A0A673YAL5_SALTR Loading...

Mediator of RNA polymerase II transcription subunit 11

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 pre-initiation complex with RNA polymerase II and the general transcription factors.

AlphaFold DB , UniProt , Accession A0A673YAL5, Species SALTR (Salmo trutta, Brown trout), Gene MED11, Length 114 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
1M60.9Low83.9Confident179 Ų17999 Ų9988%0.88250%0.501SS*.  0-64.70-83.4-171.517900113.8N3 D4 R5M1-N3 PolarHBondContact O-N 3.09Å; M1-D4 VanDerWaalsContact CA-OD2 3.27Å; M1-D4 WeakPolarHBondContact CA-OD2 3.43Å; M1-D4 PolarHBondContact N-OD2 3.43Å; M1-D4 PolarHBondContact O-N 2.94Å; M1-R5 PolarHBondContact O-N 3.43Å; M1-R5 VanDerWaalsContact O-N 3.12Å
2A71.6Confident85Confident76 Ų7691.3 Ų91.363%0.62846%0.462SS*.Hα-helixtrans-62.7-42.4178.900000112.5R5 L6A2-R5 PolarHBondContact O-N 3.23Å; A2-L6 WeakPolarHBondContact O-CG 3.49Å; A2-L6 PolarHBondContact O-N 3.25Å
3N76.9Confident85.9Confident126 Ų12694.6 Ų94.667%0.67448%0.475SS*.Hα-helixtrans-64.8-40.2177.2-156.6-16.1000112.2M1 R5 L6 R7M1-N3 PolarHBondContact O-N 3.09Å; N3-R5 VanDerWaalsContact C-N 3.31Å; N3-R5 PolarHBondContact O-N 3.41Å; N3-L6 PolarHBondContact O-N 2.86Å; N3-R7 PolarHBondContact O-N 2.67Å
4D81.6Confident86.6Confident86 Ų8695.4 Ų95.446%0.4648%0.482SS..Hα-helixtrans-64.6-35.1176.6-50-58.1000112.4M1 A8M1-D4 VanDerWaalsContact CA-OD2 3.27Å; M1-D4 WeakPolarHBondContact CA-OD2 3.43Å; M1-D4 PolarHBondContact N-OD2 3.43Å; M1-D4 PolarHBondContact O-N 2.94Å; D4-A8 PolarHBondContact O-N 3.07Å
5R83.9Confident87.3Confident72 Ų7291.9 Ų91.927%0.27246%0.463SS..Hα-helixtrans-72.3-37.5175.3-72.8-168.8178.3-89.4-4.5112.6M1 A2 N3 R7 A8 L9 Y64M1-R5 PolarHBondContact O-N 3.43Å; M1-R5 VanDerWaalsContact O-N 3.12Å; A2-R5 PolarHBondContact O-N 3.23Å; N3-R5 VanDerWaalsContact C-N 3.31Å; N3-R5 PolarHBondContact O-N 3.41Å; R5-R7 VanDerWaalsContact C-N 3.33Å; R5-A8 PolarHBondContact O-N 3.25Å; R5-L9 WeakPolarHBondContact O-CG 3.3Å; R5-L9 PolarHBondContact O-N 2.95Å; R5-Y64 VanDerWaalsContact CD-CE1 3.5Å; R5-Y64 VanDerWaalsContact NE-CE1 3.28Å; R5-Y64 VanDerWaalsContact NH1-CB 3.3Å; R5-Y64 VanDerWaalsContact NH1-CG 3.29Å
6L88.1Confident88Confident103 Ų10390.6 Ų90.654%0.53946%0.457SS..Hα-helixtrans-61.7-44.3172-73.8170.8000110.7A2 N3 A8 L9 E10A2-L6 WeakPolarHBondContact O-CG 3.49Å; A2-L6 PolarHBondContact O-N 3.25Å; N3-L6 PolarHBondContact O-N 2.86Å; L6-A8 VanDerWaalsContact C-N 3.33Å; L6-A8 PolarHBondContact O-N 3.32Å; L6-L9 WeakPolarHBondContact O-CB 3.45Å; L6-L9 PolarHBondContact O-N 2.9Å; L6-L9 VanDerWaalsContact O-N 3.09Å; L6-E10 PolarHBondContact O-N 3.34Å
7R90.1Very high88.5Confident143 Ų14388.6 Ų88.654%0.5446%0.458SS..Hα-helixtrans-60.7-40.3174.7-165.5179.573.8-161.1-2.2112.6N3 R5 L9 E10 E11N3-R7 PolarHBondContact O-N 2.67Å; R5-R7 VanDerWaalsContact C-N 3.33Å; R7-L9 VanDerWaalsContact C-N 3.28Å; R7-L9 PolarHBondContact O-N 3.39Å; R7-E10 WeakPolarHBondContact O-CB 3.37Å; R7-E10 PolarHBondContact O-N 2.93Å; R7-E11 PolarHBondContact O-N 3.37Å
8A90.1Very high89Confident16 Ų1686.3 Ų86.313%0.13245%0.448CS..Hα-helixtrans-62.4-3617500000112.3D4 R5 L6 E11 V12D4-A8 PolarHBondContact O-N 3.07Å; R5-A8 PolarHBondContact O-N 3.25Å; L6-A8 VanDerWaalsContact C-N 3.33Å; L6-A8 PolarHBondContact O-N 3.32Å; A8-E11 PolarHBondContact O-N 2.92Å; A8-V12 WeakPolarHBondContact O-CG2 3.37Å; A8-V12 PolarHBondContact O-N 2.92Å
9L92.2Very high89.5Confident67 Ų6783.1 Ų83.135%0.35143%0.431SS..Hα-helixtrans-69.4-38.7174.3-70.5172000112.3R5 L6 R7 E11 V12 E13 L58 Q61R5-L9 WeakPolarHBondContact O-CG 3.3Å; R5-L9 PolarHBondContact O-N 2.95Å; L6-L9 WeakPolarHBondContact O-CB 3.45Å; L6-L9 PolarHBondContact O-N 2.9Å; L6-L9 VanDerWaalsContact O-N 3.09Å; R7-L9 VanDerWaalsContact C-N 3.28Å; R7-L9 PolarHBondContact O-N 3.39Å; L9-E11 VanDerWaalsContact C-N 3.29Å; L9-E11 PolarHBondContact O-N 2.95Å; L9-V12 WeakPolarHBondContact O-CB 3.49Å; L9-V12 PolarHBondContact O-N 2.84Å; L9-V12 VanDerWaalsContact O-N 3.13Å; L9-E13 PolarHBondContact O-N 3.43Å; L9-L58 HydrophobicContact CD2-CD2 4.39Å; L9-Q61 HydrophobicContact CD2-CG 4.09Å
10E94.5Very high90Very high114 Ų11485.1 Ų85.153%0.53344%0.442SS..Hα-helixtrans-61-38.9171.6-69.7175.7177.200111.5L6 R7 V12 E13 N14L6-E10 PolarHBondContact O-N 3.34Å; R7-E10 WeakPolarHBondContact O-CB 3.37Å; R7-E10 PolarHBondContact O-N 2.93Å; E10-V12 VanDerWaalsContact C-N 3.33Å; E10-V12 PolarHBondContact O-N 2.97Å; E10-E13 PolarHBondContact O-N 3.26Å; E10-N14 PolarHBondContact O-N 2.93Å; E10-N14 PolarHBondContact O-ND2 3.34Å
11E93.6Very high90.4Very high107 Ų10786.6 Ų86.650%0.545%0.447SS..Hα-helixtrans-63.8-38.3173.4-73.9176-161.600111.9R7 A8 L9 N14 Q15R7-E11 PolarHBondContact O-N 3.37Å; A8-E11 PolarHBondContact O-N 2.92Å; L9-E11 VanDerWaalsContact C-N 3.29Å; L9-E11 PolarHBondContact O-N 2.95Å; E11-N14 PolarHBondContact O-N 2.96Å; E11-Q15 WeakPolarHBondContact O-CG 3.47Å; E11-Q15 PolarHBondContact O-N 2.91Å
12V96.4Very high92.1Very high6 Ų678.1 Ų78.14%0.03641%0.405CS..Hα-helixtrans-61.9-45.1173.1168.60000111.2A8 L9 E10 N14 Q15 I16 V54 E57 L58A8-V12 WeakPolarHBondContact O-CG2 3.37Å; A8-V12 PolarHBondContact O-N 2.92Å; L9-V12 WeakPolarHBondContact O-CB 3.49Å; L9-V12 PolarHBondContact O-N 2.84Å; L9-V12 VanDerWaalsContact O-N 3.13Å; E10-V12 VanDerWaalsContact C-N 3.33Å; E10-V12 PolarHBondContact O-N 2.97Å; V12-N14 VanDerWaalsContact C-N 3.33Å; V12-N14 PolarHBondContact O-N 3.46Å; V12-Q15 PolarHBondContact O-N 3.3Å; V12-Q15 VanDerWaalsContact O-N 3.11Å; V12-I16 HydrophobicContact CG1-CD1 4.05Å; V12-I16 WeakPolarHBondContact O-CG1 3.34Å; V12-I16 PolarHBondContact O-N 3.08Å; V12-V54 HydrophobicContact CG1-CG1 4.1Å; V12-V54 HydrophobicContact CG1-CG2 4.33Å; V12-E57 HydrophobicContact CG2-CB 3.71Å; V12-E57 HydrophobicContact CG2-CG 3.52Å; V12-L58 HydrophobicContact CG1-CD1 4.4Å; V12-L58 HydrophobicContact CG1-CD2 4.06Å; V12-L58 HydrophobicContact CG1-CG 4.07Å
13E96.8Very high93.4Very high135 Ų13576.1 Ų76.163%0.63139%0.389SS*.Hα-helixtrans-59.4-43.5177-72.7-179.1155.500111.9L9 E10 Q15 I16 A17L9-E13 PolarHBondContact O-N 3.43Å; E10-E13 PolarHBondContact O-N 3.26Å; E13-Q15 VanDerWaalsContact C-N 3.28Å; E13-Q15 PolarHBondContact O-N 3.44Å; E13-I16 WeakPolarHBondContact O-CB 3.22Å; E13-I16 PolarHBondContact O-N 3.49Å; E13-I16 VanDerWaalsContact O-N 3.15Å; E13-A17 PolarHBondContact O-N 3.41Å
14N96.4Very high94.4Very high106 Ų10672 Ų7257%0.56738%0.376SS*.Hα-helixtrans-62-35.9175.3-74.8-53.3000112.5E10 E11 V12 A17 T18E10-N14 PolarHBondContact O-N 2.93Å; E10-N14 PolarHBondContact O-ND2 3.34Å; E11-N14 PolarHBondContact O-N 2.96Å; V12-N14 VanDerWaalsContact C-N 3.33Å; V12-N14 PolarHBondContact O-N 3.46Å; N14-A17 PolarHBondContact O-N 3.2Å; N14-T18 PolarHBondContact O-N 2.8Å; N14-T18 VanDerWaalsContact O-N 3.09Å; N14-T18 PolarHBondContact O-OG1 3.01Å
