A0A077Z4Z4_TRITR Loading...

Receptor expression-enhancing protein

AlphaFold DB , UniProt , Accession A0A077Z4Z4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 160 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
1M65.5Low87.2Confident198 Ų19896.4 Ų96.498%0.97551%0.511SS*.  0-44.10-71.4-154.3-7200112.3D3 V4 V5M1-D3 VanDerWaalsContact C-N 3.3Å; M1-D3 PolarHBondContact O-N 3.28Å; M1-V4 PolarHBondContact O-N 3.27Å; M1-V5 PolarHBondContact O-N 3.35Å
2A83.2Confident87.5Confident67 Ų6791.7 Ų91.755%0.55449%0.486SS*.Hα-helixtrans-56.1-41.5176.900000113.1V4 V5 N6A2-V4 PolarHBondContact O-N 3.31Å; A2-V5 PolarHBondContact O-N 3.47Å; A2-N6 WeakPolarHBondContact O-CB 3.41Å; A2-N6 VanDerWaalsContact O-CG 3.24Å; A2-N6 PolarHBondContact O-N 2.94Å; A2-N6 PolarHBondContact O-ND2 3.31Å
3D90.5Very high87.9Confident129 Ų12989.1 Ų89.169%0.6947%0.472SS*.Hα-helixtrans-63.7-43.3-177.9-49.8-42.7000112.7M1 V5 N6 Q7M1-D3 VanDerWaalsContact C-N 3.3Å; M1-D3 PolarHBondContact O-N 3.28Å; D3-V5 PolarHBondContact O-N 3.39Å; D3-N6 PolarHBondContact O-N 2.86Å; D3-Q7 WeakPolarHBondContact O-CB 3.05Å; D3-Q7 PolarHBondContact O-N 3.04Å
4V87.9Confident88.2Confident93 Ų9389.1 Ų89.156%0.56448%0.478SS*.Hα-helixtrans-63.5-43.4178.1178.70000110.9M1 A2 N6 Q7 I8M1-V4 PolarHBondContact O-N 3.27Å; A2-V4 PolarHBondContact O-N 3.31Å; V4-N6 VanDerWaalsContact C-N 3.32Å; V4-N6 PolarHBondContact O-N 3.48Å; V4-Q7 PolarHBondContact O-N 3.24Å; V4-I8 HydrophobicContact CG1-CD1 3.99Å; V4-I8 WeakPolarHBondContact O-CG1 3.45Å; V4-I8 PolarHBondContact O-N 3.5Å
5V87.5Confident88.4Confident75 Ų7584.8 Ų84.846%0.45546%0.455SS..Hα-helixtrans-64.3-40.6177.6174.10000110.9M1 A2 D3 I8 K9M1-V5 PolarHBondContact O-N 3.35Å; A2-V5 PolarHBondContact O-N 3.47Å; D3-V5 PolarHBondContact O-N 3.39Å; V5-I8 PolarHBondContact O-N 3.36Å; V5-K9 HydrophobicContact CG1-CD 4.39Å; V5-K9 WeakPolarHBondContact O-CG 3.33Å; V5-K9 PolarHBondContact O-N 3.48Å
6N91.2Very high88.7Confident82 Ų8279.5 Ų79.544%0.43943%0.426SS..Hα-helixtrans-66.7-40.2177.5-71.4-24.1000111.8A2 D3 V4 K9 Q10A2-N6 WeakPolarHBondContact O-CB 3.41Å; A2-N6 VanDerWaalsContact O-CG 3.24Å; A2-N6 PolarHBondContact O-N 2.94Å; A2-N6 PolarHBondContact O-ND2 3.31Å; D3-N6 PolarHBondContact O-N 2.86Å; V4-N6 VanDerWaalsContact C-N 3.32Å; V4-N6 PolarHBondContact O-N 3.48Å; N6-K9 WeakPolarHBondContact O-CB 3.47Å; N6-K9 PolarHBondContact O-N 2.8Å; N6-Q10 WeakPolarHBondContact O-CG 3.26Å; N6-Q10 PolarHBondContact O-N 3.27Å
7Q90.8Very high88.9Confident95 Ų9581.5 Ų81.544%0.44443%0.427SS..Hα-helixtrans-60.5-50.9174.5-173.362.246.500111.1D3 V4 K9 Q10 D11D3-Q7 WeakPolarHBondContact O-CB 3.05Å; D3-Q7 PolarHBondContact O-N 3.04Å; V4-Q7 PolarHBondContact O-N 3.24Å; Q7-K9 PolarHBondContact O-N 3.32Å; Q7-Q10 WeakPolarHBondContact O-CB 3.49Å; Q7-Q10 PolarHBondContact O-N 3.01Å; Q7-D11 PolarHBondContact NE2-OD1 2.87Å; Q7-D11 PolarHBondContact O-N 3.48Å
8I88.6Confident89Confident73 Ų7379.7 Ų79.737%0.37442%0.418SS..Hα-helixtrans-57.6-40.1178.4-69.4168.4000111V4 V5 D11 I12V4-I8 HydrophobicContact CG1-CD1 3.99Å; V4-I8 WeakPolarHBondContact O-CG1 3.45Å; V4-I8 PolarHBondContact O-N 3.5Å; V5-I8 PolarHBondContact O-N 3.36Å; I8-D11 PolarHBondContact O-N 2.97Å; I8-I12 HydrophobicContact CG2-CD1 3.66Å; I8-I12 HydrophobicContact CG2-CG1 4.36Å; I8-I12 WeakPolarHBondContact O-CB 3.38Å; I8-I12 WeakPolarHBondContact O-CD1 3.48Å; I8-I12 VanDerWaalsContact O-CG1 3.23Å; I8-I12 WeakPolarHBondContact O-CG1 3.48Å; I8-I12 PolarHBondContact O-N 3.19Å
9K90.5Very high88.9Confident119 Ų11980.7 Ų80.752%0.51742%0.421SS..Hα-helixtrans-62.5-43.8175.4-76.3175.6178.3-1790112.3V5 N6 Q7 N13V5-K9 HydrophobicContact CG1-CD 4.39Å; V5-K9 WeakPolarHBondContact O-CG 3.33Å; V5-K9 PolarHBondContact O-N 3.48Å; N6-K9 WeakPolarHBondContact O-CB 3.47Å; N6-K9 PolarHBondContact O-N 2.8Å; Q7-K9 PolarHBondContact O-N 3.32Å; K9-N13 WeakPolarHBondContact O-CB 3.48Å; K9-N13 PolarHBondContact O-N 3.12Å; K9-N13 PolarHBondContact O-OD1 3.23Å
10Q92.3Very high88.7Confident112 Ų11282 Ų8252%0.52343%0.432SS..Hα-helixtrans-65.3-40.8177.2-71.6177-3.800111.7N6 Q7 N13 T14N6-Q10 WeakPolarHBondContact O-CG 3.26Å; N6-Q10 PolarHBondContact O-N 3.27Å; Q7-Q10 WeakPolarHBondContact O-CB 3.49Å; Q7-Q10 PolarHBondContact O-N 3.01Å; Q10-N13 PolarHBondContact O-N 3.04Å; Q10-T14 WeakPolarHBondContact O-CB 3.34Å; Q10-T14 PolarHBondContact O-N 3.47Å; Q10-T14 PolarHBondContact O-OG1 3.47Å
11D91.4Very high88.4Confident17 Ų1779.2 Ų79.29%0.09142%0.417CS..Hα-helixtrans-63.1-47.2177.8-65.1-16.1000111Q7 I8 N13 T14 L15 I132 Y133Q7-D11 PolarHBondContact NE2-OD1 2.87Å; Q7-D11 PolarHBondContact O-N 3.48Å; I8-D11 PolarHBondContact O-N 2.97Å; D11-N13 PolarHBondContact O-N 3.38Å; D11-T14 WeakPolarHBondContact O-CB 3.42Å; D11-T14 PolarHBondContact O-N 2.69Å; D11-L15 WeakPolarHBondContact O-CG 3.41Å; D11-L15 PolarHBondContact O-N 2.83Å; D11-I132 HydrophobicContact CB-CD1 3.62Å; D11-I132 HydrophobicContact CB-CG2 4.07Å; D11-I132 WeakPolarHBondContact O-CD1 3.26Å; D11-Y133 PolarHBondContact OD2-OH 3.47Å
12I90.7Very high89.5Confident40 Ų4072.3 Ų72.321%0.20539%0.388CS..Hα-helixtrans-59-47.5174.8-72.4164.6000110.6I8 T14 L15 L16 F42I8-I12 HydrophobicContact CG2-CD1 3.66Å; I8-I12 HydrophobicContact CG2-CG1 4.36Å; I8-I12 WeakPolarHBondContact O-CB 3.38Å; I8-I12 WeakPolarHBondContact O-CD1 3.48Å; I8-I12 VanDerWaalsContact O-CG1 3.23Å; I8-I12 WeakPolarHBondContact O-CG1 3.48Å; I8-I12 PolarHBondContact O-N 3.19Å; I12-T14 VanDerWaalsContact C-N 3.29Å; I12-T14 PolarHBondContact O-N 3.37Å; I12-L15 PolarHBondContact O-N 2.99Å; I12-L15 VanDerWaalsContact O-N 3.15Å; I12-L16 HydrophobicContact CG2-CD1 3.49Å; I12-L16 VanDerWaalsContact CG2-CD1 3.49Å; I12-L16 HydrophobicContact CG2-CG 4.05Å; I12-L16 WeakPolarHBondContact O-CB 3.33Å; I12-L16 VanDerWaalsContact O-CG 3.27Å; I12-L16 WeakPolarHBondContact O-CG 3.41Å; I12-L16 PolarHBondContact O-N 3.02Å; I12-F42 HydrophobicContact CD1-CD1 4.41Å; I12-F42 HydrophobicContact CD1-CE1 3.8Å; I12-F42 HydrophobicContact CG1-CE1 3.98Å; I12-F42 HydrophobicContact CG2-CD1 3.55Å; I12-F42 HydrophobicContact CG2-CE1 3.73Å; I12-F42 HydrophobicContact CG2-CG 4.23Å
13N92.6Very high89.7Confident58 Ų5872.7 Ų72.731%0.3138%0.377SS..Hα-helixtrans-60.7-42178.7-72.8-8.4000111.2K9 Q10 D11 L15 L16 Y17K9-N13 WeakPolarHBondContact O-CB 3.48Å; K9-N13 PolarHBondContact O-N 3.12Å; K9-N13 PolarHBondContact O-OD1 3.23Å; Q10-N13 PolarHBondContact O-N 3.04Å; D11-N13 PolarHBondContact O-N 3.38Å; N13-L15 VanDerWaalsContact C-N 3.28Å; N13-L15 PolarHBondContact O-N 2.86Å; N13-L16 PolarHBondContact O-N 2.92Å; N13-Y17 HydrophobicContact CB-CD2 4.38Å; N13-Y17 WeakPolarHBondContact O-CB 3.31Å; N13-Y17 VanDerWaalsContact O-CD2 3.26Å; N13-Y17 WeakPolarHBondContact O-CD2 3.3Å; N13-Y17 PolarHBondContact O-N 3.41Å
14T92.7Very high89.8Confident89 Ų8966.6 Ų66.655%0.54634%0.344SS..Hα-helixtrans-57.8-42.8176.5-56.10000111.2Q10 D11 I12 D18Q10-T14 WeakPolarHBondContact O-CB 3.34Å; Q10-T14 PolarHBondContact O-N 3.47Å; Q10-T14 PolarHBondContact O-OG1 3.47Å; D11-T14 WeakPolarHBondContact O-CB 3.42Å; D11-T14 PolarHBondContact O-N 2.69Å; I12-T14 VanDerWaalsContact C-N 3.29Å; I12-T14 PolarHBondContact O-N 3.37Å; T14-D18 VanDerWaalsContact O-CB 3.3Å; T14-D18 WeakPolarHBondContact O-CB 3.28Å; T14-D18 PolarHBondContact O-N 3.4Å
15L91.3Very high90Very high25 Ų2568.2 Ų68.213%0.13134%0.344CS..Hα-helixtrans-70-38.1176.6-65.5168.8000113.4D11 I12 N13 F23 L130 I132D11-L15 WeakPolarHBondContact O-CG 3.41Å; D11-L15 PolarHBondContact O-N 2.83Å; I12-L15 PolarHBondContact O-N 2.99Å; I12-L15 VanDerWaalsContact O-N 3.15Å; N13-L15 VanDerWaalsContact C-N 3.28Å; N13-L15 PolarHBondContact O-N 2.86Å; L15-F23 HydrophobicContact CB-CD1 4.27Å; L15-F23 HydrophobicContact CB-CE1 4.07Å; L15-L130 HydrophobicContact CD1-CD1 4.34Å; L15-L130 HydrophobicContact CD1-CD2 3.61Å; L15-L130 HydrophobicContact CD2-CD2 4.36Å; L15-I132 HydrophobicContact CD1-CD1 3.91Å; L15-I132 HydrophobicContact CD2-CD1 3.98Å; L15-I132 HydrophobicContact CD2-CG1 4.17Å; L15-I132 HydrophobicContact CG-CD1 3.6Å; L15-I132 HydrophobicContact CG-CG1 4.32Å
16L92.1Very high90.2Very high0 Ų066.3 Ų66.30%034%0.339CS..Hα-helixtrans-72.3-33-177.5-72.1173.2000112.8I12 N13 F23 G24 F27 R38 E39 F42I12-L16 HydrophobicContact CG2-CD1 3.49Å; I12-L16 VanDerWaalsContact CG2-CD1 3.49Å; I12-L16 HydrophobicContact CG2-CG 4.05Å; I12-L16 WeakPolarHBondContact O-CB 3.33Å; I12-L16 VanDerWaalsContact O-CG 3.27Å; I12-L16 WeakPolarHBondContact O-CG 3.41Å; I12-L16 PolarHBondContact O-N 3.02Å; N13-L16 PolarHBondContact O-N 2.92Å; L16-F23 HydrophobicContact CD2-CE1 3.59Å; L16-F23 HydrophobicContact CD2-CZ 3.94Å; L16-F23 HydrophobicContact CG-CE1 4.23Å; L16-G24 WeakPolarHBondContact O-CA 3.23Å; L16-F27 HydrophobicContact CD2-CB 3.86Å; L16-F27 HydrophobicContact CD2-CD1 3.83Å; L16-F27 HydrophobicContact CD2-CD2 3.5Å; L16-F27 VanDerWaalsContact CD2-CD2 3.5Å; L16-F27 HydrophobicContact CD2-CE1 4.3Å; L16-F27 HydrophobicContact CD2-CE2 4Å; L16-F27 HydrophobicContact CD2-CG 3.41Å; L16-F27 VanDerWaalsContact CD2-CG 3.41Å; L16-F27 HydrophobicContact CD2-CZ 4.38Å; L16-R38 HydrophobicContact CB-CB 4.13Å; L16-R38 HydrophobicContact CD1-CB 4.18Å; L16-R38 WeakPolarHBondContact O-CD 3.45Å; L16-R38 PolarHBondContact O-NH1 3.48Å; L16-E39 HydrophobicContact CD1-CB 4.38Å; L16-F42 HydrophobicContact CD1-CB 3.73Å; L16-F42 HydrophobicContact CD1-CG 4.11Å; L16-F42 HydrophobicContact CD2-CB 3.87Å; L16-F42 HydrophobicContact CD2-CD2 3.98Å; L16-F42 HydrophobicContact CD2-CG 4.07Å; L16-F42 HydrophobicContact CG-CB 4.42Å
17Y92.3Very high90.3Very high113 Ų11363.2 Ų63.244%0.44332%0.321SS..Hα-helixtrans-93.6-4.8179.7-72-79.2000113.3N13 E19 R38 E39N13-Y17 HydrophobicContact CB-CD2 4.38Å; N13-Y17 WeakPolarHBondContact O-CB 3.31Å; N13-Y17 VanDerWaalsContact O-CD2 3.26Å; N13-Y17 WeakPolarHBondContact O-CD2 3.3Å; N13-Y17 PolarHBondContact O-N 3.41Å; Y17-E19 PolarHBondContact O-N 2.82Å; Y17-E19 VanDerWaalsContact O-N 3.17Å; Y17-R38 HydrophobicContact CE1-CG 4.32Å; Y17-R38 HydrophobicContact CE2-CB 4.47Å; Y17-E39 PolarHBondContact OH-OE2 2.92Å
18D90.8Very high90.5Very high49 Ų4959.6 Ų59.626%0.26231%0.308SS..  trans-79.992.2170.8179.315.7000111.9T14 T20 N21 G24T14-D18 VanDerWaalsContact O-CB 3.3Å; T14-D18 WeakPolarHBondContact O-CB 3.28Å; T14-D18 PolarHBondContact O-N 3.4Å; D18-T20 VanDerWaalsContact CG-OG1 3.29Å; D18-T20 PolarHBondContact O-N 2.92Å; D18-T20 VanDerWaalsContact OD1-CB 3.3Å; D18-T20 WeakPolarHBondContact OD1-CB 3.47Å; D18-T20 WeakPolarHBondContact OD1-CG2 3.41Å; D18-T20 PolarHBondContact OD1-N 3.35Å; D18-T20 PolarHBondContact OD1-OG1 2.97Å; D18-T20 PolarHBondContact OD2-OG1 3.04Å; D18-N21 PolarHBondContact O-N 2.9Å; D18-N21 PolarHBondContact OD2-ND2 3.44Å; D18-G24 WeakPolarHBondContact O-CA 3.29Å
19E86.6Confident90.7Very high100 Ų10063.2 Ų63.247%0.46732%0.321SS..THydrogen-bonded Turntrans-77.50.6178.3-63-173-174.100114Y17 N21 K25 R38Y17-E19 PolarHBondContact O-N 2.82Å; Y17-E19 VanDerWaalsContact O-N 3.17Å; E19-N21 PolarHBondContact O-N 3.34Å; E19-K25 HydrophobicContact CB-CG 4.41Å; E19-K25 WeakPolarHBondContact O-CE 3.27Å; E19-K25 VanDerWaalsContact O-CG 3.29Å; E19-K25 WeakPolarHBondContact O-CG 3.37Å; E19-R38 IonicContact OE1-CZ 3.44Å; E19-R38 IonicContact OE1-NH1 2.77Å; E19-R38 PolarHBondContact OE1-NH1 2.85Å; E19-R38 VanDerWaalsContact OE1-NH1 3.16Å; E19-R38 IonicContact OE1-NH2 3.31Å; E19-R38 PolarHBondContact OE1-NH2 3.34Å
20T86Confident90.8Very high105 Ų10560.5 Ų60.564%0.64431%0.311SS*.THydrogen-bonded Turntrans-70.4-26.7170.371.50000111.2D18D18-T20 VanDerWaalsContact CG-OG1 3.29Å; D18-T20 PolarHBondContact O-N 2.92Å; D18-T20 VanDerWaalsContact OD1-CB 3.3Å; D18-T20 WeakPolarHBondContact OD1-CB 3.47Å; D18-T20 WeakPolarHBondContact OD1-CG2 3.41Å; D18-T20 PolarHBondContact OD1-N 3.35Å; D18-T20 PolarHBondContact OD1-OG1 2.97Å; D18-T20 PolarHBondContact OD2-OG1 3.04Å
21N83Confident90.8Very high24 Ų2457.7 Ų57.713%0.12830%0.298CS..SBendtrans-96.4146.4-178.4-78.2-50.6000112.2D18 E19 F23 G24 K25D18-N21 PolarHBondContact O-N 2.9Å; D18-N21 PolarHBondContact OD2-ND2 3.44Å; E19-N21 PolarHBondContact O-N 3.34Å; N21-F23 PolarHBondContact O-N 2.81Å; N21-F23 VanDerWaalsContact O-N 3.13Å; N21-G24 PolarHBondContact O-N 3.23Å; N21-K25 PolarHBondContact O-N 2.95Å
22P87.7Confident90.9Very high54 Ų5464.2 Ų64.235%0.35133%0.328SS..Hα-helixtrans-60.4-26177.925.7-35000112.4G26 Y70 Y73P22-G26 PolarHBondContact O-N 2.97Å; P22-Y70 HydrophobicContact CG-CD2 4.29Å; P22-Y70 HydrophobicContact CG-CE2 3.89Å; P22-Y73 HydrophobicContact CG-CD1 4.32Å; P22-Y73 HydrophobicContact CG-CE1 3.96Å
