A0A5K4FD93_SCHMA Loading...

Mediator of RNA polymerase II transcription subunit 21

Component of the Mediator complex, a coactivator involved in the regulated transcription of nearly all RNA polymerase II-dependent genes. Mediator functions as a bridge to convey information from gene-specific regulatory proteins to the basal RNA polymerase II transcription machinery. Mediator is recruited to promoters by direct interactions with regulatory proteins and serves as a scaffold for the assembly of a functional preinitiation complex with RNA polymerase II and the general transcription factors.

AlphaFold DB , UniProt , Accession A0A5K4FD93, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 153 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
1M57.5Low84.6Confident170 Ų17086 Ų8684%0.83745%0.45SS*.  0-48.20-90171.9128.400112.4D3 P84M1-D3 PolarHBondContact O-N 2.99Å; M1-P84 HydrophobicContact CE-CG 4.27Å; M1-P84 HydrophobicContact CG-CG 4.42Å
2A67.1Low85.4Confident73 Ų7386.3 Ų86.360%0.60345%0.45SS*.Hα-helixtrans-60.3-44.8-176.400000114.1R4 L5 T6A2-R4 PolarHBondContact O-N 2.98Å; A2-L5 PolarHBondContact O-N 2.85Å; A2-L5 VanDerWaalsContact O-N 3.16Å; A2-T6 PolarHBondContact O-N 2.99Å; A2-T6 PolarHBondContact O-OG1 3.38Å; A2-T6 VanDerWaalsContact O-OG1 3.08Å
3D84.1Confident86.2Confident122 Ų12285.6 Ų85.665%0.65245%0.448SS*.Hα-helixtrans-58.2-47.8-172.5-165.340.5000113.8M1 L5 T6 E7M1-D3 PolarHBondContact O-N 2.99Å; D3-L5 PolarHBondContact O-N 3.34Å; D3-T6 PolarHBondContact O-N 3.45Å; D3-E7 WeakPolarHBondContact O-CB 3.4Å; D3-E7 PolarHBondContact O-N 2.85Å
4R84.8Confident86.7Confident115 Ų11584.6 Ų84.643%0.43444%0.443SS..Hα-helixtrans-69-33.8178.4-65.9-67.2166.8-171.2-0.8113.3A2 E7 L8 L83A2-R4 PolarHBondContact O-N 2.98Å; R4-E7 WeakPolarHBondContact CD-OE2 3.22Å; R4-E7 IonicContact CZ-OE2 3.32Å; R4-E7 IonicContact NE-OE2 3.28Å; R4-E7 IonicContact NH1-OE1 3.58Å; R4-E7 IonicContact NH1-OE2 2.64Å; R4-E7 PolarHBondContact NH1-OE2 3.47Å; R4-L8 VanDerWaalsContact O-CB 3.3Å; R4-L8 WeakPolarHBondContact O-CB 3.32Å; R4-L8 PolarHBondContact O-N 3.23Å; R4-L83 HydrophobicContact CB-CD2 4.48Å
5L85.7Confident87.3Confident106 Ų10680.7 Ų80.756%0.55542%0.421SS*.Hα-helixtrans-69.4-39.6175.7-175.165.3000110.9A2 D3 L8 Q9A2-L5 PolarHBondContact O-N 2.85Å; A2-L5 VanDerWaalsContact O-N 3.16Å; D3-L5 PolarHBondContact O-N 3.34Å; L5-L8 PolarHBondContact O-N 2.84Å; L5-Q9 WeakPolarHBondContact O-CB 3.16Å; L5-Q9 PolarHBondContact O-N 2.86Å
6T89.8Confident87.8Confident67 Ų6778.7 Ų78.741%0.41142%0.42SS..Hα-helixtrans-63.7-46.6173.3-60.40000110.9A2 D3 L8 Q9 D10A2-T6 PolarHBondContact O-N 2.99Å; A2-T6 PolarHBondContact O-OG1 3.38Å; A2-T6 VanDerWaalsContact O-OG1 3.08Å; D3-T6 PolarHBondContact O-N 3.45Å; T6-L8 VanDerWaalsContact C-N 3.31Å; T6-L8 PolarHBondContact O-N 3.35Å; T6-Q9 WeakPolarHBondContact O-CB 3.45Å; T6-Q9 PolarHBondContact O-N 3.29Å; T6-Q9 VanDerWaalsContact O-N 3.1Å; T6-D10 PolarHBondContact O-N 3.01Å
7E90.4Very high88.2Confident61 Ų6180.7 Ų80.729%0.28543%0.426SS..Hα-helixtrans-61.5-39.4176.8-169.7-176.7-175.700112.2D3 R4 D10 A11 L79D3-E7 WeakPolarHBondContact O-CB 3.4Å; D3-E7 PolarHBondContact O-N 2.85Å; R4-E7 WeakPolarHBondContact CD-OE2 3.22Å; R4-E7 IonicContact CZ-OE2 3.32Å; R4-E7 IonicContact NE-OE2 3.28Å; R4-E7 IonicContact NH1-OE1 3.58Å; R4-E7 IonicContact NH1-OE2 2.64Å; R4-E7 PolarHBondContact NH1-OE2 3.47Å; E7-D10 PolarHBondContact O-N 3.11Å; E7-A11 WeakPolarHBondContact O-CB 3.32Å; E7-A11 PolarHBondContact O-N 3.49Å; E7-L79 HydrophobicContact CB-CD2 4.41Å; E7-L79 HydrophobicContact CG-CD1 3.97Å; E7-L79 HydrophobicContact CG-CD2 3.9Å; E7-L79 VanDerWaalsContact OE2-CD2 3.29Å; E7-L79 WeakPolarHBondContact OE2-CD2 3.31Å
8L92Very high88.5Confident22 Ų2277.7 Ų77.712%0.11541%0.41CS..Hα-helixtrans-62.7-43.7173.6-177.767.6000111.1R4 L5 T6 D10 A11 I12 L76 L79 I80 L83R4-L8 VanDerWaalsContact O-CB 3.3Å; R4-L8 WeakPolarHBondContact O-CB 3.32Å; R4-L8 PolarHBondContact O-N 3.23Å; L5-L8 PolarHBondContact O-N 2.84Å; T6-L8 VanDerWaalsContact C-N 3.31Å; T6-L8 PolarHBondContact O-N 3.35Å; L8-D10 VanDerWaalsContact C-N 3.34Å; L8-D10 PolarHBondContact O-N 3.44Å; L8-A11 PolarHBondContact O-N 3.2Å; L8-I12 HydrophobicContact CG-CD1 4.1Å; L8-I12 VanDerWaalsContact O-CG1 3.25Å; L8-I12 WeakPolarHBondContact O-CG1 3.42Å; L8-I12 PolarHBondContact O-N 2.92Å; L8-L76 HydrophobicContact CD1-CD2 3.7Å; L8-L79 HydrophobicContact CD1-CB 3.91Å; L8-L79 HydrophobicContact CD1-CD1 4.45Å; L8-I80 HydrophobicContact CD1-CG1 3.98Å; L8-L83 HydrophobicContact CD2-CD1 4.33Å
9Q92.3Very high88.8Confident113 Ų11377.6 Ų77.653%0.52841%0.41SS..Hα-helixtrans-61.9-42.5176.5-174.3179.24.500111.7L5 T6 I12 N13L5-Q9 WeakPolarHBondContact O-CB 3.16Å; L5-Q9 PolarHBondContact O-N 2.86Å; T6-Q9 WeakPolarHBondContact O-CB 3.45Å; T6-Q9 PolarHBondContact O-N 3.29Å; T6-Q9 VanDerWaalsContact O-N 3.1Å; Q9-I12 PolarHBondContact O-N 3.42Å; Q9-N13 VanDerWaalsContact O-CG 3.3Å; Q9-N13 PolarHBondContact O-N 3.46Å; Q9-N13 PolarHBondContact O-ND2 2.95Å
10D93.9Very high89Confident94 Ų9478.1 Ų78.150%0.50342%0.419SS..Hα-helixtrans-64.4-42.1177.6-68.3-23.1000111.5T6 E7 L8 I12 N13 L14T6-D10 PolarHBondContact O-N 3.01Å; E7-D10 PolarHBondContact O-N 3.11Å; L8-D10 VanDerWaalsContact C-N 3.34Å; L8-D10 PolarHBondContact O-N 3.44Å; D10-I12 VanDerWaalsContact C-N 3.35Å; D10-I12 PolarHBondContact O-N 2.92Å; D10-N13 PolarHBondContact O-N 3.02Å; D10-L14 WeakPolarHBondContact O-CB 3.41Å; D10-L14 PolarHBondContact O-N 2.86Å
11A92.9Very high89.2Confident3 Ų378.4 Ų78.43%0.02542%0.421CS..Hα-helixtrans-65-36.4175.300000112.4E7 L8 Q15 L76 L79E7-A11 WeakPolarHBondContact O-CB 3.32Å; E7-A11 PolarHBondContact O-N 3.49Å; L8-A11 PolarHBondContact O-N 3.2Å; A11-Q15 WeakPolarHBondContact O-CB 3.44Å; A11-Q15 PolarHBondContact O-N 2.9Å; A11-L76 HydrophobicContact CB-CD2 3.47Å; A11-L76 VanDerWaalsContact CB-CD2 3.47Å; A11-L76 HydrophobicContact CB-CG 4.22Å; A11-L79 HydrophobicContact CB-CD1 3.95Å
12I94.8Very high90.8Very high89 Ų8970.7 Ų70.746%0.45638%0.383SS..Hα-helixtrans-66-44174.7-71168.2000110.5L8 Q9 D10 Q15 A16 L76L8-I12 HydrophobicContact CG-CD1 4.1Å; L8-I12 VanDerWaalsContact O-CG1 3.25Å; L8-I12 WeakPolarHBondContact O-CG1 3.42Å; L8-I12 PolarHBondContact O-N 2.92Å; Q9-I12 PolarHBondContact O-N 3.42Å; D10-I12 VanDerWaalsContact C-N 3.35Å; D10-I12 PolarHBondContact O-N 2.92Å; I12-Q15 WeakPolarHBondContact O-CB 3.49Å; I12-Q15 PolarHBondContact O-N 3.44Å; I12-A16 PolarHBondContact O-N 3.25Å; I12-L76 HydrophobicContact CG1-CD2 3.62Å
13N95Very high92Very high78 Ų7871.7 Ų71.742%0.41738%0.378SS..Hα-helixtrans-61.8-46.6176.9-70.7-26.2000110.9Q9 D10 Q15 A16 E17Q9-N13 VanDerWaalsContact O-CG 3.3Å; Q9-N13 PolarHBondContact O-N 3.46Å; Q9-N13 PolarHBondContact O-ND2 2.95Å; D10-N13 PolarHBondContact O-N 3.02Å; N13-Q15 VanDerWaalsContact C-N 3.3Å; N13-Q15 PolarHBondContact O-N 3.18Å; N13-A16 WeakPolarHBondContact O-CB 3.34Å; N13-A16 PolarHBondContact O-N 3.48Å; N13-A16 VanDerWaalsContact O-N 3.12Å; N13-E17 WeakPolarHBondContact O-CG 3.3Å; N13-E17 PolarHBondContact O-N 2.71Å
14L94.1Very high92.3Very high72 Ų7267.1 Ų67.138%0.37736%0.359SS..Hα-helixtrans-60.5-39.6176.2-178.363.3000112.1D10 A16 E17 N18 T72D10-L14 WeakPolarHBondContact O-CB 3.41Å; D10-L14 PolarHBondContact O-N 2.86Å; L14-A16 VanDerWaalsContact C-N 3.34Å; L14-A16 PolarHBondContact O-N 2.75Å; L14-E17 PolarHBondContact O-N 2.75Å; L14-N18 WeakPolarHBondContact O-CB 3.41Å; L14-N18 VanDerWaalsContact O-CG 3.29Å; L14-N18 PolarHBondContact O-N 3.42Å; L14-N18 PolarHBondContact O-ND2 3.46Å; L14-T72 HydrophobicContact CD2-CG2 3.75Å; L14-T72 HydrophobicContact CG-CG2 4.04Å
15Q95.4Very high92.5Very high25 Ų2563.8 Ų63.812%0.11735%0.352CS..Hα-helixtrans-61.5-42.8174.7-17869.249.400111.5A11 I12 N13 N18 L19 I69 T72 L76A11-Q15 WeakPolarHBondContact O-CB 3.44Å; A11-Q15 PolarHBondContact O-N 2.9Å; I12-Q15 WeakPolarHBondContact O-CB 3.49Å; I12-Q15 PolarHBondContact O-N 3.44Å; N13-Q15 VanDerWaalsContact C-N 3.3Å; N13-Q15 PolarHBondContact O-N 3.18Å; Q15-N18 PolarHBondContact O-N 2.91Å; Q15-L19 HydrophobicContact CG-CD1 4.34Å; Q15-L19 WeakPolarHBondContact O-CG 3.44Å; Q15-L19 PolarHBondContact O-N 3Å; Q15-I69 VanDerWaalsContact NE2-CG2 3.32Å; Q15-I69 PolarHBondContact OE1-O 3.38Å; Q15-T72 PolarHBondContact OE1-OG1 2.97Å; Q15-L76 HydrophobicContact CB-CD1 4.2Å; Q15-L76 HydrophobicContact CG-CD1 4.21Å
16A95.7Very high92.5Very high49 Ų4962.2 Ų62.241%0.40534%0.343SS..Hα-helixtrans-64.9-43.317700000111.6I12 N13 L14 L19 C20I12-A16 PolarHBondContact O-N 3.25Å; N13-A16 WeakPolarHBondContact O-CB 3.34Å; N13-A16 PolarHBondContact O-N 3.48Å; N13-A16 VanDerWaalsContact O-N 3.12Å; L14-A16 VanDerWaalsContact C-N 3.34Å; L14-A16 PolarHBondContact O-N 2.75Å; A16-L19 PolarHBondContact O-N 2.9Å; A16-C20 WeakPolarHBondContact O-CB 3.48Å; A16-C20 PolarHBondContact O-N 3.43Å; A16-C20 PolarHBondContact O-SG 2.95Å; A16-C20 VanDerWaalsContact O-SG 3.37Å