15Q96.6Very high95.2Very high42 Ų4269.9 Ų69.920%0.19637%0.365CS..Hα-helixtrans-70.6-35.5174.4-70.5-161.44900112.6E11 V12 E13 A17 T18 I19 V54E11-Q15 WeakPolarHBondContact O-CG 3.47Å; E11-Q15 PolarHBondContact O-N 2.91Å; V12-Q15 PolarHBondContact O-N 3.3Å; V12-Q15 VanDerWaalsContact O-N 3.11Å; E13-Q15 VanDerWaalsContact C-N 3.28Å; E13-Q15 PolarHBondContact O-N 3.44Å; Q15-A17 VanDerWaalsContact C-N 3.34Å; Q15-A17 PolarHBondContact O-N 3.19Å; Q15-T18 WeakPolarHBondContact O-CB 3.46Å; Q15-T18 PolarHBondContact O-N 3.37Å; Q15-T18 VanDerWaalsContact O-N 3.14Å; Q15-I19 VanDerWaalsContact O-CG1 3.29Å; Q15-I19 WeakPolarHBondContact O-CG1 3.49Å; Q15-I19 PolarHBondContact O-N 3.09Å; Q15-V54 HydrophobicContact CB-CG2 3.63Å
16I97.8Very high95.9Very high72 Ų7267.8 Ų67.837%0.36936%0.359SS..Hα-helixtrans-61.9-43.2172.8-66.8167.9000110.8V12 E13 T18 I19 L20 V54V12-I16 HydrophobicContact CG1-CD1 4.05Å; V12-I16 WeakPolarHBondContact O-CG1 3.34Å; V12-I16 PolarHBondContact O-N 3.08Å; E13-I16 WeakPolarHBondContact O-CB 3.22Å; E13-I16 PolarHBondContact O-N 3.49Å; E13-I16 VanDerWaalsContact O-N 3.15Å; I16-T18 VanDerWaalsContact C-N 3.27Å; I16-T18 PolarHBondContact O-N 3.15Å; I16-I19 WeakPolarHBondContact O-CB 3.41Å; I16-I19 PolarHBondContact O-N 3.14Å; I16-L20 PolarHBondContact O-N 3.37Å; I16-V54 HydrophobicContact CD1-CG1 4.43Å; I16-V54 HydrophobicContact CG1-CG1 4.16Å; I16-V54 HydrophobicContact CG1-CG2 4.04Å
17A97.9Very high96.3Very high57 Ų5767.6 Ų67.647%0.47136%0.362SS..Hα-helixtrans-58.8-40.9173.400000111.8E13 N14 Q15 L20 Q21E13-A17 PolarHBondContact O-N 3.41Å; N14-A17 PolarHBondContact O-N 3.2Å; Q15-A17 VanDerWaalsContact C-N 3.34Å; Q15-A17 PolarHBondContact O-N 3.19Å; A17-L20 PolarHBondContact O-N 3.35Å; A17-Q21 PolarHBondContact O-N 3.02Å
18T97.5Very high96.7Very high46 Ų4666 Ų6628%0.28236%0.363SS..Hα-helixtrans-63.4-41.5175.8-58.20000112.2N14 Q15 I16 Q21 C22 Q46N14-T18 PolarHBondContact O-N 2.8Å; N14-T18 VanDerWaalsContact O-N 3.09Å; N14-T18 PolarHBondContact O-OG1 3.01Å; Q15-T18 WeakPolarHBondContact O-CB 3.46Å; Q15-T18 PolarHBondContact O-N 3.37Å; Q15-T18 VanDerWaalsContact O-N 3.14Å; I16-T18 VanDerWaalsContact C-N 3.27Å; I16-T18 PolarHBondContact O-N 3.15Å; T18-Q21 PolarHBondContact O-N 3.36Å; T18-C22 PolarHBondContact O-N 3.04Å; T18-C22 PolarHBondContact O-SG 2.88Å; T18-Q46 HydrophobicContact CG2-CG 4.29Å
19I98.6Very high97Very high25 Ų2566 Ų6613%0.12836%0.36CS..Hα-helixtrans-58.8-49.2175.8-69.5165.8000110.1Q15 I16 Q21 C22 A23 F47 S50 V51 V54Q15-I19 VanDerWaalsContact O-CG1 3.29Å; Q15-I19 WeakPolarHBondContact O-CG1 3.49Å; Q15-I19 PolarHBondContact O-N 3.09Å; I16-I19 WeakPolarHBondContact O-CB 3.41Å; I16-I19 PolarHBondContact O-N 3.14Å; I19-Q21 VanDerWaalsContact C-N 3.34Å; I19-Q21 PolarHBondContact O-N 2.98Å; I19-C22 PolarHBondContact O-N 3.19Å; I19-A23 WeakPolarHBondContact O-CB 3.27Å; I19-A23 PolarHBondContact O-N 3.17Å; I19-F47 HydrophobicContact CG2-CD2 3.83Å; I19-F47 HydrophobicContact CG2-CE2 3.42Å; I19-F47 VanDerWaalsContact CG2-CE2 3.42Å; I19-F47 HydrophobicContact CG2-CZ 4.16Å; I19-S50 VanDerWaalsContact CG1-CB 3.49Å; I19-V51 HydrophobicContact CD1-CB 4.36Å; I19-V51 HydrophobicContact CD1-CG2 3.75Å; I19-V51 HydrophobicContact CG1-CG2 3.98Å; I19-V51 HydrophobicContact CG2-CG2 4.04Å; I19-V54 HydrophobicContact CD1-CB 4.4Å; I19-V54 HydrophobicContact CD1-CG2 3.85Å
20L98.4Very high97.2Very high123 Ų12367.2 Ų67.264%0.64437%0.367SS*.Hα-helixtrans-61.5-42.6178.9-69.5173.6000111.8I16 A17 A23 G24I16-L20 PolarHBondContact O-N 3.37Å; A17-L20 PolarHBondContact O-N 3.35Å; L20-A23 PolarHBondContact O-N 3.32Å; L20-G24 PolarHBondContact O-N 2.84Å
21Q98.1Very high97.4Very high117 Ų11766 Ų6655%0.54737%0.371SS..Hα-helixtrans-63.1-45.8176.9-174.66257.300112A17 T18 I19 A23 G24 N25A17-Q21 PolarHBondContact O-N 3.02Å; T18-Q21 PolarHBondContact O-N 3.36Å; I19-Q21 VanDerWaalsContact C-N 3.34Å; I19-Q21 PolarHBondContact O-N 2.98Å; Q21-A23 VanDerWaalsContact C-N 3.35Å; Q21-A23 PolarHBondContact O-N 2.92Å; Q21-G24 PolarHBondContact O-N 3.18Å; Q21-N25 PolarHBondContact NE2-OD1 3.5Å; Q21-N25 WeakPolarHBondContact O-CB 3.35Å; Q21-N25 PolarHBondContact O-N 3.46Å; Q21-N25 PolarHBondContact O-ND2 3.34Å
22C98.1Very high97.5Very high2 Ų265.7 Ų65.71%0.01437%0.368CS..Hα-helixtrans-62.2-43.7178-65.60000111T18 I19 N25 I26 F47T18-C22 PolarHBondContact O-N 3.04Å; T18-C22 PolarHBondContact O-SG 2.88Å; I19-C22 PolarHBondContact O-N 3.19Å; C22-N25 PolarHBondContact O-N 2.92Å; C22-I26 WeakPolarHBondContact O-CD1 3.43Å; C22-I26 VanDerWaalsContact O-CG1 3.22Å; C22-I26 WeakPolarHBondContact O-CG1 3.28Å; C22-I26 PolarHBondContact O-N 3.28Å; C22-F47 HydrophobicContact CB-CB 3.89Å; C22-F47 HydrophobicContact CB-CD2 4.25Å
23A98.4Very high97.4Very high34 Ų3473.8 Ų73.828%0.28141%0.411SS..Hα-helixtrans-60.5-45.8176.400000111.9I19 L20 Q21 N25 I26 V27 F47I19-A23 WeakPolarHBondContact O-CB 3.27Å; I19-A23 PolarHBondContact O-N 3.17Å; L20-A23 PolarHBondContact O-N 3.32Å; Q21-A23 VanDerWaalsContact C-N 3.35Å; Q21-A23 PolarHBondContact O-N 2.92Å; A23-N25 VanDerWaalsContact C-N 3.34Å; A23-N25 PolarHBondContact O-N 3.49Å; A23-I26 PolarHBondContact O-N 2.8Å; A23-V27 WeakPolarHBondContact O-CG2 3.43Å; A23-V27 PolarHBondContact O-N 3.38Å; A23-F47 HydrophobicContact CB-CD2 4.23Å; A23-F47 HydrophobicContact CB-CE2 3.96Å
24G98.1Very high97.4Very high39 Ų3976.2 Ų76.240%0.40242%0.419SS..Hα-helixtrans-59.2-44.1175.800000112.4L20 Q21 V27 L28L20-G24 PolarHBondContact O-N 2.84Å; Q21-G24 PolarHBondContact O-N 3.18Å; G24-V27 PolarHBondContact O-N 2.95Å; G24-L28 VanDerWaalsContact O-CB 3.3Å; G24-L28 WeakPolarHBondContact O-CB 3.49Å; G24-L28 PolarHBondContact O-N 2.91Å
25N97.8Very high97.2Very high42 Ų4275.4 Ų75.423%0.22541%0.412CS..Hα-helixtrans-64.2-40177-70.3-13.5000112.6Q21 C22 A23 E29 F39 Q43Q21-N25 PolarHBondContact NE2-OD1 3.5Å; Q21-N25 WeakPolarHBondContact O-CB 3.35Å; Q21-N25 PolarHBondContact O-N 3.46Å; Q21-N25 PolarHBondContact O-ND2 3.34Å; C22-N25 PolarHBondContact O-N 2.92Å; A23-N25 VanDerWaalsContact C-N 3.34Å; A23-N25 PolarHBondContact O-N 3.49Å; N25-E29 WeakPolarHBondContact O-CB 3.4Å; N25-E29 PolarHBondContact O-N 2.99Å; N25-F39 HydrophobicContact CB-CE1 4.26Å; N25-F39 HydrophobicContact CB-CZ 4.04Å; N25-Q43 HydrophobicContact CB-CG 4.19Å; N25-Q43 VanDerWaalsContact CB-OE1 3.31Å; N25-Q43 PolarHBondContact ND2-OE1 3.24Å
