-K63 PolarHBondContact O-N 3.5Å; K63-Y65 PolarHBondContact O-N 3.37Å; K63-Q66 PolarHBondContact O-N 3.41Å; K63-S67 PolarHBondContact O-N 3.42Å; K63-S67 PolarHBondContact O-OG 3.02Å
64Y72.1Confident62Low178 Ų17881.2 Ų81.270%0.69844%0.439SS*.Hα-helixtrans-57.8-47.3176-179.6-95.5000111.7A60 M61 Q66 S67 G68A60-Y64 WeakPolarHBondContact O-CB 3.3Å; A60-Y64 PolarHBondContact O-N 3.19Å; M61-Y64 WeakPolarHBondContact O-CB 3.28Å; M61-Y64 PolarHBondContact O-N 3.41Å; M61-Y64 VanDerWaalsContact O-N 3.13Å; Y64-Q66 PolarHBondContact O-N 3.3Å; Y64-S67 PolarHBondContact O-N 2.93Å; Y64-G68 PolarHBondContact O-N 2.91Å
65Y68.7Low61.6Low40 Ų4083 Ų8316%0.15745%0.45CS..Hα-helixtrans-64.9-39.4176.9-80.9-75.6000112.7L22 P24 F27 M61 C62 K63 G68 I69L22-Y65 WeakPolarHBondContact O-CE1 3.27Å; L22-Y65 PolarHBondContact O-OH 3.35Å; P24-Y65 HydrophobicContact CB-CD1 4.28Å; P24-Y65 HydrophobicContact CG-CD1 4.15Å; P24-Y65 HydrophobicContact CG-CE1 4.26Å; F27-Y65 HydrophobicContact CD1-CG 4.48Å; F27-Y65 HydrophobicContact CG-CG 4.3Å; M61-Y65 WeakPolarHBondContact O-CD2 3.34Å; M61-Y65 PolarHBondContact O-N 2.68Å; C62-Y65 PolarHBondContact O-N 3.11Å; K63-Y65 PolarHBondContact O-N 3.37Å; Y65-G68 PolarHBondContact O-N 2.78Å; Y65-I69 VanDerWaalsContact O-CD1 3.3Å; Y65-I69 WeakPolarHBondContact O-CD1 3.47Å; Y65-I69 WeakPolarHBondContact O-CG1 3.47Å; Y65-I69 PolarHBondContact O-N 3.32Å; Y65-I69 VanDerWaalsContact O-N 3.07Å
66Q66.9Low61.2Low86 Ų8685.8 Ų85.840%0.40247%0.466SS..Hα-helixtrans-61.4-44.9174.3-80.1-178.4-36.500112F27 N31 C62 K63 Y64 I70F27-Q66 HydrophobicContact CE1-CG 4.27Å; N31-Q66 PolarHBondContact ND2-NE2 3.29Å; C62-Q66 WeakPolarHBondContact O-CG 3.36Å; C62-Q66 PolarHBondContact O-N 3.21Å; K63-Q66 PolarHBondContact O-N 3.41Å; Y64-Q66 PolarHBondContact O-N 3.3Å; Q66-I70 WeakPolarHBondContact O-CG1 3.11Å; Q66-I70 PolarHBondContact O-N 3.35Å
67S68Low60.6Low72 Ų7284.8 Ų84.850%0.50346%0.461SS..Hα-helixtrans-69.1-37.4178.1-62.70000112.7K63 Y64 I69 I70 F71K63-S67 PolarHBondContact O-N 3.42Å; K63-S67 PolarHBondContact O-OG 3.02Å; Y64-S67 PolarHBondContact O-N 2.93Å; S67-I69 VanDerWaalsContact C-N 3.35Å; S67-I69 PolarHBondContact O-N 3.49Å; S67-I70 WeakPolarHBondContact O-CB 3.35Å; S67-I70 PolarHBondContact O-N 3.31Å; S67-F71 PolarHBondContact O-N 2.79Å; S67-F71 VanDerWaalsContact O-N 3.14Å