17E94.7Very high92.4Very high113 Ų11365.9 Ų65.953%0.52836%0.356SS..Hα-helixtrans-60.1-46.6174.3-72.2179-168.600111.8N13 L14 L19 C20 N21N13-E17 WeakPolarHBondContact O-CG 3.3Å; N13-E17 PolarHBondContact O-N 2.71Å; L14-E17 PolarHBondContact O-N 2.75Å; E17-L19 VanDerWaalsContact C-N 3.3Å; E17-L19 PolarHBondContact O-N 3.47Å; E17-C20 PolarHBondContact O-N 3.33Å; E17-N21 VanDerWaalsContact O-CB 3.23Å; E17-N21 WeakPolarHBondContact O-CB 3.5Å; E17-N21 PolarHBondContact O-N 2.94Å; E17-N21 PolarHBondContact O-ND2 3.41Å
18N92.3Very high92.1Very high26 Ų2670.8 Ų70.814%0.13938%0.379CS..Hα-helixtrans-58.3-42.3177.1-77-22.2000112L14 Q15 A22 I69 T72L14-N18 WeakPolarHBondContact O-CB 3.41Å; L14-N18 VanDerWaalsContact O-CG 3.29Å; L14-N18 PolarHBondContact O-N 3.42Å; L14-N18 PolarHBondContact O-ND2 3.46Å; Q15-N18 PolarHBondContact O-N 2.91Å; N18-A22 WeakPolarHBondContact O-CB 3.17Å; N18-A22 PolarHBondContact O-N 3.47Å; N18-I69 HydrophobicContact CB-CG1 4.03Å; N18-T72 WeakPolarHBondContact ND2-CG2 3.43Å
19L94.1Very high91.6Very high77 Ų7772 Ų7240%0.40339%0.387SS..Hα-helixtrans-67.3-46.8177.5-73168.2000112Q15 A16 E17 A22 I23 I69Q15-L19 HydrophobicContact CG-CD1 4.34Å; Q15-L19 WeakPolarHBondContact O-CG 3.44Å; Q15-L19 PolarHBondContact O-N 3Å; A16-L19 PolarHBondContact O-N 2.9Å; E17-L19 VanDerWaalsContact C-N 3.3Å; E17-L19 PolarHBondContact O-N 3.47Å; L19-A22 PolarHBondContact O-N 3.27Å; L19-I23 WeakPolarHBondContact O-CD1 3.35Å; L19-I23 VanDerWaalsContact O-CG1 3.31Å; L19-I23 WeakPolarHBondContact O-CG1 3.47Å; L19-I23 PolarHBondContact O-N 3.44Å; L19-I69 HydrophobicContact CD2-CD1 3.76Å; L19-I69 HydrophobicContact CD2-CG1 4.27Å; L19-I69 HydrophobicContact CD2-CG2 4.35Å; L19-I69 HydrophobicContact CG-CD1 4.5Å
20C94.3Very high90.8Very high86 Ų8669.5 Ų69.558%0.58139%0.386SS*.Hα-helixtrans-62.8-44.2178.4-73.70000111.9A16 E17 I23 G24A16-C20 WeakPolarHBondContact O-CB 3.48Å; A16-C20 PolarHBondContact O-N 3.43Å; A16-C20 PolarHBondContact O-SG 2.95Å; A16-C20 VanDerWaalsContact O-SG 3.37Å; E17-C20 PolarHBondContact O-N 3.33Å; C20-I23 PolarHBondContact O-N 2.88Å; C20-G24 PolarHBondContact O-N 3.27Å
21N92.5Very high89.6Confident86 Ų8668.9 Ų68.946%0.4638%0.38SS..Hα-helixtrans-65-43.7176.9-70.2-25.3000111.2E17 G24 V25 F65E17-N21 VanDerWaalsContact O-CB 3.23Å; E17-N21 WeakPolarHBondContact O-CB 3.5Å; E17-N21 PolarHBondContact O-N 2.94Å; E17-N21 PolarHBondContact O-ND2 3.41Å; N21-G24 PolarHBondContact O-N 2.94Å; N21-V25 WeakPolarHBondContact O-CB 3.32Å; N21-V25 VanDerWaalsContact O-CG2 3.31Å; N21-V25 WeakPolarHBondContact O-CG2 3.36Å; N21-V25 PolarHBondContact O-N 2.92Å; N21-F65 HydrophobicContact CB-CE1 3.95Å; N21-F65 HydrophobicContact CB-CZ 4.35Å
22A91.6Very high88.5Confident7 Ų772.1 Ų72.16%0.05840%0.401CS..Hα-helixtrans-58.7-49.7175.900000111.2N18 L19 G24 I26 F65 I69N18-A22 WeakPolarHBondContact O-CB 3.17Å; N18-A22 PolarHBondContact O-N 3.47Å; L19-A22 PolarHBondContact O-N 3.27Å; A22-G24 PolarHBondContact O-N 2.94Å; A22-I26 HydrophobicContact CB-CD1 4.42Å; A22-I26 WeakPolarHBondContact O-CB 3.38Å; A22-I26 WeakPolarHBondContact O-CD1 3.42Å; A22-I26 WeakPolarHBondContact O-CG1 3.47Å; A22-I26 PolarHBondContact O-N 3.25Å; A22-F65 HydrophobicContact CB-CB 3.7Å; A22-F65 HydrophobicContact CB-CD1 3.68Å; A22-F65 HydrophobicContact CB-CD2 4.03Å; A22-F65 HydrophobicContact CB-CE1 4.29Å; A22-F65 HydrophobicContact CB-CG 3.54Å; A22-I69 HydrophobicContact CB-CD1 4.2Å
23I91.4Very high87.1Confident94 Ų9473.1 Ų73.148%0.48242%0.415SS..Hα-helixtrans-59.8-49.7178.2-70.3161.4000110.6L19 C20 V25 I26 Q27L19-I23 WeakPolarHBondContact O-CD1 3.35Å; L19-I23 VanDerWaalsContact O-CG1 3.31Å; L19-I23 WeakPolarHBondContact O-CG1 3.47Å; L19-I23 PolarHBondContact O-N 3.44Å; C20-I23 PolarHBondContact O-N 2.88Å; I23-V25 PolarHBondContact O-N 3.34Å; I23-I26 PolarHBondContact O-N 3.34Å; I23-Q27 HydrophobicContact CG2-CG 4.35Å; I23-Q27 WeakPolarHBondContact O-CB 3.3Å; I23-Q27 VanDerWaalsContact O-CG 3.25Å; I23-Q27 WeakPolarHBondContact O-CG 3.33Å; I23-Q27 PolarHBondContact O-N 2.95Å
24G90.5Very high85.5Confident26 Ų2673.4 Ų73.427%0.26841%0.413SS..Hα-helixtrans-60.5-47-177.900000112.6C20 N21 A22 Q28C20-G24 PolarHBondContact O-N 3.27Å; N21-G24 PolarHBondContact O-N 2.94Å; A22-G24 PolarHBondContact O-N 2.94Å; G24-Q28 VanDerWaalsContact O-CG 3.29Å; G24-Q28 WeakPolarHBondContact O-CG 3.38Å; G24-Q28 PolarHBondContact O-N 3.34Å; G24-Q28 VanDerWaalsContact O-N 3.16Å
25V88.9Confident84.1Confident46 Ų4677.6 Ų77.628%0.27943%0.428SS..Hα-helixtrans-69.1-46.3179.4176.30000110.9N21 I23 Q27 Q28 V29 I61 F65N21-V25 WeakPolarHBondContact O-CB 3.32Å; N21-V25 VanDerWaalsContact O-CG2 3.31Å; N21-V25 WeakPolarHBondContact O-CG2 3.36Å; N21-V25 PolarHBondContact O-N 2.92Å; I23-V25 PolarHBondContact O-N 3.34Å; V25-Q27 VanDerWaalsContact C-N 3.28Å; V25-Q27 PolarHBondContact O-N 2.96Å; V25-Q28 PolarHBondContact O-N 3.31Å; V25-Q28 VanDerWaalsContact O-N 3.09Å; V25-V29 HydrophobicContact CG1-CG1 4.41Å; V25-V29 WeakPolarHBondContact O-CG2 3.45Å; V25-V29 PolarHBondContact O-N 3.46Å; V25-I61 HydrophobicContact CG1-CG2 3.63Å; V25-F65 HydrophobicContact CB-CE2 3.83Å; V25-F65 HydrophobicContact CB-CZ 4.15Å; V25-F65 HydrophobicContact CG1-CE2 4.02Å; V25-F65 HydrophobicContact CG2-CE2 4.16Å; V25-F65 HydrophobicContact CG2-CZ 3.98Å
26I85.9Confident82.4Confident73 Ų7381.9 Ų81.937%0.37446%0.461SS..Hα-helixtrans-59.2-41.5179.6-70.2167.1000110.4A22 I23 Q28 V29 A30A22-I26 HydrophobicContact CB-CD1 4.42Å; A22-I26 WeakPolarHBondContact O-CB 3.38Å; A22-I26 WeakPolarHBondContact O-CD1 3.42Å; A22-I26 WeakPolarHBondContact O-CG1 3.47Å; A22-I26 PolarHBondContact O-N 3.25Å; I23-I26 PolarHBondContact O-N 3.34Å; I26-Q28 PolarHBondContact O-N 2.97Å; I26-V29 PolarHBondContact O-N 3.39Å; I26-A30 WeakPolarHBondContact O-CA 3.48Å; I26-A30 WeakPolarHBondContact O-CB 3.37Å; I26-A30 PolarHBondContact O-N 2.98Å
27Q86.9Confident80.8Confident143 Ų14386.5 Ų86.567%0.66848%0.479SS*.Hα-helixtrans-65.1-36.4176.2-75177.2-9.100113.1I23 V25I23-Q27 HydrophobicContact CG2-CG 4.35Å; I23-Q27 WeakPolarHBondContact O-CB 3.3Å; I23-Q27 VanDerWaalsContact O-CG 3.25Å; I23-Q27 WeakPolarHBondContact O-CG 3.33Å; I23-Q27 PolarHBondContact O-N 2.95Å; V25-Q27 VanDerWaalsContact C-N 3.28Å; V25-Q27 PolarHBondContact O-N 2.96Å
28Q85Confident79Confident164 Ų16487.5 Ų87.577%0.76648%0.482SS*.Hα-helixtrans-70.2-36.4177.9-74.41747.700112.8G24 V25 I26G24-Q28 VanDerWaalsContact O-CG 3.29Å; G24-Q28 WeakPolarHBondContact O-CG 3.38Å; G24-Q28 PolarHBondContact O-N 3.34Å; G24-Q28 VanDerWaalsContact O-N 3.16Å; V25-Q28 PolarHBondContact O-N 3.31Å; V25-Q28 VanDerWaalsContact O-N 3.09Å; I26-Q28 PolarHBondContact O-N 2.97Å
29V81.7Confident77.4Confident49 Ų4992 Ų9230%0.29751%0.506SS..Hα-helixtrans-94.1-8.6-179.3-540000113.3V25 I26 Q31 T58 I61V25-V29 HydrophobicContact CG1-CG1 4.41Å; V25-V29 WeakPolarHBondContact O-CG2 3.45Å; V25-V29 PolarHBondContact O-N 3.46Å; I26-V29 PolarHBondContact O-N 3.39Å; V29-Q31 PolarHBondContact O-N 3.1Å; V29-T58 HydrophobicContact CB-CG2 4.24Å; V29-T58 HydrophobicContact CG2-CG2 3.96Å; V29-I61 HydrophobicContact CG1-CD1 4.28Å
30A74.9Confident75.7Confident60 Ų6093.4 Ų93.450%0.49651%0.506SS..  trans-60113.6-179.800000110I26I26-A30 WeakPolarHBondContact O-CA 3.48Å; I26-A30 WeakPolarHBondContact O-CB 3.37Å; I26-A30 PolarHBondContact O-N 2.98Å
31Q69.7Low74Confident80 Ų8093 Ų9337%0.37451%0.508SS..PPolyproline II helixtrans-69.9139.3168.7-64.9-175.55.100108.7V29 S33 F52V29-Q31 PolarHBondContact O-N 3.1Å; Q31-S33 PolarHBondContact O-N 3.04Å; Q31-S33 VanDerWaalsContact O-N 3.16Å; Q31-F52 PolarHBondContact NE2-O 3.06Å
32P69.8Low72.5Confident72 Ų7292.8 Ų92.847%0.46851%0.514SS..PPolyproline II helixtrans-53.5125.8172.8-2230.9000109.7F34P32-F34 HydrophobicContact CB-CE1 4.29Å; P32-F34 HydrophobicContact CB-CE2 3.99Å; P32-F34 HydrophobicContact CB-CZ 3.77Å; P32-F34 HydrophobicContact CG-CZ 4.27Å; P32-F34 WeakPolarHBondContact O-CD2 3.4Å; P32-F34 WeakPolarHBondContact O-CE2 3.4Å; P32-F34 PolarHBondContact O-N 3.36Å
33S65.7Low70.9Confident109 Ų10997.2 Ų97.276%0.76253%0.529SS*.PPolyproline II helixtrans-74.3123.3173.1-650000108.8Q31Q31-S33 PolarHBondContact O-N 3.04Å; Q31-S33 VanDerWaalsContact O-N 3.16Å
34F59.6Low69.3Low84 Ų8494.2 Ų94.237%0.36852%0.517SS..PPolyproline II helixtrans-101.7117.4177.6-58.8-83.6000109P32 W40 Y49P32-F34 HydrophobicContact CB-CE1 4.29Å; P32-F34 HydrophobicContact CB-CE2 3.99Å; P32-F34 HydrophobicContact CB-CZ 3.77Å; P32-F34 HydrophobicContact CG-CZ 4.27Å; P32-F34 WeakPolarHBondContact O-CD2 3.4Å; P32-F34 WeakPolarHBondContact O-CE2 3.4Å; P32-F34 PolarHBondContact O-N 3.36Å; F34-W40 HydrophobicContact CB-CE3 4Å; F34-W40 HydrophobicContact CB-CZ3 4.01Å; F34-W40 HydrophobicContact CD1-CE3 4.11Å; F34-W40 AromaticContact CD1-CZ3 3.86Å; F34-W40 HydrophobicContact CD1-CZ3 3.86Å; F34-W40 HydrophobicContact CD2-CE3 4.04Å; F34-W40 AromaticContact CD2-CH2 3.81Å; F34-W40 HydrophobicContact CD2-CH2 3.81Å; F34-W40 AromaticContact CD2-CZ3 3.19Å; F34-W40 HydrophobicContact CD2-CZ3 3.19Å; F34-W40 HydrophobicContact CE1-CZ3 4.09Å; F34-W40 AromaticContact CE2-CH2 3.97Å; F34-W40 HydrophobicContact CE2-CH2 3.97Å; F34-W40 AromaticContact CE2-CZ3 3.46Å; F34-W40 HydrophobicContact CE2-CZ3 3.46Å; F34-W40 VanDerWaalsContact CE2-CZ3 3.46Å; F34-W40 AromaticContact CG-CE3 3.78Å; F34-W40 HydrophobicContact CG-CE3 3.78Å; F34-W40 HydrophobicContact CG-CH2 4.4Å; F34-W40 AromaticContact CG-CZ3 3.4Å; F34-W40 HydrophobicContact CG-CZ3 3.4Å; F34-W40 VanDerWaalsContact CG-CZ3 3.4Å; F34-W40 AromaticContact CZ-CZ3 3.9Å; F34-W40 HydrophobicContact CZ-CZ3 3.9Å; F34-Y49 HydrophobicContact CZ-CD1 4.23Å; F34-Y49 HydrophobicContact CZ-CE1 4.48Å