26I98.1Very high97.2Very high28 Ų2877.5 Ų77.514%0.14442%0.424CS..Hα-helixtrans-63.2-50.5176.6-71162.6000110C22 A23 L28 E29 L30 L40 Q43 L44 F47C22-I26 WeakPolarHBondContact O-CD1 3.43Å; C22-I26 VanDerWaalsContact O-CG1 3.22Å; C22-I26 WeakPolarHBondContact O-CG1 3.28Å; C22-I26 PolarHBondContact O-N 3.28Å; A23-I26 PolarHBondContact O-N 2.8Å; I26-L28 VanDerWaalsContact C-N 3.34Å; I26-L28 PolarHBondContact O-N 3.25Å; I26-E29 PolarHBondContact O-N 3.13Å; I26-L30 HydrophobicContact CG2-CD1 3.82Å; I26-L30 HydrophobicContact CG2-CG 4.4Å; I26-L30 WeakPolarHBondContact O-CB 3.37Å; I26-L30 VanDerWaalsContact O-CG 3.27Å; I26-L30 WeakPolarHBondContact O-CG 3.26Å; I26-L30 PolarHBondContact O-N 3.06Å; I26-L40 HydrophobicContact CB-CD2 4.45Å; I26-L40 HydrophobicContact CG1-CD2 4.47Å; I26-L40 HydrophobicContact CG2-CD2 4.14Å; I26-Q43 HydrophobicContact CD1-CB 4.03Å; I26-Q43 HydrophobicContact CG1-CB 3.6Å; I26-L44 HydrophobicContact CD1-CD1 4.49Å; I26-F47 HydrophobicContact CD1-CB 4.39Å
27V97.9Very high97.1Very high99 Ų9977.2 Ų77.260%0.643%0.433SS*.Hα-helixtrans-61.2-43.5-179.7172.60000111.2A23 G24 L30 S31A23-V27 WeakPolarHBondContact O-CG2 3.43Å; A23-V27 PolarHBondContact O-N 3.38Å; G24-V27 PolarHBondContact O-N 2.95Å; V27-L30 PolarHBondContact O-N 3.41Å; V27-S31 PolarHBondContact O-N 3.2Å; V27-S31 VanDerWaalsContact O-N 3.07Å
28L97.4Very high97.1Very high109 Ų10978.9 Ų78.957%0.57144%0.441SS*.Hα-helixtrans-65.8-36.8178-177.366.3000112.7G24 I26 S31G24-L28 VanDerWaalsContact O-CB 3.3Å; G24-L28 WeakPolarHBondContact O-CB 3.49Å; G24-L28 PolarHBondContact O-N 2.91Å; I26-L28 VanDerWaalsContact C-N 3.34Å; I26-L28 PolarHBondContact O-N 3.25Å; L28-S31 PolarHBondContact O-OG 3.4Å
29E97.3Very high97.1Very high15 Ų1579 Ų797%0.0744%0.438CS..Hα-helixtrans-67.4-45.1175-173.863.8-151.900110.2N25 I26 S31 K32 H35 N36 F39 L40N25-E29 WeakPolarHBondContact O-CB 3.4Å; N25-E29 PolarHBondContact O-N 2.99Å; I26-E29 PolarHBondContact O-N 3.13Å; E29-S31 PolarHBondContact O-N 3.43Å; E29-K32 WeakPolarHBondContact O-CB 3.38Å; E29-K32 WeakPolarHBondContact O-CG 3.42Å; E29-K32 PolarHBondContact O-N 3.05Å; E29-K32 VanDerWaalsContact O-N 3.09Å; E29-K32 IonicContact OE1-NZ 3.85Å; E29-K32 WeakPolarHBondContact OE2-CE 3.29Å; E29-K32 IonicContact OE2-NZ 2.67Å; E29-K32 PolarHBondContact OE2-NZ 3.32Å; E29-H35 PolarHBondContact O-CD2 2.96Å; E29-H35 VanDerWaalsContact O-CD2 3.25Å; E29-N36 WeakPolarHBondContact OE1-CB 3.35Å; E29-N36 PolarHBondContact OE1-N 2.98Å; E29-F39 HydrophobicContact CB-CD1 4.13Å; E29-F39 HydrophobicContact CB-CE1 4.12Å; E29-F39 HydrophobicContact CG-CD1 3.92Å; E29-F39 HydrophobicContact CG-CE1 4.41Å; E29-L40 HydrophobicContact CB-CD2 3.79Å; E29-L40 HydrophobicContact CB-CG 4.38Å; E29-L40 HydrophobicContact CG-CD1 4.32Å; E29-L40 HydrophobicContact CG-CD2 3.82Å; E29-L40 HydrophobicContact CG-CG 3.83Å
30L96.6Very high97Very high94 Ų9479.1 Ų79.149%0.49244%0.439SS..Hα-helixtrans-61.6-24.4178.4-71174.6000113.8I26 V27 K32 H35 L40I26-L30 HydrophobicContact CG2-CD1 3.82Å; I26-L30 HydrophobicContact CG2-CG 4.4Å; I26-L30 WeakPolarHBondContact O-CB 3.37Å; I26-L30 VanDerWaalsContact O-CG 3.27Å; I26-L30 WeakPolarHBondContact O-CG 3.26Å; I26-L30 PolarHBondContact O-N 3.06Å; V27-L30 PolarHBondContact O-N 3.41Å; L30-K32 VanDerWaalsContact C-N 3.26Å; L30-K32 PolarHBondContact O-N 3.42Å; L30-H35 VanDerWaalsContact CA-CD2 3.49Å; L30-H35 WeakPolarHBondContact CA-CD2 3.43Å; L30-H35 PolarHBondContact O-NE2 3.11Å; L30-L40 HydrophobicContact CD2-CD1 3.89Å; L30-L40 HydrophobicContact CD2-CD2 4.34Å; L30-L40 HydrophobicContact CG-CD2 4.21Å
31S96.8Very high97Very high88 Ų8878.2 Ų78.262%0.61543%0.434SS*.THydrogen-bonded Turntrans-77.6-5.4176.468.70000114.4V27 L28 E29V27-S31 PolarHBondContact O-N 3.2Å; V27-S31 VanDerWaalsContact O-N 3.07Å; L28-S31 PolarHBondContact O-OG 3.4Å; E29-S31 PolarHBondContact O-N 3.43Å
32K97.2Very high97Very high100 Ų10080.1 Ų80.144%0.43544%0.436SS..SBendtrans-81.7153.4177.8-61.6174.8-176.3172.90110.9E29 L30 K34 H35E29-K32 WeakPolarHBondContact O-CB 3.38Å; E29-K32 WeakPolarHBondContact O-CG 3.42Å; E29-K32 PolarHBondContact O-N 3.05Å; E29-K32 VanDerWaalsContact O-N 3.09Å; E29-K32 IonicContact OE1-NZ 3.85Å; E29-K32 WeakPolarHBondContact OE2-CE 3.29Å; E29-K32 IonicContact OE2-NZ 2.67Å; E29-K32 PolarHBondContact OE2-NZ 3.32Å; L30-K32 VanDerWaalsContact C-N 3.26Å; L30-K32 PolarHBondContact O-N 3.42Å; K32-K34 VanDerWaalsContact C-N 3.25Å; K32-K34 PolarHBondContact O-N 3.5Å; K32-H35 PolarHBondContact O-CE1 3.01Å; K32-H35 PolarHBondContact O-NE2 2.94Å
33D94.3Very high97Very high176 Ų17680.4 Ų80.494%0.94144%0.438SS*.SBendtrans-65.6-30.1175-65.1-43000112.8
34K95.3Very high97Very high186 Ų18683.1 Ų83.181%0.80945%0.447SS*.SBendtrans-130.2114.7176.1-173.6179.2-179.7179.70110.3K32K32-K34 VanDerWaalsContact C-N 3.25Å; K32-K34 PolarHBondContact O-N 3.5Å
35H93.5Very high97Very high90 Ų9085.1 Ų85.142%0.41746%0.455SS..  trans-85.3144.7-177-43.591.5000112.7E29 L30 K32 L40E29-H35 PolarHBondContact O-CD2 2.96Å; E29-H35 VanDerWaalsContact O-CD2 3.25Å; L30-H35 VanDerWaalsContact CA-CD2 3.49Å; L30-H35 WeakPolarHBondContact CA-CD2 3.43Å; L30-H35 PolarHBondContact O-NE2 3.11Å; K32-H35 PolarHBondContact O-CE1 3.01Å; K32-H35 PolarHBondContact O-NE2 2.94Å; H35-L40 HydrophobicContact CB-CD1 4.13Å
36N96.6Very high97Very high85 Ų8587.4 Ų87.446%0.45546%0.464SS..  trans-90.898167.3-175-21.5000110.9E29 S38 F39 L40E29-N36 WeakPolarHBondContact OE1-CB 3.35Å; E29-N36 PolarHBondContact OE1-N 2.98Å; N36-S38 VanDerWaalsContact C-N 3.34Å; N36-S38 PolarHBondContact O-N 3.33Å; N36-S38 PolarHBondContact OD1-N 2.97Å; N36-F39 HydrophobicContact CB-CB 3.91Å; N36-F39 PolarHBondContact O-N 3.48Å; N36-F39 PolarHBondContact OD1-N 3.48Å; N36-F39 VanDerWaalsContact OD1-N 3.08Å; N36-L40 PolarHBondContact O-N 2.74Å
37A95.7Very high97Very high67 Ų6789 Ų8955%0.55447%0.47SS*.Hα-helixtrans-57-42.2-179.400000113.4F39 L40 D41A37-F39 VanDerWaalsContact C-N 3.33Å; A37-F39 PolarHBondContact O-N 3.39Å; A37-L40 PolarHBondContact O-N 3.16Å; A37-D41 PolarHBondContact O-N 3.43Å
38S97.5Very high97Very high92 Ų9287.9 Ų87.964%0.64346%0.464SS*.Hα-helixtrans-65.6-37179.7177.10000112.2N36 R42N36-S38 VanDerWaalsContact C-N 3.34Å; N36-S38 PolarHBondContact O-N 3.33Å; N36-S38 PolarHBondContact OD1-N 2.97Å; S38-R42 PolarHBondContact O-N 3.22Å
39F97.1Very high97Very high48 Ų4884.2 Ų84.221%0.21145%0.452CS..Hα-helixtrans-66.1-45.7173.9176.3-97.9000111.4N25 E29 N36 A37 R42 Q43N25-F39 HydrophobicContact CB-CE1 4.26Å; N25-F39 HydrophobicContact CB-CZ 4.04Å; E29-F39 HydrophobicContact CB-CD1 4.13Å; E29-F39 HydrophobicContact CB-CE1 4.12Å; E29-F39 HydrophobicContact CG-CD1 3.92Å; E29-F39 HydrophobicContact CG-CE1 4.41Å; N36-F39 HydrophobicContact CB-CB 3.91Å; N36-F39 PolarHBondContact O-N 3.48Å; N36-F39 PolarHBondContact OD1-N 3.48Å; N36-F39 VanDerWaalsContact OD1-N 3.08Å; A37-F39 VanDerWaalsContact C-N 3.33Å; A37-F39 PolarHBondContact O-N 3.39Å; F39-R42 PolarHBondContact O-N 3.03Å; F39-Q43 HydrophobicContact CD1-CG 4.07Å; F39-Q43 HydrophobicContact CD2-CG 4.39Å; F39-Q43 HydrophobicContact CE1-CG 3.62Å; F39-Q43 HydrophobicContact CE2-CG 3.95Å; F39-Q43 HydrophobicContact CG-CG 4.45Å; F39-Q43 HydrophobicContact CZ-CG 3.55Å; F39-Q43 WeakPolarHBondContact O-CG 3.33Å; F39-Q43 PolarHBondContact O-N 2.9Å