23F88.2Confident91.1Very high75 Ų7567.9 Ų67.933%0.32935%0.352SS..Hα-helixtrans-62.9-54.1175.2-177.1-98.7000112.1L15 L16 N21 K25 G26 F27 F42L15-F23 HydrophobicContact CB-CD1 4.27Å; L15-F23 HydrophobicContact CB-CE1 4.07Å; L16-F23 HydrophobicContact CD2-CE1 3.59Å; L16-F23 HydrophobicContact CD2-CZ 3.94Å; L16-F23 HydrophobicContact CG-CE1 4.23Å; N21-F23 PolarHBondContact O-N 2.81Å; N21-F23 VanDerWaalsContact O-N 3.13Å; F23-K25 PolarHBondContact O-N 3.34Å; F23-G26 PolarHBondContact O-N 3.48Å; F23-F27 HydrophobicContact CD1-CD2 4.41Å; F23-F27 HydrophobicContact CD2-CD2 4.34Å; F23-F27 HydrophobicContact CD2-CE2 4.12Å; F23-F27 HydrophobicContact CE1-CD2 4.09Å; F23-F27 HydrophobicContact CE1-CE2 4.21Å; F23-F27 HydrophobicContact CE2-CD2 4.01Å; F23-F27 AromaticContact CE2-CE2 3.47Å; F23-F27 HydrophobicContact CE2-CE2 3.47Å; F23-F27 VanDerWaalsContact CE2-CE2 3.47Å; F23-F27 AromaticContact CZ-CD2 3.87Å; F23-F27 HydrophobicContact CZ-CD2 3.87Å; F23-F27 AromaticContact CZ-CE2 3.52Å; F23-F27 HydrophobicContact CZ-CE2 3.52Å; F23-F27 HydrophobicContact CZ-CZ 4.47Å; F23-F27 WeakPolarHBondContact O-CD2 3.46Å; F23-F27 PolarHBondContact O-N 3.19Å; F23-F27 VanDerWaalsContact O-N 3.08Å; F23-F42 HydrophobicContact CE2-CE2 4.25Å; F23-F42 AromaticContact CZ-CD2 3.78Å; F23-F42 HydrophobicContact CZ-CD2 3.78Å; F23-F42 AromaticContact CZ-CE2 3.59Å; F23-F42 HydrophobicContact CZ-CE2 3.59Å
24G91Very high91.1Very high0 Ų068.2 Ų68.20%036%0.357CS..Hα-helixtrans-63.6-40.8177.800000112.7L16 D18 N21 G26 F27 A28L16-G24 WeakPolarHBondContact O-CA 3.23Å; D18-G24 WeakPolarHBondContact O-CA 3.29Å; N21-G24 PolarHBondContact O-N 3.23Å; G24-G26 VanDerWaalsContact C-N 3.31Å; G24-G26 PolarHBondContact O-N 3.45Å; G24-F27 PolarHBondContact O-N 3.17Å; G24-A28 WeakPolarHBondContact O-CB 3.49Å; G24-A28 PolarHBondContact O-N 2.77Å
25K92.6Very high91Very high128 Ų12873 Ų7356%0.55737%0.37SS*.Hα-helixtrans-60.2-39.5173.1-66.5-172.1-175.8-175.70112.7E19 N21 F23 A28 K29E19-K25 HydrophobicContact CB-CG 4.41Å; E19-K25 WeakPolarHBondContact O-CE 3.27Å; E19-K25 VanDerWaalsContact O-CG 3.29Å; E19-K25 WeakPolarHBondContact O-CG 3.37Å; N21-K25 PolarHBondContact O-N 2.95Å; F23-K25 PolarHBondContact O-N 3.34Å; K25-A28 PolarHBondContact O-N 3.16Å; K25-K29 PolarHBondContact O-N 3.3Å; K25-K29 VanDerWaalsContact O-N 3.14Å
26G92.5Very high91.1Very high34 Ų3479.1 Ų79.135%0.35139%0.391SS..Hα-helixtrans-61.1-47.5176.100000111.7P22 F23 G24 K29 I30P22-G26 PolarHBondContact O-N 2.97Å; F23-G26 PolarHBondContact O-N 3.48Å; G24-G26 VanDerWaalsContact C-N 3.31Å; G24-G26 PolarHBondContact O-N 3.45Å; G26-K29 PolarHBondContact O-N 2.96Å; G26-I30 WeakPolarHBondContact O-CG1 3.29Å; G26-I30 PolarHBondContact O-N 3.47Å; G26-I30 VanDerWaalsContact O-N 3.09Å
27F93.5Very high91.1Very high17 Ų1784.7 Ų84.78%0.07542%0.415CS..Hα-helixtrans-71.1-31.4177.9-84.5-80.9000113.7L16 F23 G24 K29 I30 E31 R38 C41 F42L16-F27 HydrophobicContact CD2-CB 3.86Å; L16-F27 HydrophobicContact CD2-CD1 3.83Å; L16-F27 HydrophobicContact CD2-CD2 3.5Å; L16-F27 VanDerWaalsContact CD2-CD2 3.5Å; L16-F27 HydrophobicContact CD2-CE1 4.3Å; L16-F27 HydrophobicContact CD2-CE2 4Å; L16-F27 HydrophobicContact CD2-CG 3.41Å; L16-F27 VanDerWaalsContact CD2-CG 3.41Å; L16-F27 HydrophobicContact CD2-CZ 4.38Å; F23-F27 HydrophobicContact CD1-CD2 4.41Å; F23-F27 HydrophobicContact CD2-CD2 4.34Å; F23-F27 HydrophobicContact CD2-CE2 4.12Å; F23-F27 HydrophobicContact CE1-CD2 4.09Å; F23-F27 HydrophobicContact CE1-CE2 4.21Å; F23-F27 HydrophobicContact CE2-CD2 4.01Å; F23-F27 AromaticContact CE2-CE2 3.47Å; F23-F27 HydrophobicContact CE2-CE2 3.47Å; F23-F27 VanDerWaalsContact CE2-CE2 3.47Å; F23-F27 AromaticContact CZ-CD2 3.87Å; F23-F27 HydrophobicContact CZ-CD2 3.87Å; F23-F27 AromaticContact CZ-CE2 3.52Å; F23-F27 HydrophobicContact CZ-CE2 3.52Å; F23-F27 HydrophobicContact CZ-CZ 4.47Å; F23-F27 WeakPolarHBondContact O-CD2 3.46Å; F23-F27 PolarHBondContact O-N 3.19Å; F23-F27 VanDerWaalsContact O-N 3.08Å; G24-F27 PolarHBondContact O-N 3.17Å; F27-K29 VanDerWaalsContact C-N 3.33Å; F27-K29 PolarHBondContact O-N 3.31Å; F27-I30 HydrophobicContact CD1-CD1 4.2Å; F27-I30 HydrophobicContact CE1-CD1 4.24Å; F27-I30 PolarHBondContact O-N 3.35Å; F27-E31 WeakPolarHBondContact O-CB 3.46Å; F27-E31 PolarHBondContact O-N 3.49Å; F27-R38 HydrophobicContact CB-CG 4.45Å; F27-C41 HydrophobicContact CD1-CB 4.21Å; F27-C41 HydrophobicContact CE1-CB 4.24Å; F27-F42 HydrophobicContact CD1-CB 4.37Å; F27-F42 VanDerWaalsContact CE1-CA 3.48Å; F27-F42 HydrophobicContact CE1-CB 3.81Å; F27-F42 HydrophobicContact CE1-CD2 4.2Å; F27-F42 AromaticContact CE2-CD2 3.98Å; F27-F42 HydrophobicContact CE2-CD2 3.98Å; F27-F42 HydrophobicContact CZ-CB 4.12Å; F27-F42 AromaticContact CZ-CD2 3.62Å; F27-F42 HydrophobicContact CZ-CD2 3.62Å; F27-F42 HydrophobicContact CZ-CG 4.36Å
28A93.4Very high91.1Very high20 Ų2080.1 Ų80.117%0.16540%0.397CS..Hα-helixtrans-58.7-44.9170.700000111.5G24 K25 I30 E31 E32 R38G24-A28 WeakPolarHBondContact O-CB 3.49Å; G24-A28 PolarHBondContact O-N 2.77Å; K25-A28 PolarHBondContact O-N 3.16Å; A28-I30 PolarHBondContact O-N 2.98Å; A28-E31 PolarHBondContact O-N 2.7Å; A28-E32 PolarHBondContact O-N 3.07Å; A28-R38 VanDerWaalsContact CB-NH2 3.32Å
29K93.3Very high91.2Very high149 Ų14980.5 Ų80.565%0.64840%0.398SS*.Hα-helixtrans-65.5-37.7175.7-171.5174.5-177.6176.90112.4K25 G26 F27 E32 V33K25-K29 PolarHBondContact O-N 3.3Å; K25-K29 VanDerWaalsContact O-N 3.14Å; G26-K29 PolarHBondContact O-N 2.96Å; F27-K29 VanDerWaalsContact C-N 3.33Å; F27-K29 PolarHBondContact O-N 3.31Å; K29-E32 PolarHBondContact O-N 3.34Å; K29-V33 WeakPolarHBondContact O-CG2 3.27Å; K29-V33 PolarHBondContact O-N 3.15Å; K29-V33 VanDerWaalsContact O-N 3.16Å
30I93Very high91.5Very high61 Ų6180.1 Ų80.131%0.31340%0.396SS..Hα-helixtrans-66.2-43.1175.7-66.7167.1000110.6G26 F27 A28 V33 T34 C41G26-I30 WeakPolarHBondContact O-CG1 3.29Å; G26-I30 PolarHBondContact O-N 3.47Å; G26-I30 VanDerWaalsContact O-N 3.09Å; F27-I30 HydrophobicContact CD1-CD1 4.2Å; F27-I30 HydrophobicContact CE1-CD1 4.24Å; F27-I30 PolarHBondContact O-N 3.35Å; A28-I30 PolarHBondContact O-N 2.98Å; I30-V33 PolarHBondContact O-N 3.25Å; I30-T34 HydrophobicContact CG2-CG2 3.98Å; I30-T34 WeakPolarHBondContact O-CB 3.49Å; I30-T34 VanDerWaalsContact O-CG2 3.31Å; I30-T34 WeakPolarHBondContact O-CG2 3.36Å; I30-T34 PolarHBondContact O-N 3.39Å; I30-T34 PolarHBondContact O-OG1 2.95Å; I30-C41 HydrophobicContact CG2-CB 3.88Å
31E92.6Very high91.8Very high53 Ų5375.6 Ų75.625%0.24837%0.368CS..Hα-helixtrans-59.3-45.1174.8167.5175-130.600111.2F27 A28 V33 T34 K35 R36 R38F27-E31 WeakPolarHBondContact O-CB 3.46Å; F27-E31 PolarHBondContact O-N 3.49Å; A28-E31 PolarHBondContact O-N 2.7Å; E31-V33 VanDerWaalsContact C-N 3.33Å; E31-V33 PolarHBondContact O-N 3.47Å; E31-T34 PolarHBondContact O-N 3.38Å; E31-K35 VanDerWaalsContact O-CA 3.26Å; E31-K35 WeakPolarHBondContact O-CA 3.35Å; E31-K35 PolarHBondContact O-N 2.8Å; E31-R36 WeakPolarHBondContact CG-O 3.46Å; E31-R38 HydrophobicContact CB-CG 3.95Å; E31-R38 HydrophobicContact CG-CG 4.4Å; E31-R38 WeakPolarHBondContact OE2-CG 3.13Å; E31-R38 IonicContact OE2-CZ 3.9Å; E31-R38 IonicContact OE2-NE 3.16Å; E31-R38 PolarHBondContact OE2-NE 3.09Å; E31-R38 IonicContact OE2-NH2 3.42Å; E31-R38 PolarHBondContact OE2-NH2 3.16Å
32E93.3Very high92.4Very high155 Ų15576.8 Ų76.872%0.72437%0.372SS*.Hα-helixtrans-59.2-42.7177.9-171.4-176.6-17900112.2A28 K29A28-E32 PolarHBondContact O-N 3.07Å; K29-E32 PolarHBondContact O-N 3.34Å
33V94.1Very high92.7Very high116 Ų11676.9 Ų76.970%0.70338%0.378SS*.Hα-helixtrans-75.2-44.6-179.5173.80000112.1K29 I30 E31K29-V33 WeakPolarHBondContact O-CG2 3.27Å; K29-V33 PolarHBondContact O-N 3.15Å; K29-V33 VanDerWaalsContact O-N 3.16Å; I30-V33 PolarHBondContact O-N 3.25Å; E31-V33 VanDerWaalsContact C-N 3.33Å; E31-V33 PolarHBondContact O-N 3.47Å
34T92.4Very high93Very high66 Ų6675.9 Ų75.941%0.40538%0.383SS..Hα-helixtrans-84.9-19.8-173.460.20000113.3I30 E31 R36 C41I30-T34 HydrophobicContact CG2-CG2 3.98Å; I30-T34 WeakPolarHBondContact O-CB 3.49Å; I30-T34 VanDerWaalsContact O-CG2 3.31Å; I30-T34 WeakPolarHBondContact O-CG2 3.36Å; I30-T34 PolarHBondContact O-N 3.39Å; I30-T34 PolarHBondContact O-OG1 2.95Å; E31-T34 PolarHBondContact O-N 3.38Å; T34-R36 PolarHBondContact O-N 2.89Å; T34-R36 PolarHBondContact OG1-N 3.45Å; T34-C41 PolarHBondContact OG1-SG 3.19Å; T34-C41 VanDerWaalsContact OG1-SG 3.37Å
35K91.5Very high93.2Very high188 Ų18879.2 Ų79.282%0.81740%0.403SS*.  trans53.629.4-169.8-55.8-175.6179.3-177.50113E31E31-K35 VanDerWaalsContact O-CA 3.26Å; E31-K35 WeakPolarHBondContact O-CA 3.35Å; E31-K35 PolarHBondContact O-N 2.8Å
36R92.4Very high93.2Very high154 Ų15475.1 Ų75.158%0.58139%0.391SS*.SBendtrans-112.6152.6175.6-66.8-69.5-176.9170.4-1.7109E31 T34 E40E31-R36 WeakPolarHBondContact CG-O 3.46Å; T34-R36 PolarHBondContact O-N 2.89Å; T34-R36 PolarHBondContact OG1-N 3.45Å; R36-E40 WeakPolarHBondContact CD-OE2 3.4Å; R36-E40 IonicContact NH1-OE2 3.26Å
37K93Very high93.3Very high117 Ų11775.9 Ų75.951%0.50939%0.394SS..  trans-63.7146.8179.4-56.2-171.8-178.6179.20110.7E39 E40 C41K37-E39 HydrophobicContact CB-CG 4.36Å; K37-E39 WeakPolarHBondContact CB-OE2 3.48Å; K37-E39 WeakPolarHBondContact CD-OE1 3.31Å; K37-E39 IonicContact NZ-OE1 4Å; K37-E39 PolarHBondContact O-N 3.04Å; K37-E40 HydrophobicContact CB-CG 4.42Å; K37-E40 PolarHBondContact O-N 2.85Å; K37-C41 PolarHBondContact O-N 2.84Å; K37-C41 VanDerWaalsContact O-N 3.12Å
38R92.9Very high93.4Very high17 Ų1780.8 Ų80.86%0.06442%0.421CS..Hα-helixtrans-55.2-38.1-178.2-61.1-175.2-170.9-175.14.3112.2L16 Y17 E19 F27 A28 E31 C41 F42L16-R38 HydrophobicContact CB-CB 4.13Å; L16-R38 HydrophobicContact CD1-CB 4.18Å; L16-R38 WeakPolarHBondContact O-CD 3.45Å; L16-R38 PolarHBondContact O-NH1 3.48Å; Y17-R38 HydrophobicContact CE1-CG 4.32Å; Y17-R38 HydrophobicContact CE2-CB 4.47Å; E19-R38 IonicContact OE1-CZ 3.44Å; E19-R38 IonicContact OE1-NH1 2.77Å; E19-R38 PolarHBondContact OE1-NH1 2.85Å; E19-R38 VanDerWaalsContact OE1-NH1 3.16Å; E19-R38 IonicContact OE1-NH2 3.31Å; E19-R38 PolarHBondContact OE1-NH2 3.34Å; F27-R38 HydrophobicContact CB-CG 4.45Å; A28-R38 VanDerWaalsContact CB-NH2 3.32Å; E31-R38 HydrophobicContact CB-CG 3.95Å; E31-R38 HydrophobicContact CG-CG 4.4Å; E31-R38 WeakPolarHBondContact OE2-CG 3.13Å; E31-R38 IonicContact OE2-CZ 3.9Å; E31-R38 IonicContact OE2-NE 3.16Å; E31-R38 PolarHBondContact OE2-NE 3.09Å; E31-R38 IonicContact OE2-NH2 3.42Å; E31-R38 PolarHBondContact OE2-NH2 3.16Å; R38-C41 PolarHBondContact O-N 3.23Å; R38-F42 VanDerWaalsContact O-CB 3.31Å; R38-F42 WeakPolarHBondContact O-CB 3.39Å; R38-F42 PolarHBondContact O-N 3.42Å
39E93.1Very high93.5Very high58 Ų5882.2 Ų82.227%0.27143%0.425SS..Hα-helixtrans-66.7-35.217964.9-88.6-157.900113.4L16 Y17 K37 A43L16-E39 HydrophobicContact CD1-CB 4.38Å; Y17-E39 PolarHBondContact OH-OE2 2.92Å; K37-E39 HydrophobicContact CB-CG 4.36Å; K37-E39 WeakPolarHBondContact CB-OE2 3.48Å; K37-E39 WeakPolarHBondContact CD-OE1 3.31Å; K37-E39 IonicContact NZ-OE1 4Å; K37-E39 PolarHBondContact O-N 3.04Å; E39-A43 VanDerWaalsContact O-CB 3.3Å; E39-A43 WeakPolarHBondContact O-CB 3.41Å; E39-A43 PolarHBondContact O-N 2.89Å
40E92Very high93.6Very high91 Ų9176.6 Ų76.643%0.42541%0.406SS..Hα-helixtrans-70.3-43.5176.1-66.5-179.8-176.300110.2R36 K37 A43 A44R36-E40 WeakPolarHBondContact CD-OE2 3.4Å; R36-E40 IonicContact NH1-OE2 3.26Å; K37-E40 HydrophobicContact CB-CG 4.42Å; K37-E40 PolarHBondContact O-N 2.85Å; E40-A43 PolarHBondContact O-N 2.87Å; E40-A44 WeakPolarHBondContact O-CB 3.4Å; E40-A44 PolarHBondContact O-N 3.46Å
41C93.5Very high93.7Very high11 Ų1178.2 Ų78.27%0.07442%0.415CS..Hα-helixtrans-61.4-45.4174.6-65.40000111.5F27 I30 T34 K37 R38 A44 V45F27-C41 HydrophobicContact CD1-CB 4.21Å; F27-C41 HydrophobicContact CE1-CB 4.24Å; I30-C41 HydrophobicContact CG2-CB 3.88Å; T34-C41 PolarHBondContact OG1-SG 3.19Å; T34-C41 VanDerWaalsContact OG1-SG 3.37Å; K37-C41 PolarHBondContact O-N 2.84Å; K37-C41 VanDerWaalsContact O-N 3.12Å; R38-C41 PolarHBondContact O-N 3.23Å; C41-A44 PolarHBondContact O-N 2.89Å; C41-V45 WeakPolarHBondContact O-CB 3.2Å; C41-V45 VanDerWaalsContact O-CG2 3.28Å; C41-V45 WeakPolarHBondContact O-CG2 3.46Å; C41-V45 PolarHBondContact O-N 3.39Å