35F65.7Low67.8Low160 Ų16096.3 Ų96.370%0.70253%0.531SS*.PPolyproline II helixtrans-68.7137.8168-64.2-81.2000109D37 F38F35-D37 PolarHBondContact O-N 3.21Å; F35-F38 PolarHBondContact O-N 3.49Å; F35-F38 VanDerWaalsContact O-N 3.13Å
36S60.2Low66.6Low116 Ų11699 Ų9981%0.81154%0.539SS*.THydrogen-bonded Turntrans-55.1-20.8-17945.30000114F38S36-F38 PolarHBondContact O-N 2.94Å
37D60.6Low65.4Low145 Ų145100.4 Ų100.478%0.77555%0.553SS**THydrogen-bonded Turntrans-76.6-9-177.1-55.9-29.9000113.6F35F35-D37 PolarHBondContact O-N 3.21Å
38F58.7Low64.3Low135 Ų13598.3 Ų98.359%0.59254%0.543SS*.SBendtrans-104101.9-179-109.5-84.1000111.5F35 S36 W40 R43F35-F38 PolarHBondContact O-N 3.49Å; F35-F38 VanDerWaalsContact O-N 3.13Å; S36-F38 PolarHBondContact O-N 2.94Å; F38-W40 VanDerWaalsContact C-N 3.35Å; F38-W40 WeakPolarHBondContact O-CA 3.46Å; F38-W40 PolarHBondContact O-N 3.47Å; F38-R43 VanDerWaalsContact CE1-NH2 3.34Å
39N57.2Low63.1Low120 Ų12093.4 Ų93.464%0.64252%0.518SS*.  trans-17.278.5173.9-161.1-7.8000115.7
40W59.4Low61.9Low107 Ų10796.4 Ų96.441%0.40553%0.529SS..  trans-79.3-37.9-165.9167.3-102.5000113.1F34 F38 S42 R43 S44 I53F34-W40 HydrophobicContact CB-CE3 4Å; F34-W40 HydrophobicContact CB-CZ3 4.01Å; F34-W40 HydrophobicContact CD1-CE3 4.11Å; F34-W40 AromaticContact CD1-CZ3 3.86Å; F34-W40 HydrophobicContact CD1-CZ3 3.86Å; F34-W40 HydrophobicContact CD2-CE3 4.04Å; F34-W40 AromaticContact CD2-CH2 3.81Å; F34-W40 HydrophobicContact CD2-CH2 3.81Å; F34-W40 AromaticContact CD2-CZ3 3.19Å; F34-W40 HydrophobicContact CD2-CZ3 3.19Å; F34-W40 HydrophobicContact CE1-CZ3 4.09Å; F34-W40 AromaticContact CE2-CH2 3.97Å; F34-W40 HydrophobicContact CE2-CH2 3.97Å; F34-W40 AromaticContact CE2-CZ3 3.46Å; F34-W40 HydrophobicContact CE2-CZ3 3.46Å; F34-W40 VanDerWaalsContact CE2-CZ3 3.46Å; F34-W40 AromaticContact CG-CE3 3.78Å; F34-W40 HydrophobicContact CG-CE3 3.78Å; F34-W40 HydrophobicContact CG-CH2 4.4Å; F34-W40 AromaticContact CG-CZ3 3.4Å; F34-W40 HydrophobicContact CG-CZ3 3.4Å; F34-W40 VanDerWaalsContact CG-CZ3 3.4Å; F34-W40 AromaticContact CZ-CZ3 3.9Å; F34-W40 HydrophobicContact CZ-CZ3 3.9Å; F38-W40 VanDerWaalsContact C-N 3.35Å; F38-W40 WeakPolarHBondContact O-CA 3.46Å; F38-W40 PolarHBondContact O-N 3.47Å; W40-S42 PolarHBondContact O-N 3.18Å; W40-R43 PolarHBondContact O-N 3.07Å; W40-S44 PolarHBondContact O-N 3.41Å; W40-S44 PolarHBondContact O-OG 3.33Å; W40-I53 HydrophobicContact CH2-CD1 4.15Å; W40-I53 HydrophobicContact CZ2-CD1 4.26Å
41A59.1Low61.2Low76 Ų7696.8 Ų96.863%0.62853%0.532SS*.THydrogen-bonded Turntrans-57.3-29.3-175.900000113.2S44A41-S44 PolarHBondContact O-OG 3Å
42S60.3Low60.5Low83 Ų8399.2 Ų99.258%0.5854%0.541SS*.THydrogen-bonded Turntrans-85.5-21.5178.4-62.40000114.4W40W40-S42 PolarHBondContact O-N 3.18Å
43R57.7Low59.8Low99 Ų9999.8 Ų99.837%0.37454%0.54SS..THydrogen-bonded Turntrans-95.7-32.9178.9-65.4-162.2-147.3-179.47.5112.8F38 W40 A45 K46 Y49F38-R43 VanDerWaalsContact CE1-NH2 3.34Å; W40-R43 PolarHBondContact O-N 3.07Å; R43-A45 PolarHBondContact O-N 2.87Å; R43-A45 VanDerWaalsContact O-N 3.13Å; R43-K46 PolarHBondContact O-N 3.31Å; R43-K46 VanDerWaalsContact O-N 3.08Å; R43-Y49 HydrophobicContact CB-CD2 4.29Å; R43-Y49 HydrophobicContact CB-CE2 4.22Å; R43-Y49 WeakPolarHBondContact O-CD2 3.38Å
44S57.2Low59.2Low31 Ų31102.7 Ų102.722%0.21754%0.541CS..THydrogen-bonded Turntrans-62.8-18176.462.80000113.5W40 A41W40-S44 PolarHBondContact O-N 3.41Å; W40-S44 PolarHBondContact O-OG 3.33Å; A41-S44 PolarHBondContact O-OG 3Å
45A59.5Low59Low70 Ų70101.4 Ų101.458%0.57955%0.546SS*.THydrogen-bonded Turntrans-83-11.8176.900000114R43R43-A45 PolarHBondContact O-N 2.87Å; R43-A45 VanDerWaalsContact O-N 3.13Å
46K64.1Low58.6Low103 Ų103100.6 Ų100.645%0.44855%0.545SS..SBendtrans-81.3132.6175.1-61.5-174.2175.51780109.8R43 E48 Y49 Q50R43-K46 PolarHBondContact O-N 3.31Å; R43-K46 VanDerWaalsContact O-N 3.08Å; K46-E48 HydrophobicContact CB-CG 3.77Å; K46-E48 HydrophobicContact CD-CG 4.18Å; K46-E48 WeakPolarHBondContact CD-OE1 3.49Å; K46-E48 IonicContact NZ-OE1 2.93Å; K46-E48 PolarHBondContact NZ-OE1 2.9Å; K46-E48 PolarHBondContact O-N 3.49Å; K46-Y49 HydrophobicContact CB-CD2 4.05Å; K46-Y49 HydrophobicContact CD-CD2 4.49Å; K46-Y49 HydrophobicContact CD-CE2 4.2Å; K46-Y49 PolarHBondContact O-N 3.35Å; K46-Q50 PolarHBondContact O-N 3.07Å
47P61.7Low58.7Low102 Ų10298.8 Ų98.866%0.66253%0.53SS*.Hα-helixtrans-59.8-25.4-177.121.9-31.6000112.7Y49 Q50 A51P47-Y49 VanDerWaalsContact C-N 3.33Å; P47-Y49 PolarHBondContact O-N 2.94Å; P47-Q50 PolarHBondContact O-N 2.89Å; P47-A51 PolarHBondContact O-N 3.27Å
48E63Low59Low99 Ų9994.3 Ų94.346%0.46351%0.508SS..Hα-helixtrans-58.4-39.2173.962.8-167.6-176.800112.9K46 F52K46-E48 HydrophobicContact CB-CG 3.77Å; K46-E48 HydrophobicContact CD-CG 4.18Å; K46-E48 WeakPolarHBondContact CD-OE1 3.49Å; K46-E48 IonicContact NZ-OE1 2.93Å; K46-E48 PolarHBondContact NZ-OE1 2.9Å; K46-E48 PolarHBondContact O-N 3.49Å; E48-F52 WeakPolarHBondContact O-CD2 3.48Å; E48-F52 WeakPolarHBondContact O-CE2 3.41Å
49Y59.8Low59.6Low62 Ų6292.6 Ų92.624%0.24351%0.505CS..Hα-helixtrans-84.8-27.5178.8-64.7-73.4000112.9F34 R43 K46 P47 F52 I53F34-Y49 HydrophobicContact CZ-CD1 4.23Å; F34-Y49 HydrophobicContact CZ-CE1 4.48Å; R43-Y49 HydrophobicContact CB-CD2 4.29Å; R43-Y49 HydrophobicContact CB-CE2 4.22Å; R43-Y49 WeakPolarHBondContact O-CD2 3.38Å; K46-Y49 HydrophobicContact CB-CD2 4.05Å; K46-Y49 HydrophobicContact CD-CD2 4.49Å; K46-Y49 HydrophobicContact CD-CE2 4.2Å; K46-Y49 PolarHBondContact O-N 3.35Å; P47-Y49 VanDerWaalsContact C-N 3.33Å; P47-Y49 PolarHBondContact O-N 2.94Å; Y49-F52 PolarHBondContact O-N 3.43Å; Y49-I53 PolarHBondContact O-N 3.17Å
50Q56.8Low60.9Low112 Ų11291.4 Ų91.452%0.52350%0.499SS..Hα-helixtrans-71.9-31-179.2-137.2161.119.900112.4K46 P47 F52 I53K46-Q50 PolarHBondContact O-N 3.07Å; P47-Q50 PolarHBondContact O-N 2.89Å; Q50-F52 VanDerWaalsContact C-N 3.34Å; Q50-I53 PolarHBondContact O-N 3.02Å
51A59.2Low62Low67 Ų6787.8 Ų87.855%0.55449%0.487SS*.Hα-helixtrans-65.7-33.4171.700000112.8P47P47-A51 PolarHBondContact O-N 3.27Å
52F55.9Low63.3Low131 Ų13186 Ų8658%0.57547%0.473SS*.Hα-helixtrans-71.8-30.4176.4-74.6-72.7000112.9Q31 E48 Y49 Q50 Q54Q31-F52 PolarHBondContact NE2-O 3.06Å; E48-F52 WeakPolarHBondContact O-CD2 3.48Å; E48-F52 WeakPolarHBondContact O-CE2 3.41Å; Y49-F52 PolarHBondContact O-N 3.43Å; Q50-F52 VanDerWaalsContact C-N 3.34Å; F52-Q54 VanDerWaalsContact C-N 3.31Å; F52-Q54 PolarHBondContact O-N 3.48Å
53I54.2Low64.7Low85 Ų8589.7 Ų89.744%0.43647%0.474SS..Hα-helixtrans-71.4-26-179.9-64.4175.2000112.1W40 Y49 Q50W40-I53 HydrophobicContact CH2-CD1 4.15Å; W40-I53 HydrophobicContact CZ2-CD1 4.26Å; Y49-I53 PolarHBondContact O-N 3.17Å; Q50-I53 PolarHBondContact O-N 3.02Å
54Q54.3Low66.2Low170 Ų17088.9 Ų88.979%0.79448%0.483SS*.THydrogen-bonded Turntrans-85.4-3.4-178.9-71.8-174.8-15.800114.4F52 Q56F52-Q54 VanDerWaalsContact C-N 3.31Å; F52-Q54 PolarHBondContact O-N 3.48Å; Q54-Q56 PolarHBondContact O-N 2.87Å
55A55.4Low67.9Low57 Ų5789.2 Ų89.247%0.47148%0.481SS..SBendtrans-76.7115.3178.900000110.7
56Q56.2Low69.4Low143 Ų14388.6 Ų88.667%0.66848%0.475SS*.  trans22.9136.2159-139.3162.6-5700118.7Q54 T58Q54-Q56 PolarHBondContact O-N 2.87Å; Q56-T58 PolarHBondContact O-N 3.32Å
57P62Low70.9Confident78 Ų7888.7 Ų88.751%0.50648%0.484SS..  trans-59.499.9-179.825.6-34.1000110.6D59 D60P57-D59 PolarHBondContact O-N 3.23Å; P57-D60 HydrophobicContact CG-CB 4.41Å; P57-D60 WeakPolarHBondContact CG-OD2 3.39Å; P57-D60 PolarHBondContact O-N 3.03Å
58T67.2Low72.3Confident51 Ų5185.3 Ų85.331%0.31347%0.465SS..Hα-helixtrans-54.3-28.4177.750.60000111.4V29 Q56 D60 I61 A62V29-T58 HydrophobicContact CB-CG2 4.24Å; V29-T58 HydrophobicContact CG2-CG2 3.96Å; Q56-T58 PolarHBondContact O-N 3.32Å; T58-D60 PolarHBondContact O-N 3.31Å; T58-I61 PolarHBondContact O-N 2.92Å; T58-A62 WeakPolarHBondContact O-CB 3.26Å; T58-A62 PolarHBondContact O-N 3.41Å
59D72.3Confident73.8Confident99 Ų9982.5 Ų82.553%0.52945%0.453SS..Hα-helixtrans-62.7-37.9178.3-72.6-1.6000113.2P57 R63P57-D59 PolarHBondContact O-N 3.23Å; D59-R63 VanDerWaalsContact O-CB 3.28Å; D59-R63 WeakPolarHBondContact O-CB 3.48Å; D59-R63 WeakPolarHBondContact O-CG 3.35Å; D59-R63 PolarHBondContact O-N 3.07Å
60D82.5Confident75.5Confident94 Ų9482.2 Ų82.250%0.50346%0.46SS..Hα-helixtrans-72.5-38.5-178.7-73.1-23.7000111.1P57 T58 R63 S64P57-D60 HydrophobicContact CG-CB 4.41Å; P57-D60 WeakPolarHBondContact CG-OD2 3.39Å; P57-D60 PolarHBondContact O-N 3.03Å; T58-D60 PolarHBondContact O-N 3.31Å; D60-R63 PolarHBondContact O-N 3.32Å; D60-S64 WeakPolarHBondContact O-CB 3.45Å; D60-S64 PolarHBondContact O-N 2.67Å