40L97.7Very high97.1Very high28 Ų2884 Ų8415%0.14745%0.452CS..Hα-helixtrans-58-48.2177.2-75.8173.5000111.7I26 E29 L30 H35 N36 A37 R42 Q43 L44I26-L40 HydrophobicContact CB-CD2 4.45Å; I26-L40 HydrophobicContact CG1-CD2 4.47Å; I26-L40 HydrophobicContact CG2-CD2 4.14Å; E29-L40 HydrophobicContact CB-CD2 3.79Å; E29-L40 HydrophobicContact CB-CG 4.38Å; E29-L40 HydrophobicContact CG-CD1 4.32Å; E29-L40 HydrophobicContact CG-CD2 3.82Å; E29-L40 HydrophobicContact CG-CG 3.83Å; L30-L40 HydrophobicContact CD2-CD1 3.89Å; L30-L40 HydrophobicContact CD2-CD2 4.34Å; L30-L40 HydrophobicContact CG-CD2 4.21Å; H35-L40 HydrophobicContact CB-CD1 4.13Å; N36-L40 PolarHBondContact O-N 2.74Å; A37-L40 PolarHBondContact O-N 3.16Å; L40-R42 VanDerWaalsContact C-N 3.29Å; L40-R42 PolarHBondContact O-N 3.02Å; L40-Q43 PolarHBondContact O-N 2.75Å; L40-L44 VanDerWaalsContact O-CB 3.28Å; L40-L44 WeakPolarHBondContact O-CB 3.5Å; L40-L44 PolarHBondContact O-N 2.93Å
41D97.8Very high97.1Very high103 Ų10382.1 Ų82.155%0.55144%0.444SS*.Hα-helixtrans-59.6-41.1179-78.8-14.1000112A37 L44 S45A37-D41 PolarHBondContact O-N 3.43Å; D41-L44 PolarHBondContact O-N 3.43Å; D41-S45 VanDerWaalsContact O-CB 3.32Å; D41-S45 WeakPolarHBondContact O-CB 3.37Å; D41-S45 PolarHBondContact O-N 2.85Å; D41-S45 PolarHBondContact O-OG 3.41Å
42R98.1Very high97.2Very high157 Ų15780.9 Ų80.959%0.59244%0.436SS*.Hα-helixtrans-65-46.7176.1-174.5177.966.6170.93.2111.7S38 F39 L40 L44 S45 Q46S38-R42 PolarHBondContact O-N 3.22Å; F39-R42 PolarHBondContact O-N 3.03Å; L40-R42 VanDerWaalsContact C-N 3.29Å; L40-R42 PolarHBondContact O-N 3.02Å; R42-L44 VanDerWaalsContact C-N 3.33Å; R42-S45 PolarHBondContact O-N 3.02Å; R42-Q46 WeakPolarHBondContact O-CB 3.49Å; R42-Q46 PolarHBondContact O-N 3.09Å
43Q98.2Very high97.1Very high9 Ų983.8 Ų83.84%0.04244%0.444CS..Hα-helixtrans-64.3-39.5178.4-67.7-59.4-78.200111.6N25 I26 F39 L40 Q46 F47N25-Q43 HydrophobicContact CB-CG 4.19Å; N25-Q43 VanDerWaalsContact CB-OE1 3.31Å; N25-Q43 PolarHBondContact ND2-OE1 3.24Å; I26-Q43 HydrophobicContact CD1-CB 4.03Å; I26-Q43 HydrophobicContact CG1-CB 3.6Å; F39-Q43 HydrophobicContact CD1-CG 4.07Å; F39-Q43 HydrophobicContact CD2-CG 4.39Å; F39-Q43 HydrophobicContact CE1-CG 3.62Å; F39-Q43 HydrophobicContact CE2-CG 3.95Å; F39-Q43 HydrophobicContact CG-CG 4.45Å; F39-Q43 HydrophobicContact CZ-CG 3.55Å; F39-Q43 WeakPolarHBondContact O-CG 3.33Å; F39-Q43 PolarHBondContact O-N 2.9Å; L40-Q43 PolarHBondContact O-N 2.75Å; Q43-Q46 PolarHBondContact O-N 3.4Å; Q43-F47 VanDerWaalsContact O-CB 3.26Å; Q43-F47 WeakPolarHBondContact O-CB 3.32Å; Q43-F47 PolarHBondContact O-N 2.93Å
44L97.9Very high97.3Very high91 Ų9176.2 Ų76.248%0.47640%0.404SS..Hα-helixtrans-67.2-40.4177.9-174.664.1000111.8I26 L40 D41 R42 Q46 F47 T48I26-L44 HydrophobicContact CD1-CD1 4.49Å; L40-L44 VanDerWaalsContact O-CB 3.28Å; L40-L44 WeakPolarHBondContact O-CB 3.5Å; L40-L44 PolarHBondContact O-N 2.93Å; D41-L44 PolarHBondContact O-N 3.43Å; R42-L44 VanDerWaalsContact C-N 3.33Å; L44-Q46 VanDerWaalsContact C-N 3.35Å; L44-F47 PolarHBondContact O-N 3.03Å; L44-T48 HydrophobicContact CD1-CG2 4.35Å; L44-T48 WeakPolarHBondContact O-CB 3.49Å; L44-T48 WeakPolarHBondContact O-CG2 3.49Å; L44-T48 PolarHBondContact O-N 3.4Å; L44-T48 PolarHBondContact O-OG1 3Å
45S98.1Very high97.4Very high80 Ų8073.4 Ų73.456%0.55939%0.394SS*.Hα-helixtrans-63.3-42.2175-600000111.4D41 R42 T48 G49D41-S45 VanDerWaalsContact O-CB 3.32Å; D41-S45 WeakPolarHBondContact O-CB 3.37Å; D41-S45 PolarHBondContact O-N 2.85Å; D41-S45 PolarHBondContact O-OG 3.41Å; R42-S45 PolarHBondContact O-N 3.02Å; S45-T48 PolarHBondContact O-OG1 3.07Å; S45-G49 PolarHBondContact O-N 3.31Å
46Q97.9Very high97.5Very high91 Ų9173.3 Ų73.343%0.42540%0.4SS..Hα-helixtrans-68.4-40.8176.8-172.4174.48.200112T18 R42 Q43 L44 S50T18-Q46 HydrophobicContact CG2-CG 4.29Å; R42-Q46 WeakPolarHBondContact O-CB 3.49Å; R42-Q46 PolarHBondContact O-N 3.09Å; Q43-Q46 PolarHBondContact O-N 3.4Å; L44-Q46 VanDerWaalsContact C-N 3.35Å; Q46-S50 WeakPolarHBondContact O-CB 3.46Å; Q46-S50 PolarHBondContact O-N 2.94Å; Q46-S50 PolarHBondContact O-OG 3.43Å
47F98.5Very high97.4Very high62 Ų6272.2 Ų72.227%0.27239%0.392SS..Hα-helixtrans-59.1-55.8176176.2-90000110.9I19 C22 A23 I26 Q43 L44 G49 S50 V51I19-F47 HydrophobicContact CG2-CD2 3.83Å; I19-F47 HydrophobicContact CG2-CE2 3.42Å; I19-F47 VanDerWaalsContact CG2-CE2 3.42Å; I19-F47 HydrophobicContact CG2-CZ 4.16Å; C22-F47 HydrophobicContact CB-CB 3.89Å; C22-F47 HydrophobicContact CB-CD2 4.25Å; A23-F47 HydrophobicContact CB-CD2 4.23Å; A23-F47 HydrophobicContact CB-CE2 3.96Å; I26-F47 HydrophobicContact CD1-CB 4.39Å; Q43-F47 VanDerWaalsContact O-CB 3.26Å; Q43-F47 WeakPolarHBondContact O-CB 3.32Å; Q43-F47 PolarHBondContact O-N 2.93Å; L44-F47 PolarHBondContact O-N 3.03Å; F47-G49 PolarHBondContact O-N 3.38Å; F47-S50 PolarHBondContact O-N 3.3Å; F47-V51 HydrophobicContact CD1-CG2 4.25Å; F47-V51 HydrophobicContact CE1-CG2 3.91Å; F47-V51 HydrophobicContact CE2-CG2 4.45Å; F47-V51 HydrophobicContact CZ-CG2 4.02Å; F47-V51 WeakPolarHBondContact O-CG2 3.42Å; F47-V51 PolarHBondContact O-N 2.97Å
48T98.1Very high97.4Very high75 Ų7572.3 Ų72.346%0.4638%0.383SS..Hα-helixtrans-63.6-40.9-177.851.50000111.9L44 S45 S50 V51 S52L44-T48 HydrophobicContact CD1-CG2 4.35Å; L44-T48 WeakPolarHBondContact O-CB 3.49Å; L44-T48 WeakPolarHBondContact O-CG2 3.49Å; L44-T48 PolarHBondContact O-N 3.4Å; L44-T48 PolarHBondContact O-OG1 3Å; S45-T48 PolarHBondContact O-OG1 3.07Å; T48-S50 PolarHBondContact O-N 3.46Å; T48-V51 PolarHBondContact O-N 2.87Å; T48-S52 WeakPolarHBondContact O-CB 3.44Å; T48-S52 PolarHBondContact O-N 3.23Å
49G97.9Very high97.3Very high32 Ų3270.2 Ų70.233%0.3337%0.368SS..Hα-helixtrans-61.6-41.4174.900000113.2S45 F47 R53S45-G49 PolarHBondContact O-N 3.31Å; F47-G49 PolarHBondContact O-N 3.38Å; G49-R53 WeakPolarHBondContact O-CG 3.32Å; G49-R53 PolarHBondContact O-N 2.97Å
50S97.6Very high97.1Very high10 Ų1070.5 Ų70.57%0.0738%0.376CS..Hα-helixtrans-70.2-40.7178.3-540000111.5I19 Q46 F47 T48 S52 R53 V54I19-S50 VanDerWaalsContact CG1-CB 3.49Å; Q46-S50 WeakPolarHBondContact O-CB 3.46Å; Q46-S50 PolarHBondContact O-N 2.94Å; Q46-S50 PolarHBondContact O-OG 3.43Å; F47-S50 PolarHBondContact O-N 3.3Å; T48-S50 PolarHBondContact O-N 3.46Å; S50-S52 PolarHBondContact O-N 3.26Å; S50-R53 PolarHBondContact O-N 3.17Å; S50-V54 WeakPolarHBondContact O-CG2 3.29Å; S50-V54 PolarHBondContact O-N 3.36Å