42F94.6Very high93.7Very high48 Ų4880.1 Ų80.121%0.21142%0.42CS..Hα-helixtrans-61.7-48.5177.7178.8-101.5000111I12 L16 F23 F27 R38 A44 V45 S46I12-F42 HydrophobicContact CD1-CD1 4.41Å; I12-F42 HydrophobicContact CD1-CE1 3.8Å; I12-F42 HydrophobicContact CG1-CE1 3.98Å; I12-F42 HydrophobicContact CG2-CD1 3.55Å; I12-F42 HydrophobicContact CG2-CE1 3.73Å; I12-F42 HydrophobicContact CG2-CG 4.23Å; L16-F42 HydrophobicContact CD1-CB 3.73Å; L16-F42 HydrophobicContact CD1-CG 4.11Å; L16-F42 HydrophobicContact CD2-CB 3.87Å; L16-F42 HydrophobicContact CD2-CD2 3.98Å; L16-F42 HydrophobicContact CD2-CG 4.07Å; L16-F42 HydrophobicContact CG-CB 4.42Å; F23-F42 HydrophobicContact CE2-CE2 4.25Å; F23-F42 AromaticContact CZ-CD2 3.78Å; F23-F42 HydrophobicContact CZ-CD2 3.78Å; F23-F42 AromaticContact CZ-CE2 3.59Å; F23-F42 HydrophobicContact CZ-CE2 3.59Å; F27-F42 HydrophobicContact CD1-CB 4.37Å; F27-F42 VanDerWaalsContact CE1-CA 3.48Å; F27-F42 HydrophobicContact CE1-CB 3.81Å; F27-F42 HydrophobicContact CE1-CD2 4.2Å; F27-F42 AromaticContact CE2-CD2 3.98Å; F27-F42 HydrophobicContact CE2-CD2 3.98Å; F27-F42 HydrophobicContact CZ-CB 4.12Å; F27-F42 AromaticContact CZ-CD2 3.62Å; F27-F42 HydrophobicContact CZ-CD2 3.62Å; F27-F42 HydrophobicContact CZ-CG 4.36Å; R38-F42 VanDerWaalsContact O-CB 3.31Å; R38-F42 WeakPolarHBondContact O-CB 3.39Å; R38-F42 PolarHBondContact O-N 3.42Å; F42-A44 VanDerWaalsContact C-N 3.3Å; F42-A44 PolarHBondContact O-N 2.91Å; F42-V45 PolarHBondContact O-N 3.37Å; F42-S46 WeakPolarHBondContact CZ-OG 3.34Å; F42-S46 WeakPolarHBondContact O-CB 3.49Å; F42-S46 PolarHBondContact O-N 2.95Å; F42-S46 PolarHBondContact O-OG 2.87Å
43A93.8Very high93.7Very high57 Ų5772.9 Ų72.947%0.47139%0.386SS..Hα-helixtrans-57.8-42.9177.200000112.1E39 E40 A47E39-A43 VanDerWaalsContact O-CB 3.3Å; E39-A43 WeakPolarHBondContact O-CB 3.41Å; E39-A43 PolarHBondContact O-N 2.89Å; E40-A43 PolarHBondContact O-N 2.87Å; A43-A47 VanDerWaalsContact O-CB 3.27Å; A43-A47 WeakPolarHBondContact O-CB 3.33Å; A43-A47 PolarHBondContact O-N 3.49Å
44A94.6Very high93.6Very high53 Ų5370.5 Ų70.544%0.43837%0.369SS..Hα-helixtrans-64.4-47.1176.700000112.2E40 C41 F42 A47 L48E40-A44 WeakPolarHBondContact O-CB 3.4Å; E40-A44 PolarHBondContact O-N 3.46Å; C41-A44 PolarHBondContact O-N 2.89Å; F42-A44 VanDerWaalsContact C-N 3.3Å; F42-A44 PolarHBondContact O-N 2.91Å; A44-A47 PolarHBondContact O-N 3.44Å; A44-L48 WeakPolarHBondContact O-CB 3.4Å; A44-L48 VanDerWaalsContact O-CG 3.29Å; A44-L48 WeakPolarHBondContact O-CG 3.41Å; A44-L48 PolarHBondContact O-N 3.24Å
45V94.3Very high93.5Very high70 Ų7073.8 Ų73.842%0.42438%0.383SS..Hα-helixtrans-62.1-45.3177.7170.70000110.8C41 F42 L48 L49C41-V45 WeakPolarHBondContact O-CB 3.2Å; C41-V45 VanDerWaalsContact O-CG2 3.28Å; C41-V45 WeakPolarHBondContact O-CG2 3.46Å; C41-V45 PolarHBondContact O-N 3.39Å; F42-V45 PolarHBondContact O-N 3.37Å; V45-L48 PolarHBondContact O-N 3Å; V45-L49 WeakPolarHBondContact O-CB 3.49Å; V45-L49 PolarHBondContact O-N 3.22Å
46S93.9Very high93.4Very high42 Ų4265.8 Ų65.829%0.29435%0.354SS..Hα-helixtrans-63.5-40.3177.3-61.90000112.4F42 L49 A50F42-S46 WeakPolarHBondContact CZ-OG 3.34Å; F42-S46 WeakPolarHBondContact O-CB 3.49Å; F42-S46 PolarHBondContact O-N 2.95Å; F42-S46 PolarHBondContact O-OG 2.87Å; S46-L49 PolarHBondContact O-N 3.45Å; S46-A50 WeakPolarHBondContact O-CB 3.39Å; S46-A50 PolarHBondContact O-N 3.23Å
47A95.1Very high92.8Very high50 Ų5068.8 Ų68.841%0.41337%0.367SS..Hα-helixtrans-66.3-46.2177.200000111.9A43 A44 L49 A50 I51A43-A47 VanDerWaalsContact O-CB 3.27Å; A43-A47 WeakPolarHBondContact O-CB 3.33Å; A43-A47 PolarHBondContact O-N 3.49Å; A44-A47 PolarHBondContact O-N 3.44Å; A47-L49 VanDerWaalsContact C-N 3.33Å; A47-L49 PolarHBondContact O-N 3.38Å; A47-A50 PolarHBondContact O-N 3.13Å; A47-I51 VanDerWaalsContact O-CG1 3.29Å; A47-I51 WeakPolarHBondContact O-CG1 3.3Å; A47-I51 PolarHBondContact O-N 3.31Å
48L95.5Very high92.7Very high121 Ų12168.8 Ų68.863%0.63437%0.367SS*.Hα-helixtrans-62.1-42.1176-70.5173.3000111.6A44 V45 I51 Y52A44-L48 WeakPolarHBondContact O-CB 3.4Å; A44-L48 VanDerWaalsContact O-CG 3.29Å; A44-L48 WeakPolarHBondContact O-CG 3.41Å; A44-L48 PolarHBondContact O-N 3.24Å; V45-L48 PolarHBondContact O-N 3Å; L48-I51 PolarHBondContact O-N 2.86Å; L48-Y52 WeakPolarHBondContact O-CB 3.29Å; L48-Y52 PolarHBondContact O-N 3.35Å
49L95.3Very high92.5Very high49 Ų4968.2 Ų68.226%0.25737%0.365SS..Hα-helixtrans-61.9-46.4175.2177.265.9000111.3V45 S46 A47 I51 Y52 L53 V62 I66V45-L49 WeakPolarHBondContact O-CB 3.49Å; V45-L49 PolarHBondContact O-N 3.22Å; S46-L49 PolarHBondContact O-N 3.45Å; A47-L49 VanDerWaalsContact C-N 3.33Å; A47-L49 PolarHBondContact O-N 3.38Å; L49-I51 VanDerWaalsContact C-N 3.35Å; L49-I51 PolarHBondContact O-N 3.46Å; L49-Y52 PolarHBondContact O-N 3.27Å; L49-L53 HydrophobicContact CD1-CD1 4.35Å; L49-L53 HydrophobicContact CD1-CG 4.22Å; L49-L53 HydrophobicContact CG-CD1 4.17Å; L49-L53 HydrophobicContact CG-CG 4.42Å; L49-L53 WeakPolarHBondContact O-CB 3.22Å; L49-L53 VanDerWaalsContact O-CG 3.29Å; L49-L53 WeakPolarHBondContact O-CG 3.21Å; L49-L53 PolarHBondContact O-N 3.13Å; L49-V62 HydrophobicContact CD1-CG1 3.66Å; L49-I66 HydrophobicContact CD1-CD1 3.74Å; L49-I66 HydrophobicContact CD2-CD1 3.56Å; L49-I66 HydrophobicContact CG-CD1 4.21Å
50A94.6Very high92.4Very high31 Ų3170 Ų7026%0.25637%0.373SS..Hα-helixtrans-61-43.8178.600000111.7S46 A47 L53 I54 V119S46-A50 WeakPolarHBondContact O-CB 3.39Å; S46-A50 PolarHBondContact O-N 3.23Å; A47-A50 PolarHBondContact O-N 3.13Å; A50-L53 PolarHBondContact O-N 3.11Å; A50-I54 WeakPolarHBondContact O-CD1 3.39Å; A50-I54 VanDerWaalsContact O-CG1 3.3Å; A50-I54 WeakPolarHBondContact O-CG1 3.46Å; A50-I54 PolarHBondContact O-N 2.78Å; A50-V119 HydrophobicContact CB-CG1 4.45Å; A50-V119 HydrophobicContact CB-CG2 4.39Å
51I94.4Very high92.4Very high95 Ų9570.9 Ų70.949%0.48738%0.38SS..Hα-helixtrans-60.2-48.8174.7-67.6164.9000110.1A47 L48 L49 L53 I54 I55A47-I51 VanDerWaalsContact O-CG1 3.29Å; A47-I51 WeakPolarHBondContact O-CG1 3.3Å; A47-I51 PolarHBondContact O-N 3.31Å; L48-I51 PolarHBondContact O-N 2.86Å; L49-I51 VanDerWaalsContact C-N 3.35Å; L49-I51 PolarHBondContact O-N 3.46Å; I51-L53 VanDerWaalsContact C-N 3.3Å; I51-L53 PolarHBondContact O-N 3.31Å; I51-I54 PolarHBondContact O-N 3.28Å; I51-I55 HydrophobicContact CG2-CD1 3.9Å; I51-I55 WeakPolarHBondContact O-CG1 3.4Å; I51-I55 PolarHBondContact O-N 3.17Å
52Y94.4Very high92.4Very high93 Ų9372.3 Ų72.337%0.36539%0.388SS..Hα-helixtrans-59.5-39.5178.5-178-88.3000112.4L48 L49 I54 I55 G56 V62L48-Y52 WeakPolarHBondContact O-CB 3.29Å; L48-Y52 PolarHBondContact O-N 3.35Å; L49-Y52 PolarHBondContact O-N 3.27Å; Y52-I54 PolarHBondContact O-N 3.06Å; Y52-I55 PolarHBondContact O-N 3.32Å; Y52-G56 WeakPolarHBondContact O-CA 3.46Å; Y52-G56 PolarHBondContact O-N 3.19Å; Y52-V62 HydrophobicContact CD1-CB 4.44Å; Y52-V62 HydrophobicContact CD1-CG1 4.41Å; Y52-V62 HydrophobicContact CD1-CG2 4.19Å; Y52-V62 HydrophobicContact CE1-CB 4.05Å; Y52-V62 HydrophobicContact CE1-CG1 4.45Å; Y52-V62 HydrophobicContact CE1-CG2 3.46Å; Y52-V62 VanDerWaalsContact CE1-CG2 3.46Å
53L93.3Very high92.3Very high3 Ų370 Ų702%0.01638%0.378CS..Hα-helixtrans-67-20.8178.1-71.8178.6000113.3L49 A50 I51 A59 V62 C63 W118 V119 C122L49-L53 HydrophobicContact CD1-CD1 4.35Å; L49-L53 HydrophobicContact CD1-CG 4.22Å; L49-L53 HydrophobicContact CG-CD1 4.17Å; L49-L53 HydrophobicContact CG-CG 4.42Å; L49-L53 WeakPolarHBondContact O-CB 3.22Å; L49-L53 VanDerWaalsContact O-CG 3.29Å; L49-L53 WeakPolarHBondContact O-CG 3.21Å; L49-L53 PolarHBondContact O-N 3.13Å; A50-L53 PolarHBondContact O-N 3.11Å; I51-L53 VanDerWaalsContact C-N 3.3Å; I51-L53 PolarHBondContact O-N 3.31Å; L53-A59 HydrophobicContact CD2-CB 4.13Å; L53-A59 WeakPolarHBondContact CD2-O 3.3Å; L53-A59 WeakPolarHBondContact O-CB 3.39Å; L53-V62 HydrophobicContact CD2-CB 4.23Å; L53-V62 HydrophobicContact CD2-CG1 4.09Å; L53-C63 HydrophobicContact CD2-CB 4.05Å; L53-W118 HydrophobicContact CB-CB 4.01Å; L53-W118 HydrophobicContact CD2-CB 4.33Å; L53-W118 WeakPolarHBondContact O-CB 3.3Å; L53-V119 HydrophobicContact CB-CG2 3.86Å; L53-C122 HydrophobicContact CD1-CB 3.69Å
54I91.5Very high92.3Very high66 Ų6668.9 Ų68.934%0.33836%0.364SS..Hα-helixtrans-85.9-41.8177.5-64160.5000111.3A50 I51 Y52 F116 V119A50-I54 WeakPolarHBondContact O-CD1 3.39Å; A50-I54 VanDerWaalsContact O-CG1 3.3Å; A50-I54 WeakPolarHBondContact O-CG1 3.46Å; A50-I54 PolarHBondContact O-N 2.78Å; I51-I54 PolarHBondContact O-N 3.28Å; Y52-I54 PolarHBondContact O-N 3.06Å; I54-F116 HydrophobicContact CD1-CD1 3.65Å; I54-F116 HydrophobicContact CD1-CE1 3.77Å; I54-F116 HydrophobicContact CG1-CD1 3.88Å; I54-F116 HydrophobicContact CG1-CE1 4.3Å; I54-V119 HydrophobicContact CD1-CG2 4.16Å; I54-V119 HydrophobicContact CG1-CG2 3.74Å
55I89.8Confident92.2Very high136 Ų13669.8 Ų69.870%0.69736%0.364SS*.Hα-helixtrans-110.4-11.9-170.270.5-176.7000114.6I51 Y52I51-I55 HydrophobicContact CG2-CD1 3.9Å; I51-I55 WeakPolarHBondContact O-CG1 3.4Å; I51-I55 PolarHBondContact O-N 3.17Å; Y52-I55 PolarHBondContact O-N 3.32Å
56G88.7Confident92.2Very high20 Ų2068.3 Ų68.321%0.20635%0.353CS..  trans-81.6139.1-167.700000114.3Y52 F58 A59Y52-G56 WeakPolarHBondContact O-CA 3.46Å; Y52-G56 PolarHBondContact O-N 3.19Å; G56-F58 PolarHBondContact O-N 2.82Å; G56-F58 VanDerWaalsContact O-N 3.11Å; G56-A59 PolarHBondContact O-N 3.3Å
57Y81.4Confident92.1Very high217 Ų21766.3 Ų66.385%0.85134%0.339SS*.THydrogen-bonded Turntrans-66.2-11.3-178.8-163.1-101.1000114.4
58F89.5Confident92Very high117 Ų11767.2 Ų67.251%0.51333%0.334SS..THydrogen-bonded Turntrans-12928.2178.2-66.4-74.6000113.5G56 K60 L61 V62G56-F58 PolarHBondContact O-N 2.82Å; G56-F58 VanDerWaalsContact O-N 3.11Å; F58-K60 PolarHBondContact O-N 3.38Å; F58-K60 VanDerWaalsContact O-N 3.13Å; F58-L61 HydrophobicContact CB-CB 4.29Å; F58-L61 PolarHBondContact O-N 3.02Å; F58-V62 PolarHBondContact O-N 3.32Å
59A90.4Very high92Very high4 Ų464.1 Ų64.13%0.03333%0.326CS..Hα-helixtrans-52.6-37.2-179.800000113L53 G56 L61 V62 C63 W118L53-A59 HydrophobicContact CD2-CB 4.13Å; L53-A59 WeakPolarHBondContact CD2-O 3.3Å; L53-A59 WeakPolarHBondContact O-CB 3.39Å; G56-A59 PolarHBondContact O-N 3.3Å; A59-L61 PolarHBondContact O-N 3.49Å; A59-V62 PolarHBondContact O-N 3.29Å; A59-C63 WeakPolarHBondContact O-CB 3.44Å; A59-C63 PolarHBondContact O-N 2.6Å; A59-W118 HydrophobicContact CB-CB 4.31Å; A59-W118 HydrophobicContact CB-CD2 4.3Å; A59-W118 HydrophobicContact CB-CG 3.76Å
60K89.5Confident91.8Very high97 Ų9763.9 Ų63.942%0.42232%0.322SS..Hα-helixtrans-57-48.9173.3-174.1164.2-170.5169.20112.9F58 N64 D108 W118F58-K60 PolarHBondContact O-N 3.38Å; F58-K60 VanDerWaalsContact O-N 3.13Å; K60-N64 VanDerWaalsContact O-CB 3.29Å; K60-N64 WeakPolarHBondContact O-CB 3.42Å; K60-N64 PolarHBondContact O-N 3.23Å; K60-D108 IonicContact NZ-OD1 3.32Å; K60-D108 IonicContact NZ-OD2 3.91Å; K60-W118 HydrophobicContact CB-CH2 3.47Å; K60-W118 VanDerWaalsContact CB-CH2 3.47Å; K60-W118 HydrophobicContact CB-CZ2 3.5Å; K60-W118 VanDerWaalsContact CB-CZ2 3.5Å; K60-W118 HydrophobicContact CB-CZ3 4.04Å; K60-W118 HydrophobicContact CD-CH2 3.77Å; K60-W118 HydrophobicContact CD-CZ2 4.1Å; K60-W118 HydrophobicContact CG-CH2 3.38Å; K60-W118 HydrophobicContact CG-CZ2 3.89Å; K60-W118 HydrophobicContact CG-CZ3 3.99Å
61L92.5Very high91.7Very high109 Ų10962.4 Ų62.457%0.57131%0.31SS*.Hα-helixtrans-66.6-45-178.7-179.165.3000110.6F58 A59 N64 T65F58-L61 HydrophobicContact CB-CB 4.29Å; F58-L61 PolarHBondContact O-N 3.02Å; A59-L61 PolarHBondContact O-N 3.49Å; L61-N64 PolarHBondContact O-N 3.42Å; L61-T65 WeakPolarHBondContact O-CB 3.16Å; L61-T65 PolarHBondContact O-N 3.08Å; L61-T65 PolarHBondContact O-OG1 3.19Å
62V93.9Very high91.7Very high40 Ų4059.5 Ų59.524%0.24230%0.3CS..Hα-helixtrans-63.8-47.8179.81730000110.9L49 Y52 L53 F58 A59 N64 T65 I66L49-V62 HydrophobicContact CD1-CG1 3.66Å; Y52-V62 HydrophobicContact CD1-CB 4.44Å; Y52-V62 HydrophobicContact CD1-CG1 4.41Å; Y52-V62 HydrophobicContact CD1-CG2 4.19Å; Y52-V62 HydrophobicContact CE1-CB 4.05Å; Y52-V62 HydrophobicContact CE1-CG1 4.45Å; Y52-V62 HydrophobicContact CE1-CG2 3.46Å; Y52-V62 VanDerWaalsContact CE1-CG2 3.46Å; L53-V62 HydrophobicContact CD2-CB 4.23Å; L53-V62 HydrophobicContact CD2-CG1 4.09Å; F58-V62 PolarHBondContact O-N 3.32Å; A59-V62 PolarHBondContact O-N 3.29Å; V62-N64 PolarHBondContact O-N 2.73Å; V62-T65 WeakPolarHBondContact O-CB 3.49Å; V62-T65 PolarHBondContact O-N 3.39Å; V62-I66 HydrophobicContact CG1-CD1 4.09Å; V62-I66 WeakPolarHBondContact O-CG1 3.39Å; V62-I66 PolarHBondContact O-N 2.94Å