61I84.2Confident77.2Confident32 Ų3279.5 Ų79.516%0.16446%0.457CS..Hα-helixtrans-64.9-49.9176.7-60.7174.5000109.9V25 V29 T58 R63 S64 F65V25-I61 HydrophobicContact CG1-CG2 3.63Å; V29-I61 HydrophobicContact CG1-CD1 4.28Å; T58-I61 PolarHBondContact O-N 2.92Å; I61-R63 VanDerWaalsContact C-N 3.33Å; I61-R63 PolarHBondContact O-N 3.01Å; I61-S64 PolarHBondContact O-N 3Å; I61-F65 HydrophobicContact CG2-CD2 3.79Å; I61-F65 HydrophobicContact CG2-CE2 3.58Å; I61-F65 VanDerWaalsContact O-CD2 3.24Å; I61-F65 WeakPolarHBondContact O-CD2 3.38Å; I61-F65 PolarHBondContact O-N 3.08Å
62A85.8Confident78.8Confident39 Ų3976.8 Ų76.832%0.32243%0.434SS..Hα-helixtrans-60.9-42178.600000111.8T58 F65 A66T58-A62 WeakPolarHBondContact O-CB 3.26Å; T58-A62 PolarHBondContact O-N 3.41Å; A62-F65 PolarHBondContact O-N 3.38Å; A62-A66 WeakPolarHBondContact O-CB 3.45Å; A62-A66 PolarHBondContact O-N 2.9Å
63R89.6Confident80.6Confident159 Ų15972.3 Ų72.360%0.642%0.421SS*.Hα-helixtrans-63.7-42.8175-76.4173.1-173.61695.1112.2D59 D60 I61 F65 A66 V67D59-R63 VanDerWaalsContact O-CB 3.28Å; D59-R63 WeakPolarHBondContact O-CB 3.48Å; D59-R63 WeakPolarHBondContact O-CG 3.35Å; D59-R63 PolarHBondContact O-N 3.07Å; D60-R63 PolarHBondContact O-N 3.32Å; I61-R63 VanDerWaalsContact C-N 3.33Å; I61-R63 PolarHBondContact O-N 3.01Å; R63-F65 VanDerWaalsContact C-N 3.34Å; R63-F65 PolarHBondContact O-N 2.92Å; R63-A66 PolarHBondContact O-N 3.04Å; R63-V67 WeakPolarHBondContact O-CG2 3.44Å; R63-V67 PolarHBondContact O-N 3.43Å
64S90.2Very high82.5Confident82 Ų8275.1 Ų75.157%0.57343%0.43SS*.Hα-helixtrans-59.1-46.1177.2-174.60000111.5D60 I61 V67 A68D60-S64 WeakPolarHBondContact O-CB 3.45Å; D60-S64 PolarHBondContact O-N 2.67Å; I61-S64 PolarHBondContact O-N 3Å; S64-V67 PolarHBondContact O-N 3.24Å; S64-A68 PolarHBondContact O-N 3.26Å
65F91.7Very high84.3Confident39 Ų3970.9 Ų70.917%0.17141%0.41CS..Hα-helixtrans-65-41.8175.2-77.2-63.5000112.3N21 A22 V25 I61 A62 R63 V67 A68 I69N21-F65 HydrophobicContact CB-CE1 3.95Å; N21-F65 HydrophobicContact CB-CZ 4.35Å; A22-F65 HydrophobicContact CB-CB 3.7Å; A22-F65 HydrophobicContact CB-CD1 3.68Å; A22-F65 HydrophobicContact CB-CD2 4.03Å; A22-F65 HydrophobicContact CB-CE1 4.29Å; A22-F65 HydrophobicContact CB-CG 3.54Å; V25-F65 HydrophobicContact CB-CE2 3.83Å; V25-F65 HydrophobicContact CB-CZ 4.15Å; V25-F65 HydrophobicContact CG1-CE2 4.02Å; V25-F65 HydrophobicContact CG2-CE2 4.16Å; V25-F65 HydrophobicContact CG2-CZ 3.98Å; I61-F65 HydrophobicContact CG2-CD2 3.79Å; I61-F65 HydrophobicContact CG2-CE2 3.58Å; I61-F65 VanDerWaalsContact O-CD2 3.24Å; I61-F65 WeakPolarHBondContact O-CD2 3.38Å; I61-F65 PolarHBondContact O-N 3.08Å; A62-F65 PolarHBondContact O-N 3.38Å; R63-F65 VanDerWaalsContact C-N 3.34Å; R63-F65 PolarHBondContact O-N 2.92Å; F65-V67 VanDerWaalsContact C-N 3.31Å; F65-V67 PolarHBondContact O-N 3.48Å; F65-A68 PolarHBondContact O-N 3.18Å; F65-I69 WeakPolarHBondContact O-CB 3.36Å; F65-I69 WeakPolarHBondContact O-CD1 3.47Å; F65-I69 WeakPolarHBondContact O-CG1 3.38Å; F65-I69 PolarHBondContact O-N 2.9Å
66A92.1Very high86.1Confident56 Ų5669.5 Ų69.546%0.46339%0.394SS..Hα-helixtrans-60.5-40.3176.900000112.2A62 R63 S70A62-A66 WeakPolarHBondContact O-CB 3.45Å; A62-A66 PolarHBondContact O-N 2.9Å; R63-A66 PolarHBondContact O-N 3.04Å; A66-S70 VanDerWaalsContact O-CB 3.24Å; A66-S70 WeakPolarHBondContact O-CB 3.43Å; A66-S70 PolarHBondContact O-N 2.92Å
67V93.9Very high87.8Confident105 Ų10568 Ų6864%0.63639%0.391SS*.Hα-helixtrans-64.3-46.6174.4171.10000110.9R63 S64 F65 S70 A71R63-V67 WeakPolarHBondContact O-CG2 3.44Å; R63-V67 PolarHBondContact O-N 3.43Å; S64-V67 PolarHBondContact O-N 3.24Å; F65-V67 VanDerWaalsContact C-N 3.31Å; F65-V67 PolarHBondContact O-N 3.48Å; V67-S70 PolarHBondContact O-N 2.88Å; V67-A71 WeakPolarHBondContact O-CB 3.4Å; V67-A71 PolarHBondContact O-N 3.49Å
68A92.6Very high89.1Confident32 Ų3267.4 Ų67.426%0.26439%0.393SS..Hα-helixtrans-60.9-49.4178.500000112S64 F65 S70 A71 T72S64-A68 PolarHBondContact O-N 3.26Å; F65-A68 PolarHBondContact O-N 3.18Å; A68-S70 VanDerWaalsContact C-N 3.34Å; A68-S70 PolarHBondContact O-N 3.48Å; A68-A71 PolarHBondContact O-N 2.82Å; A68-T72 PolarHBondContact O-N 3.42Å; A68-T72 PolarHBondContact O-OG1 3.32Å
69I94.3Very high90.2Very high39 Ų3965.4 Ų65.420%0.238%0.38CS..Hα-helixtrans-59.1-43.7176.8-69.9166.4000110.8Q15 N18 L19 A22 F65 T72 A73Q15-I69 VanDerWaalsContact NE2-CG2 3.32Å; Q15-I69 PolarHBondContact OE1-O 3.38Å; N18-I69 HydrophobicContact CB-CG1 4.03Å; L19-I69 HydrophobicContact CD2-CD1 3.76Å; L19-I69 HydrophobicContact CD2-CG1 4.27Å; L19-I69 HydrophobicContact CD2-CG2 4.35Å; L19-I69 HydrophobicContact CG-CD1 4.5Å; A22-I69 HydrophobicContact CB-CD1 4.2Å; F65-I69 WeakPolarHBondContact O-CB 3.36Å; F65-I69 WeakPolarHBondContact O-CD1 3.47Å; F65-I69 WeakPolarHBondContact O-CG1 3.38Å; F65-I69 PolarHBondContact O-N 2.9Å; I69-T72 WeakPolarHBondContact CA-OG1 3.41Å; I69-T72 PolarHBondContact O-OG1 2.85Å; I69-T72 VanDerWaalsContact O-OG1 3.11Å; I69-A73 VanDerWaalsContact O-CB 3.3Å; I69-A73 WeakPolarHBondContact O-CB 3.4Å; I69-A73 PolarHBondContact O-N 3.32Å
70S94.6Very high91Very high56 Ų5665.2 Ų65.239%0.39238%0.378SS..Hα-helixtrans-67.8-37.9178.4-178.30000112.2A66 V67 A68 K74A66-S70 VanDerWaalsContact O-CB 3.24Å; A66-S70 WeakPolarHBondContact O-CB 3.43Å; A66-S70 PolarHBondContact O-N 2.92Å; V67-S70 PolarHBondContact O-N 2.88Å; A68-S70 VanDerWaalsContact C-N 3.34Å; A68-S70 PolarHBondContact O-N 3.48Å; S70-K74 WeakPolarHBondContact O-CG 3.41Å; S70-K74 PolarHBondContact O-N 2.84Å
71A93Very high91.2Very high56 Ų5664 Ų6446%0.46339%0.387SS..Hα-helixtrans-65.7-46.117700000111.3V67 A68 K74 Q75V67-A71 WeakPolarHBondContact O-CB 3.4Å; V67-A71 PolarHBondContact O-N 3.49Å; A68-A71 PolarHBondContact O-N 2.82Å; A71-K74 PolarHBondContact O-N 3.33Å; A71-Q75 PolarHBondContact O-N 3.21Å
72T92.5Very high91.3Very high10 Ų1065.1 Ų65.16%0.06140%0.402CS..Hα-helixtrans-66.6-37.1177.246.80000112L14 Q15 N18 A68 I69 K74 Q75 L76L14-T72 HydrophobicContact CD2-CG2 3.75Å; L14-T72 HydrophobicContact CG-CG2 4.04Å; Q15-T72 PolarHBondContact OE1-OG1 2.97Å; N18-T72 WeakPolarHBondContact ND2-CG2 3.43Å; A68-T72 PolarHBondContact O-N 3.42Å; A68-T72 PolarHBondContact O-OG1 3.32Å; I69-T72 WeakPolarHBondContact CA-OG1 3.41Å; I69-T72 PolarHBondContact O-OG1 2.85Å; I69-T72 VanDerWaalsContact O-OG1 3.11Å; T72-K74 PolarHBondContact O-N 3.45Å; T72-Q75 WeakPolarHBondContact O-CB 3.29Å; T72-Q75 PolarHBondContact O-N 3.25Å; T72-L76 WeakPolarHBondContact O-CG 3.48Å; T72-L76 PolarHBondContact O-N 2.94Å
73A93.9Very high91.1Very high37 Ų3766.4 Ų66.431%0.30640%0.403SS..Hα-helixtrans-61.3-43.3173.300000112.6I69 Q75 L76 D77I69-A73 VanDerWaalsContact O-CB 3.3Å; I69-A73 WeakPolarHBondContact O-CB 3.4Å; I69-A73 PolarHBondContact O-N 3.32Å; A73-Q75 VanDerWaalsContact C-N 3.3Å; A73-Q75 PolarHBondContact O-N 3.37Å; A73-L76 WeakPolarHBondContact O-CB 3.27Å; A73-L76 PolarHBondContact O-N 3.43Å; A73-D77 PolarHBondContact O-N 2.74Å
74K93.8Very high90.3Very high143 Ų14362.8 Ų62.862%0.62240%0.4SS*.Hα-helixtrans-63.7-36.9174.9-74.2174.4-179175.70112.5S70 A71 T72 L76 D77 A78S70-K74 WeakPolarHBondContact O-CG 3.41Å; S70-K74 PolarHBondContact O-N 2.84Å; A71-K74 PolarHBondContact O-N 3.33Å; T72-K74 PolarHBondContact O-N 3.45Å; K74-L76 VanDerWaalsContact C-N 3.35Å; K74-D77 PolarHBondContact O-N 2.89Å; K74-A78 WeakPolarHBondContact O-CB 3.35Å; K74-A78 PolarHBondContact O-N 2.87Å
75Q92.3Very high89.2Confident82 Ų8266.6 Ų66.638%0.38341%0.409SS..Hα-helixtrans-64.3-42174.7-176.4179.8-10.700110.8A71 T72 A73 A78 L79A71-Q75 PolarHBondContact O-N 3.21Å; T72-Q75 WeakPolarHBondContact O-CB 3.29Å; T72-Q75 PolarHBondContact O-N 3.25Å; A73-Q75 VanDerWaalsContact C-N 3.3Å; A73-Q75 PolarHBondContact O-N 3.37Å; Q75-A78 PolarHBondContact O-N 3.43Å; Q75-L79 HydrophobicContact CG-CD1 4.08Å; Q75-L79 HydrophobicContact CG-CG 4.46Å; Q75-L79 WeakPolarHBondContact O-CB 3.4Å; Q75-L79 VanDerWaalsContact O-CG 3.27Å; Q75-L79 WeakPolarHBondContact O-CG 3.3Å; Q75-L79 PolarHBondContact O-N 2.89Å
76L92.8Very high87.7Confident27 Ų2773.9 Ų73.914%0.14144%0.443CS..Hα-helixtrans-58.8-48.5173.8-69.4172.7000111.7L8 A11 I12 Q15 T72 A73 K74 A78 L79 I80L8-L76 HydrophobicContact CD1-CD2 3.7Å; A11-L76 HydrophobicContact CB-CD2 3.47Å; A11-L76 VanDerWaalsContact CB-CD2 3.47Å; A11-L76 HydrophobicContact CB-CG 4.22Å; I12-L76 HydrophobicContact CG1-CD2 3.62Å; Q15-L76 HydrophobicContact CB-CD1 4.2Å; Q15-L76 HydrophobicContact CG-CD1 4.21Å; T72-L76 WeakPolarHBondContact O-CG 3.48Å; T72-L76 PolarHBondContact O-N 2.94Å; A73-L76 WeakPolarHBondContact O-CB 3.27Å; A73-L76 PolarHBondContact O-N 3.43Å; K74-L76 VanDerWaalsContact C-N 3.35Å; L76-A78 VanDerWaalsContact C-N 3.3Å; L76-A78 PolarHBondContact O-N 3.23Å; L76-L79 PolarHBondContact O-N 2.83Å; L76-L79 VanDerWaalsContact O-N 3.17Å; L76-I80 WeakPolarHBondContact O-CB 3.47Å; L76-I80 VanDerWaalsContact O-CG1 3.24Å; L76-I80 WeakPolarHBondContact O-CG1 3.3Å; L76-I80 PolarHBondContact O-N 3.48Å
77D92.6Very high85.9Confident112 Ų11279.2 Ų79.260%0.59946%0.459SS*.Hα-helixtrans-59.1-41.9177.4-72.3-29.1000111.9A73 K74 I80 G81A73-D77 PolarHBondContact O-N 2.74Å; K74-D77 PolarHBondContact O-N 2.89Å; D77-I80 PolarHBondContact O-N 2.95Å; D77-G81 PolarHBondContact O-N 3.41Å