51V98.3Very high96.7Very high54 Ų5470 Ų7033%0.32737%0.373SS..Hα-helixtrans-58.4-48.6174.5170.40000111I19 F47 T48 R53 V54 E55I19-V51 HydrophobicContact CD1-CB 4.36Å; I19-V51 HydrophobicContact CD1-CG2 3.75Å; I19-V51 HydrophobicContact CG1-CG2 3.98Å; I19-V51 HydrophobicContact CG2-CG2 4.04Å; F47-V51 HydrophobicContact CD1-CG2 4.25Å; F47-V51 HydrophobicContact CE1-CG2 3.91Å; F47-V51 HydrophobicContact CE2-CG2 4.45Å; F47-V51 HydrophobicContact CZ-CG2 4.02Å; F47-V51 WeakPolarHBondContact O-CG2 3.42Å; F47-V51 PolarHBondContact O-N 2.97Å; T48-V51 PolarHBondContact O-N 2.87Å; V51-R53 VanDerWaalsContact C-N 3.3Å; V51-R53 PolarHBondContact O-N 2.96Å; V51-V54 PolarHBondContact O-N 2.93Å; V51-E55 WeakPolarHBondContact O-CB 3.31Å; V51-E55 PolarHBondContact O-N 3.36Å
52S97.6Very high96.3Very high63 Ų6370.1 Ų70.144%0.44137%0.373SS..Hα-helixtrans-61-38.7-179.8177.20000112.7T48 S50 T56T48-S52 WeakPolarHBondContact O-CB 3.44Å; T48-S52 PolarHBondContact O-N 3.23Å; S50-S52 PolarHBondContact O-N 3.26Å; S52-T56 WeakPolarHBondContact O-CB 3.36Å; S52-T56 PolarHBondContact O-N 3Å; S52-T56 PolarHBondContact O-OG1 3.41Å
53R96.1Very high95.9Very high161 Ų16169.8 Ų69.861%0.60838%0.376SS*.Hα-helixtrans-67-46.1175.8-77174.6-179.3-176.20.8112.1G49 S50 V51 E55 T56 E57G49-R53 WeakPolarHBondContact O-CG 3.32Å; G49-R53 PolarHBondContact O-N 2.97Å; S50-R53 PolarHBondContact O-N 3.17Å; V51-R53 VanDerWaalsContact C-N 3.3Å; V51-R53 PolarHBondContact O-N 2.96Å; R53-E55 VanDerWaalsContact C-N 3.32Å; R53-E55 PolarHBondContact O-N 3.48Å; R53-T56 PolarHBondContact O-N 2.99Å; R53-E57 WeakPolarHBondContact O-CB 3.48Å; R53-E57 PolarHBondContact O-N 2.74Å
54V97.8Very high95.2Very high16 Ų1672.9 Ų72.910%0.09739%0.387CS..Hα-helixtrans-58-46.5175.8167.80000110.6V12 Q15 I16 I19 S50 V51 T56 E57 L58V12-V54 HydrophobicContact CG1-CG1 4.1Å; V12-V54 HydrophobicContact CG1-CG2 4.33Å; Q15-V54 HydrophobicContact CB-CG2 3.63Å; I16-V54 HydrophobicContact CD1-CG1 4.43Å; I16-V54 HydrophobicContact CG1-CG1 4.16Å; I16-V54 HydrophobicContact CG1-CG2 4.04Å; I19-V54 HydrophobicContact CD1-CB 4.4Å; I19-V54 HydrophobicContact CD1-CG2 3.85Å; S50-V54 WeakPolarHBondContact O-CG2 3.29Å; S50-V54 PolarHBondContact O-N 3.36Å; V51-V54 PolarHBondContact O-N 2.93Å; V54-T56 PolarHBondContact O-N 3.38Å; V54-E57 PolarHBondContact O-N 3.49Å; V54-L58 HydrophobicContact CG1-CD1 3.69Å; V54-L58 HydrophobicContact CG1-CG 4.32Å; V54-L58 VanDerWaalsContact O-CB 3.31Å; V54-L58 WeakPolarHBondContact O-CB 3.38Å; V54-L58 VanDerWaalsContact O-CG 3.32Å; V54-L58 WeakPolarHBondContact O-CG 3.39Å; V54-L58 PolarHBondContact O-N 3.38Å
55E97.4Very high94.5Very high127 Ų12773.5 Ų73.559%0.59339%0.39SS*.Hα-helixtrans-59.9-46.7177.7-176.2-176.7178.600112.1V51 R53 S59V51-E55 WeakPolarHBondContact O-CB 3.31Å; V51-E55 PolarHBondContact O-N 3.36Å; R53-E55 VanDerWaalsContact C-N 3.32Å; R53-E55 PolarHBondContact O-N 3.48Å; E55-S59 WeakPolarHBondContact O-CB 3.2Å; E55-S59 PolarHBondContact O-N 3.31Å; E55-S59 PolarHBondContact O-OG 2.78Å
56T96Very high93.9Very high88 Ų8873.3 Ų73.354%0.5439%0.386SS..Hα-helixtrans-63.2-47.5-179-59.70000111.3S52 R53 V54 S59 S60S52-T56 WeakPolarHBondContact O-CB 3.36Å; S52-T56 PolarHBondContact O-N 3Å; S52-T56 PolarHBondContact O-OG1 3.41Å; R53-T56 PolarHBondContact O-N 2.99Å; V54-T56 PolarHBondContact O-N 3.38Å; T56-S59 PolarHBondContact O-N 3.12Å; T56-S60 PolarHBondContact O-N 2.8Å
57E95Very high93Very high63 Ų6374.4 Ų74.429%0.29439%0.391SS..Hα-helixtrans-70.6-45.2-176.1-167.955.8-142.600111.2V12 R53 V54 S59 S60 Q61V12-E57 HydrophobicContact CG2-CB 3.71Å; V12-E57 HydrophobicContact CG2-CG 3.52Å; R53-E57 WeakPolarHBondContact O-CB 3.48Å; R53-E57 PolarHBondContact O-N 2.74Å; V54-E57 PolarHBondContact O-N 3.49Å; E57-S59 VanDerWaalsContact C-N 3.3Å; E57-S59 PolarHBondContact O-N 2.96Å; E57-S60 VanDerWaalsContact O-CB 3.31Å; E57-S60 WeakPolarHBondContact O-CB 3.03Å; E57-S60 PolarHBondContact O-N 3.41Å; E57-S60 VanDerWaalsContact O-N 3.09Å; E57-Q61 WeakPolarHBondContact O-CG 3.41Å; E57-Q61 PolarHBondContact O-N 3.49Å; E57-Q61 PolarHBondContact OE1-NE2 2.85Å
58L95.5Very high91.8Very high68 Ų6873.7 Ų73.736%0.35639%0.392SS..Hα-helixtrans-60.2-41.1174.7-72.8177.1000111.7L9 V12 V54 S60 Q61 I62L9-L58 HydrophobicContact CD2-CD2 4.39Å; V12-L58 HydrophobicContact CG1-CD1 4.4Å; V12-L58 HydrophobicContact CG1-CD2 4.06Å; V12-L58 HydrophobicContact CG1-CG 4.07Å; V54-L58 HydrophobicContact CG1-CD1 3.69Å; V54-L58 HydrophobicContact CG1-CG 4.32Å; V54-L58 VanDerWaalsContact O-CB 3.31Å; V54-L58 WeakPolarHBondContact O-CB 3.38Å; V54-L58 VanDerWaalsContact O-CG 3.32Å; V54-L58 WeakPolarHBondContact O-CG 3.39Å; V54-L58 PolarHBondContact O-N 3.38Å; L58-S60 VanDerWaalsContact C-N 3.3Å; L58-S60 PolarHBondContact O-N 3.26Å; L58-Q61 PolarHBondContact O-N 2.94Å; L58-I62 VanDerWaalsContact O-CG1 3.29Å; L58-I62 WeakPolarHBondContact O-CG1 3.48Å; L58-I62 PolarHBondContact O-N 3.48Å
59S95.1Very high90.5Very high49 Ų4974.2 Ų74.234%0.34340%0.404SS..Hα-helixtrans-60.7-40.1174.9-65.50000112.2E55 T56 E57 K63E55-S59 WeakPolarHBondContact O-CB 3.2Å; E55-S59 PolarHBondContact O-N 3.31Å; E55-S59 PolarHBondContact O-OG 2.78Å; T56-S59 PolarHBondContact O-N 3.12Å; E57-S59 VanDerWaalsContact C-N 3.3Å; E57-S59 PolarHBondContact O-N 2.96Å; S59-K63 WeakPolarHBondContact O-CB 3.5Å; S59-K63 VanDerWaalsContact O-CG 3.26Å; S59-K63 WeakPolarHBondContact O-CG 3.43Å; S59-K63 PolarHBondContact O-N 3.35Å
60S91.8Very high89Confident54 Ų5477.5 Ų77.538%0.37842%0.417SS..Hα-helixtrans-62.6-45.4174.6-177.70000111.7T56 E57 L58 K63 Y64T56-S60 PolarHBondContact O-N 2.8Å; E57-S60 VanDerWaalsContact O-CB 3.31Å; E57-S60 WeakPolarHBondContact O-CB 3.03Å; E57-S60 PolarHBondContact O-N 3.41Å; E57-S60 VanDerWaalsContact O-N 3.09Å; L58-S60 VanDerWaalsContact C-N 3.3Å; L58-S60 PolarHBondContact O-N 3.26Å; S60-K63 PolarHBondContact O-N 3.32Å; S60-Y64 PolarHBondContact O-N 3.37Å
61Q89.3Confident87Confident16 Ų1679.8 Ų79.88%0.07544%0.443CS..Hα-helixtrans-65.2-41.4177.9-61.4-59.3-2200112L9 E57 L58 Y64 L65L9-Q61 HydrophobicContact CD2-CG 4.09Å; E57-Q61 WeakPolarHBondContact O-CG 3.41Å; E57-Q61 PolarHBondContact O-N 3.49Å; E57-Q61 PolarHBondContact OE1-NE2 2.85Å; L58-Q61 PolarHBondContact O-N 2.94Å; Q61-Y64 PolarHBondContact O-N 2.97Å; Q61-L65 WeakPolarHBondContact O-CB 3.45Å; Q61-L65 WeakPolarHBondContact O-CG 3.44Å; Q61-L65 PolarHBondContact O-N 3.42Å
62I90.8Very high84.9Confident107 Ų10782.7 Ų82.755%0.54945%0.453SS..Hα-helixtrans-62-45.7175.1-69.4165.5000110.9L58 Y64 L65 T66L58-I62 VanDerWaalsContact O-CG1 3.29Å; L58-I62 WeakPolarHBondContact O-CG1 3.48Å; L58-I62 PolarHBondContact O-N 3.48Å; I62-Y64 VanDerWaalsContact C-N 3.32Å; I62-Y64 PolarHBondContact O-N 2.94Å; I62-L65 PolarHBondContact O-N 2.75Å; I62-T66 WeakPolarHBondContact O-CB 3.26Å; I62-T66 PolarHBondContact O-N 3.17Å; I62-T66 PolarHBondContact O-OG1 2.89Å