63C92.9Very high91.7Very high0 Ų060.6 Ų60.60%030%0.304CS..Hα-helixtrans-60.2-45.2177.4-173.50000112L53 A59 T65 I66 G67 W118L53-C63 HydrophobicContact CD2-CB 4.05Å; A59-C63 WeakPolarHBondContact O-CB 3.44Å; A59-C63 PolarHBondContact O-N 2.6Å; C63-T65 VanDerWaalsContact C-N 3.33Å; C63-I66 PolarHBondContact O-N 3.14Å; C63-G67 PolarHBondContact O-N 3.18Å; C63-W118 HydrophobicContact CB-CE3 3.83Å; C63-W118 HydrophobicContact CB-CZ3 4.44Å
64N92.6Very high91.6Very high33 Ų3361.4 Ų61.418%0.17631%0.308CS..Hα-helixtrans-66.4-36.9177.8-73.2-3.8000111.6K60 L61 V62 I66 G67 F68 K121K60-N64 VanDerWaalsContact O-CB 3.29Å; K60-N64 WeakPolarHBondContact O-CB 3.42Å; K60-N64 PolarHBondContact O-N 3.23Å; L61-N64 PolarHBondContact O-N 3.42Å; V62-N64 PolarHBondContact O-N 2.73Å; N64-I66 VanDerWaalsContact C-N 3.33Å; N64-I66 PolarHBondContact O-N 3.49Å; N64-G67 CarbonylContact O-C 3.59Å; N64-G67 PolarHBondContact O-N 3.35Å; N64-F68 HydrophobicContact CB-CD2 4.28Å; N64-F68 HydrophobicContact CB-CE2 3.88Å; N64-F68 HydrophobicContact CB-CZ 4.12Å; N64-F68 VanDerWaalsContact O-CB 3.3Å; N64-F68 WeakPolarHBondContact O-CB 3.48Å; N64-F68 WeakPolarHBondContact O-CD1 3.33Å; N64-F68 WeakPolarHBondContact O-CD2 3.46Å; N64-F68 WeakPolarHBondContact O-CG 3.36Å; N64-F68 PolarHBondContact O-N 2.99Å; N64-K121 PolarHBondContact OD1-NZ 3.26Å; N64-K121 VanDerWaalsContact OD1-NZ 3.08Å
65T93.9Very high91.6Very high72 Ų7259 Ų5944%0.44230%0.297SS..Hα-helixtrans-61.2-43.6175.4-59.90000111L61 V62 C63 G67 F68 A69L61-T65 WeakPolarHBondContact O-CB 3.16Å; L61-T65 PolarHBondContact O-N 3.08Å; L61-T65 PolarHBondContact O-OG1 3.19Å; V62-T65 WeakPolarHBondContact O-CB 3.49Å; V62-T65 PolarHBondContact O-N 3.39Å; C63-T65 VanDerWaalsContact C-N 3.33Å; T65-G67 VanDerWaalsContact C-N 3.34Å; T65-G67 PolarHBondContact O-N 3.05Å; T65-F68 PolarHBondContact O-N 3.45Å; T65-A69 HydrophobicContact CG2-CB 4.2Å; T65-A69 WeakPolarHBondContact O-CB 3.11Å; T65-A69 PolarHBondContact O-N 3.2Å
66I92.8Very high91.8Very high39 Ų3957.3 Ų57.320%0.229%0.288CS..Hα-helixtrans-62-45176.2-67.2163000110.6L49 V62 C63 N64 F68 L126 Y129L49-I66 HydrophobicContact CD1-CD1 3.74Å; L49-I66 HydrophobicContact CD2-CD1 3.56Å; L49-I66 HydrophobicContact CG-CD1 4.21Å; V62-I66 HydrophobicContact CG1-CD1 4.09Å; V62-I66 WeakPolarHBondContact O-CG1 3.39Å; V62-I66 PolarHBondContact O-N 2.94Å; C63-I66 PolarHBondContact O-N 3.14Å; N64-I66 VanDerWaalsContact C-N 3.33Å; N64-I66 PolarHBondContact O-N 3.49Å; I66-F68 VanDerWaalsContact C-N 3.31Å; I66-F68 PolarHBondContact O-N 3.22Å; I66-L126 HydrophobicContact CG2-CD2 4.32Å; I66-L126 HydrophobicContact CG2-CG 4.41Å; I66-Y129 PolarHBondContact O-OH 2.86Å
67G91.9Very high91.9Very high0 Ų061 Ų610%030%0.296CS..Hα-helixtrans-67.5-24.9178.100000114.8C63 N64 T65 P71 Y93C63-G67 PolarHBondContact O-N 3.18Å; N64-G67 CarbonylContact O-C 3.59Å; N64-G67 PolarHBondContact O-N 3.35Å; T65-G67 VanDerWaalsContact C-N 3.34Å; T65-G67 PolarHBondContact O-N 3.05Å; G67-P71 WeakPolarHBondContact O-CD 3.09Å; G67-P71 VanDerWaalsContact O-CG 3.28Å; G67-P71 WeakPolarHBondContact O-CG 3.44Å; G67-Y93 PolarHBondContact O-OH 2.95Å
68F93.9Very high92.3Very high70 Ų7050.8 Ų50.831%0.30726%0.256SS..Hα-helixtrans-109.5-40.8-171.1-59.6-10000112.8N64 T65 I66 Y70 A72 W94 F97N64-F68 HydrophobicContact CB-CD2 4.28Å; N64-F68 HydrophobicContact CB-CE2 3.88Å; N64-F68 HydrophobicContact CB-CZ 4.12Å; N64-F68 VanDerWaalsContact O-CB 3.3Å; N64-F68 WeakPolarHBondContact O-CB 3.48Å; N64-F68 WeakPolarHBondContact O-CD1 3.33Å; N64-F68 WeakPolarHBondContact O-CD2 3.46Å; N64-F68 WeakPolarHBondContact O-CG 3.36Å; N64-F68 PolarHBondContact O-N 2.99Å; T65-F68 PolarHBondContact O-N 3.45Å; I66-F68 VanDerWaalsContact C-N 3.31Å; I66-F68 PolarHBondContact O-N 3.22Å; F68-Y70 PolarHBondContact O-N 3.36Å; F68-A72 WeakPolarHBondContact O-CA 3.3Å; F68-A72 WeakPolarHBondContact O-CB 3.44Å; F68-A72 PolarHBondContact O-N 3.21Å; F68-W94 HydrophobicContact CD1-CH2 4.43Å; F68-W94 HydrophobicContact CD1-CZ3 4.35Å; F68-F97 HydrophobicContact CD1-CE2 4.48Å; F68-F97 HydrophobicContact CD1-CZ 4.26Å; F68-F97 HydrophobicContact CE1-CD1 4.44Å; F68-F97 HydrophobicContact CE1-CD2 4.25Å; F68-F97 AromaticContact CE1-CE1 3.64Å; F68-F97 HydrophobicContact CE1-CE1 3.64Å; F68-F97 AromaticContact CE1-CE2 3.44Å; F68-F97 HydrophobicContact CE1-CE2 3.44Å; F68-F97 VanDerWaalsContact CE1-CE2 3.44Å; F68-F97 AromaticContact CE1-CZ 3.1Å; F68-F97 HydrophobicContact CE1-CZ 3.1Å; F68-F97 AromaticContact CZ-CE1 3.9Å; F68-F97 HydrophobicContact CZ-CE1 3.9Å; F68-F97 HydrophobicContact CZ-CE2 4.06Å; F68-F97 AromaticContact CZ-CZ 3.34Å; F68-F97 HydrophobicContact CZ-CZ 3.34Å
69A93.9Very high92.4Very high56 Ų5650.5 Ų50.546%0.46326%0.259SS..Hα-helixtrans-63.7-49.5-169.200000112T65 Y73T65-A69 HydrophobicContact CG2-CB 4.2Å; T65-A69 WeakPolarHBondContact O-CB 3.11Å; T65-A69 PolarHBondContact O-N 3.2Å; A69-Y73 WeakPolarHBondContact O-CB 3.19Å; A69-Y73 PolarHBondContact O-N 2.9Å
70Y91.7Very high92.5Very high44 Ų4457.6 Ų57.617%0.17329%0.291CS..Hα-helixtrans-69.2-49.1179.7178.7-98.5000112.2P22 F68 A72 Y73 M74 W90 Y129P22-Y70 HydrophobicContact CG-CD2 4.29Å; P22-Y70 HydrophobicContact CG-CE2 3.89Å; F68-Y70 PolarHBondContact O-N 3.36Å; Y70-A72 VanDerWaalsContact C-N 3.33Å; Y70-A72 PolarHBondContact O-N 3.11Å; Y70-Y73 PolarHBondContact O-N 3.05Å; Y70-M74 HydrophobicContact CD1-CG 4.3Å; Y70-M74 HydrophobicContact CD2-CG 4.25Å; Y70-M74 HydrophobicContact CE1-CG 3.86Å; Y70-M74 HydrophobicContact CE2-CG 3.79Å; Y70-M74 HydrophobicContact CE2-SD 4.06Å; Y70-M74 HydrophobicContact CG-CG 4.48Å; Y70-M74 WeakPolarHBondContact O-CG 3.41Å; Y70-M74 PolarHBondContact O-N 3.37Å; Y70-W90 HydrophobicContact CE1-CH2 4.09Å; Y70-Y129 AromaticContact CD1-CD2 3.65Å; Y70-Y129 HydrophobicContact CD1-CD2 3.65Å; Y70-Y129 AromaticContact CD1-CE2 3.51Å; Y70-Y129 HydrophobicContact CD1-CE2 3.51Å; Y70-Y129 AromaticContact CE1-CD2 3.96Å; Y70-Y129 HydrophobicContact CE1-CD2 3.96Å; Y70-Y129 HydrophobicContact CE1-CE2 4.07Å; Y70-Y129 HydrophobicContact CG-CE2 4.39Å
71P93.2Very high92.5Very high0 Ų055.4 Ų55.40%029%0.286CS..Hα-helixtrans-60.9-38175.5-29.840.8000114G67 M74 S75 W90 Y93 W94 Y129G67-P71 WeakPolarHBondContact O-CD 3.09Å; G67-P71 VanDerWaalsContact O-CG 3.28Å; G67-P71 WeakPolarHBondContact O-CG 3.44Å; P71-M74 PolarHBondContact O-N 3.3Å; P71-S75 VanDerWaalsContact O-CB 3.28Å; P71-S75 WeakPolarHBondContact O-CB 3.18Å; P71-S75 PolarHBondContact O-N 3.04Å; P71-S75 PolarHBondContact O-OG 2.96Å; P71-W90 HydrophobicContact CB-CE3 4.07Å; P71-W90 HydrophobicContact CB-CZ3 3.8Å; P71-W90 HydrophobicContact CG-CZ3 4.25Å; P71-Y93 HydrophobicContact CB-CD1 3.73Å; P71-Y93 HydrophobicContact CB-CE1 3.34Å; P71-Y93 HydrophobicContact CG-CD1 4.32Å; P71-Y93 HydrophobicContact CG-CE1 3.66Å; P71-Y93 HydrophobicContact CG-CE2 4.42Å; P71-W94 HydrophobicContact CB-CZ2 4.13Å; P71-Y129 HydrophobicContact CG-CD1 3.43Å; P71-Y129 VanDerWaalsContact CG-CD1 3.43Å; P71-Y129 HydrophobicContact CG-CD2 4.35Å; P71-Y129 HydrophobicContact CG-CE1 3.88Å; P71-Y129 HydrophobicContact CG-CG 3.71Å
72A94.6Very high92.3Very high34 Ų3456.3 Ų56.328%0.28130%0.299SS..Hα-helixtrans-64.5-46.4175.700000111.3F68 Y70 M74 S75 I76 W94F68-A72 WeakPolarHBondContact O-CA 3.3Å; F68-A72 WeakPolarHBondContact O-CB 3.44Å; F68-A72 PolarHBondContact O-N 3.21Å; Y70-A72 VanDerWaalsContact C-N 3.33Å; Y70-A72 PolarHBondContact O-N 3.11Å; A72-M74 VanDerWaalsContact C-N 3.32Å; A72-M74 PolarHBondContact O-N 3.33Å; A72-S75 PolarHBondContact O-N 3.04Å; A72-I76 VanDerWaalsContact O-CG1 3.27Å; A72-I76 WeakPolarHBondContact O-CG1 3.39Å; A72-I76 PolarHBondContact O-N 3.22Å; A72-W94 HydrophobicContact CB-CZ2 4.16Å
73Y92.9Very high91.9Very high115 Ų11558.3 Ų58.345%0.45131%0.308SS..Hα-helixtrans-57.1-46.5175.4173.7-100000111.9P22 A69 Y70 I76 R77P22-Y73 HydrophobicContact CG-CD1 4.32Å; P22-Y73 HydrophobicContact CG-CE1 3.96Å; A69-Y73 WeakPolarHBondContact O-CB 3.19Å; A69-Y73 PolarHBondContact O-N 2.9Å; Y70-Y73 PolarHBondContact O-N 3.05Å; Y73-I76 PolarHBondContact O-N 3.17Å; Y73-R77 VanDerWaalsContact CE1-CD 3.4Å; Y73-R77 HydrophobicContact CE1-CG 4.22Å; Y73-R77 PolarHBondContact O-N 3.45Å
74M91.2Very high91.5Very high21 Ų2163.1 Ų63.110%0.10333%0.329CS..Hα-helixtrans-71.2-33.9179.8-66-63.7-67.500112.9Y70 P71 A72 R77 A78 W90Y70-M74 HydrophobicContact CD1-CG 4.3Å; Y70-M74 HydrophobicContact CD2-CG 4.25Å; Y70-M74 HydrophobicContact CE1-CG 3.86Å; Y70-M74 HydrophobicContact CE2-CG 3.79Å; Y70-M74 HydrophobicContact CE2-SD 4.06Å; Y70-M74 HydrophobicContact CG-CG 4.48Å; Y70-M74 WeakPolarHBondContact O-CG 3.41Å; Y70-M74 PolarHBondContact O-N 3.37Å; P71-M74 PolarHBondContact O-N 3.3Å; A72-M74 VanDerWaalsContact C-N 3.32Å; A72-M74 PolarHBondContact O-N 3.33Å; M74-R77 WeakPolarHBondContact O-CB 3.3Å; M74-R77 PolarHBondContact O-N 3.35Å; M74-A78 WeakPolarHBondContact O-CB 3.49Å; M74-A78 PolarHBondContact O-N 3.2Å; M74-W90 HydrophobicContact CB-CD2 3.99Å; M74-W90 HydrophobicContact CB-CE3 4.27Å; M74-W90 HydrophobicContact CB-CH2 3.44Å; M74-W90 VanDerWaalsContact CB-CH2 3.44Å; M74-W90 HydrophobicContact CB-CZ2 3.06Å; M74-W90 HydrophobicContact CB-CZ3 4.02Å; M74-W90 HydrophobicContact CE-CZ2 3.93Å; M74-W90 HydrophobicContact CG-CH2 3.75Å; M74-W90 HydrophobicContact CG-CZ2 3.6Å
75S93Very high91Very high14 Ų1469.7 Ų69.710%0.09836%0.356CS..Hα-helixtrans-63.4-42.2173.1-560000111.1P71 A72 R77 A78 I79 W90 W94P71-S75 VanDerWaalsContact O-CB 3.28Å; P71-S75 WeakPolarHBondContact O-CB 3.18Å; P71-S75 PolarHBondContact O-N 3.04Å; P71-S75 PolarHBondContact O-OG 2.96Å; A72-S75 PolarHBondContact O-N 3.04Å; S75-R77 VanDerWaalsContact C-N 3.31Å; S75-R77 PolarHBondContact O-N 3.49Å; S75-A78 PolarHBondContact O-N 2.9Å; S75-I79 WeakPolarHBondContact O-CD1 3.47Å; S75-I79 WeakPolarHBondContact O-CG1 3.43Å; S75-I79 PolarHBondContact O-N 3.5Å; S75-W90 WeakPolarHBondContact OG-CB 3.33Å; S75-W94 PolarHBondContact OG-NE1 2.89Å
76I93.1Very high90.4Very high102 Ų10268.6 Ų68.652%0.52335%0.347SS..Hα-helixtrans-60.7-44.5174.4-68.4162.8000109.8A72 Y73 A78 I79 E80A72-I76 VanDerWaalsContact O-CG1 3.27Å; A72-I76 WeakPolarHBondContact O-CG1 3.39Å; A72-I76 PolarHBondContact O-N 3.22Å; Y73-I76 PolarHBondContact O-N 3.17Å; I76-A78 PolarHBondContact O-N 2.79Å; I76-I79 PolarHBondContact O-N 2.78Å; I76-E80 HydrophobicContact CG2-CG 4.44Å; I76-E80 VanDerWaalsContact O-CG 3.29Å; I76-E80 WeakPolarHBondContact O-CG 3.35Å; I76-E80 PolarHBondContact O-N 3.47Å; I76-E80 VanDerWaalsContact O-N 3.11Å
77R90.8Very high90.2Very high98 Ų9868.4 Ų68.437%0.3735%0.346SS..Hα-helixtrans-59.5-45.4176-74.2-174.664.8-160.90.5112.5Y73 M74 S75 I79 E80 T81Y73-R77 VanDerWaalsContact CE1-CD 3.4Å; Y73-R77 HydrophobicContact CE1-CG 4.22Å; Y73-R77 PolarHBondContact O-N 3.45Å; M74-R77 WeakPolarHBondContact O-CB 3.3Å; M74-R77 PolarHBondContact O-N 3.35Å; S75-R77 VanDerWaalsContact C-N 3.31Å; S75-R77 PolarHBondContact O-N 3.49Å; R77-I79 VanDerWaalsContact C-N 3.35Å; R77-I79 PolarHBondContact O-N 2.97Å; R77-E80 PolarHBondContact O-N 3.44Å; R77-T81 WeakPolarHBondContact O-CG2 3.3Å; R77-T81 PolarHBondContact O-N 2.86Å; R77-T81 PolarHBondContact O-OG1 3.3Å; R77-T81 VanDerWaalsContact O-OG1 3.08Å
78A90.7Very high90.1Very high1 Ų172.9 Ų72.91%0.00837%0.374CS..Hα-helixtrans-60.9-43.2179.100000112M74 S75 I76 E80 T81 K84 D86 D87M74-A78 WeakPolarHBondContact O-CB 3.49Å; M74-A78 PolarHBondContact O-N 3.2Å; S75-A78 PolarHBondContact O-N 2.9Å; I76-A78 PolarHBondContact O-N 2.79Å; A78-E80 PolarHBondContact O-N 2.91Å; A78-T81 WeakPolarHBondContact CA-OG1 3.33Å; A78-T81 PolarHBondContact O-N 2.87Å; A78-T81 PolarHBondContact O-OG1 3.11Å; A78-T81 VanDerWaalsContact O-OG1 3.05Å; A78-K84 PolarHBondContact O-NZ 3.43Å; A78-D86 WeakPolarHBondContact CA-OD2 3.48Å; A78-D86 HydrophobicContact CB-CB 4.32Å; A78-D86 VanDerWaalsContact CB-OD2 3.22Å; A78-D86 WeakPolarHBondContact CB-OD2 2.84Å; A78-D87 VanDerWaalsContact CB-OD1 3.3Å; A78-D87 WeakPolarHBondContact CB-OD1 3.42Å
79I91.7Very high89.8Confident111 Ų11170.7 Ų70.757%0.56937%0.365SS*.Hα-helixtrans-59.6-45.8176.8-70.2164000111.3S75 I76 R77 K84S75-I79 WeakPolarHBondContact O-CD1 3.47Å; S75-I79 WeakPolarHBondContact O-CG1 3.43Å; S75-I79 PolarHBondContact O-N 3.5Å; I76-I79 PolarHBondContact O-N 2.78Å; R77-I79 VanDerWaalsContact C-N 3.35Å; R77-I79 PolarHBondContact O-N 2.97Å; I79-K84 PolarHBondContact O-NZ 2.84Å
80E92.2Very high89.7Confident154 Ų15468.9 Ų68.972%0.7235%0.346SS*.Hα-helixtrans-77.9-17.9-176.4-64.4-65.616100113.4I76 R77 A78I76-E80 HydrophobicContact CG2-CG 4.44Å; I76-E80 VanDerWaalsContact O-CG 3.29Å; I76-E80 WeakPolarHBondContact O-CG 3.35Å; I76-E80 PolarHBondContact O-N 3.47Å; I76-E80 VanDerWaalsContact O-N 3.11Å; R77-E80 PolarHBondContact O-N 3.44Å; A78-E80 PolarHBondContact O-N 2.91Å