78A90.1Very high84.2Confident66 Ų6675.8 Ų75.855%0.54544%0.442SS..Hα-helixtrans-65.2-40.4176.800000112.3K74 Q75 L76 G81 A82K74-A78 WeakPolarHBondContact O-CB 3.35Å; K74-A78 PolarHBondContact O-N 2.87Å; Q75-A78 PolarHBondContact O-N 3.43Å; L76-A78 VanDerWaalsContact C-N 3.3Å; L76-A78 PolarHBondContact O-N 3.23Å; A78-G81 PolarHBondContact O-N 2.85Å; A78-A82 WeakPolarHBondContact O-CB 3.39Å; A78-A82 PolarHBondContact O-N 2.82Å
79L89.9Confident83Confident9 Ų977 Ų775%0.04745%0.448CS..Hα-helixtrans-67.8-41.1177.3-71.4171.2000111.7E7 L8 A11 Q75 L76 A82 L83E7-L79 HydrophobicContact CB-CD2 4.41Å; E7-L79 HydrophobicContact CG-CD1 3.97Å; E7-L79 HydrophobicContact CG-CD2 3.9Å; E7-L79 VanDerWaalsContact OE2-CD2 3.29Å; E7-L79 WeakPolarHBondContact OE2-CD2 3.31Å; L8-L79 HydrophobicContact CD1-CB 3.91Å; L8-L79 HydrophobicContact CD1-CD1 4.45Å; A11-L79 HydrophobicContact CB-CD1 3.95Å; Q75-L79 HydrophobicContact CG-CD1 4.08Å; Q75-L79 HydrophobicContact CG-CG 4.46Å; Q75-L79 WeakPolarHBondContact O-CB 3.4Å; Q75-L79 VanDerWaalsContact O-CG 3.27Å; Q75-L79 WeakPolarHBondContact O-CG 3.3Å; Q75-L79 PolarHBondContact O-N 2.89Å; L76-L79 PolarHBondContact O-N 2.83Å; L76-L79 VanDerWaalsContact O-N 3.17Å; L79-A82 PolarHBondContact O-N 2.83Å; L79-A82 VanDerWaalsContact O-N 3.17Å; L79-L83 PolarHBondContact O-N 3.45Å
80I88.1Confident82.2Confident94 Ų9478 Ų7848%0.48246%0.462SS..Hα-helixtrans-62.2-45.7174.7-67.7164.9000110.1L8 L76 D77 A82 L83L8-I80 HydrophobicContact CD1-CG1 3.98Å; L76-I80 WeakPolarHBondContact O-CB 3.47Å; L76-I80 VanDerWaalsContact O-CG1 3.24Å; L76-I80 WeakPolarHBondContact O-CG1 3.3Å; L76-I80 PolarHBondContact O-N 3.48Å; D77-I80 PolarHBondContact O-N 2.95Å; I80-A82 PolarHBondContact O-N 3.39Å; I80-L83 WeakPolarHBondContact O-CB 3.26Å; I80-L83 PolarHBondContact O-N 3.34Å; I80-L83 VanDerWaalsContact O-N 3.14Å
81G87.8Confident81.5Confident68 Ų6879.8 Ų79.870%0.70147%0.467SS*.Hα-helixtrans-66.3-19.8175.900000114.4D77 A78D77-G81 PolarHBondContact O-N 3.41Å; A78-G81 PolarHBondContact O-N 2.85Å
82A85.7Confident80.9Confident57 Ų5781.6 Ų81.647%0.47147%0.468SS..THydrogen-bonded Turntrans-91.6-3.6175.600000113.4A78 L79 I80A78-A82 WeakPolarHBondContact O-CB 3.39Å; A78-A82 PolarHBondContact O-N 2.82Å; L79-A82 PolarHBondContact O-N 2.83Å; L79-A82 VanDerWaalsContact O-N 3.17Å; I80-A82 PolarHBondContact O-N 3.39Å
83L81.1Confident80.3Confident65 Ų6585 Ų8534%0.3448%0.483SS..SBendtrans-66.6139.3173.6-71.1170.4000109.5R4 L8 L79 I80 E85R4-L83 HydrophobicContact CB-CD2 4.48Å; L8-L83 HydrophobicContact CD2-CD1 4.33Å; L79-L83 PolarHBondContact O-N 3.45Å; I80-L83 WeakPolarHBondContact O-CB 3.26Å; I80-L83 PolarHBondContact O-N 3.34Å; I80-L83 VanDerWaalsContact O-N 3.14Å; L83-E85 PolarHBondContact O-N 3Å
84P73.5Confident79.9Confident83 Ų8390.8 Ų90.854%0.53950%0.497SS..PPolyproline II helixtrans-59.9136172.826.6-32.6000109.1M1 E86M1-P84 HydrophobicContact CE-CG 4.27Å; M1-P84 HydrophobicContact CG-CG 4.42Å; P84-E86 PolarHBondContact O-N 2.82Å
85E66.5Low79.6Confident163 Ų16386.2 Ų86.276%0.76249%0.487SS*.PPolyproline II helixtrans-49.5126.1-178.5-67.7177.5166.800111.2L83 E87 A88L83-E85 PolarHBondContact O-N 3Å; E85-E87 PolarHBondContact O-N 3.39Å; E85-E87 VanDerWaalsContact O-N 3.11Å; E85-A88 PolarHBondContact O-N 2.73Å
86E60.8Low79.3Confident191 Ų19186.3 Ų86.389%0.89349%0.493SS*.THydrogen-bonded Turntrans-64.3-14-179.6-163.4173-176.900112.3P84 A88P84-E86 PolarHBondContact O-N 2.82Å; E86-A88 PolarHBondContact O-N 2.83Å; E86-A88 VanDerWaalsContact O-N 3.09Å
87E54.1Low79.2Confident168 Ų16888.9 Ų88.979%0.78551%0.509SS*.THydrogen-bonded Turntrans-67.5-7.6-179.4-69.9-158.2161.200115E85 S89E85-E87 PolarHBondContact O-N 3.39Å; E85-E87 VanDerWaalsContact O-N 3.11Å; E87-S89 PolarHBondContact O-N 3.09Å
88A57.3Low79.2Confident34 Ų3488.8 Ų88.828%0.28151%0.505SS..SBendtrans-73.579.8163.300000108.7E85 E86 A90 Q93E85-A88 PolarHBondContact O-N 2.73Å; E86-A88 PolarHBondContact O-N 2.83Å; E86-A88 VanDerWaalsContact O-N 3.09Å; A88-A90 PolarHBondContact O-N 3.39Å; A88-Q93 HydrophobicContact CB-CG 3.52Å; A88-Q93 WeakPolarHBondContact O-CG 3.17Å; A88-Q93 PolarHBondContact O-NE2 3.11Å
89S68.4Low79.3Confident57 Ų5792.6 Ų92.640%0.39951%0.509SS..  trans-40139.5165.6169.60000108.5E87 D91 I92 Q93E87-S89 PolarHBondContact O-N 3.09Å; S89-D91 CarbonylContact O-C 3.58Å; S89-D91 PolarHBondContact O-N 3.24Å; S89-I92 WeakPolarHBondContact O-CA 3.5Å; S89-I92 WeakPolarHBondContact O-CB 3.45Å; S89-I92 PolarHBondContact O-N 3.09Å; S89-Q93 PolarHBondContact O-N 3.5Å; S89-Q93 VanDerWaalsContact O-N 3.09Å
90A77.2Confident79.5Confident59 Ų5998.1 Ų98.149%0.48854%0.538SS..Hα-helixtrans-49.7-25.1-178.600000112.5A88 R94A88-A90 PolarHBondContact O-N 3.39Å; A90-R94 VanDerWaalsContact O-CB 3.27Å; A90-R94 WeakPolarHBondContact O-CB 3.27Å; A90-R94 WeakPolarHBondContact O-CG 3.41Å; A90-R94 PolarHBondContact O-N 2.92Å; A90-R94 PolarHBondContact O-NE 2.59Å; A90-R94 VanDerWaalsContact O-NE 3.12Å
91D79Confident79.8Confident95 Ų9598.8 Ų98.851%0.50854%0.542SS..Hα-helixtrans-68-45171.5-63.7-36.6000114S89 R94 A95S89-D91 CarbonylContact O-C 3.58Å; S89-D91 PolarHBondContact O-N 3.24Å; D91-R94 PolarHBondContact O-N 3.4Å; D91-R94 IonicContact OD1-CZ 3.67Å; D91-R94 VanDerWaalsContact OD1-CZ 3.28Å; D91-R94 IonicContact OD1-NE 2.97Å; D91-R94 IonicContact OD1-NH2 3.71Å; D91-R94 PolarHBondContact OD1-NH2 3.12Å; D91-A95 VanDerWaalsContact O-CB 3.3Å; D91-A95 WeakPolarHBondContact O-CB 3.45Å; D91-A95 PolarHBondContact O-N 2.99Å
92I80.5Confident80.1Confident94 Ų94100.5 Ų100.548%0.48253%0.532SS..Hα-helixtrans-66.3-42.6176.7-60.2174.5000110S89 A95 T96S89-I92 WeakPolarHBondContact O-CA 3.5Å; S89-I92 WeakPolarHBondContact O-CB 3.45Å; S89-I92 PolarHBondContact O-N 3.09Å; I92-A95 PolarHBondContact O-N 3.28Å; I92-T96 VanDerWaalsContact O-CB 3.31Å; I92-T96 WeakPolarHBondContact O-CB 3.32Å; I92-T96 PolarHBondContact O-N 3.2Å; I92-T96 PolarHBondContact O-OG1 2.64Å
93Q80.1Confident80.6Confident81 Ų81100.2 Ų100.238%0.37953%0.529SS..Hα-helixtrans-60.9-47.8175-63.6-17515.500110.6A88 S89 A95 T96 V97A88-Q93 HydrophobicContact CB-CG 3.52Å; A88-Q93 WeakPolarHBondContact O-CG 3.17Å; A88-Q93 PolarHBondContact O-NE2 3.11Å; S89-Q93 PolarHBondContact O-N 3.5Å; S89-Q93 VanDerWaalsContact O-N 3.09Å; Q93-A95 PolarHBondContact O-N 3.17Å; Q93-T96 PolarHBondContact O-N 3.14Å; Q93-V97 WeakPolarHBondContact O-CB 3.46Å; Q93-V97 VanDerWaalsContact O-CG2 3.26Å; Q93-V97 WeakPolarHBondContact O-CG2 3.27Å; Q93-V97 PolarHBondContact O-N 2.99Å
94R85.6Confident81.2Confident158 Ų158105.4 Ų105.460%0.59655%0.546SS*.Hα-helixtrans-59.4-44.5175.4-80.1-177.2-73.5175-11.8112.6A90 D91 T96 V97 H98A90-R94 VanDerWaalsContact O-CB 3.27Å; A90-R94 WeakPolarHBondContact O-CB 3.27Å; A90-R94 WeakPolarHBondContact O-CG 3.41Å; A90-R94 PolarHBondContact O-N 2.92Å; A90-R94 PolarHBondContact O-NE 2.59Å; A90-R94 VanDerWaalsContact O-NE 3.12Å; D91-R94 PolarHBondContact O-N 3.4Å; D91-R94 IonicContact OD1-CZ 3.67Å; D91-R94 VanDerWaalsContact OD1-CZ 3.28Å; D91-R94 IonicContact OD1-NE 2.97Å; D91-R94 IonicContact OD1-NH2 3.71Å; D91-R94 PolarHBondContact OD1-NH2 3.12Å; R94-T96 VanDerWaalsContact C-N 3.33Å; R94-T96 PolarHBondContact O-N 3.45Å; R94-V97 PolarHBondContact O-N 3.46Å; R94-H98 WeakPolarHBondContact O-CB 3.29Å; R94-H98 PolarHBondContact O-N 2.86Å
95A87.8Confident82.2Confident48 Ų48111.3 Ų111.340%0.39756%0.557SS.*Hα-helixtrans-63.7-39.5177.200000111.9D91 I92 Q93 H98 K99D91-A95 VanDerWaalsContact O-CB 3.3Å; D91-A95 WeakPolarHBondContact O-CB 3.45Å; D91-A95 PolarHBondContact O-N 2.99Å; I92-A95 PolarHBondContact O-N 3.28Å; Q93-A95 PolarHBondContact O-N 3.17Å; A95-H98 PolarHBondContact O-N 3.45Å; A95-K99 WeakPolarHBondContact O-CG 3.41Å; A95-K99 PolarHBondContact O-N 2.91Å
96T87.1Confident83.6Confident83 Ų83106.3 Ų106.351%0.50954%0.541SS..Hα-helixtrans-66.8-45.2176.6-56.90000111I92 Q93 R94 H98 K99 L100I92-T96 VanDerWaalsContact O-CB 3.31Å; I92-T96 WeakPolarHBondContact O-CB 3.32Å; I92-T96 PolarHBondContact O-N 3.2Å; I92-T96 PolarHBondContact O-OG1 2.64Å; Q93-T96 PolarHBondContact O-N 3.14Å; R94-T96 VanDerWaalsContact C-N 3.33Å; R94-T96 PolarHBondContact O-N 3.45Å; T96-H98 VanDerWaalsContact C-N 3.32Å; T96-H98 PolarHBondContact O-N 3Å; T96-K99 PolarHBondContact O-N 2.9Å; T96-L100 WeakPolarHBondContact O-CB 3.38Å; T96-L100 PolarHBondContact O-N 3.31Å
97V89.4Confident85.2Confident82 Ų82102.3 Ų102.350%0.49752%0.522SS..Hα-helixtrans-59.2-44.5173.9169.50000110.4Q93 R94 L100 L101Q93-V97 WeakPolarHBondContact O-CB 3.46Å; Q93-V97 VanDerWaalsContact O-CG2 3.26Å; Q93-V97 WeakPolarHBondContact O-CG2 3.27Å; Q93-V97 PolarHBondContact O-N 2.99Å; R94-V97 PolarHBondContact O-N 3.46Å; V97-L100 PolarHBondContact O-N 3.37Å; V97-L101 HydrophobicContact CG1-CD1 3.92Å; V97-L101 HydrophobicContact CG1-CG 4.34Å; V97-L101 WeakPolarHBondContact O-CB 3.44Å; V97-L101 VanDerWaalsContact O-CG 3.3Å; V97-L101 WeakPolarHBondContact O-CG 3.48Å; V97-L101 PolarHBondContact O-N 3.47Å