63K88.1Confident82.5Confident150 Ų15084.7 Ų84.765%0.65247%0.465SS*.Hα-helixtrans-59-44.7176.3-76.5171.7-176175.70111.3S59 S60 T66 Q67S59-K63 WeakPolarHBondContact O-CB 3.5Å; S59-K63 VanDerWaalsContact O-CG 3.26Å; S59-K63 WeakPolarHBondContact O-CG 3.43Å; S59-K63 PolarHBondContact O-N 3.35Å; S60-K63 PolarHBondContact O-N 3.32Å; K63-T66 PolarHBondContact O-N 3.44Å; K63-Q67 WeakPolarHBondContact O-CB 3.35Å; K63-Q67 PolarHBondContact O-N 2.95Å
64Y85.1Confident80.7Confident73 Ų7382.1 Ų82.129%0.28646%0.459SS..Hα-helixtrans-62.4-50.7176.3172.1-104.4000112.2R5 S60 Q61 I62 T66 Q67 V68R5-Y64 VanDerWaalsContact CD-CE1 3.5Å; R5-Y64 VanDerWaalsContact NE-CE1 3.28Å; R5-Y64 VanDerWaalsContact NH1-CB 3.3Å; R5-Y64 VanDerWaalsContact NH1-CG 3.29Å; S60-Y64 PolarHBondContact O-N 3.37Å; Q61-Y64 PolarHBondContact O-N 2.97Å; I62-Y64 VanDerWaalsContact C-N 3.32Å; I62-Y64 PolarHBondContact O-N 2.94Å; Y64-T66 PolarHBondContact O-N 3.09Å; Y64-Q67 WeakPolarHBondContact O-CB 3.27Å; Y64-Q67 PolarHBondContact O-N 3Å; Y64-V68 HydrophobicContact CD1-CG2 4.42Å; Y64-V68 HydrophobicContact CD2-CG1 3.96Å; Y64-V68 HydrophobicContact CE1-CG1 4.12Å; Y64-V68 HydrophobicContact CE1-CG2 4.11Å; Y64-V68 HydrophobicContact CE2-CG1 3.44Å; Y64-V68 VanDerWaalsContact CE2-CG1 3.44Å; Y64-V68 WeakPolarHBondContact O-CG2 3.42Å; Y64-V68 PolarHBondContact O-N 3.32Å
65L83.6Confident78.5Confident104 Ų10491.2 Ų91.255%0.54550%0.5SS..Hα-helixtrans-56.8-42.4177.8-77.4172.2000111Q61 I62 Q67 V68 A69Q61-L65 WeakPolarHBondContact O-CB 3.45Å; Q61-L65 WeakPolarHBondContact O-CG 3.44Å; Q61-L65 PolarHBondContact O-N 3.42Å; I62-L65 PolarHBondContact O-N 2.75Å; L65-Q67 PolarHBondContact O-N 2.86Å; L65-V68 WeakPolarHBondContact O-CG2 3.41Å; L65-V68 PolarHBondContact O-N 2.7Å; L65-A69 WeakPolarHBondContact O-CB 3.31Å; L65-A69 PolarHBondContact O-N 3.03Å
66T83.4Confident76.5Confident77 Ų7788.4 Ų88.447%0.47251%0.506SS..Hα-helixtrans-59.5-46.8174.3-55.60000111I62 K63 Y64 T70I62-T66 WeakPolarHBondContact O-CB 3.26Å; I62-T66 PolarHBondContact O-N 3.17Å; I62-T66 PolarHBondContact O-OG1 2.89Å; K63-T66 PolarHBondContact O-N 3.44Å; Y64-T66 PolarHBondContact O-N 3.09Å; T66-T70 HydrophobicContact CG2-CG2 4.34Å; T66-T70 WeakPolarHBondContact O-CB 3.49Å; T66-T70 WeakPolarHBondContact O-CG2 3.21Å; T66-T70 PolarHBondContact O-N 2.94Å; T66-T70 VanDerWaalsContact O-N 3.07Å; T66-T70 PolarHBondContact O-OG1 2.66Å
67Q79.1Confident74.7Confident114 Ų11485.1 Ų85.153%0.53349%0.486SS..Hα-helixtrans-62.1-45.1178.8-174.4179.8-3.800112.2K63 Y64 L65 T70 Q72K63-Q67 WeakPolarHBondContact O-CB 3.35Å; K63-Q67 PolarHBondContact O-N 2.95Å; Y64-Q67 WeakPolarHBondContact O-CB 3.27Å; Y64-Q67 PolarHBondContact O-N 3Å; L65-Q67 PolarHBondContact O-N 2.86Å; Q67-T70 PolarHBondContact O-OG1 3.42Å; Q67-Q72 HydrophobicContact CG-CB 3.99Å; Q67-Q72 HydrophobicContact CG-CG 4.17Å; Q67-Q72 WeakPolarHBondContact O-CB 3.37Å; Q67-Q72 PolarHBondContact O-N 3.46Å
68V74.2Confident73.1Confident46 Ų4686.7 Ų86.728%0.27950%0.5SS..Hα-helixtrans-78.9-31.9-177.8-590000113.2Y64 L65Y64-V68 HydrophobicContact CD1-CG2 4.42Å; Y64-V68 HydrophobicContact CD2-CG1 3.96Å; Y64-V68 HydrophobicContact CE1-CG1 4.12Å; Y64-V68 HydrophobicContact CE1-CG2 4.11Å; Y64-V68 HydrophobicContact CE2-CG1 3.44Å; Y64-V68 VanDerWaalsContact CE2-CG1 3.44Å; Y64-V68 WeakPolarHBondContact O-CG2 3.42Å; Y64-V68 PolarHBondContact O-N 3.32Å; L65-V68 WeakPolarHBondContact O-CG2 3.41Å; L65-V68 PolarHBondContact O-N 2.7Å
69A70.9Confident71.8Confident86 Ų8691 Ų9171%0.71151%0.513SS*.Hα-helixtrans-76.9-26.6179.100000112.9L65 G71L65-A69 WeakPolarHBondContact O-CB 3.31Å; L65-A69 PolarHBondContact O-N 3.03Å; A69-G71 VanDerWaalsContact C-N 3.25Å; A69-G71 PolarHBondContact O-N 3.42Å
70T67.2Low70.6Confident101 Ų10191.3 Ų91.362%0.6252%0.515SS*.THydrogen-bonded Turntrans-85.17.6177.556.80000113.8T66 Q67T66-T70 HydrophobicContact CG2-CG2 4.34Å; T66-T70 WeakPolarHBondContact O-CB 3.49Å; T66-T70 WeakPolarHBondContact O-CG2 3.21Å; T66-T70 PolarHBondContact O-N 2.94Å; T66-T70 VanDerWaalsContact O-N 3.07Å; T66-T70 PolarHBondContact O-OG1 2.66Å; Q67-T70 PolarHBondContact O-OG1 3.42Å
71G54.7Low70Confident59 Ų5991.8 Ų91.861%0.60852%0.522SS*.THydrogen-bonded Turntrans7721.5171.800000114.7A69A69-G71 VanDerWaalsContact C-N 3.25Å; A69-G71 PolarHBondContact O-N 3.42Å
72Q53.5Low69.7Low115 Ų11599 Ų9954%0.53755%0.549SS..  trans-58.7131.4166-75.9-79.2-33.700108.6Q67 H74Q67-Q72 HydrophobicContact CG-CB 3.99Å; Q67-Q72 HydrophobicContact CG-CG 4.17Å; Q67-Q72 WeakPolarHBondContact O-CB 3.37Å; Q67-Q72 PolarHBondContact O-N 3.46Å; Q72-H74 VanDerWaalsContact C-N 3.28Å; Q72-H74 PolarHBondContact O-N 3.07Å; Q72-H74 PolarHBondContact O-ND1 2.82Å
73P48.6Very low69.4Low105 Ų10599.2 Ų99.268%0.68255%0.545SS*.  trans-68.791-174.427.8-31.9000108.3E75P73-E75 PolarHBondContact O-N 3.29Å
74H56.6Low69.4Low106 Ų10696 Ų9649%0.49154%0.536SS..  trans-61.6127.8159.946.1-65.4000106Q72 G76 S77Q72-H74 VanDerWaalsContact C-N 3.28Å; Q72-H74 PolarHBondContact O-N 3.07Å; Q72-H74 PolarHBondContact O-ND1 2.82Å; H74-G76 PolarHBondContact O-N 3.44Å; H74-S77 VanDerWaalsContact CE1-CB 3.46Å; H74-S77 WeakPolarHBondContact CE1-CB 3.33Å; H74-S77 WeakPolarHBondContact NE2-CB 3.33Å; H74-S77 PolarHBondContact O-N 2.92Å
75E51.9Low69.7Low207 Ų20796.5 Ų96.597%0.96755%0.549SS*.THydrogen-bonded Turntrans-45.8102.5174.4-66.1174.9159.100108.8P73P73-E75 PolarHBondContact O-N 3.29Å
76G55.9Low70.2Confident68 Ų6896.2 Ų96.270%0.70155%0.545SS*.THydrogen-bonded Turntrans100.330.4-179.300000117.1H74 T78H74-G76 PolarHBondContact O-N 3.44Å; G76-T78 PolarHBondContact O-N 3.32Å
77S58.1Low70.8Confident19 Ų1995.7 Ų95.713%0.13354%0.538CS..  trans-58.6114.2166.878.50000110.1H74 Y79 S80 A81H74-S77 VanDerWaalsContact CE1-CB 3.46Å; H74-S77 WeakPolarHBondContact CE1-CB 3.33Å; H74-S77 WeakPolarHBondContact NE2-CB 3.33Å; H74-S77 PolarHBondContact O-N 2.92Å; S77-Y79 PolarHBondContact O-N 3.19Å; S77-S80 PolarHBondContact O-N 3.34Å; S77-S80 VanDerWaalsContact OG-CB 3.23Å; S77-S80 WeakPolarHBondContact OG-CB 3.3Å; S77-S80 PolarHBondContact OG-N 2.96Å; S77-A81 PolarHBondContact O-N 2.98Å
78T62.6Low71.7Confident96 Ų9692.8 Ų92.859%0.58953%0.533SS*.Hα-helixtrans-50.5-25.3169.9-54.70000111.1G76 R82G76-T78 PolarHBondContact O-N 3.32Å; T78-R82 HydrophobicContact CG2-CG 4.43Å; T78-R82 WeakPolarHBondContact O-CB 3.2Å; T78-R82 VanDerWaalsContact O-CG 3.3Å; T78-R82 WeakPolarHBondContact O-CG 3.28Å; T78-R82 PolarHBondContact O-N 2.91Å
79Y68Low72.8Confident160 Ų16095.3 Ų95.363%0.62754%0.544SS*.Hα-helixtrans-66.5-48.6172.3-175.9-105.1000113.5S77 R82 K83S77-Y79 PolarHBondContact O-N 3.19Å; Y79-R82 PolarHBondContact O-N 3.06Å; Y79-K83 HydrophobicContact CE1-CD 4.35Å; Y79-K83 VanDerWaalsContact O-CB 3.28Å; Y79-K83 WeakPolarHBondContact O-CB 3.23Å; Y79-K83 PolarHBondContact O-N 3.02Å