81T89.1Confident89.8Confident50 Ų5072.2 Ų72.231%0.30737%0.366SS..SBendtrans-83.8145.9176.946.80000112.5R77 A78 D83 K84R77-T81 WeakPolarHBondContact O-CG2 3.3Å; R77-T81 PolarHBondContact O-N 2.86Å; R77-T81 PolarHBondContact O-OG1 3.3Å; R77-T81 VanDerWaalsContact O-OG1 3.08Å; A78-T81 WeakPolarHBondContact CA-OG1 3.33Å; A78-T81 PolarHBondContact O-N 2.87Å; A78-T81 PolarHBondContact O-OG1 3.11Å; A78-T81 VanDerWaalsContact O-OG1 3.05Å; T81-D83 VanDerWaalsContact C-N 3.28Å; T81-D83 PolarHBondContact O-N 3.05Å; T81-D83 PolarHBondContact OG1-O 3.15Å; T81-K84 PolarHBondContact O-NZ 3.43Å; T81-K84 VanDerWaalsContact O-NZ 3.15Å
82P87.7Confident89.8Confident129 Ų12972.9 Ų72.984%0.83837%0.37SS*.SBendtrans-71.6-24.8175.429-34.7000112.6
83D86.9Confident89.9Confident82 Ų8271.2 Ų71.244%0.43936%0.357SS..  trans-71.5129.8170.3-165.1-7.3000108.8T81 K85T81-D83 VanDerWaalsContact C-N 3.28Å; T81-D83 PolarHBondContact O-N 3.05Å; T81-D83 PolarHBondContact OG1-O 3.15Å; D83-K85 WeakPolarHBondContact OD1-CB 3.3Å; D83-K85 WeakPolarHBondContact OD1-CD 3.47Å; D83-K85 WeakPolarHBondContact OD1-CG 3.21Å; D83-K85 PolarHBondContact OD1-N 3.17Å; D83-K85 VanDerWaalsContact OD1-N 3.07Å
84K84.5Confident90Very high101 Ų10169.6 Ų69.644%0.43935%0.35SS..  trans-107.24.9-176.8-61.6-69.1160.6-150.40112.6A78 I79 T81 D86 D87A78-K84 PolarHBondContact O-NZ 3.43Å; I79-K84 PolarHBondContact O-NZ 2.84Å; T81-K84 PolarHBondContact O-NZ 3.43Å; T81-K84 VanDerWaalsContact O-NZ 3.15Å; K84-D86 VanDerWaalsContact C-N 3.29Å; K84-D86 PolarHBondContact O-N 3.26Å; K84-D87 WeakPolarHBondContact CD-OD2 3.49Å; K84-D87 IonicContact NZ-OD2 2.74Å; K84-D87 PolarHBondContact NZ-OD2 3.38Å; K84-D87 WeakPolarHBondContact O-CB 3.47Å; K84-D87 PolarHBondContact O-N 3.01Å
85K81.3Confident90.2Very high171 Ų17171.4 Ų71.474%0.74336%0.362SS*.THydrogen-bonded Turntrans-65.2-31.6-179.3-73.1172.1-173.2171.50113.1D83D83-K85 WeakPolarHBondContact OD1-CB 3.3Å; D83-K85 WeakPolarHBondContact OD1-CD 3.47Å; D83-K85 WeakPolarHBondContact OD1-CG 3.21Å; D83-K85 PolarHBondContact OD1-N 3.17Å; D83-K85 VanDerWaalsContact OD1-N 3.07Å
86D82.1Confident90.3Very high48 Ų4871.2 Ų71.226%0.25736%0.36SS..THydrogen-bonded Turntrans-86.8-18.5179.461.2-21.4000113.4A78 K84 T88 Q89 W90A78-D86 WeakPolarHBondContact CA-OD2 3.48Å; A78-D86 HydrophobicContact CB-CB 4.32Å; A78-D86 VanDerWaalsContact CB-OD2 3.22Å; A78-D86 WeakPolarHBondContact CB-OD2 2.84Å; K84-D86 VanDerWaalsContact C-N 3.29Å; K84-D86 PolarHBondContact O-N 3.26Å; D86-T88 VanDerWaalsContact C-N 3.31Å; D86-T88 PolarHBondContact O-N 3.13Å; D86-Q89 WeakPolarHBondContact O-CB 3.44Å; D86-Q89 PolarHBondContact O-N 2.74Å; D86-Q89 VanDerWaalsContact O-N 3.1Å; D86-W90 PolarHBondContact O-N 3.08Å
87D87.8Confident90.4Very high35 Ų3567.5 Ų67.519%0.18734%0.34CS..Hα-helixtrans-54.1-46.1174.6-75.73.1000111.6A78 K84 Q89 W90 L91A78-D87 VanDerWaalsContact CB-OD1 3.3Å; A78-D87 WeakPolarHBondContact CB-OD1 3.42Å; K84-D87 WeakPolarHBondContact CD-OD2 3.49Å; K84-D87 IonicContact NZ-OD2 2.74Å; K84-D87 PolarHBondContact NZ-OD2 3.38Å; K84-D87 WeakPolarHBondContact O-CB 3.47Å; K84-D87 PolarHBondContact O-N 3.01Å; D87-Q89 VanDerWaalsContact C-N 3.28Å; D87-Q89 PolarHBondContact O-N 3.26Å; D87-W90 PolarHBondContact O-N 3.01Å; D87-L91 WeakPolarHBondContact O-CB 3.29Å; D87-L91 VanDerWaalsContact O-CG 3.31Å; D87-L91 WeakPolarHBondContact O-CG 3.45Å; D87-L91 PolarHBondContact O-N 3.48Å
88T88.8Confident90.6Very high95 Ų9565.3 Ų65.358%0.58334%0.343SS*.Hα-helixtrans-60.8-37.3179.5-53.90000112.2D86 T92D86-T88 VanDerWaalsContact C-N 3.31Å; D86-T88 PolarHBondContact O-N 3.13Å; T88-T92 WeakPolarHBondContact O-CB 3.45Å; T88-T92 PolarHBondContact O-N 3.04Å; T88-T92 PolarHBondContact O-OG1 3.46Å
89Q88.4Confident90.8Very high24 Ų2469 Ų6911%0.11236%0.362CS..Hα-helixtrans-66.1-46.217917762.545.500110.8D86 D87 T92 Y93D86-Q89 WeakPolarHBondContact O-CB 3.44Å; D86-Q89 PolarHBondContact O-N 2.74Å; D86-Q89 VanDerWaalsContact O-N 3.1Å; D87-Q89 VanDerWaalsContact C-N 3.28Å; D87-Q89 PolarHBondContact O-N 3.26Å; Q89-T92 PolarHBondContact O-N 3.41Å; Q89-Y93 WeakPolarHBondContact O-CB 3.44Å; Q89-Y93 PolarHBondContact O-N 2.99Å
90W93Very high90.9Very high18 Ų1865.5 Ų65.57%0.06834%0.342CS..Hα-helixtrans-73.3-38.1-178.2-63.1114.8000112.4Y70 P71 M74 S75 D86 D87 Y93 W94Y70-W90 HydrophobicContact CE1-CH2 4.09Å; P71-W90 HydrophobicContact CB-CE3 4.07Å; P71-W90 HydrophobicContact CB-CZ3 3.8Å; P71-W90 HydrophobicContact CG-CZ3 4.25Å; M74-W90 HydrophobicContact CB-CD2 3.99Å; M74-W90 HydrophobicContact CB-CE3 4.27Å; M74-W90 HydrophobicContact CB-CH2 3.44Å; M74-W90 VanDerWaalsContact CB-CH2 3.44Å; M74-W90 HydrophobicContact CB-CZ2 3.06Å; M74-W90 HydrophobicContact CB-CZ3 4.02Å; M74-W90 HydrophobicContact CE-CZ2 3.93Å; M74-W90 HydrophobicContact CG-CH2 3.75Å; M74-W90 HydrophobicContact CG-CZ2 3.6Å; S75-W90 WeakPolarHBondContact OG-CB 3.33Å; D86-W90 PolarHBondContact O-N 3.08Å; D87-W90 PolarHBondContact O-N 3.01Å; W90-Y93 WeakPolarHBondContact O-CB 3.33Å; W90-Y93 PolarHBondContact O-N 3.27Å; W90-W94 PolarHBondContact O-N 3.03Å
91L93Very high90.9Very high114 Ų11460.3 Ų60.360%0.59732%0.322SS*.Hα-helixtrans-63.7-41.8173-72.8172.8000111.7D87 Y93 W94 T95D87-L91 WeakPolarHBondContact O-CB 3.29Å; D87-L91 VanDerWaalsContact O-CG 3.31Å; D87-L91 WeakPolarHBondContact O-CG 3.45Å; D87-L91 PolarHBondContact O-N 3.48Å; L91-Y93 VanDerWaalsContact C-N 3.34Å; L91-W94 PolarHBondContact O-N 2.85Å; L91-T95 WeakPolarHBondContact O-CB 2.98Å; L91-T95 PolarHBondContact O-N 3.11Å; L91-T95 PolarHBondContact O-OG1 3.36Å
92T94Very high91.1Very high13 Ų1363.5 Ų63.58%0.0834%0.337CS..Hα-helixtrans-61.2-45.1173.8-62.60000110.9T88 Q89 T95 I96 A136 Y140T88-T92 WeakPolarHBondContact O-CB 3.45Å; T88-T92 PolarHBondContact O-N 3.04Å; T88-T92 PolarHBondContact O-OG1 3.46Å; Q89-T92 PolarHBondContact O-N 3.41Å; T92-T95 PolarHBondContact O-N 2.64Å; T92-I96 HydrophobicContact CG2-CG1 4.42Å; T92-I96 WeakPolarHBondContact O-CG1 3.48Å; T92-I96 PolarHBondContact O-N 2.86Å; T92-A136 HydrophobicContact CG2-CB 4.17Å; T92-A136 WeakPolarHBondContact CG2-O 3.28Å; T92-Y140 VanDerWaalsContact CG2-CB 3.5Å; T92-Y140 HydrophobicContact CG2-CD2 4.05Å; T92-Y140 HydrophobicContact CG2-CG 3.88Å
93Y95Very high91.2Very high0 Ų064.8 Ų64.80%033%0.33CS..Hα-helixtrans-55.1-54.2174.2172.1-98.7000112.1G67 P71 Q89 W90 L91 T95 I96 F97 L128 Y129 A136G67-Y93 PolarHBondContact O-OH 2.95Å; P71-Y93 HydrophobicContact CB-CD1 3.73Å; P71-Y93 HydrophobicContact CB-CE1 3.34Å; P71-Y93 HydrophobicContact CG-CD1 4.32Å; P71-Y93 HydrophobicContact CG-CE1 3.66Å; P71-Y93 HydrophobicContact CG-CE2 4.42Å; Q89-Y93 WeakPolarHBondContact O-CB 3.44Å; Q89-Y93 PolarHBondContact O-N 2.99Å; W90-Y93 WeakPolarHBondContact O-CB 3.33Å; W90-Y93 PolarHBondContact O-N 3.27Å; L91-Y93 VanDerWaalsContact C-N 3.34Å; Y93-T95 VanDerWaalsContact C-N 3.28Å; Y93-T95 PolarHBondContact O-N 3.4Å; Y93-I96 PolarHBondContact O-N 3.49Å; Y93-F97 HydrophobicContact CE1-CB 4.42Å; Y93-F97 WeakPolarHBondContact O-CB 3.34Å; Y93-F97 PolarHBondContact O-N 3.45Å; Y93-L128 HydrophobicContact CD2-CB 3.86Å; Y93-L128 HydrophobicContact CE2-CB 3.69Å; Y93-L128 HydrophobicContact CE2-CD1 4.17Å; Y93-Y129 AromaticContact CE2-CD1 3.86Å; Y93-Y129 HydrophobicContact CE2-CD1 3.86Å; Y93-Y129 HydrophobicContact CE2-CG 4.34Å; Y93-A136 HydrophobicContact CD2-CB 4.37Å
94W96.2Very high91.4Very high81 Ų8161.9 Ų61.931%0.30731%0.314SS..Hα-helixtrans-64.1-33.1-178.9-72.1116.7000112.6F68 P71 A72 S75 W90 L91 F97 A98F68-W94 HydrophobicContact CD1-CH2 4.43Å; F68-W94 HydrophobicContact CD1-CZ3 4.35Å; P71-W94 HydrophobicContact CB-CZ2 4.13Å; A72-W94 HydrophobicContact CB-CZ2 4.16Å; S75-W94 PolarHBondContact OG-NE1 2.89Å; W90-W94 PolarHBondContact O-N 3.03Å; L91-W94 PolarHBondContact O-N 2.85Å; W94-F97 AromaticContact CE3-CD1 3.96Å; W94-F97 HydrophobicContact CE3-CD1 3.96Å; W94-F97 HydrophobicContact CE3-CG 4.49Å; W94-F97 HydrophobicContact CZ3-CD1 4.06Å; W94-A98 VanDerWaalsContact O-CB 3.27Å; W94-A98 WeakPolarHBondContact O-CB 3.46Å; W94-A98 PolarHBondContact O-N 2.76Å
95T95Very high91.6Very high59 Ų5964.8 Ų64.836%0.36233%0.327SS..Hα-helixtrans-65.1-50.5175.2-58.40000111.4L91 T92 Y93 F97 A98 L99 Y140L91-T95 WeakPolarHBondContact O-CB 2.98Å; L91-T95 PolarHBondContact O-N 3.11Å; L91-T95 PolarHBondContact O-OG1 3.36Å; T92-T95 PolarHBondContact O-N 2.64Å; Y93-T95 VanDerWaalsContact C-N 3.28Å; Y93-T95 PolarHBondContact O-N 3.4Å; T95-F97 VanDerWaalsContact C-N 3.33Å; T95-F97 PolarHBondContact O-N 3.34Å; T95-A98 PolarHBondContact O-N 3.28Å; T95-L99 WeakPolarHBondContact O-CG 3.49Å; T95-L99 PolarHBondContact O-N 2.84Å; T95-L99 VanDerWaalsContact O-N 3.07Å; T95-Y140 HydrophobicContact CG2-CE2 4.49Å
96I95.7Very high92Very high10 Ų1061.6 Ų61.65%0.05131%0.313CS..Hα-helixtrans-65.1-40.2177.5-64.6-56.9000111.2T92 Y93 A98 L99 Y100 L128 A136 L139 V144T92-I96 HydrophobicContact CG2-CG1 4.42Å; T92-I96 WeakPolarHBondContact O-CG1 3.48Å; T92-I96 PolarHBondContact O-N 2.86Å; Y93-I96 PolarHBondContact O-N 3.49Å; I96-A98 PolarHBondContact O-N 3.24Å; I96-L99 HydrophobicContact CD1-CD1 4.45Å; I96-L99 PolarHBondContact O-N 3.05Å; I96-Y100 WeakPolarHBondContact O-CB 3.11Å; I96-Y100 PolarHBondContact O-N 3.5Å; I96-L128 HydrophobicContact CG2-CD1 4.3Å; I96-L128 HydrophobicContact CG2-CD2 3.78Å; I96-A136 HydrophobicContact CB-CB 4.3Å; I96-A136 HydrophobicContact CG1-CB 4.22Å; I96-A136 WeakPolarHBondContact CG1-O 3.19Å; I96-L139 HydrophobicContact CD1-CB 3.94Å; I96-L139 HydrophobicContact CG1-CB 4.25Å; I96-L139 HydrophobicContact CG2-CB 4.18Å; I96-L139 HydrophobicContact CG2-CD1 3.68Å; I96-V144 HydrophobicContact CD1-CG2 3.56Å
97F94.9Very high92.3Very high24 Ų2459.4 Ų59.411%0.10530%0.302CS..Hα-helixtrans-60.8-44.2175.2176.5-97.1000111.6F68 Y93 W94 T95 L99 Y100 S101 L125F68-F97 HydrophobicContact CD1-CE2 4.48Å; F68-F97 HydrophobicContact CD1-CZ 4.26Å; F68-F97 HydrophobicContact CE1-CD1 4.44Å; F68-F97 HydrophobicContact CE1-CD2 4.25Å; F68-F97 AromaticContact CE1-CE1 3.64Å; F68-F97 HydrophobicContact CE1-CE1 3.64Å; F68-F97 AromaticContact CE1-CE2 3.44Å; F68-F97 HydrophobicContact CE1-CE2 3.44Å; F68-F97 VanDerWaalsContact CE1-CE2 3.44Å; F68-F97 AromaticContact CE1-CZ 3.1Å; F68-F97 HydrophobicContact CE1-CZ 3.1Å; F68-F97 AromaticContact CZ-CE1 3.9Å; F68-F97 HydrophobicContact CZ-CE1 3.9Å; F68-F97 HydrophobicContact CZ-CE2 4.06Å; F68-F97 AromaticContact CZ-CZ 3.34Å; F68-F97 HydrophobicContact CZ-CZ 3.34Å; Y93-F97 HydrophobicContact CE1-CB 4.42Å; Y93-F97 WeakPolarHBondContact O-CB 3.34Å; Y93-F97 PolarHBondContact O-N 3.45Å; W94-F97 AromaticContact CE3-CD1 3.96Å; W94-F97 HydrophobicContact CE3-CD1 3.96Å; W94-F97 HydrophobicContact CE3-CG 4.49Å; W94-F97 HydrophobicContact CZ3-CD1 4.06Å; T95-F97 VanDerWaalsContact C-N 3.33Å; T95-F97 PolarHBondContact O-N 3.34Å; F97-L99 PolarHBondContact O-N 3.45Å; F97-Y100 HydrophobicContact CD2-CD1 4.36Å; F97-Y100 HydrophobicContact CE2-CD1 4.27Å; F97-Y100 PolarHBondContact O-N 3.35Å; F97-S101 WeakPolarHBondContact O-CB 3.42Å; F97-S101 PolarHBondContact O-N 3.02Å; F97-L125 HydrophobicContact CD2-CD2 3.75Å; F97-L125 HydrophobicContact CE2-CD2 3.9Å
98A95.1Very high92.2Very high51 Ų5162 Ų6242%0.42132%0.316SS..Hα-helixtrans-61.3-44.4176.900000111.7W94 T95 I96 S101W94-A98 VanDerWaalsContact O-CB 3.27Å; W94-A98 WeakPolarHBondContact O-CB 3.46Å; W94-A98 PolarHBondContact O-N 2.76Å; T95-A98 PolarHBondContact O-N 3.28Å; I96-A98 PolarHBondContact O-N 3.24Å; A98-S101 WeakPolarHBondContact O-CB 3.39Å; A98-S101 PolarHBondContact O-N 2.74Å; A98-S101 PolarHBondContact O-OG 3.23Å
99L94.5Very high92.2Very high78 Ų7863.8 Ų63.841%0.40832%0.315SS..Hα-helixtrans-61.9-45.8174.3-68.4172.7000111.8T95 I96 F97 S101 L102 F103 V144T95-L99 WeakPolarHBondContact O-CG 3.49Å; T95-L99 PolarHBondContact O-N 2.84Å; T95-L99 VanDerWaalsContact O-N 3.07Å; I96-L99 HydrophobicContact CD1-CD1 4.45Å; I96-L99 PolarHBondContact O-N 3.05Å; F97-L99 PolarHBondContact O-N 3.45Å; L99-S101 VanDerWaalsContact C-N 3.27Å; L99-S101 PolarHBondContact O-N 2.87Å; L99-L102 WeakPolarHBondContact O-CB 3.45Å; L99-L102 PolarHBondContact O-N 3.28Å; L99-F103 WeakPolarHBondContact O-CD2 3.34Å; L99-V144 HydrophobicContact CD1-CG2 3.6Å