98H92.1Very high87.2Confident109 Ų10996 Ų9651%0.50550%0.502SS..Hα-helixtrans-60.8-48.5177.6-167.6-88.6000111.9R94 A95 T96 L100 L101 E102R94-H98 WeakPolarHBondContact O-CB 3.29Å; R94-H98 PolarHBondContact O-N 2.86Å; A95-H98 PolarHBondContact O-N 3.45Å; T96-H98 VanDerWaalsContact C-N 3.32Å; T96-H98 PolarHBondContact O-N 3Å; H98-L100 VanDerWaalsContact C-N 3.29Å; H98-L100 PolarHBondContact O-N 2.91Å; H98-L101 PolarHBondContact O-N 3.16Å; H98-E102 VanDerWaalsContact CE1-CD 3.46Å; H98-E102 IonicContact CE1-OE1 3.47Å; H98-E102 PolarHBondContact CE1-OE1 3.32Å; H98-E102 IonicContact ND1-OE1 3.79Å; H98-E102 PolarHBondContact ND1-OE1 2.86Å; H98-E102 IonicContact ND1-OE2 3.73Å; H98-E102 WeakPolarHBondContact O-CG 3.24Å; H98-E102 PolarHBondContact O-N 3.36Å
99K93.2Very high89.1Confident147 Ų14797.2 Ų97.264%0.63951%0.512SS*.Hα-helixtrans-58.2-41.6175.1-74.8177.2-179.9179.90112.1A95 T96 E102 A103A95-K99 WeakPolarHBondContact O-CG 3.41Å; A95-K99 PolarHBondContact O-N 2.91Å; T96-K99 PolarHBondContact O-N 2.9Å; K99-E102 PolarHBondContact O-N 3.17Å; K99-A103 WeakPolarHBondContact O-CB 3.49Å; K99-A103 PolarHBondContact O-N 2.87Å
100L93.7Very high90.4Very high125 Ų12599.5 Ų99.565%0.65451%0.514SS*.Hα-helixtrans-66.1-41.1178.3-173.464.8000111.5T96 V97 H98 A103 Y104T96-L100 WeakPolarHBondContact O-CB 3.38Å; T96-L100 PolarHBondContact O-N 3.31Å; V97-L100 PolarHBondContact O-N 3.37Å; H98-L100 VanDerWaalsContact C-N 3.29Å; H98-L100 PolarHBondContact O-N 2.91Å; L100-A103 PolarHBondContact O-N 3.08Å; L100-Y104 VanDerWaalsContact O-CB 3.29Å; L100-Y104 WeakPolarHBondContact O-CB 3.3Å; L100-Y104 PolarHBondContact O-N 3.04Å
101L94.7Very high91.3Very high107 Ų107102 Ų10256%0.5652%0.519SS*.Hα-helixtrans-65.8-40.2175.7-72.9172.8000112.1V97 H98 Y104 R105V97-L101 HydrophobicContact CG1-CD1 3.92Å; V97-L101 HydrophobicContact CG1-CG 4.34Å; V97-L101 WeakPolarHBondContact O-CB 3.44Å; V97-L101 VanDerWaalsContact O-CG 3.3Å; V97-L101 WeakPolarHBondContact O-CG 3.48Å; V97-L101 PolarHBondContact O-N 3.47Å; H98-L101 PolarHBondContact O-N 3.16Å; L101-Y104 PolarHBondContact O-N 3.42Å; L101-R105 VanDerWaalsContact O-CB 3.27Å; L101-R105 WeakPolarHBondContact O-CB 3.37Å; L101-R105 PolarHBondContact O-N 3.21Å
102E95Very high92.2Very high105 Ų105100 Ų10049%0.49152%0.516SS..Hα-helixtrans-63-45.6174-74.4178.6152.800111.7H98 K99 R105 S106H98-E102 VanDerWaalsContact CE1-CD 3.46Å; H98-E102 IonicContact CE1-OE1 3.47Å; H98-E102 PolarHBondContact CE1-OE1 3.32Å; H98-E102 IonicContact ND1-OE1 3.79Å; H98-E102 PolarHBondContact ND1-OE1 2.86Å; H98-E102 IonicContact ND1-OE2 3.73Å; H98-E102 WeakPolarHBondContact O-CG 3.24Å; H98-E102 PolarHBondContact O-N 3.36Å; K99-E102 PolarHBondContact O-N 3.17Å; E102-R105 PolarHBondContact O-N 3.32Å; E102-S106 WeakPolarHBondContact O-CB 3.45Å; E102-S106 PolarHBondContact O-N 3.06Å
103A94.6Very high93Very high50 Ų50103.8 Ų103.841%0.41352%0.524SS..Hα-helixtrans-60.8-47.617500000111K99 L100 R105 S106 E107K99-A103 WeakPolarHBondContact O-CB 3.49Å; K99-A103 PolarHBondContact O-N 2.87Å; L100-A103 PolarHBondContact O-N 3.08Å; A103-R105 VanDerWaalsContact C-N 3.32Å; A103-R105 PolarHBondContact O-N 3.44Å; A103-S106 WeakPolarHBondContact O-CB 3.39Å; A103-S106 PolarHBondContact O-N 3.48Å; A103-E107 WeakPolarHBondContact O-CG 3.4Å; A103-E107 PolarHBondContact O-N 2.93Å
104Y94.3Very high93.8Very high175 Ų175104.4 Ų104.469%0.68653%0.529SS*.Hα-helixtrans-59-42.1176.6-176.5-101.4000112.1L100 L101 E107 G108L100-Y104 VanDerWaalsContact O-CB 3.29Å; L100-Y104 WeakPolarHBondContact O-CB 3.3Å; L100-Y104 PolarHBondContact O-N 3.04Å; L101-Y104 PolarHBondContact O-N 3.42Å; Y104-E107 PolarHBondContact O-N 3.2Å; Y104-G108 PolarHBondContact O-N 2.95Å
105R95.3Very high94.3Very high206 Ų20699.6 Ų99.678%0.77752%0.517SS*.Hα-helixtrans-65.2-41.3176.5-174.7178.2-179.5175.50.8112L101 E102 A103 G108 A109L101-R105 VanDerWaalsContact O-CB 3.27Å; L101-R105 WeakPolarHBondContact O-CB 3.37Å; L101-R105 PolarHBondContact O-N 3.21Å; E102-R105 PolarHBondContact O-N 3.32Å; A103-R105 VanDerWaalsContact C-N 3.32Å; A103-R105 PolarHBondContact O-N 3.44Å; R105-G108 PolarHBondContact O-N 3.37Å; R105-A109 WeakPolarHBondContact O-CB 3.25Å; R105-A109 PolarHBondContact O-N 3.38Å
106S95.3Very high94.8Very high59 Ų59101.5 Ų101.541%0.41352%0.524SS..Hα-helixtrans-63.9-47.4176.3-176.60000111.6E102 A103 A109 K110E102-S106 WeakPolarHBondContact O-CB 3.45Å; E102-S106 PolarHBondContact O-N 3.06Å; A103-S106 WeakPolarHBondContact O-CB 3.39Å; A103-S106 PolarHBondContact O-N 3.48Å; S106-A109 PolarHBondContact O-N 2.95Å; S106-K110 WeakPolarHBondContact O-CG 3.45Å; S106-K110 PolarHBondContact O-N 3.44Å
107E95Very high95.3Very high107 Ų107103 Ų10350%0.552%0.523SS..Hα-helixtrans-63.8-41175.6-66.8-51.1135.500111.9A103 Y104 A109 K110 L111A103-E107 WeakPolarHBondContact O-CG 3.4Å; A103-E107 PolarHBondContact O-N 2.93Å; Y104-E107 PolarHBondContact O-N 3.2Å; E107-A109 VanDerWaalsContact C-N 3.34Å; E107-A109 PolarHBondContact O-N 3.1Å; E107-K110 WeakPolarHBondContact O-CB 3.39Å; E107-K110 PolarHBondContact O-N 2.95Å; E107-K110 IonicContact OE1-NZ 2.67Å; E107-K110 PolarHBondContact OE1-NZ 2.87Å; E107-K110 IonicContact OE2-NZ 2.59Å; E107-L111 PolarHBondContact O-N 3.36Å
108G96.2Very high95.7Very high35 Ų35104.2 Ų104.236%0.36153%0.527SS..Hα-helixtrans-60.8-39.8173.500000113Y104 R105 L111 A112Y104-G108 PolarHBondContact O-N 2.95Å; R105-G108 PolarHBondContact O-N 3.37Å; G108-L111 PolarHBondContact O-N 2.88Å; G108-A112 WeakPolarHBondContact O-CB 3.42Å; G108-A112 PolarHBondContact O-N 3.5Å
109A96.3Very high96Very high60 Ų60104.6 Ų104.650%0.49653%0.529SS..Hα-helixtrans-67.5-38.4175.500000112.4R105 S106 E107 A112 R113R105-A109 WeakPolarHBondContact O-CB 3.25Å; R105-A109 PolarHBondContact O-N 3.38Å; S106-A109 PolarHBondContact O-N 2.95Å; E107-A109 VanDerWaalsContact C-N 3.34Å; E107-A109 PolarHBondContact O-N 3.1Å; A109-A112 PolarHBondContact O-N 3.01Å; A109-R113 WeakPolarHBondContact O-CB 3.34Å; A109-R113 PolarHBondContact O-N 2.93Å
110K96.4Very high96.2Very high104 Ų104100.9 Ų100.945%0.45252%0.521SS..Hα-helixtrans-61.8-46.3172.8-69.1172.5-169.5171.80110.8S106 E107 R113 I114S106-K110 WeakPolarHBondContact O-CG 3.45Å; S106-K110 PolarHBondContact O-N 3.44Å; E107-K110 WeakPolarHBondContact O-CB 3.39Å; E107-K110 PolarHBondContact O-N 2.95Å; E107-K110 IonicContact OE1-NZ 2.67Å; E107-K110 PolarHBondContact OE1-NZ 2.87Å; E107-K110 IonicContact OE2-NZ 2.59Å; K110-R113 PolarHBondContact O-N 2.95Å; K110-I114 WeakPolarHBondContact O-CG1 3.32Å; K110-I114 PolarHBondContact O-N 3.37Å
111L96.5Very high96.3Very high112 Ų112103.4 Ų103.459%0.58652%0.522SS*.Hα-helixtrans-59.7-49.4177-179.260.5000111.1E107 G108 R113 I114 T115E107-L111 PolarHBondContact O-N 3.36Å; G108-L111 PolarHBondContact O-N 2.88Å; L111-R113 VanDerWaalsContact C-N 3.3Å; L111-R113 PolarHBondContact O-N 3.43Å; L111-I114 PolarHBondContact O-N 3.11Å; L111-I114 VanDerWaalsContact O-N 3.07Å; L111-T115 PolarHBondContact O-N 3.22Å; L111-T115 PolarHBondContact O-OG1 2.86Å; L111-T115 VanDerWaalsContact O-OG1 3.08Å
112A96.9Very high96.4Very high53 Ų53102.3 Ų102.344%0.43852%0.516SS..Hα-helixtrans-56.6-43.9177.600000112G108 A109 I114 T115 T116G108-A112 WeakPolarHBondContact O-CB 3.42Å; G108-A112 PolarHBondContact O-N 3.5Å; A109-A112 PolarHBondContact O-N 3.01Å; A112-I114 VanDerWaalsContact C-N 3.33Å; A112-I114 PolarHBondContact O-N 2.97Å; A112-T115 PolarHBondContact O-N 3.29Å; A112-T116 PolarHBondContact O-N 2.91Å; A112-T116 PolarHBondContact O-OG1 3.22Å; A112-T116 VanDerWaalsContact O-OG1 3.04Å
113R96.7Very high96.6Very high173 Ų17399.4 Ų99.465%0.65351%0.51SS*.Hα-helixtrans-62.2-39.1176.8-174.2179.4-176.9-176.50.6112.5A109 K110 L111 K117A109-R113 WeakPolarHBondContact O-CB 3.34Å; A109-R113 PolarHBondContact O-N 2.93Å; K110-R113 PolarHBondContact O-N 2.95Å; L111-R113 VanDerWaalsContact C-N 3.3Å; L111-R113 PolarHBondContact O-N 3.43Å; R113-K117 WeakPolarHBondContact O-CG 3.3Å; R113-K117 PolarHBondContact O-N 3.32Å
114I97.2Very high96.7Very high94 Ų94102.3 Ų102.348%0.48252%0.515SS..Hα-helixtrans-66.7-47.3176.3-68.4167.3000109.6K110 L111 A112 T116 K117 L118K110-I114 WeakPolarHBondContact O-CG1 3.32Å; K110-I114 PolarHBondContact O-N 3.37Å; L111-I114 PolarHBondContact O-N 3.11Å; L111-I114 VanDerWaalsContact O-N 3.07Å; A112-I114 VanDerWaalsContact C-N 3.33Å; A112-I114 PolarHBondContact O-N 2.97Å; I114-T116 PolarHBondContact O-N 2.55Å; I114-K117 WeakPolarHBondContact O-CB 3.47Å; I114-K117 PolarHBondContact O-N 2.94Å; I114-K117 VanDerWaalsContact O-N 3.17Å; I114-L118 HydrophobicContact CG2-CD1 3.93Å; I114-L118 HydrophobicContact CG2-CG 4.31Å; I114-L118 WeakPolarHBondContact O-CG 3.39Å; I114-L118 PolarHBondContact O-N 3.29Å
115T97.5Very high96.8Very high58 Ų5897.8 Ų97.836%0.35651%0.506SS..Hα-helixtrans-57.1-48177.8-55.70000111.7L111 A112 K117 L118 E119L111-T115 PolarHBondContact O-N 3.22Å; L111-T115 PolarHBondContact O-OG1 2.86Å; L111-T115 VanDerWaalsContact O-OG1 3.08Å; A112-T115 PolarHBondContact O-N 3.29Å; T115-K117 VanDerWaalsContact C-N 3.32Å; T115-K117 PolarHBondContact O-N 3.48Å; T115-L118 WeakPolarHBondContact O-CB 3.47Å; T115-L118 PolarHBondContact O-N 2.9Å; T115-E119 HydrophobicContact CG2-CG 4.44Å; T115-E119 WeakPolarHBondContact O-CG 3.24Å; T115-E119 PolarHBondContact O-N 2.99Å