80S68.4Low74.1Confident55 Ų5595.6 Ų95.639%0.38553%0.534SS..Hα-helixtrans-60.5-48.7175.8-165.30000110.6S77 R82 K83 D84S77-S80 PolarHBondContact O-N 3.34Å; S77-S80 VanDerWaalsContact OG-CB 3.23Å; S77-S80 WeakPolarHBondContact OG-CB 3.3Å; S77-S80 PolarHBondContact OG-N 2.96Å; S80-R82 VanDerWaalsContact C-N 3.33Å; S80-R82 PolarHBondContact O-N 2.85Å; S80-K83 PolarHBondContact O-N 3.26Å; S80-K83 VanDerWaalsContact O-N 3.11Å; S80-D84 WeakPolarHBondContact O-CB 3.48Å; S80-D84 PolarHBondContact O-N 2.79Å; S80-D84 PolarHBondContact OG-OD2 2.76Å
81A79.6Confident75.5Confident63 Ų6399 Ų9952%0.52154%0.536SS..Hα-helixtrans-59.7-41.1177.800000112.4S77 C85S77-A81 PolarHBondContact O-N 2.98Å; A81-C85 VanDerWaalsContact O-CB 3.25Å; A81-C85 WeakPolarHBondContact O-CB 3.48Å; A81-C85 PolarHBondContact O-N 2.65Å
82R82.8Confident77.6Confident169 Ų16999.1 Ų99.164%0.63853%0.531SS*.Hα-helixtrans-66.2-40.8173.8-84.8-166.5-71-174.2-4.1112.7T78 Y79 S80 C85 Q86T78-R82 HydrophobicContact CG2-CG 4.43Å; T78-R82 WeakPolarHBondContact O-CB 3.2Å; T78-R82 VanDerWaalsContact O-CG 3.3Å; T78-R82 WeakPolarHBondContact O-CG 3.28Å; T78-R82 PolarHBondContact O-N 2.91Å; Y79-R82 PolarHBondContact O-N 3.06Å; S80-R82 VanDerWaalsContact C-N 3.33Å; S80-R82 PolarHBondContact O-N 2.85Å; R82-C85 PolarHBondContact O-N 3.38Å; R82-Q86 WeakPolarHBondContact O-CB 3.46Å; R82-Q86 PolarHBondContact O-N 2.86Å
83K85.4Confident79.7Confident110 Ų11097.8 Ų97.848%0.47852%0.524SS..Hα-helixtrans-66.6-42.1178.6-174-178.1177-175.80110.9Y79 S80 Q86 M87Y79-K83 HydrophobicContact CE1-CD 4.35Å; Y79-K83 VanDerWaalsContact O-CB 3.28Å; Y79-K83 WeakPolarHBondContact O-CB 3.23Å; Y79-K83 PolarHBondContact O-N 3.02Å; S80-K83 PolarHBondContact O-N 3.26Å; S80-K83 VanDerWaalsContact O-N 3.11Å; K83-Q86 PolarHBondContact O-N 3.23Å; K83-M87 HydrophobicContact CG-CE 4.29Å; K83-M87 WeakPolarHBondContact O-CB 3.49Å; K83-M87 WeakPolarHBondContact O-CG 3.25Å; K83-M87 PolarHBondContact O-N 3.44Å
84D87.8Confident82Confident84 Ų8499.9 Ų99.945%0.44952%0.52SS..Hα-helixtrans-64-43.9175.9-67.4-27.7000110.7S80 M87 A88S80-D84 WeakPolarHBondContact O-CB 3.48Å; S80-D84 PolarHBondContact O-N 2.79Å; S80-D84 PolarHBondContact OG-OD2 2.76Å; D84-M87 PolarHBondContact O-N 3.11Å; D84-M87 WeakPolarHBondContact OD1-CE 3.4Å; D84-A88 WeakPolarHBondContact O-CB 3.43Å; D84-A88 PolarHBondContact O-N 3.05Å
85C91.1Very high84Confident83 Ų8397.1 Ų97.156%0.56152%0.515SS*.Hα-helixtrans-59.8-46172.2-176.80000111.9A81 R82 M87 A88 L89A81-C85 VanDerWaalsContact O-CB 3.25Å; A81-C85 WeakPolarHBondContact O-CB 3.48Å; A81-C85 PolarHBondContact O-N 2.65Å; R82-C85 PolarHBondContact O-N 3.38Å; C85-M87 PolarHBondContact O-N 3.05Å; C85-A88 WeakPolarHBondContact O-CB 3.42Å; C85-A88 PolarHBondContact O-N 3.35Å; C85-L89 WeakPolarHBondContact O-CB 3.3Å; C85-L89 PolarHBondContact O-N 3.35Å
86Q94.6Very high86.2Confident98 Ų9895 Ų9546%0.45850%0.498SS..Hα-helixtrans-61.9-42.1177.6-175.362.75200111.9R82 K83 L89 N90R82-Q86 WeakPolarHBondContact O-CB 3.46Å; R82-Q86 PolarHBondContact O-N 2.86Å; K83-Q86 PolarHBondContact O-N 3.23Å; Q86-L89 WeakPolarHBondContact O-CB 3.37Å; Q86-L89 PolarHBondContact O-N 2.91Å; Q86-N90 PolarHBondContact NE2-OD1 3.17Å; Q86-N90 PolarHBondContact O-N 3.35Å; Q86-N90 PolarHBondContact O-OD1 2.96Å
87M96.8Very high88.2Confident66 Ų6695 Ų9533%0.32549%0.485SS..Hα-helixtrans-66.1-40.3175.9-74.3-169.8-63.800111.7K83 D84 C85 L89 N90 R91K83-M87 HydrophobicContact CG-CE 4.29Å; K83-M87 WeakPolarHBondContact O-CB 3.49Å; K83-M87 WeakPolarHBondContact O-CG 3.25Å; K83-M87 PolarHBondContact O-N 3.44Å; D84-M87 PolarHBondContact O-N 3.11Å; D84-M87 WeakPolarHBondContact OD1-CE 3.4Å; C85-M87 PolarHBondContact O-N 3.05Å; M87-L89 VanDerWaalsContact C-N 3.33Å; M87-N90 PolarHBondContact O-N 3Å; M87-R91 VanDerWaalsContact O-CG 3.3Å; M87-R91 WeakPolarHBondContact O-CG 3.38Å; M87-R91 PolarHBondContact O-N 2.86Å
88A97.1Very high90.1Very high52 Ų5298.2 Ų98.243%0.4350%0.496SS..Hα-helixtrans-61.6-42174.100000111.4D84 C85 R91 A92D84-A88 WeakPolarHBondContact O-CB 3.43Å; D84-A88 PolarHBondContact O-N 3.05Å; C85-A88 WeakPolarHBondContact O-CB 3.42Å; C85-A88 PolarHBondContact O-N 3.35Å; A88-R91 PolarHBondContact O-N 2.94Å; A88-A92 PolarHBondContact O-N 2.88Å
89L97.6Very high91.7Very high99 Ų9999.2 Ų99.252%0.51850%0.497SS..Hα-helixtrans-60.9-47.7175.3-161.586.2000111.5C85 Q86 M87 R91 A92 E93C85-L89 WeakPolarHBondContact O-CB 3.3Å; C85-L89 PolarHBondContact O-N 3.35Å; Q86-L89 WeakPolarHBondContact O-CB 3.37Å; Q86-L89 PolarHBondContact O-N 2.91Å; M87-L89 VanDerWaalsContact C-N 3.33Å; L89-R91 VanDerWaalsContact C-N 3.29Å; L89-R91 PolarHBondContact O-N 3.47Å; L89-A92 PolarHBondContact O-N 2.99Å; L89-A92 VanDerWaalsContact O-N 3.17Å; L89-E93 PolarHBondContact O-N 2.8Å
90N97.6Very high93.1Very high92 Ų9293.2 Ų93.249%0.49248%0.484SS..Hα-helixtrans-60.2-39.4177.7-68.2-4.1000111.8Q86 M87 Y94Q86-N90 PolarHBondContact NE2-OD1 3.17Å; Q86-N90 PolarHBondContact O-N 3.35Å; Q86-N90 PolarHBondContact O-OD1 2.96Å; M87-N90 PolarHBondContact O-N 3Å; N90-Y94 WeakPolarHBondContact O-CB 3.49Å; N90-Y94 PolarHBondContact O-N 3.38Å
91R97.9Very high94.4Very high174 Ų17494.2 Ų94.266%0.65748%0.483SS*.Hα-helixtrans-66.1-42.4175.7-71.9170.5-175.6159.12.1111.8M87 A88 L89 Y94 A95M87-R91 VanDerWaalsContact O-CG 3.3Å; M87-R91 WeakPolarHBondContact O-CG 3.38Å; M87-R91 PolarHBondContact O-N 2.86Å; A88-R91 PolarHBondContact O-N 2.94Å; L89-R91 VanDerWaalsContact C-N 3.29Å; L89-R91 PolarHBondContact O-N 3.47Å; R91-Y94 PolarHBondContact O-N 2.93Å; R91-A95 PolarHBondContact O-N 3.04Å
92A97.6Very high95.2Very high61 Ų6196 Ų9650%0.50448%0.483SS..Hα-helixtrans-63.6-43.7177.500000111.6A88 L89 Y94 A95 R96A88-A92 PolarHBondContact O-N 2.88Å; L89-A92 PolarHBondContact O-N 2.99Å; L89-A92 VanDerWaalsContact O-N 3.17Å; A92-Y94 PolarHBondContact O-N 3.3Å; A92-A95 PolarHBondContact O-N 3.38Å; A92-R96 PolarHBondContact O-N 3.29Å
93E97.6Very high95.8Very high86 Ų8689.5 Ų89.540%0.40247%0.469SS..Hα-helixtrans-60.4-44.7174.2-81.4-62.2155.400112.2L89 A95 R96 V97L89-E93 PolarHBondContact O-N 2.8Å; E93-A95 PolarHBondContact O-N 2.95Å; E93-R96 WeakPolarHBondContact O-CB 3.34Å; E93-R96 PolarHBondContact O-N 3.03Å; E93-R96 IonicContact OE1-CZ 3.65Å; E93-R96 IonicContact OE1-NE 3.84Å; E93-R96 IonicContact OE1-NH2 3.59Å; E93-R96 IonicContact OE2-CZ 3.1Å; E93-R96 IonicContact OE2-NE 3.05Å; E93-R96 PolarHBondContact OE2-NE 3.29Å; E93-R96 IonicContact OE2-NH2 2.65Å; E93-R96 PolarHBondContact OE2-NH2 3Å; E93-V97 WeakPolarHBondContact O-CG2 3.49Å; E93-V97 PolarHBondContact O-N 3.43Å