100Y93.2Very high92.2Very high39 Ų3965.3 Ų65.315%0.15333%0.326CS..Hα-helixtrans-60-37.6176169.2-106.6000112.2I96 F97 L102 F103 D104 K121 F124 L125I96-Y100 WeakPolarHBondContact O-CB 3.11Å; I96-Y100 PolarHBondContact O-N 3.5Å; F97-Y100 HydrophobicContact CD2-CD1 4.36Å; F97-Y100 HydrophobicContact CE2-CD1 4.27Å; F97-Y100 PolarHBondContact O-N 3.35Å; Y100-L102 PolarHBondContact O-N 3.08Å; Y100-L102 VanDerWaalsContact O-N 3.14Å; Y100-F103 WeakPolarHBondContact O-CA 3.49Å; Y100-F103 WeakPolarHBondContact O-CB 3.35Å; Y100-F103 PolarHBondContact O-N 3.05Å; Y100-D104 HydrophobicContact CD1-CB 4.3Å; Y100-D104 HydrophobicContact CE1-CB 3.84Å; Y100-D104 PolarHBondContact O-N 2.91Å; Y100-D104 PolarHBondContact OH-OD1 3.42Å; Y100-K121 HydrophobicContact CE1-CG 4.47Å; Y100-K121 WeakPolarHBondContact OH-CG 3.42Å; Y100-F124 HydrophobicContact CD1-CE1 4.12Å; Y100-F124 HydrophobicContact CD2-CD1 4.15Å; Y100-F124 AromaticContact CD2-CE1 3.51Å; Y100-F124 HydrophobicContact CD2-CE1 3.51Å; Y100-F124 HydrophobicContact CD2-CZ 4.27Å; Y100-F124 HydrophobicContact CE1-CD1 4.3Å; Y100-F124 HydrophobicContact CE1-CE1 4.34Å; Y100-F124 AromaticContact CE2-CD1 3.93Å; Y100-F124 HydrophobicContact CE2-CD1 3.93Å; Y100-F124 AromaticContact CE2-CE1 3.77Å; Y100-F124 HydrophobicContact CE2-CE1 3.77Å; Y100-F124 HydrophobicContact CG-CD1 4.43Å; Y100-F124 AromaticContact CG-CE1 3.7Å; Y100-F124 HydrophobicContact CG-CE1 3.7Å; Y100-L125 HydrophobicContact CD1-CD2 4.42Å; Y100-L125 HydrophobicContact CE1-CD2 4.25Å
101S92.4Very high91.9Very high44 Ų4466.4 Ų66.431%0.30833%0.333SS..Hα-helixtrans-59.7-27.9-17878.50000113.3F97 A98 L99 F103 D104 F105F97-S101 WeakPolarHBondContact O-CB 3.42Å; F97-S101 PolarHBondContact O-N 3.02Å; A98-S101 WeakPolarHBondContact O-CB 3.39Å; A98-S101 PolarHBondContact O-N 2.74Å; A98-S101 PolarHBondContact O-OG 3.23Å; L99-S101 VanDerWaalsContact C-N 3.27Å; L99-S101 PolarHBondContact O-N 2.87Å; S101-F103 VanDerWaalsContact C-N 3.33Å; S101-D104 PolarHBondContact O-N 3.45Å; S101-F105 PolarHBondContact O-N 2.98Å
102L92.8Very high91.5Very high118 Ų11868.4 Ų68.462%0.61834%0.339SS*.Hα-helixtrans-65.7-36.5174.5-60.2176.5000111.9L99 Y100 F105L99-L102 WeakPolarHBondContact O-CB 3.45Å; L99-L102 PolarHBondContact O-N 3.28Å; Y100-L102 PolarHBondContact O-N 3.08Å; Y100-L102 VanDerWaalsContact O-N 3.14Å; L102-F105 WeakPolarHBondContact O-CB 3.3Å
103F90.8Very high91.3Very high156 Ų15677.4 Ų77.468%0.68437%0.373SS*.Hα-helixtrans-79.6-39.7175.3-60.4-80.4000111.6L99 Y100 S101 F105 F106L99-F103 WeakPolarHBondContact O-CD2 3.34Å; Y100-F103 WeakPolarHBondContact O-CA 3.49Å; Y100-F103 WeakPolarHBondContact O-CB 3.35Å; Y100-F103 PolarHBondContact O-N 3.05Å; S101-F103 VanDerWaalsContact C-N 3.33Å; F103-F105 PolarHBondContact O-N 2.97Å; F103-F106 PolarHBondContact O-N 3.13Å; F103-F106 VanDerWaalsContact O-N 3.15Å
104D90.5Very high91Very high21 Ų2182.1 Ų82.111%0.11239%0.394CS..Hα-helixtrans-61.9-18.6175.7-175.968.6000113Y100 S101 F106 A107 Y117 K121Y100-D104 HydrophobicContact CD1-CB 4.3Å; Y100-D104 HydrophobicContact CE1-CB 3.84Å; Y100-D104 PolarHBondContact O-N 2.91Å; Y100-D104 PolarHBondContact OH-OD1 3.42Å; S101-D104 PolarHBondContact O-N 3.45Å; D104-F106 PolarHBondContact O-N 2.93Å; D104-F106 VanDerWaalsContact O-N 3.07Å; D104-A107 WeakPolarHBondContact O-CB 3.29Å; D104-A107 PolarHBondContact O-N 2.73Å; D104-Y117 PolarHBondContact OD1-OH 3.42Å; D104-K121 VanDerWaalsContact OD1-CD 3.3Å; D104-K121 WeakPolarHBondContact OD1-CD 3.48Å; D104-K121 WeakPolarHBondContact OD1-CE 3.35Å; D104-K121 IonicContact OD1-NZ 3.19Å; D104-K121 PolarHBondContact OD1-NZ 2.75Å; D104-K121 IonicContact OD2-NZ 2.7Å; D104-K121 PolarHBondContact OD2-NZ 2.9Å
105F89.5Confident90.5Very high161 Ų16181.3 Ų81.371%0.70640%0.399SS*.THydrogen-bonded Turntrans-51.7-31.7170.8-177.1-100.2000112.8S101 L102 F103 A107S101-F105 PolarHBondContact O-N 2.98Å; L102-F105 WeakPolarHBondContact O-CB 3.3Å; F103-F105 PolarHBondContact O-N 2.97Å; F105-A107 VanDerWaalsContact C-N 3.3Å; F105-A107 PolarHBondContact O-N 3.15Å
106F89.4Confident90.3Very high105 Ų10583.6 Ų83.646%0.46140%0.404SS..THydrogen-bonded Turntrans-86.57.4177.9-57.5-76.1000114.1F103 D104 D108 K109 V110F103-F106 PolarHBondContact O-N 3.13Å; F103-F106 VanDerWaalsContact O-N 3.15Å; D104-F106 PolarHBondContact O-N 2.93Å; D104-F106 VanDerWaalsContact O-N 3.07Å; F106-D108 VanDerWaalsContact C-N 3.27Å; F106-D108 PolarHBondContact O-N 3.14Å; F106-K109 HydrophobicContact CD1-CD 4.47Å; F106-K109 WeakPolarHBondContact O-CB 3.11Å; F106-K109 PolarHBondContact O-N 2.62Å; F106-V110 PolarHBondContact O-N 3.46Å
107A88.9Confident90.1Very high2 Ų284.4 Ų84.42%0.01741%0.406CS..Hα-helixtrans-48.1-44.5-177.500000113.7D104 F105 K109 V110 M111 Y117 W118D104-A107 WeakPolarHBondContact O-CB 3.29Å; D104-A107 PolarHBondContact O-N 2.73Å; F105-A107 VanDerWaalsContact C-N 3.3Å; F105-A107 PolarHBondContact O-N 3.15Å; A107-K109 VanDerWaalsContact C-N 3.3Å; A107-K109 PolarHBondContact O-N 3.18Å; A107-V110 PolarHBondContact O-N 2.86Å; A107-V110 VanDerWaalsContact O-N 3.15Å; A107-M111 PolarHBondContact O-N 3.1Å; A107-Y117 HydrophobicContact CB-CD1 4.26Å; A107-Y117 HydrophobicContact CB-CE1 3.34Å; A107-Y117 WeakPolarHBondContact CB-OH 3.03Å; A107-W118 HydrophobicContact CB-CH2 4.34Å
108D84.8Confident90Very high89 Ų8984.2 Ų84.248%0.47641%0.405SS..Hα-helixtrans-66-34.6-176.9-62.3-31.3000111.5K60 F106 Q112K60-D108 IonicContact NZ-OD1 3.32Å; K60-D108 IonicContact NZ-OD2 3.91Å; F106-D108 VanDerWaalsContact C-N 3.27Å; F106-D108 PolarHBondContact O-N 3.14Å; D108-Q112 WeakPolarHBondContact O-CG 3.37Å; D108-Q112 PolarHBondContact O-N 3.27Å
109K88.4Confident89.9Confident132 Ų13283 Ų8357%0.57439%0.393SS*.Hα-helixtrans-70.6-41.9172.5-66-175.8-176.91770111.1F106 A107 M111 Q112 Y113F106-K109 HydrophobicContact CD1-CD 4.47Å; F106-K109 WeakPolarHBondContact O-CB 3.11Å; F106-K109 PolarHBondContact O-N 2.62Å; A107-K109 VanDerWaalsContact C-N 3.3Å; A107-K109 PolarHBondContact O-N 3.18Å; K109-M111 VanDerWaalsContact C-N 3.29Å; K109-M111 PolarHBondContact O-N 3.33Å; K109-Q112 PolarHBondContact O-N 3.27Å; K109-Y113 VanDerWaalsContact O-CD2 3.22Å; K109-Y113 WeakPolarHBondContact O-CD2 3.47Å
110V88.6Confident89.9Confident57 Ų5781.6 Ų81.635%0.34539%0.392SS..Hα-helixtrans-62.1-39.7177.7-179.60000110.8F106 A107 Q112 Y113 F114 Y117F106-V110 PolarHBondContact O-N 3.46Å; A107-V110 PolarHBondContact O-N 2.86Å; A107-V110 VanDerWaalsContact O-N 3.15Å; V110-Q112 VanDerWaalsContact C-N 3.28Å; V110-Q112 PolarHBondContact O-N 3.07Å; V110-Y113 PolarHBondContact O-N 3.41Å; V110-Y113 VanDerWaalsContact O-N 3.11Å; V110-F114 HydrophobicContact CG1-CB 4.48Å; V110-F114 PolarHBondContact O-N 3.33Å; V110-Y117 HydrophobicContact CB-CD2 3.96Å; V110-Y117 HydrophobicContact CB-CE2 4.14Å; V110-Y117 HydrophobicContact CB-CG 4.41Å; V110-Y117 HydrophobicContact CG1-CD2 3.34Å; V110-Y117 HydrophobicContact CG1-CE2 3.86Å; V110-Y117 HydrophobicContact CG1-CG 3.98Å
111M86.3Confident89.9Confident41 Ų4179.9 Ų79.920%0.20239%0.385CS..Hα-helixtrans-58.5-37.5178-164.862.354.300113.2A107 K109 Y113 F114 Y117 W118A107-M111 PolarHBondContact O-N 3.1Å; K109-M111 VanDerWaalsContact C-N 3.29Å; K109-M111 PolarHBondContact O-N 3.33Å; M111-Y113 PolarHBondContact O-N 3.19Å; M111-F114 CarbonylContact O-C 3.56Å; M111-F114 PolarHBondContact O-N 2.8Å; M111-Y117 HydrophobicContact CE-CD1 3.51Å; M111-Y117 HydrophobicContact CE-CG 3.96Å; M111-W118 HydrophobicContact CE-CB 4.37Å; M111-W118 HydrophobicContact CE-CD2 3.77Å; M111-W118 VanDerWaalsContact CE-CE2 3.42Å; M111-W118 HydrophobicContact CE-CG 3.51Å; M111-W118 HydrophobicContact CE-CZ2 4.13Å
112Q86.1Confident90Very high155 Ų15578 Ų7872%0.72437%0.372SS*.Hα-helixtrans-61.9-30.7179.2-69.7174.5-3.100112.2D108 K109 V110D108-Q112 WeakPolarHBondContact O-CG 3.37Å; D108-Q112 PolarHBondContact O-N 3.27Å; K109-Q112 PolarHBondContact O-N 3.27Å; V110-Q112 VanDerWaalsContact C-N 3.28Å; V110-Q112 PolarHBondContact O-N 3.07Å
113Y88.4Confident90Very high203 Ų20377.4 Ų77.480%0.79637%0.368SS*.Hα-helixtrans-97-28177.6-62.3-77000113K109 V110 M111K109-Y113 VanDerWaalsContact O-CD2 3.22Å; K109-Y113 WeakPolarHBondContact O-CD2 3.47Å; V110-Y113 PolarHBondContact O-N 3.41Å; V110-Y113 VanDerWaalsContact O-N 3.11Å; M111-Y113 PolarHBondContact O-N 3.19Å
114F89.5Confident90.2Very high99 Ų9972.8 Ų72.843%0.43435%0.348SS..  trans-137.295.9-173.2-170.5-109.5000111.5V110 M111 F116 Y117V110-F114 HydrophobicContact CG1-CB 4.48Å; V110-F114 PolarHBondContact O-N 3.33Å; M111-F114 CarbonylContact O-C 3.56Å; M111-F114 PolarHBondContact O-N 2.8Å; F114-F116 HydrophobicContact CD1-CB 4.24Å; F114-F116 HydrophobicContact CD2-CD2 4.49Å; F114-F116 HydrophobicContact CE1-CB 3.6Å; F114-F116 HydrophobicContact CE2-CB 4.36Å; F114-F116 AromaticContact CE2-CD2 3.99Å; F114-F116 HydrophobicContact CE2-CD2 3.99Å; F114-F116 HydrophobicContact CZ-CB 3.67Å; F114-F116 HydrophobicContact CZ-CD2 4.11Å; F114-F116 HydrophobicContact CZ-CG 4.37Å; F114-F116 PolarHBondContact O-N 3.24Å; F114-F116 VanDerWaalsContact O-N 3.13Å; F114-Y117 WeakPolarHBondContact O-CB 3.49Å; F114-Y117 PolarHBondContact O-N 3.41Å
115P85.2Confident90.4Very high64 Ų6471.8 Ų71.842%0.41634%0.343SS..THydrogen-bonded Turntrans-69.4-12.8-17428-35.5000113.9Y117P115-Y117 VanDerWaalsContact C-N 3.31Å
116F91.9Very high90.6Very high107 Ų10766.7 Ų66.747%0.46932%0.323SS..THydrogen-bonded Turntrans-89.67.2177.7-52.9-78000113.3I54 F114 W118 V119 A120I54-F116 HydrophobicContact CD1-CD1 3.65Å; I54-F116 HydrophobicContact CD1-CE1 3.77Å; I54-F116 HydrophobicContact CG1-CD1 3.88Å; I54-F116 HydrophobicContact CG1-CE1 4.3Å; F114-F116 HydrophobicContact CD1-CB 4.24Å; F114-F116 HydrophobicContact CD2-CD2 4.49Å; F114-F116 HydrophobicContact CE1-CB 3.6Å; F114-F116 HydrophobicContact CE2-CB 4.36Å; F114-F116 AromaticContact CE2-CD2 3.99Å; F114-F116 HydrophobicContact CE2-CD2 3.99Å; F114-F116 HydrophobicContact CZ-CB 3.67Å; F114-F116 HydrophobicContact CZ-CD2 4.11Å; F114-F116 HydrophobicContact CZ-CG 4.37Å; F114-F116 PolarHBondContact O-N 3.24Å; F114-F116 VanDerWaalsContact O-N 3.13Å; F116-W118 VanDerWaalsContact C-N 3.32Å; F116-W118 PolarHBondContact O-N 2.95Å; F116-V119 WeakPolarHBondContact O-CB 3.45Å; F116-V119 PolarHBondContact O-N 3.26Å; F116-V119 VanDerWaalsContact O-N 3.13Å; F116-A120 PolarHBondContact O-N 2.71Å
117Y92.1Very high90.8Very high27 Ų2765.6 Ų65.611%0.10632%0.315CS..Hα-helixtrans-58.5-40.5-176.1172.3-92000112.9D104 A107 V110 M111 F114 P115 V119 A120 K121D104-Y117 PolarHBondContact OD1-OH 3.42Å; A107-Y117 HydrophobicContact CB-CD1 4.26Å; A107-Y117 HydrophobicContact CB-CE1 3.34Å; A107-Y117 WeakPolarHBondContact CB-OH 3.03Å; V110-Y117 HydrophobicContact CB-CD2 3.96Å; V110-Y117 HydrophobicContact CB-CE2 4.14Å; V110-Y117 HydrophobicContact CB-CG 4.41Å; V110-Y117 HydrophobicContact CG1-CD2 3.34Å; V110-Y117 HydrophobicContact CG1-CE2 3.86Å; V110-Y117 HydrophobicContact CG1-CG 3.98Å; M111-Y117 HydrophobicContact CE-CD1 3.51Å; M111-Y117 HydrophobicContact CE-CG 3.96Å; F114-Y117 WeakPolarHBondContact O-CB 3.49Å; F114-Y117 PolarHBondContact O-N 3.41Å; P115-Y117 VanDerWaalsContact C-N 3.31Å; Y117-V119 VanDerWaalsContact C-N 3.3Å; Y117-V119 PolarHBondContact O-N 3.38Å; Y117-A120 PolarHBondContact O-N 3.5Å; Y117-K121 HydrophobicContact CE1-CB 4.42Å; Y117-K121 HydrophobicContact CE1-CD 4.16Å; Y117-K121 WeakPolarHBondContact O-CB 3.22Å; Y117-K121 PolarHBondContact O-N 2.95Å
118W91.7Very high91.1Very high19 Ų1965.5 Ų65.57%0.07232%0.315CS..Hα-helixtrans-63.5-36.5178-71.6125.6000112.5L53 A59 K60 C63 A107 M111 F116 K121 C122L53-W118 HydrophobicContact CB-CB 4.01Å; L53-W118 HydrophobicContact CD2-CB 4.33Å; L53-W118 WeakPolarHBondContact O-CB 3.3Å; A59-W118 HydrophobicContact CB-CB 4.31Å; A59-W118 HydrophobicContact CB-CD2 4.3Å; A59-W118 HydrophobicContact CB-CG 3.76Å; K60-W118 HydrophobicContact CB-CH2 3.47Å; K60-W118 VanDerWaalsContact CB-CH2 3.47Å; K60-W118 HydrophobicContact CB-CZ2 3.5Å; K60-W118 VanDerWaalsContact CB-CZ2 3.5Å; K60-W118 HydrophobicContact CB-CZ3 4.04Å; K60-W118 HydrophobicContact CD-CH2 3.77Å; K60-W118 HydrophobicContact CD-CZ2 4.1Å; K60-W118 HydrophobicContact CG-CH2 3.38Å; K60-W118 HydrophobicContact CG-CZ2 3.89Å; K60-W118 HydrophobicContact CG-CZ3 3.99Å; C63-W118 HydrophobicContact CB-CE3 3.83Å; C63-W118 HydrophobicContact CB-CZ3 4.44Å; A107-W118 HydrophobicContact CB-CH2 4.34Å; M111-W118 HydrophobicContact CE-CB 4.37Å; M111-W118 HydrophobicContact CE-CD2 3.77Å; M111-W118 VanDerWaalsContact CE-CE2 3.42Å; M111-W118 HydrophobicContact CE-CG 3.51Å; M111-W118 HydrophobicContact CE-CZ2 4.13Å; F116-W118 VanDerWaalsContact C-N 3.32Å; F116-W118 PolarHBondContact O-N 2.95Å; W118-K121 HydrophobicContact CE3-CD 3.96Å; W118-K121 HydrophobicContact CZ3-CD 3.78Å; W118-C122 VanDerWaalsContact O-CB 3.3Å; W118-C122 WeakPolarHBondContact O-CB 3.18Å; W118-C122 PolarHBondContact O-N 3.39Å