116T97.6Very high96.9Very high87 Ų8795.6 Ų95.653%0.53450%0.497SS..Hα-helixtrans-60.5-38.8177.7-53.60000112.7A112 I114 E119 S120A112-T116 PolarHBondContact O-N 2.91Å; A112-T116 PolarHBondContact O-OG1 3.22Å; A112-T116 VanDerWaalsContact O-OG1 3.04Å; I114-T116 PolarHBondContact O-N 2.55Å; T116-E119 PolarHBondContact O-N 2.95Å; T116-S120 PolarHBondContact O-N 3.28Å
117K97.4Very high97Very high115 Ų115100.8 Ų100.850%0.551%0.508SS..Hα-helixtrans-66.7-37.5174.9-75.4178.1177.1-175.70112.3R113 I114 T115 S120 R121R113-K117 WeakPolarHBondContact O-CG 3.3Å; R113-K117 PolarHBondContact O-N 3.32Å; I114-K117 WeakPolarHBondContact O-CB 3.47Å; I114-K117 PolarHBondContact O-N 2.94Å; I114-K117 VanDerWaalsContact O-N 3.17Å; T115-K117 VanDerWaalsContact C-N 3.32Å; T115-K117 PolarHBondContact O-N 3.48Å; K117-S120 PolarHBondContact O-OG 3.33Å; K117-R121 WeakPolarHBondContact O-CG 3.44Å; K117-R121 PolarHBondContact O-N 3.4Å
118L97.7Very high97.1Very high108 Ų10899.1 Ų99.157%0.56551%0.507SS*.Hα-helixtrans-68.1-42.3176.8-70.2174.7000110.8I114 T115 S120 R121 L122I114-L118 HydrophobicContact CG2-CD1 3.93Å; I114-L118 HydrophobicContact CG2-CG 4.31Å; I114-L118 WeakPolarHBondContact O-CG 3.39Å; I114-L118 PolarHBondContact O-N 3.29Å; T115-L118 WeakPolarHBondContact O-CB 3.47Å; T115-L118 PolarHBondContact O-N 2.9Å; L118-S120 PolarHBondContact O-N 3.38Å; L118-R121 PolarHBondContact O-N 2.9Å; L118-L122 WeakPolarHBondContact O-CB 3.33Å; L118-L122 PolarHBondContact O-N 3.04Å
119E97.8Very high97.2Very high117 Ų117102.6 Ų102.655%0.54752%0.517SS..Hα-helixtrans-61.4-42.4175.5-72.5172.9164.300112.2T115 T116 R121 L122 A123T115-E119 HydrophobicContact CG2-CG 4.44Å; T115-E119 WeakPolarHBondContact O-CG 3.24Å; T115-E119 PolarHBondContact O-N 2.99Å; T116-E119 PolarHBondContact O-N 2.95Å; E119-R121 PolarHBondContact O-N 3.4Å; E119-L122 PolarHBondContact O-N 3.44Å; E119-A123 WeakPolarHBondContact O-CB 3.16Å; E119-A123 PolarHBondContact O-N 3.23Å
120S97.2Very high97.2Very high69 Ų69103.4 Ų103.448%0.48352%0.516SS..Hα-helixtrans-64.6-41.3178.376.10000112.2T116 K117 L118 A123 E124T116-S120 PolarHBondContact O-N 3.28Å; K117-S120 PolarHBondContact O-OG 3.33Å; L118-S120 PolarHBondContact O-N 3.38Å; S120-A123 PolarHBondContact O-N 2.9Å; S120-E124 PolarHBondContact O-N 3.24Å; S120-E124 VanDerWaalsContact O-N 3.07Å
121R97.3Very high97.3Very high177 Ų177100.7 Ų100.767%0.66851%0.513SS*.Hα-helixtrans-66.2-41.6175.1-73.8-178.4176.8-145.1-2111.5K117 L118 E119 A123 E124 V125K117-R121 WeakPolarHBondContact O-CG 3.44Å; K117-R121 PolarHBondContact O-N 3.4Å; L118-R121 PolarHBondContact O-N 2.9Å; E119-R121 PolarHBondContact O-N 3.4Å; R121-A123 VanDerWaalsContact C-N 3.29Å; R121-A123 PolarHBondContact O-N 3.46Å; R121-E124 WeakPolarHBondContact O-CB 3.28Å; R121-E124 PolarHBondContact O-N 2.91Å; R121-V125 WeakPolarHBondContact O-CG2 3.37Å; R121-V125 PolarHBondContact O-N 3.45Å
122L97.4Very high97.3Very high85 Ų8599.6 Ų99.645%0.44551%0.506SS..Hα-helixtrans-61-39.5175-177.163.5000111.4L118 E119 E124 V125 R126L118-L122 WeakPolarHBondContact O-CB 3.33Å; L118-L122 PolarHBondContact O-N 3.04Å; E119-L122 PolarHBondContact O-N 3.44Å; L122-E124 VanDerWaalsContact C-N 3.35Å; L122-V125 PolarHBondContact O-N 2.9Å; L122-R126 WeakPolarHBondContact O-CB 3.46Å; L122-R126 VanDerWaalsContact O-CG 3.26Å; L122-R126 WeakPolarHBondContact O-CG 3.2Å; L122-R126 PolarHBondContact O-N 3.31Å
123A97.2Very high97.2Very high43 Ų4399.1 Ų99.136%0.35550%0.503SS..Hα-helixtrans-66.7-33.5175.700000113E119 S120 R121 R127E119-A123 WeakPolarHBondContact O-CB 3.16Å; E119-A123 PolarHBondContact O-N 3.23Å; S120-A123 PolarHBondContact O-N 2.9Å; R121-A123 VanDerWaalsContact C-N 3.29Å; R121-A123 PolarHBondContact O-N 3.46Å; A123-R127 WeakPolarHBondContact O-CG 3.34Å; A123-R127 PolarHBondContact O-N 3.37Å; A123-R127 VanDerWaalsContact O-N 3.1Å; A123-R127 PolarHBondContact O-NE 2.96Å
124E97.3Very high97.2Very high112 Ų11296.6 Ų96.652%0.52350%0.498SS..Hα-helixtrans-68.8-48.4172.9-172.7175.5-172.100111.7S120 R121 L122 R126 R127 C128S120-E124 PolarHBondContact O-N 3.24Å; S120-E124 VanDerWaalsContact O-N 3.07Å; R121-E124 WeakPolarHBondContact O-CB 3.28Å; R121-E124 PolarHBondContact O-N 2.91Å; L122-E124 VanDerWaalsContact C-N 3.35Å; E124-R126 VanDerWaalsContact C-N 3.28Å; E124-R126 PolarHBondContact O-N 3.06Å; E124-R127 WeakPolarHBondContact O-CB 3.38Å; E124-R127 PolarHBondContact O-N 2.93Å; E124-C128 PolarHBondContact O-N 3.42Å; E124-C128 PolarHBondContact O-SG 3.04Å
125V97.4Very high97.1Very high80 Ų8096 Ų9649%0.48550%0.499SS..Hα-helixtrans-57-44175172.90000110.9R121 L122 R127 C128 L129R121-V125 WeakPolarHBondContact O-CG2 3.37Å; R121-V125 PolarHBondContact O-N 3.45Å; L122-V125 PolarHBondContact O-N 2.9Å; V125-R127 PolarHBondContact O-N 3.44Å; V125-C128 PolarHBondContact O-N 3.38Å; V125-L129 HydrophobicContact CG1-CD1 4.08Å; V125-L129 HydrophobicContact CG1-CG 4.45Å; V125-L129 WeakPolarHBondContact O-CG 3.35Å; V125-L129 PolarHBondContact O-N 3.5Å
126R97.1Very high97.1Very high160 Ų16098.9 Ų98.960%0.60451%0.508SS*.Hα-helixtrans-59.8-42.9175.2-77.1174.5176.9173.6-0.2112.2L122 E124 L129 T130L122-R126 WeakPolarHBondContact O-CB 3.46Å; L122-R126 VanDerWaalsContact O-CG 3.26Å; L122-R126 WeakPolarHBondContact O-CG 3.2Å; L122-R126 PolarHBondContact O-N 3.31Å; E124-R126 VanDerWaalsContact C-N 3.28Å; E124-R126 PolarHBondContact O-N 3.06Å; R126-L129 PolarHBondContact O-N 3.45Å; R126-T130 PolarHBondContact O-N 2.92Å; R126-T130 PolarHBondContact O-OG1 2.93Å; R126-T130 VanDerWaalsContact O-OG1 3.04Å
127R97.4Very high96.9Very high168 Ų168100.1 Ų100.163%0.63451%0.511SS*.Hα-helixtrans-62.6-44176.5-80.7-178.8-76151.5-3.9112.2A123 E124 V125 T130 A131A123-R127 WeakPolarHBondContact O-CG 3.34Å; A123-R127 PolarHBondContact O-N 3.37Å; A123-R127 VanDerWaalsContact O-N 3.1Å; A123-R127 PolarHBondContact O-NE 2.96Å; E124-R127 WeakPolarHBondContact O-CB 3.38Å; E124-R127 PolarHBondContact O-N 2.93Å; V125-R127 PolarHBondContact O-N 3.44Å; R127-T130 PolarHBondContact O-N 3.38Å; R127-A131 WeakPolarHBondContact O-CB 3.49Å; R127-A131 PolarHBondContact O-N 3.12Å
128C97Very high96.8Very high72 Ų7298.4 Ų98.449%0.48651%0.51SS..Hα-helixtrans-61.9-44.9176.4-66.60000111.8E124 V125 T130 A131 I132E124-C128 PolarHBondContact O-N 3.42Å; E124-C128 PolarHBondContact O-SG 3.04Å; V125-C128 PolarHBondContact O-N 3.38Å; C128-T130 PolarHBondContact O-N 3.49Å; C128-A131 PolarHBondContact O-N 3.49Å; C128-I132 VanDerWaalsContact O-CG1 3.3Å; C128-I132 WeakPolarHBondContact O-CG1 3.38Å; C128-I132 PolarHBondContact O-N 3.05Å
129L97.7Very high96.6Very high107 Ų10796.2 Ų96.256%0.5650%0.502SS*.Hα-helixtrans-61.9-41.3176.7-70.6174.4000112V125 R126 I132 A133V125-L129 HydrophobicContact CG1-CD1 4.08Å; V125-L129 HydrophobicContact CG1-CG 4.45Å; V125-L129 WeakPolarHBondContact O-CG 3.35Å; V125-L129 PolarHBondContact O-N 3.5Å; R126-L129 PolarHBondContact O-N 3.45Å; L129-I132 PolarHBondContact O-N 2.87Å; L129-A133 WeakPolarHBondContact O-CB 3.43Å; L129-A133 PolarHBondContact O-N 3.5Å
130T97.4Very high96.4Very high77 Ų7796.2 Ų96.247%0.47250%0.502SS..Hα-helixtrans-64.1-41.4175.2-58.50000112.1R126 R127 C128 A133 Q134R126-T130 PolarHBondContact O-N 2.92Å; R126-T130 PolarHBondContact O-OG1 2.93Å; R126-T130 VanDerWaalsContact O-OG1 3.04Å; R127-T130 PolarHBondContact O-N 3.38Å; C128-T130 PolarHBondContact O-N 3.49Å; T130-A133 PolarHBondContact O-N 3.3Å; T130-Q134 HydrophobicContact CG2-CG 4.47Å; T130-Q134 WeakPolarHBondContact O-CB 3.44Å; T130-Q134 WeakPolarHBondContact O-CG 3.45Å; T130-Q134 PolarHBondContact O-N 3.45Å
131A96.9Very high96.1Very high47 Ų4795.6 Ų95.639%0.38850%0.497SS..Hα-helixtrans-65.5-40.1177.200000112.2R127 C128 Q134 T135R127-A131 WeakPolarHBondContact O-CB 3.49Å; R127-A131 PolarHBondContact O-N 3.12Å; C128-A131 PolarHBondContact O-N 3.49Å; A131-Q134 PolarHBondContact O-N 3.18Å; A131-T135 WeakPolarHBondContact O-CB 3.1Å; A131-T135 PolarHBondContact O-N 2.83Å; A131-T135 PolarHBondContact O-OG1 3.49Å
132I96.5Very high95.9Very high89 Ų8992.1 Ų92.146%0.45649%0.491SS..Hα-helixtrans-61.4-48.2173.4-68.4165.3000110C128 L129 Q134 T135 Q136C128-I132 VanDerWaalsContact O-CG1 3.3Å; C128-I132 WeakPolarHBondContact O-CG1 3.38Å; C128-I132 PolarHBondContact O-N 3.05Å; L129-I132 PolarHBondContact O-N 2.87Å; I132-Q134 PolarHBondContact O-N 2.94Å; I132-T135 PolarHBondContact O-N 2.92Å; I132-Q136 HydrophobicContact CG2-CG 4.44Å; I132-Q136 WeakPolarHBondContact O-CG 3.18Å; I132-Q136 PolarHBondContact O-N 2.83Å
133A96.7Very high95.6Very high43 Ų4393.2 Ų93.236%0.35549%0.494SS..Hα-helixtrans-61.2-42.4178.700000112.3L129 T130 Q136 L137L129-A133 WeakPolarHBondContact O-CB 3.43Å; L129-A133 PolarHBondContact O-N 3.5Å; T130-A133 PolarHBondContact O-N 3.3Å; A133-Q136 PolarHBondContact O-N 3.45Å; A133-L137 WeakPolarHBondContact O-CG 3.24Å; A133-L137 PolarHBondContact O-N 3.36Å
134Q96.3Very high95.1Very high121 Ų12194.4 Ų94.457%0.56550%0.5SS*.Hα-helixtrans-63.4-44.3175-76.1175.1-1700111.8T130 A131 I132 Q136 L137 T138T130-Q134 HydrophobicContact CG2-CG 4.47Å; T130-Q134 WeakPolarHBondContact O-CB 3.44Å; T130-Q134 WeakPolarHBondContact O-CG 3.45Å; T130-Q134 PolarHBondContact O-N 3.45Å; A131-Q134 PolarHBondContact O-N 3.18Å; I132-Q134 PolarHBondContact O-N 2.94Å; Q134-Q136 VanDerWaalsContact C-N 3.33Å; Q134-Q136 PolarHBondContact O-N 3Å; Q134-L137 PolarHBondContact O-N 3.09Å; Q134-T138 WeakPolarHBondContact O-CG2 3.23Å; Q134-T138 PolarHBondContact O-N 3.34Å; Q134-T138 PolarHBondContact O-OG1 2.92Å