68G58.8Low59.9Low27 Ų2784.1 Ų84.128%0.27846%0.459SS..Hα-helixtrans-66.2-34.3177.700000113.2Y64 Y65 F71 F72Y64-G68 PolarHBondContact O-N 2.91Å; Y65-G68 PolarHBondContact O-N 2.78Å; G68-F71 PolarHBondContact O-N 3.11Å; G68-F72 PolarHBondContact O-N 3.39Å
69I53Low59.2Low18 Ų1889.3 Ų89.39%0.09249%0.487CS..Hα-helixtrans-67.7-37.8173.2-66.6160.1000111P24 Q28 Y65 S67 F71 F72 I73P24-I69 HydrophobicContact CB-CD1 4.19Å; P24-I69 HydrophobicContact CB-CG1 3.62Å; P24-I69 VanDerWaalsContact O-CD1 3.28Å; P24-I69 WeakPolarHBondContact O-CD1 3.25Å; Q28-I69 HydrophobicContact CB-CD1 3.9Å; Q28-I69 HydrophobicContact CG-CD1 4.19Å; Y65-I69 VanDerWaalsContact O-CD1 3.3Å; Y65-I69 WeakPolarHBondContact O-CD1 3.47Å; Y65-I69 WeakPolarHBondContact O-CG1 3.47Å; Y65-I69 PolarHBondContact O-N 3.32Å; Y65-I69 VanDerWaalsContact O-N 3.07Å; S67-I69 VanDerWaalsContact C-N 3.35Å; S67-I69 PolarHBondContact O-N 3.49Å; I69-F71 PolarHBondContact O-N 3.12Å; I69-F72 PolarHBondContact O-N 3.46Å; I69-I73 HydrophobicContact CG2-CD1 3.77Å; I69-I73 WeakPolarHBondContact O-CG1 3.27Å; I69-I73 PolarHBondContact O-N 3.03Å
70I46.3Very low58.2Low128 Ų12893.1 Ų93.166%0.65651%0.506SS*.Hα-helixtrans-61.6-37.1174.8-65.6167.2000110.2Q66 S67 F72 I73 G74Q66-I70 WeakPolarHBondContact O-CG1 3.11Å; Q66-I70 PolarHBondContact O-N 3.35Å; S67-I70 WeakPolarHBondContact O-CB 3.35Å; S67-I70 PolarHBondContact O-N 3.31Å; I70-F72 PolarHBondContact O-N 3.23Å; I70-I73 PolarHBondContact O-N 3Å; I70-G74 PolarHBondContact O-N 3.32Å
71F42.2Very low57.1Low180 Ų18095.6 Ų95.679%0.78951%0.508SS*.Hα-helixtrans-71.1-23.9176.6-116.6-84.6000114.6S67 G68 I69S67-F71 PolarHBondContact O-N 2.79Å; S67-F71 VanDerWaalsContact O-N 3.14Å; G68-F71 PolarHBondContact O-N 3.11Å; I69-F71 PolarHBondContact O-N 3.12Å
72F37.4Very low55.9Low173 Ų17399.4 Ų99.476%0.75953%0.53SS*.Hα-helixtrans-88-6.3177.1-100.6-85.5000114G68 I69 I70G68-F72 PolarHBondContact O-N 3.39Å; I69-F72 PolarHBondContact O-N 3.46Å; I70-F72 PolarHBondContact O-N 3.23Å
73I39.3Very low54.7Low125 Ų125106.7 Ų106.764%0.64157%0.567SS**  trans-111.92.3179.2-59.1171000111.5I69 I70I69-I73 HydrophobicContact CG2-CD1 3.77Å; I69-I73 WeakPolarHBondContact O-CG1 3.27Å; I69-I73 PolarHBondContact O-N 3.03Å; I70-I73 PolarHBondContact O-N 3Å
74G29.5Very low52.9Low123 Ų123104.5 Ų104.5100%1.26857%0.568SS**  trans-94.50167.600000111.4I70I70-G74 PolarHBondContact O-N 3.32Å

Retrieved 74 of 74 residues in 91.6 ms (Link to these results)

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