119V93.2Very high91.4Very high27 Ų2762 Ų6216%0.16430%0.295CS..Hα-helixtrans-66.8-47.4175179.90000110A50 L53 I54 F116 Y117 K121 C122 I123A50-V119 HydrophobicContact CB-CG1 4.45Å; A50-V119 HydrophobicContact CB-CG2 4.39Å; L53-V119 HydrophobicContact CB-CG2 3.86Å; I54-V119 HydrophobicContact CD1-CG2 4.16Å; I54-V119 HydrophobicContact CG1-CG2 3.74Å; F116-V119 WeakPolarHBondContact O-CB 3.45Å; F116-V119 PolarHBondContact O-N 3.26Å; F116-V119 VanDerWaalsContact O-N 3.13Å; Y117-V119 VanDerWaalsContact C-N 3.3Å; Y117-V119 PolarHBondContact O-N 3.38Å; V119-K121 VanDerWaalsContact C-N 3.35Å; V119-K121 PolarHBondContact O-N 2.94Å; V119-C122 PolarHBondContact O-N 3.28Å; V119-I123 HydrophobicContact CG1-CD1 3.96Å; V119-I123 WeakPolarHBondContact O-CG1 3.49Å; V119-I123 PolarHBondContact O-N 2.91Å
120A93.4Very high91.5Very high47 Ų4757.3 Ų57.339%0.38828%0.276SS..Hα-helixtrans-60.3-44177.800000111.9F116 Y117 I123 F124F116-A120 PolarHBondContact O-N 2.71Å; Y117-A120 PolarHBondContact O-N 3.5Å; A120-I123 PolarHBondContact O-N 2.85Å; A120-F124 WeakPolarHBondContact O-CB 3.37Å; A120-F124 PolarHBondContact O-N 3.49Å
121K94.1Very high91.2Very high3 Ų357.8 Ų57.81%0.01328%0.28CS..Hα-helixtrans-60.2-46.8174177.7175.7-176.5178.20111.4N64 Y100 D104 Y117 W118 V119 I123 F124 L125N64-K121 PolarHBondContact OD1-NZ 3.26Å; N64-K121 VanDerWaalsContact OD1-NZ 3.08Å; Y100-K121 HydrophobicContact CE1-CG 4.47Å; Y100-K121 WeakPolarHBondContact OH-CG 3.42Å; D104-K121 VanDerWaalsContact OD1-CD 3.3Å; D104-K121 WeakPolarHBondContact OD1-CD 3.48Å; D104-K121 WeakPolarHBondContact OD1-CE 3.35Å; D104-K121 IonicContact OD1-NZ 3.19Å; D104-K121 PolarHBondContact OD1-NZ 2.75Å; D104-K121 IonicContact OD2-NZ 2.7Å; D104-K121 PolarHBondContact OD2-NZ 2.9Å; Y117-K121 HydrophobicContact CE1-CB 4.42Å; Y117-K121 HydrophobicContact CE1-CD 4.16Å; Y117-K121 WeakPolarHBondContact O-CB 3.22Å; Y117-K121 PolarHBondContact O-N 2.95Å; W118-K121 HydrophobicContact CE3-CD 3.96Å; W118-K121 HydrophobicContact CZ3-CD 3.78Å; V119-K121 VanDerWaalsContact C-N 3.35Å; V119-K121 PolarHBondContact O-N 2.94Å; K121-I123 VanDerWaalsContact C-N 3.33Å; K121-I123 PolarHBondContact O-N 2.63Å; K121-F124 PolarHBondContact O-N 2.82Å; K121-L125 HydrophobicContact CG-CD1 3.91Å; K121-L125 HydrophobicContact CG-CG 4.26Å; K121-L125 VanDerWaalsContact O-CG 3.3Å; K121-L125 WeakPolarHBondContact O-CG 3.44Å; K121-L125 PolarHBondContact O-N 3.31Å
122C94.1Very high91.1Very high6 Ų658.7 Ų58.74%0.04129%0.285CS..Hα-helixtrans-59.7-44.6178.6-172.10000111.6L53 W118 V119 F124 L125 L126L53-C122 HydrophobicContact CD1-CB 3.69Å; W118-C122 VanDerWaalsContact O-CB 3.3Å; W118-C122 WeakPolarHBondContact O-CB 3.18Å; W118-C122 PolarHBondContact O-N 3.39Å; V119-C122 PolarHBondContact O-N 3.28Å; C122-F124 VanDerWaalsContact C-N 3.35Å; C122-L125 PolarHBondContact O-N 2.79Å; C122-L126 WeakPolarHBondContact O-CB 3.49Å; C122-L126 WeakPolarHBondContact O-CD1 3.36Å; C122-L126 VanDerWaalsContact O-CG 3.3Å; C122-L126 WeakPolarHBondContact O-CG 3.5Å; C122-L126 PolarHBondContact O-N 3.22Å
123I94Very high91.3Very high105 Ų10554 Ų5454%0.53826%0.261SS..Hα-helixtrans-61.9-44175.9-67.7167.3000110.7V119 A120 K121 L126 W127V119-I123 HydrophobicContact CG1-CD1 3.96Å; V119-I123 WeakPolarHBondContact O-CG1 3.49Å; V119-I123 PolarHBondContact O-N 2.91Å; A120-I123 PolarHBondContact O-N 2.85Å; K121-I123 VanDerWaalsContact C-N 3.33Å; K121-I123 PolarHBondContact O-N 2.63Å; I123-L126 PolarHBondContact O-N 2.81Å; I123-W127 WeakPolarHBondContact O-CB 3.28Å; I123-W127 PolarHBondContact O-N 3Å
124F94.9Very high91.3Very high59 Ų5949.1 Ų49.126%0.25924%0.241SC..Hα-helixtrans-61.6-47.8178177.6-108.5000111.9Y100 A120 K121 C122 L126 W127 L128 L139Y100-F124 HydrophobicContact CD1-CE1 4.12Å; Y100-F124 HydrophobicContact CD2-CD1 4.15Å; Y100-F124 AromaticContact CD2-CE1 3.51Å; Y100-F124 HydrophobicContact CD2-CE1 3.51Å; Y100-F124 HydrophobicContact CD2-CZ 4.27Å; Y100-F124 HydrophobicContact CE1-CD1 4.3Å; Y100-F124 HydrophobicContact CE1-CE1 4.34Å; Y100-F124 AromaticContact CE2-CD1 3.93Å; Y100-F124 HydrophobicContact CE2-CD1 3.93Å; Y100-F124 AromaticContact CE2-CE1 3.77Å; Y100-F124 HydrophobicContact CE2-CE1 3.77Å; Y100-F124 HydrophobicContact CG-CD1 4.43Å; Y100-F124 AromaticContact CG-CE1 3.7Å; Y100-F124 HydrophobicContact CG-CE1 3.7Å; A120-F124 WeakPolarHBondContact O-CB 3.37Å; A120-F124 PolarHBondContact O-N 3.49Å; K121-F124 PolarHBondContact O-N 2.82Å; C122-F124 VanDerWaalsContact C-N 3.35Å; F124-L126 VanDerWaalsContact C-N 3.35Å; F124-L126 PolarHBondContact O-N 2.92Å; F124-W127 HydrophobicContact CD2-CE3 4.2Å; F124-W127 HydrophobicContact CE2-CE3 4.1Å; F124-W127 HydrophobicContact CE2-CZ3 4.1Å; F124-W127 WeakPolarHBondContact O-CB 3.02Å; F124-W127 PolarHBondContact O-N 3.17Å; F124-W127 VanDerWaalsContact O-N 3.17Å; F124-L128 HydrophobicContact CD1-CD1 4.19Å; F124-L128 HydrophobicContact CD1-CG 4.42Å; F124-L128 HydrophobicContact CE1-CD1 3.66Å; F124-L128 HydrophobicContact CE1-CD2 4.31Å; F124-L128 HydrophobicContact CE1-CG 4.05Å; F124-L128 HydrophobicContact CE2-CD2 4.14Å; F124-L128 HydrophobicContact CE2-CG 4.41Å; F124-L128 HydrophobicContact CZ-CD1 4.03Å; F124-L128 HydrophobicContact CZ-CD2 3.83Å; F124-L128 HydrophobicContact CZ-CG 4.05Å; F124-L128 WeakPolarHBondContact O-CG 3.12Å; F124-L128 PolarHBondContact O-N 3.35Å; F124-L139 HydrophobicContact CE2-CD1 4.22Å; F124-L139 HydrophobicContact CZ-CD1 4.05Å
125L94.7Very high91.4Very high0 Ų044.4 Ų44.40%022%0.221CC..Hα-helixtrans-61.6-42.7177.7-66.6174.1000111.6F97 Y100 K121 C122 W127 L128 Y129F97-L125 HydrophobicContact CD2-CD2 3.75Å; F97-L125 HydrophobicContact CE2-CD2 3.9Å; Y100-L125 HydrophobicContact CD1-CD2 4.42Å; Y100-L125 HydrophobicContact CE1-CD2 4.25Å; K121-L125 HydrophobicContact CG-CD1 3.91Å; K121-L125 HydrophobicContact CG-CG 4.26Å; K121-L125 VanDerWaalsContact O-CG 3.3Å; K121-L125 WeakPolarHBondContact O-CG 3.44Å; K121-L125 PolarHBondContact O-N 3.31Å; C122-L125 PolarHBondContact O-N 2.79Å; L125-W127 PolarHBondContact O-N 3.29Å; L125-L128 HydrophobicContact CD2-CD1 4.21Å; L125-L128 WeakPolarHBondContact O-CB 3.41Å; L125-L128 PolarHBondContact O-N 2.81Å; L125-Y129 WeakPolarHBondContact O-CD1 3.38Å; L125-Y129 WeakPolarHBondContact O-CE1 3.34Å; L125-Y129 PolarHBondContact O-N 3.49Å
126L93.4Very high91.8Very high54 Ų5441.4 Ų41.428%0.28320%0.201SC..Hα-helixtrans-58-48172.9-76.6163.5000111.1I66 C122 I123 F124 L128 Y129 L130I66-L126 HydrophobicContact CG2-CD2 4.32Å; I66-L126 HydrophobicContact CG2-CG 4.41Å; C122-L126 WeakPolarHBondContact O-CB 3.49Å; C122-L126 WeakPolarHBondContact O-CD1 3.36Å; C122-L126 VanDerWaalsContact O-CG 3.3Å; C122-L126 WeakPolarHBondContact O-CG 3.5Å; C122-L126 PolarHBondContact O-N 3.22Å; I123-L126 PolarHBondContact O-N 2.81Å; F124-L126 VanDerWaalsContact C-N 3.35Å; F124-L126 PolarHBondContact O-N 2.92Å; L126-L128 VanDerWaalsContact C-N 3.25Å; L126-L128 PolarHBondContact O-N 2.97Å; L126-Y129 HydrophobicContact CD2-CE2 4.2Å; L126-Y129 WeakPolarHBondContact CD2-OH 3.47Å; L126-Y129 PolarHBondContact O-N 3.31Å; L126-L130 HydrophobicContact CB-CD1 4.14Å; L126-L130 WeakPolarHBondContact O-CB 3.21Å; L126-L130 WeakPolarHBondContact O-CG 3.27Å; L126-L130 PolarHBondContact O-N 3.05Å
127W94.2Very high91.9Very high81 Ų8138.8 Ų38.831%0.30719%0.19SC..Hα-helixtrans-60.5-33.5178.317782.5000113I123 F124 L125 Y133 G135 K138 L139I123-W127 WeakPolarHBondContact O-CB 3.28Å; I123-W127 PolarHBondContact O-N 3Å; F124-W127 HydrophobicContact CD2-CE3 4.2Å; F124-W127 HydrophobicContact CE2-CE3 4.1Å; F124-W127 HydrophobicContact CE2-CZ3 4.1Å; F124-W127 WeakPolarHBondContact O-CB 3.02Å; F124-W127 PolarHBondContact O-N 3.17Å; F124-W127 VanDerWaalsContact O-N 3.17Å; L125-W127 PolarHBondContact O-N 3.29Å; W127-Y133 AromaticContact CD1-CG 3.69Å; W127-G135 VanDerWaalsContact CH2-CA 3.48Å; W127-G135 WeakPolarHBondContact CH2-O 3.45Å; W127-G135 WeakPolarHBondContact O-CA 3.44Å; W127-G135 PolarHBondContact O-N 2.63Å; W127-G135 VanDerWaalsContact O-N 3.11Å; W127-K138 HydrophobicContact CZ2-CD 4.41Å; W127-L139 HydrophobicContact CH2-CD1 4.37Å; W127-L139 HydrophobicContact CH2-CG 4.1Å; W127-L139 HydrophobicContact CZ3-CD1 3.8Å; W127-L139 HydrophobicContact CZ3-CG 4.04Å
128L93.7Very high91.9Very high0 Ų042.7 Ų42.70%021%0.208CC..Hα-helixtrans-63.1-46.5178.1-72.9-177.5000113.2Y93 I96 F124 L125 L126 G135 A136 L139Y93-L128 HydrophobicContact CD2-CB 3.86Å; Y93-L128 HydrophobicContact CE2-CB 3.69Å; Y93-L128 HydrophobicContact CE2-CD1 4.17Å; I96-L128 HydrophobicContact CG2-CD1 4.3Å; I96-L128 HydrophobicContact CG2-CD2 3.78Å; F124-L128 HydrophobicContact CD1-CD1 4.19Å; F124-L128 HydrophobicContact CD1-CG 4.42Å; F124-L128 HydrophobicContact CE1-CD1 3.66Å; F124-L128 HydrophobicContact CE1-CD2 4.31Å; F124-L128 HydrophobicContact CE1-CG 4.05Å; F124-L128 HydrophobicContact CE2-CD2 4.14Å; F124-L128 HydrophobicContact CE2-CG 4.41Å; F124-L128 HydrophobicContact CZ-CD1 4.03Å; F124-L128 HydrophobicContact CZ-CD2 3.83Å; F124-L128 HydrophobicContact CZ-CG 4.05Å; F124-L128 WeakPolarHBondContact O-CG 3.12Å; F124-L128 PolarHBondContact O-N 3.35Å; L125-L128 HydrophobicContact CD2-CD1 4.21Å; L125-L128 WeakPolarHBondContact O-CB 3.41Å; L125-L128 PolarHBondContact O-N 2.81Å; L126-L128 VanDerWaalsContact C-N 3.25Å; L126-L128 PolarHBondContact O-N 2.97Å; L128-G135 PolarHBondContact O-N 3.27Å; L128-A136 HydrophobicContact CB-CB 4.45Å; L128-A136 HydrophobicContact CD2-CB 4.34Å; L128-A136 WeakPolarHBondContact O-CB 3.41Å; L128-A136 PolarHBondContact O-N 3.32Å; L128-L139 HydrophobicContact CD2-CD1 3.64Å
129Y91.8Very high92.1Very high16 Ų1643.9 Ų43.96%0.06322%0.215CC..Hα-helixtrans-103-14.6-173.167.3-109.8000115I66 Y70 P71 Y93 L125 L126 P131I66-Y129 PolarHBondContact O-OH 2.86Å; Y70-Y129 AromaticContact CD1-CD2 3.65Å; Y70-Y129 HydrophobicContact CD1-CD2 3.65Å; Y70-Y129 AromaticContact CD1-CE2 3.51Å; Y70-Y129 HydrophobicContact CD1-CE2 3.51Å; Y70-Y129 AromaticContact CE1-CD2 3.96Å; Y70-Y129 HydrophobicContact CE1-CD2 3.96Å; Y70-Y129 HydrophobicContact CE1-CE2 4.07Å; Y70-Y129 HydrophobicContact CG-CE2 4.39Å; P71-Y129 HydrophobicContact CG-CD1 3.43Å; P71-Y129 VanDerWaalsContact CG-CD1 3.43Å; P71-Y129 HydrophobicContact CG-CD2 4.35Å; P71-Y129 HydrophobicContact CG-CE1 3.88Å; P71-Y129 HydrophobicContact CG-CG 3.71Å; Y93-Y129 AromaticContact CE2-CD1 3.86Å; Y93-Y129 HydrophobicContact CE2-CD1 3.86Å; Y93-Y129 HydrophobicContact CE2-CG 4.34Å; L125-Y129 WeakPolarHBondContact O-CD1 3.38Å; L125-Y129 WeakPolarHBondContact O-CE1 3.34Å; L125-Y129 PolarHBondContact O-N 3.49Å; L126-Y129 HydrophobicContact CD2-CE2 4.2Å; L126-Y129 WeakPolarHBondContact CD2-OH 3.47Å; L126-Y129 PolarHBondContact O-N 3.31Å; Y129-P131 WeakPolarHBondContact O-CD 3.15Å
130L89.8Confident92.1Very high34 Ų3446.1 Ų46.118%0.17822%0.221CC..  trans-61.8126.9-178.6-85.4176.3000110.6L15 L126 I132 Y133 R134L15-L130 HydrophobicContact CD1-CD1 4.34Å; L15-L130 HydrophobicContact CD1-CD2 3.61Å; L15-L130 HydrophobicContact CD2-CD2 4.36Å; L126-L130 HydrophobicContact CB-CD1 4.14Å; L126-L130 WeakPolarHBondContact O-CB 3.21Å; L126-L130 WeakPolarHBondContact O-CG 3.27Å; L126-L130 PolarHBondContact O-N 3.05Å; L130-I132 PolarHBondContact O-N 3Å; L130-Y133 HydrophobicContact CB-CD2 3.89Å; L130-Y133 HydrophobicContact CD1-CD2 4.03Å; L130-Y133 HydrophobicContact CD1-CE2 4.01Å; L130-Y133 PolarHBondContact O-N 3.07Å; L130-R134 PolarHBondContact O-N 3.39Å
131P83.1Confident92.1Very high66 Ų6649.4 Ų49.443%0.42923%0.229SC..THydrogen-bonded Turntrans-56.8-27.8-174.4-28.234.2000115Y129 R134Y129-P131 WeakPolarHBondContact O-CD 3.15Å; P131-R134 WeakPolarHBondContact O-CG 3.46Å
132I85Confident92Very high60 Ų6052.9 Ų52.931%0.30825%0.253SS..THydrogen-bonded Turntrans-72.7-37.1-179-57.9-179000111.3D11 L15 L130D11-I132 HydrophobicContact CB-CD1 3.62Å; D11-I132 HydrophobicContact CB-CG2 4.07Å; D11-I132 WeakPolarHBondContact O-CD1 3.26Å; L15-I132 HydrophobicContact CD1-CD1 3.91Å; L15-I132 HydrophobicContact CD2-CD1 3.98Å; L15-I132 HydrophobicContact CD2-CG1 4.17Å; L15-I132 HydrophobicContact CG-CD1 3.6Å; L15-I132 HydrophobicContact CG-CG1 4.32Å; L130-I132 PolarHBondContact O-N 3Å