135T95.5Very high94.8Very high82 Ų8294 Ų9450%0.50350%0.498SS..Hα-helixtrans-60.5-45.5177.7-54.50000110.4A131 I132 L137 T138 T139A131-T135 WeakPolarHBondContact O-CB 3.1Å; A131-T135 PolarHBondContact O-N 2.83Å; A131-T135 PolarHBondContact O-OG1 3.49Å; I132-T135 PolarHBondContact O-N 2.92Å; T135-L137 PolarHBondContact O-N 3.07Å; T135-T138 WeakPolarHBondContact CA-OG1 3.37Å; T135-T138 PolarHBondContact O-N 2.75Å; T135-T138 PolarHBondContact O-OG1 3.44Å; T135-T139 WeakPolarHBondContact O-CB 3.31Å; T135-T139 PolarHBondContact O-N 3.48Å; T135-T139 PolarHBondContact O-OG1 2.91Å
136Q95.6Very high94.2Very high117 Ų11793.7 Ų93.755%0.54750%0.496SS..Hα-helixtrans-60.3-44.2176.6-72.8175.1-15.900112.4I132 A133 Q134 T139 Q140I132-Q136 HydrophobicContact CG2-CG 4.44Å; I132-Q136 WeakPolarHBondContact O-CG 3.18Å; I132-Q136 PolarHBondContact O-N 2.83Å; A133-Q136 PolarHBondContact O-N 3.45Å; Q134-Q136 VanDerWaalsContact C-N 3.33Å; Q134-Q136 PolarHBondContact O-N 3Å; Q136-T139 PolarHBondContact O-N 3.16Å; Q136-Q140 WeakPolarHBondContact O-CB 3.45Å; Q136-Q140 VanDerWaalsContact O-CG 3.3Å; Q136-Q140 WeakPolarHBondContact O-CG 3.38Å; Q136-Q140 PolarHBondContact O-N 3.05Å
137L95.2Very high93.6Very high113 Ų11393.5 Ų93.559%0.59250%0.497SS*.Hα-helixtrans-63.7-41.7175.6-72.1171.2000112.1A133 Q134 T135 Q140 S141A133-L137 WeakPolarHBondContact O-CG 3.24Å; A133-L137 PolarHBondContact O-N 3.36Å; Q134-L137 PolarHBondContact O-N 3.09Å; T135-L137 PolarHBondContact O-N 3.07Å; L137-Q140 PolarHBondContact O-N 3.41Å; L137-S141 WeakPolarHBondContact O-CB 3.14Å; L137-S141 PolarHBondContact O-N 3.16Å
138T94.7Very high92.9Very high79 Ų7994.8 Ų94.849%0.48550%0.501SS..Hα-helixtrans-66.3-40.9176.652.50000112.3Q134 T135 S141 L142Q134-T138 WeakPolarHBondContact O-CG2 3.23Å; Q134-T138 PolarHBondContact O-N 3.34Å; Q134-T138 PolarHBondContact O-OG1 2.92Å; T135-T138 WeakPolarHBondContact CA-OG1 3.37Å; T135-T138 PolarHBondContact O-N 2.75Å; T135-T138 PolarHBondContact O-OG1 3.44Å; T138-S141 PolarHBondContact O-N 3.46Å; T138-L142 WeakPolarHBondContact O-CB 3.41Å; T138-L142 WeakPolarHBondContact O-CG 3.15Å; T138-L142 PolarHBondContact O-N 3.39Å
139T93.3Very high92.1Very high63 Ų6399.1 Ų99.139%0.38752%0.515SS..Hα-helixtrans-62.1-45175.2-600000110.7T135 Q136 S141 L142 E143T135-T139 WeakPolarHBondContact O-CB 3.31Å; T135-T139 PolarHBondContact O-N 3.48Å; T135-T139 PolarHBondContact O-OG1 2.91Å; Q136-T139 PolarHBondContact O-N 3.16Å; T139-S141 PolarHBondContact O-N 3.38Å; T139-L142 PolarHBondContact O-N 2.93Å; T139-E143 HydrophobicContact CG2-CG 4.41Å; T139-E143 WeakPolarHBondContact O-CB 3.49Å; T139-E143 VanDerWaalsContact O-CG 3.32Å; T139-E143 WeakPolarHBondContact O-CG 3.31Å; T139-E143 PolarHBondContact O-N 3.33Å
140Q92.4Very high91.2Very high117 Ų117101.4 Ų101.455%0.54752%0.52SS..Hα-helixtrans-63.2-39.6176.2-74.1176-1.700112.7Q136 L137 S144Q136-Q140 WeakPolarHBondContact O-CB 3.45Å; Q136-Q140 VanDerWaalsContact O-CG 3.3Å; Q136-Q140 WeakPolarHBondContact O-CG 3.38Å; Q136-Q140 PolarHBondContact O-N 3.05Å; L137-Q140 PolarHBondContact O-N 3.41Å; Q140-S144 WeakPolarHBondContact O-CB 3.43Å; Q140-S144 PolarHBondContact O-N 3.48Å; Q140-S144 PolarHBondContact O-OG 3.35Å
141S92.3Very high90.2Very high55 Ų55106.3 Ų106.339%0.38553%0.532SS..Hα-helixtrans-62.6-48.4175.7-166.10000111L137 T138 T139 S144 E145L137-S141 WeakPolarHBondContact O-CB 3.14Å; L137-S141 PolarHBondContact O-N 3.16Å; T138-S141 PolarHBondContact O-N 3.46Å; T139-S141 PolarHBondContact O-N 3.38Å; S141-S144 PolarHBondContact O-N 3.22Å; S141-S144 PolarHBondContact O-OG 3.41Å; S141-E145 WeakPolarHBondContact O-CG 3.29Å; S141-E145 PolarHBondContact O-N 3.41Å
142L92.1Very high88.6Confident104 Ų104106.6 Ų106.655%0.54554%0.539SS..Hα-helixtrans-63.4-42.9177.6-72.3167.3000112T138 T139 S144 E145 V146T138-L142 WeakPolarHBondContact O-CB 3.41Å; T138-L142 WeakPolarHBondContact O-CG 3.15Å; T138-L142 PolarHBondContact O-N 3.39Å; T139-L142 PolarHBondContact O-N 2.93Å; L142-S144 VanDerWaalsContact C-N 3.31Å; L142-S144 PolarHBondContact O-N 3.2Å; L142-E145 PolarHBondContact O-N 3.4Å; L142-V146 WeakPolarHBondContact O-CB 3.25Å; L142-V146 VanDerWaalsContact O-CG2 3.22Å; L142-V146 WeakPolarHBondContact O-CG2 3.34Å; L142-V146 PolarHBondContact O-N 3.28Å
143E90.8Very high86.3Confident109 Ų109111.4 Ų111.451%0.50958%0.58SS.*Hα-helixtrans-58.7-45173.5-76.6175.1178.400110.6T139 E145 V146 Y147T139-E143 HydrophobicContact CG2-CG 4.41Å; T139-E143 WeakPolarHBondContact O-CB 3.49Å; T139-E143 VanDerWaalsContact O-CG 3.32Å; T139-E143 WeakPolarHBondContact O-CG 3.31Å; T139-E143 PolarHBondContact O-N 3.33Å; E143-E145 PolarHBondContact O-N 3.35Å; E143-V146 PolarHBondContact O-N 3.13Å; E143-Y147 WeakPolarHBondContact O-CB 3.07Å; E143-Y147 WeakPolarHBondContact O-CD2 3.04Å; E143-Y147 PolarHBondContact O-N 2.98Å
144S88.5Confident85.7Confident68 Ų68114.9 Ų114.948%0.47659%0.592SS.*Hα-helixtrans-64.9-36.3178.378.40000113.4Q140 S141 L142 R148Q140-S144 WeakPolarHBondContact O-CB 3.43Å; Q140-S144 PolarHBondContact O-N 3.48Å; Q140-S144 PolarHBondContact O-OG 3.35Å; S141-S144 PolarHBondContact O-N 3.22Å; S141-S144 PolarHBondContact O-OG 3.41Å; L142-S144 VanDerWaalsContact C-N 3.31Å; L142-S144 PolarHBondContact O-N 3.2Å; S144-R148 WeakPolarHBondContact O-CB 3.4Å; S144-R148 PolarHBondContact O-N 3.06Å
145E89.3Confident85.2Confident103 Ų103114.5 Ų114.548%0.48159%0.593SS.*Hα-helixtrans-68.8-45.8175.1-75.8173.5-174.500111.1S141 L142 E143 Y147 R148 E149S141-E145 WeakPolarHBondContact O-CG 3.29Å; S141-E145 PolarHBondContact O-N 3.41Å; L142-E145 PolarHBondContact O-N 3.4Å; E143-E145 PolarHBondContact O-N 3.35Å; E145-Y147 PolarHBondContact O-N 3Å; E145-R148 CarbonylContact O-C 3.51Å; E145-R148 WeakPolarHBondContact O-CB 3.01Å; E145-R148 PolarHBondContact O-N 2.98Å; E145-R148 VanDerWaalsContact O-N 3.11Å; E145-E149 PolarHBondContact O-N 2.75Å
146V86.1Confident84.6Confident73 Ų73116.3 Ų116.344%0.44260%0.598SS.*Hα-helixtrans-60.6-46.4175.1171.10000110.5L142 E143 R148 E149 F150L142-V146 WeakPolarHBondContact O-CB 3.25Å; L142-V146 VanDerWaalsContact O-CG2 3.22Å; L142-V146 WeakPolarHBondContact O-CG2 3.34Å; L142-V146 PolarHBondContact O-N 3.28Å; E143-V146 PolarHBondContact O-N 3.13Å; V146-R148 VanDerWaalsContact C-N 3.27Å; V146-R148 PolarHBondContact O-N 2.97Å; V146-E149 PolarHBondContact O-N 3.08Å; V146-F150 HydrophobicContact CG1-CD2 3.7Å; V146-F150 HydrophobicContact CG1-CE2 3.94Å; V146-F150 WeakPolarHBondContact O-CD2 3.38Å; V146-F150 PolarHBondContact O-N 3.13Å
147Y83.7Confident84Confident156 Ų156116.3 Ų116.361%0.61260%0.601SS**Hα-helixtrans-59.3-38.5174.5-88-70.9000112.1E143 E145 Y151E143-Y147 WeakPolarHBondContact O-CB 3.07Å; E143-Y147 WeakPolarHBondContact O-CD2 3.04Å; E143-Y147 PolarHBondContact O-N 2.98Å; E145-Y147 PolarHBondContact O-N 3Å; Y147-Y151 AromaticContact CD1-CD2 3.89Å; Y147-Y151 HydrophobicContact CD1-CD2 3.89Å; Y147-Y151 HydrophobicContact CD1-CE2 4.17Å; Y147-Y151 HydrophobicContact CE1-CD2 4.48Å; Y147-Y151 HydrophobicContact CE1-CE2 4.34Å; Y147-Y151 WeakPolarHBondContact O-CB 3.15Å; Y147-Y151 PolarHBondContact O-N 3.06Å
148R83.2Confident83.3Confident195 Ų195116.5 Ų116.574%0.73660%0.602SS**Hα-helixtrans-68.9-38.2176.6-172.7-174.5-87175.1-5.4112.4S144 E145 V146 G152S144-R148 WeakPolarHBondContact O-CB 3.4Å; S144-R148 PolarHBondContact O-N 3.06Å; E145-R148 CarbonylContact O-C 3.51Å; E145-R148 WeakPolarHBondContact O-CB 3.01Å; E145-R148 PolarHBondContact O-N 2.98Å; E145-R148 VanDerWaalsContact O-N 3.11Å; V146-R148 VanDerWaalsContact C-N 3.27Å; V146-R148 PolarHBondContact O-N 2.97Å; R148-G152 WeakPolarHBondContact O-CA 2.9Å; R148-G152 PolarHBondContact O-N 2.93Å
149E80.6Confident82.5Confident163 Ų163119 Ų11976%0.76261%0.609SS**Hα-helixtrans-70.4-38.9177.4-74.5-169.5163.400113E145 V146E145-E149 PolarHBondContact O-N 2.75Å; V146-E149 PolarHBondContact O-N 3.08Å
150F78.2Confident81.7Confident155 Ų155123 Ų12368%0.6863%0.625SS**Hα-helixtrans-85.9-28.2-177-79.7-83.4000114.4V146V146-F150 HydrophobicContact CG1-CD2 3.7Å; V146-F150 HydrophobicContact CG1-CE2 3.94Å; V146-F150 WeakPolarHBondContact O-CD2 3.38Å; V146-F150 PolarHBondContact O-N 3.13Å
151Y76.2Confident80.9Confident181 Ų181123.5 Ų123.571%0.7163%0.631SS**Hα-helixtrans-127.82.5-173.1-62-81.5000114.6Y147Y147-Y151 AromaticContact CD1-CD2 3.89Å; Y147-Y151 HydrophobicContact CD1-CD2 3.89Å; Y147-Y151 HydrophobicContact CD1-CE2 4.17Å; Y147-Y151 HydrophobicContact CE1-CD2 4.48Å; Y147-Y151 HydrophobicContact CE1-CE2 4.34Å; Y147-Y151 WeakPolarHBondContact O-CB 3.15Å; Y147-Y151 PolarHBondContact O-N 3.06Å
152G63.6Low80Confident52 Ų52129.2 Ų129.254%0.53665%0.652SS.*  trans-96.725.5-172.300000116.8R148R148-G152 WeakPolarHBondContact O-CA 2.9Å; R148-G152 PolarHBondContact O-N 2.93Å
153S47.1Very low78.9Confident191 Ų191131.5 Ų131.5100%1.33666%0.662SS**  trans-100.50163-68.70000110.5

Retrieved 153 of 153 residues in 79 ms (Link to these results)