133Y88.3Confident91.9Very high57 Ų5758.4 Ų58.422%0.22428%0.278CS..THydrogen-bonded Turntrans-95.2-33.5-174.2-60.3-60.5000113D11 W127 L130 G135 K138D11-Y133 PolarHBondContact OD2-OH 3.47Å; W127-Y133 AromaticContact CD1-CG 3.69Å; L130-Y133 HydrophobicContact CB-CD2 3.89Å; L130-Y133 HydrophobicContact CD1-CD2 4.03Å; L130-Y133 HydrophobicContact CD1-CE2 4.01Å; L130-Y133 PolarHBondContact O-N 3.07Å; Y133-G135 PolarHBondContact O-N 2.82Å; Y133-K138 WeakPolarHBondContact O-CE 3.38Å; Y133-K138 PolarHBondContact O-NZ 3.46Å
134R89.1Confident91.8Very high101 Ų10154.6 Ų54.638%0.38126%0.26SS..  trans44.245.9-174.4-53-176.373.9-155.6-8.6111.5L130 P131 A136 E137 K138L130-R134 PolarHBondContact O-N 3.39Å; P131-R134 WeakPolarHBondContact O-CG 3.46Å; R134-A136 PolarHBondContact O-N 3.49Å; R134-E137 HydrophobicContact CB-CB 4.22Å; R134-E137 WeakPolarHBondContact CD-OE2 3.49Å; R134-E137 IonicContact CZ-OE1 2.77Å; R134-E137 IonicContact CZ-OE2 3.03Å; R134-E137 IonicContact NE-OE2 3.69Å; R134-E137 PolarHBondContact NE-OE2 3.43Å; R134-E137 IonicContact NH1-OE1 3.01Å; R134-E137 PolarHBondContact NH1-OE1 3.5Å; R134-E137 IonicContact NH1-OE2 2.73Å; R134-E137 PolarHBondContact NH1-OE2 3.05Å; R134-E137 IonicContact NH2-OE1 3.08Å; R134-E137 PolarHBondContact NH2-OE1 3.38Å; R134-E137 IonicContact NH2-OE2 2.62Å; R134-E137 PolarHBondContact NH2-OE2 3.08Å; R134-E137 VanDerWaalsContact NH2-OE2 3.08Å; R134-E137 WeakPolarHBondContact O-CB 3.46Å; R134-E137 PolarHBondContact O-N 3.3Å; R134-K138 PolarHBondContact O-N 3.41Å
135G92.2Very high91.6Very high0 Ų056.1 Ų56.10%027%0.268CS..Hα-helixtrans-59.6-34.5-170.700000113.6W127 L128 Y133 K138 L139W127-G135 VanDerWaalsContact CH2-CA 3.48Å; W127-G135 WeakPolarHBondContact CH2-O 3.45Å; W127-G135 WeakPolarHBondContact O-CA 3.44Å; W127-G135 PolarHBondContact O-N 2.63Å; W127-G135 VanDerWaalsContact O-N 3.11Å; L128-G135 PolarHBondContact O-N 3.27Å; Y133-G135 PolarHBondContact O-N 2.82Å; G135-K138 PolarHBondContact O-N 3.32Å; G135-L139 PolarHBondContact O-N 3.3Å
136A93.7Very high91.4Very high0 Ų059.3 Ų59.30%029%0.289CS..Hα-helixtrans-63.3-42175.200000112.7T92 Y93 I96 L128 R134 L139 Y140T92-A136 HydrophobicContact CG2-CB 4.17Å; T92-A136 WeakPolarHBondContact CG2-O 3.28Å; Y93-A136 HydrophobicContact CD2-CB 4.37Å; I96-A136 HydrophobicContact CB-CB 4.3Å; I96-A136 HydrophobicContact CG1-CB 4.22Å; I96-A136 WeakPolarHBondContact CG1-O 3.19Å; L128-A136 HydrophobicContact CB-CB 4.45Å; L128-A136 HydrophobicContact CD2-CB 4.34Å; L128-A136 WeakPolarHBondContact O-CB 3.41Å; L128-A136 PolarHBondContact O-N 3.32Å; R134-A136 PolarHBondContact O-N 3.49Å; A136-L139 PolarHBondContact O-N 2.91Å; A136-Y140 WeakPolarHBondContact O-CB 3.49Å; A136-Y140 PolarHBondContact O-N 3.03Å
137E93.2Very high91.2Very high52 Ų5261.8 Ų61.824%0.24330%0.297CS..Hα-helixtrans-62.7-46.5177.7-174.3-179-13800110.6R134 L139 Y140 E141R134-E137 HydrophobicContact CB-CB 4.22Å; R134-E137 WeakPolarHBondContact CD-OE2 3.49Å; R134-E137 IonicContact CZ-OE1 2.77Å; R134-E137 IonicContact CZ-OE2 3.03Å; R134-E137 IonicContact NE-OE2 3.69Å; R134-E137 PolarHBondContact NE-OE2 3.43Å; R134-E137 IonicContact NH1-OE1 3.01Å; R134-E137 PolarHBondContact NH1-OE1 3.5Å; R134-E137 IonicContact NH1-OE2 2.73Å; R134-E137 PolarHBondContact NH1-OE2 3.05Å; R134-E137 IonicContact NH2-OE1 3.08Å; R134-E137 PolarHBondContact NH2-OE1 3.38Å; R134-E137 IonicContact NH2-OE2 2.62Å; R134-E137 PolarHBondContact NH2-OE2 3.08Å; R134-E137 VanDerWaalsContact NH2-OE2 3.08Å; R134-E137 WeakPolarHBondContact O-CB 3.46Å; R134-E137 PolarHBondContact O-N 3.3Å; E137-L139 VanDerWaalsContact C-N 3.34Å; E137-L139 PolarHBondContact O-N 3.38Å; E137-Y140 WeakPolarHBondContact O-CB 3.39Å; E137-Y140 PolarHBondContact O-N 3.05Å; E137-Y140 VanDerWaalsContact O-N 3.11Å; E137-E141 WeakPolarHBondContact O-CG 3.47Å; E137-E141 PolarHBondContact O-N 3.07Å
138K93.2Very high91Very high109 Ų10958.5 Ų58.547%0.47429%0.288SS..Hα-helixtrans-57.7-44.5176-71.3174.2175.41570112.7W127 Y133 R134 G135 Y140 S142W127-K138 HydrophobicContact CZ2-CD 4.41Å; Y133-K138 WeakPolarHBondContact O-CE 3.38Å; Y133-K138 PolarHBondContact O-NZ 3.46Å; R134-K138 PolarHBondContact O-N 3.41Å; G135-K138 PolarHBondContact O-N 3.32Å; K138-Y140 VanDerWaalsContact C-N 3.33Å; K138-S142 WeakPolarHBondContact O-CB 3.31Å; K138-S142 PolarHBondContact O-N 3.41Å
139L94.5Very high90.8Very high44 Ų4462 Ų6223%0.2331%0.309CS..Hα-helixtrans-67.2-37.4177.5-76.9177.1000111.9I96 F124 W127 L128 G135 A136 E137 H143I96-L139 HydrophobicContact CD1-CB 3.94Å; I96-L139 HydrophobicContact CG1-CB 4.25Å; I96-L139 HydrophobicContact CG2-CB 4.18Å; I96-L139 HydrophobicContact CG2-CD1 3.68Å; F124-L139 HydrophobicContact CE2-CD1 4.22Å; F124-L139 HydrophobicContact CZ-CD1 4.05Å; W127-L139 HydrophobicContact CH2-CD1 4.37Å; W127-L139 HydrophobicContact CH2-CG 4.1Å; W127-L139 HydrophobicContact CZ3-CD1 3.8Å; W127-L139 HydrophobicContact CZ3-CG 4.04Å; L128-L139 HydrophobicContact CD2-CD1 3.64Å; G135-L139 PolarHBondContact O-N 3.3Å; A136-L139 PolarHBondContact O-N 2.91Å; E137-L139 VanDerWaalsContact C-N 3.34Å; E137-L139 PolarHBondContact O-N 3.38Å; L139-H143 PolarHBondContact O-N 2.88Å
140Y94.1Very high90.6Very high74 Ų7464.8 Ų64.829%0.2934%0.335SS..Iπ-helixtrans-63.4-55.7176.5-173.6-84.6000110.9T92 T95 A136 E137 K138 S142 H143 V144 H145T92-Y140 VanDerWaalsContact CG2-CB 3.5Å; T92-Y140 HydrophobicContact CG2-CD2 4.05Å; T92-Y140 HydrophobicContact CG2-CG 3.88Å; T95-Y140 HydrophobicContact CG2-CE2 4.49Å; A136-Y140 WeakPolarHBondContact O-CB 3.49Å; A136-Y140 PolarHBondContact O-N 3.03Å; E137-Y140 WeakPolarHBondContact O-CB 3.39Å; E137-Y140 PolarHBondContact O-N 3.05Å; E137-Y140 VanDerWaalsContact O-N 3.11Å; K138-Y140 VanDerWaalsContact C-N 3.33Å; Y140-S142 VanDerWaalsContact C-N 3.26Å; Y140-S142 PolarHBondContact O-N 3.13Å; Y140-H143 PolarHBondContact O-N 3.37Å; Y140-V144 HydrophobicContact CD2-CB 3.79Å; Y140-V144 HydrophobicContact CD2-CG1 3.79Å; Y140-V144 HydrophobicContact CD2-CG2 4.35Å; Y140-V144 HydrophobicContact CE2-CB 4.11Å; Y140-V144 HydrophobicContact CE2-CG1 3.62Å; Y140-V144 HydrophobicContact CG-CB 4.17Å; Y140-V144 CarbonylContact O-C 3.48Å; Y140-V144 WeakPolarHBondContact O-CA 3.49Å; Y140-V144 PolarHBondContact O-N 3.31Å; Y140-H145 HydrophobicContact CD1-CB 4.14Å; Y140-H145 HydrophobicContact CE1-CB 4.01Å; Y140-H145 WeakPolarHBondContact O-CB 3.3Å; Y140-H145 PolarHBondContact O-N 3.5Å
141E93.3Very high90.6Very high117 Ų11771.9 Ų71.955%0.54736%0.359SS..Iπ-helixtrans-57.8-38.1179.1-70.8-178.4166.200112.6E137 P146E137-E141 WeakPolarHBondContact O-CG 3.47Å; E137-E141 PolarHBondContact O-N 3.07Å; E141-P146 WeakPolarHBondContact O-CD 3.44Å
142S92.5Very high90.8Very high75 Ų7574.3 Ų74.352%0.52437%0.367SS..Iπ-helixtrans-80.5-36-176179.10000114.3K138 Y140K138-S142 WeakPolarHBondContact O-CB 3.31Å; K138-S142 PolarHBondContact O-N 3.41Å; Y140-S142 VanDerWaalsContact C-N 3.26Å; Y140-S142 PolarHBondContact O-N 3.13Å
143H91.1Very high90.7Very high123 Ų12375.4 Ų75.457%0.56937%0.374SS*.Iπ-helixtrans-121.6-42.6-170.1-61.581.7000113L139 Y140L139-H143 PolarHBondContact O-N 2.88Å; Y140-H143 PolarHBondContact O-N 3.37Å
144V91.5Very high90Very high25 Ų2577.6 Ų77.615%0.15240%0.395CS..Iπ-helixtrans-83.2-43.5-173.8-176.10000111.1I96 L99 Y140 F147 A148I96-V144 HydrophobicContact CD1-CG2 3.56Å; L99-V144 HydrophobicContact CD1-CG2 3.6Å; Y140-V144 HydrophobicContact CD2-CB 3.79Å; Y140-V144 HydrophobicContact CD2-CG1 3.79Å; Y140-V144 HydrophobicContact CD2-CG2 4.35Å; Y140-V144 HydrophobicContact CE2-CB 4.11Å; Y140-V144 HydrophobicContact CE2-CG1 3.62Å; Y140-V144 HydrophobicContact CG-CB 4.17Å; Y140-V144 CarbonylContact O-C 3.48Å; Y140-V144 WeakPolarHBondContact O-CA 3.49Å; Y140-V144 PolarHBondContact O-N 3.31Å; V144-F147 WeakPolarHBondContact O-CB 3.36Å; V144-F147 PolarHBondContact O-N 2.98Å; V144-A148 WeakPolarHBondContact O-CB 3.27Å; V144-A148 PolarHBondContact O-N 3.48Å
145H90.3Very high88.6Confident90 Ų9079.4 Ų79.442%0.41742%0.423SS..Hα-helixtrans-61.1-48.7-179.2177.5-88.8000112.3Y140 F147 A148 V149Y140-H145 HydrophobicContact CD1-CB 4.14Å; Y140-H145 HydrophobicContact CE1-CB 4.01Å; Y140-H145 WeakPolarHBondContact O-CB 3.3Å; Y140-H145 PolarHBondContact O-N 3.5Å; H145-F147 VanDerWaalsContact C-N 3.27Å; H145-F147 PolarHBondContact O-N 3.04Å; H145-A148 PolarHBondContact O-N 2.92Å; H145-A148 VanDerWaalsContact O-N 3.17Å; H145-V149 WeakPolarHBondContact O-CG2 2.92Å; H145-V149 PolarHBondContact O-N 2.94Å
146P90.7Very high87.1Confident68 Ų6883 Ų8344%0.44246%0.46SS..Hα-helixtrans-61.2-36.6175.6-23.135.2000112.5E141 A150E141-P146 WeakPolarHBondContact O-CD 3.44Å; P146-A150 WeakPolarHBondContact O-CB 3.29Å; P146-A150 PolarHBondContact O-N 2.84Å
147F90Very high85.3Confident105 Ų10585.1 Ų85.146%0.46148%0.482SS..Hα-helixtrans-66.9-43.5175.4179.1-90.1000112V144 H145 A150 R151 I152V144-F147 WeakPolarHBondContact O-CB 3.36Å; V144-F147 PolarHBondContact O-N 2.98Å; H145-F147 VanDerWaalsContact C-N 3.27Å; H145-F147 PolarHBondContact O-N 3.04Å; F147-A150 PolarHBondContact O-N 3.49Å; F147-R151 WeakPolarHBondContact O-CB 3.22Å; F147-R151 PolarHBondContact O-N 3.4Å; F147-I152 HydrophobicContact CD1-CD1 4.25Å; F147-I152 HydrophobicContact CE1-CD1 4.11Å; F147-I152 HydrophobicContact CE1-CG1 4.4Å
148A90.1Very high83.4Confident13 Ų1391.7 Ų91.711%0.10751%0.512CS..Hα-helixtrans-65.3-46-179.700000111.7V144 H145 A150 R151 I152 L153V144-A148 WeakPolarHBondContact O-CB 3.27Å; V144-A148 PolarHBondContact O-N 3.48Å; H145-A148 PolarHBondContact O-N 2.92Å; H145-A148 VanDerWaalsContact O-N 3.17Å; A148-A150 VanDerWaalsContact C-N 3.34Å; A148-A150 PolarHBondContact O-N 3.21Å; A148-R151 PolarHBondContact O-N 2.69Å; A148-I152 HydrophobicContact CB-CD1 4.23Å; A148-I152 WeakPolarHBondContact O-CA 3.37Å; A148-I152 WeakPolarHBondContact O-CB 3.39Å; A148-I152 PolarHBondContact O-N 3.43Å; A148-L153 PolarHBondContact O-N 3.48Å
149V88.9Confident81.4Confident74 Ų7490.7 Ų90.745%0.44853%0.525SS..Hα-helixtrans-63.2-41.2175.4175.20000111.2H145 L153H145-V149 WeakPolarHBondContact O-CG2 2.92Å; H145-V149 PolarHBondContact O-N 2.94Å; V149-L153 HydrophobicContact CG2-CD1 4.06Å
150A89.1Confident78.6Confident74 Ų74101 Ų10161%0.61257%0.572SS**Hα-helixtrans-75.1-24.8-177.100000114.5P146 F147 A148P146-A150 WeakPolarHBondContact O-CB 3.29Å; P146-A150 PolarHBondContact O-N 2.84Å; F147-A150 PolarHBondContact O-N 3.49Å; A148-A150 VanDerWaalsContact C-N 3.34Å; A148-A150 PolarHBondContact O-N 3.21Å
151R88.4Confident77.8Confident183 Ų183102.4 Ų102.469%0.69159%0.586SS**Hα-helixtrans-135.3-19.2-168.3-67.6-175.3173.586.90.1116.6F147 A148F147-R151 WeakPolarHBondContact O-CB 3.22Å; F147-R151 PolarHBondContact O-N 3.4Å; A148-R151 PolarHBondContact O-N 2.69Å
152I87Confident77Confident116 Ų116101.6 Ų101.660%0.59559%0.588SS**THydrogen-bonded Turntrans-109.5-45.5-173.8-58.1178.3000110.9F147 A148F147-I152 HydrophobicContact CD1-CD1 4.25Å; F147-I152 HydrophobicContact CE1-CD1 4.11Å; F147-I152 HydrophobicContact CE1-CG1 4.4Å; A148-I152 HydrophobicContact CB-CD1 4.23Å; A148-I152 WeakPolarHBondContact O-CA 3.37Å; A148-I152 WeakPolarHBondContact O-CB 3.39Å; A148-I152 PolarHBondContact O-N 3.43Å
153L84.3Confident76.1Confident84 Ų84103.1 Ų103.144%0.4459%0.591SS.*SBendtrans-73.1132.3-179.5-64.9178.1000110.1A148 V149 S155A148-L153 PolarHBondContact O-N 3.48Å; V149-L153 HydrophobicContact CG2-CD1 4.06Å; L153-S155 PolarHBondContact O-N 3.15Å
154P72.3Confident75.3Confident102 Ų102101.9 Ų101.966%0.66259%0.593SS**  trans-58.2138.6171.723.9-30.5000108.4G156 G157P154-G156 PolarHBondContact O-N 3.2Å; P154-G157 PolarHBondContact O-N 3.32Å
155S60.9Low74.2Confident139 Ų139106.7 Ų106.797%0.97262%0.62SS**THydrogen-bonded Turntrans-64.730.8-167.556.50000116.3L153L153-S155 PolarHBondContact O-N 3.15Å
156G60.6Low73.2Confident76 Ų76107.8 Ų107.878%0.78463%0.634SS**THydrogen-bonded Turntrans-161.818.1-178.300000115.2P154P154-G156 PolarHBondContact O-N 3.2Å
157G55.2Low71.9Confident44 Ų44110.6 Ų110.645%0.45465%0.647SS.*  trans-107.892.1172.900000111.2P154 A159P154-G157 PolarHBondContact O-N 3.32Å; G157-A159 PolarHBondContact O-N 3.11Å
158E52.7Low70.5Confident190 Ų190111.1 Ų111.189%0.88866%0.662SS**  trans-55.4120.2163.7-68.5178.9158.900108.2Q160E158-Q160 PolarHBondContact O-N 3.29Å; E158-Q160 VanDerWaalsContact O-N 3.13Å
159A52.4Low68.9Low89 Ų89119.3 Ų119.374%0.73671%0.708SS**  trans-64.7109.7167.400000107.3G157G157-A159 PolarHBondContact O-N 3.11Å
160Q35.4Very low67.1Low260 Ų260123.4 Ų123.4100%1.21573%0.732SS**  trans-68.30164-72.6-174.9-20.200110.2E158E158-Q160 PolarHBondContact O-N 3.29Å; E158-Q160 VanDerWaalsContact O-N 3.13Å

Retrieved 160 of 160 residues in 81.1 ms (Link to these results)

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