94Y97.8Very high96.2Very high150 Ų15091.5 Ų91.559%0.58847%0.473SS*.Hα-helixtrans-60.8-44.6175.9-177.5-101.4000112.2N90 R91 A92 R96 V97 K98N90-Y94 WeakPolarHBondContact O-CB 3.49Å; N90-Y94 PolarHBondContact O-N 3.38Å; R91-Y94 PolarHBondContact O-N 2.93Å; A92-Y94 PolarHBondContact O-N 3.3Å; Y94-R96 VanDerWaalsContact C-N 3.33Å; Y94-R96 PolarHBondContact O-N 3.46Å; Y94-V97 PolarHBondContact O-N 3.02Å; Y94-K98 HydrophobicContact CD1-CG 4.3Å; Y94-K98 HydrophobicContact CE1-CG 3.85Å; Y94-K98 HydrophobicContact CE2-CG 4.32Å; Y94-K98 WeakPolarHBondContact O-CG 3.33Å; Y94-K98 PolarHBondContact O-N 2.91Å; Y94-K98 WeakPolarHBondContact OH-CE 3.49Å
95A98.1Very high96.4Very high48 Ų4891.2 Ų91.240%0.39748%0.475SS..Hα-helixtrans-61.1-42.2176.300000111.7R91 A92 E93 V97 K98 L99R91-A95 PolarHBondContact O-N 3.04Å; A92-A95 PolarHBondContact O-N 3.38Å; E93-A95 PolarHBondContact O-N 2.95Å; A95-V97 PolarHBondContact O-N 3.45Å; A95-K98 PolarHBondContact O-N 3.46Å; A95-L99 WeakPolarHBondContact O-CB 3.43Å; A95-L99 WeakPolarHBondContact O-CG 3.44Å; A95-L99 PolarHBondContact O-N 3.32Å
96R97.8Very high96.4Very high162 Ų16289.9 Ų89.961%0.61147%0.466SS*.Hα-helixtrans-58.2-46.7175.5-174.9-175.170.1149.11111.7A92 E93 Y94 L99 G100A92-R96 PolarHBondContact O-N 3.29Å; E93-R96 WeakPolarHBondContact O-CB 3.34Å; E93-R96 PolarHBondContact O-N 3.03Å; E93-R96 IonicContact OE1-CZ 3.65Å; E93-R96 IonicContact OE1-NE 3.84Å; E93-R96 IonicContact OE1-NH2 3.59Å; E93-R96 IonicContact OE2-CZ 3.1Å; E93-R96 IonicContact OE2-NE 3.05Å; E93-R96 PolarHBondContact OE2-NE 3.29Å; E93-R96 IonicContact OE2-NH2 2.65Å; E93-R96 PolarHBondContact OE2-NH2 3Å; Y94-R96 VanDerWaalsContact C-N 3.33Å; Y94-R96 PolarHBondContact O-N 3.46Å; R96-L99 PolarHBondContact O-N 3.16Å; R96-G100 PolarHBondContact O-N 3.46Å
97V97.9Very high96.2Very high68 Ų6891.5 Ų91.541%0.41247%0.473SS..Hα-helixtrans-60.1-47.9177.4171.20000110.7E93 Y94 A95 L99 G100 E101E93-V97 WeakPolarHBondContact O-CG2 3.49Å; E93-V97 PolarHBondContact O-N 3.43Å; Y94-V97 PolarHBondContact O-N 3.02Å; A95-V97 PolarHBondContact O-N 3.45Å; V97-L99 PolarHBondContact O-N 3.25Å; V97-G100 PolarHBondContact O-N 2.92Å; V97-G100 VanDerWaalsContact O-N 3.16Å; V97-E101 PolarHBondContact O-N 2.95Å
98K97.9Very high95.8Very high86 Ų8693.7 Ų93.737%0.37449%0.49SS..Hα-helixtrans-64.1-38.7-179.8-70.1-58.8177.5-166.60113.6Y94 A95 G100 E101 L102Y94-K98 HydrophobicContact CD1-CG 4.3Å; Y94-K98 HydrophobicContact CE1-CG 3.85Å; Y94-K98 HydrophobicContact CE2-CG 4.32Å; Y94-K98 WeakPolarHBondContact O-CG 3.33Å; Y94-K98 PolarHBondContact O-N 2.91Å; Y94-K98 WeakPolarHBondContact OH-CE 3.49Å; A95-K98 PolarHBondContact O-N 3.46Å; K98-G100 VanDerWaalsContact C-N 3.34Å; K98-E101 VanDerWaalsContact CD-OE2 3.28Å; K98-E101 WeakPolarHBondContact CD-OE2 3.28Å; K98-E101 IonicContact NZ-OE1 3.8Å; K98-E101 IonicContact NZ-OE2 2.77Å; K98-E101 PolarHBondContact NZ-OE2 3.36Å; K98-E101 PolarHBondContact O-N 3.5Å; K98-L102 PolarHBondContact O-N 2.77Å
99L97.2Very high95.1Very high117 Ų11798.3 Ų98.361%0.61351%0.505SS*.Hα-helixtrans-65.1-38.6173.3-71.7171.7000111.9A95 R96 V97 L102 G103A95-L99 WeakPolarHBondContact O-CB 3.43Å; A95-L99 WeakPolarHBondContact O-CG 3.44Å; A95-L99 PolarHBondContact O-N 3.32Å; R96-L99 PolarHBondContact O-N 3.16Å; V97-L99 PolarHBondContact O-N 3.25Å; L99-L102 PolarHBondContact O-N 3.46Å; L99-G103 PolarHBondContact O-N 3.42Å
100G96.6Very high94.3Very high35 Ų35100.1 Ų100.136%0.36151%0.514SS..Hα-helixtrans-68.6-32.1175.500000114R96 V97 K98 R104R96-G100 PolarHBondContact O-N 3.46Å; V97-G100 PolarHBondContact O-N 2.92Å; V97-G100 VanDerWaalsContact O-N 3.16Å; K98-G100 VanDerWaalsContact C-N 3.34Å; G100-R104 WeakPolarHBondContact O-CG 3.45Å; G100-R104 PolarHBondContact O-N 3.3Å; G100-R104 PolarHBondContact O-NE 2.86Å
101E96.5Very high92.9Very high75 Ų75102.1 Ų102.135%0.3553%0.525SS..Hα-helixtrans-66.5-44.9169.8-71.9172.2-175.300111.5V97 K98 T105V97-E101 PolarHBondContact O-N 2.95Å; K98-E101 VanDerWaalsContact CD-OE2 3.28Å; K98-E101 WeakPolarHBondContact CD-OE2 3.28Å; K98-E101 IonicContact NZ-OE1 3.8Å; K98-E101 IonicContact NZ-OE2 2.77Å; K98-E101 PolarHBondContact NZ-OE2 3.36Å; K98-E101 PolarHBondContact O-N 3.5Å; E101-T105 PolarHBondContact O-N 3.09Å; E101-T105 VanDerWaalsContact O-N 3.09Å; E101-T105 PolarHBondContact O-OG1 3.03Å
102L95.6Very high91.2Very high100 Ų10099 Ų9952%0.52453%0.527SS..Hα-helixtrans-63.7-45.5177.7-178.162.4000111.8K98 L99 R104 T105 C106K98-L102 PolarHBondContact O-N 2.77Å; L99-L102 PolarHBondContact O-N 3.46Å; L102-R104 PolarHBondContact O-N 2.86Å; L102-T105 WeakPolarHBondContact O-CA 3.15Å; L102-T105 WeakPolarHBondContact O-CB 3.45Å; L102-T105 PolarHBondContact O-N 3.09Å; L102-C106 PolarHBondContact O-N 3.13Å; L102-C106 PolarHBondContact O-SG 3.36Å; L102-C106 VanDerWaalsContact O-SG 3.41Å
103G94.8Very high89.6Confident33 Ų33105 Ų10534%0.3455%0.545SS..Hα-helixtrans-56.5-48178.100000112.3L99 T105 C106 E107L99-G103 PolarHBondContact O-N 3.42Å; G103-T105 VanDerWaalsContact C-N 3.27Å; G103-T105 PolarHBondContact O-N 2.94Å; G103-C106 WeakPolarHBondContact O-CB 3.34Å; G103-C106 PolarHBondContact O-N 3.18Å; G103-E107 WeakPolarHBondContact O-CG 3.2Å; G103-E107 PolarHBondContact O-N 3.33Å
104R93.5Very high87.7Confident153 Ų153110.5 Ų110.558%0.57759%0.588SS**Hα-helixtrans-59.2-38174.2-76.7-179.8-77.7165.2-5.1112.7G100 L102 E107 V108G100-R104 WeakPolarHBondContact O-CG 3.45Å; G100-R104 PolarHBondContact O-N 3.3Å; G100-R104 PolarHBondContact O-NE 2.86Å; L102-R104 PolarHBondContact O-N 2.86Å; R104-E107 PolarHBondContact O-N 3.34Å; R104-V108 WeakPolarHBondContact O-CG2 3.5Å; R104-V108 PolarHBondContact O-N 3Å; R104-V108 VanDerWaalsContact O-N 3.09Å
105T92.7Very high87.2Confident77 Ų77108.6 Ų108.647%0.47259%0.588SS.*Hα-helixtrans-66.8-43.4177.6-54.10000110.8E101 L102 G103 V108 M109E101-T105 PolarHBondContact O-N 3.09Å; E101-T105 VanDerWaalsContact O-N 3.09Å; E101-T105 PolarHBondContact O-OG1 3.03Å; L102-T105 WeakPolarHBondContact O-CA 3.15Å; L102-T105 WeakPolarHBondContact O-CB 3.45Å; L102-T105 PolarHBondContact O-N 3.09Å; G103-T105 VanDerWaalsContact C-N 3.27Å; G103-T105 PolarHBondContact O-N 2.94Å; T105-V108 PolarHBondContact O-N 3.41Å; T105-M109 HydrophobicContact CG2-SD 4.32Å; T105-M109 VanDerWaalsContact O-CG 3.31Å; T105-M109 WeakPolarHBondContact O-CG 3.36Å; T105-M109 PolarHBondContact O-N 3.2Å
106C91.5Very high86.6Confident56 Ų56111.7 Ų111.738%0.37860%0.598SS.*Hα-helixtrans-62.2-42.2175.3-67.40000112.1L102 G103 M109 L110L102-C106 PolarHBondContact O-N 3.13Å; L102-C106 PolarHBondContact O-SG 3.36Å; L102-C106 VanDerWaalsContact O-SG 3.41Å; G103-C106 WeakPolarHBondContact O-CB 3.34Å; G103-C106 PolarHBondContact O-N 3.18Å; C106-M109 PolarHBondContact O-N 2.97Å; C106-L110 WeakPolarHBondContact O-CB 3.48Å; C106-L110 WeakPolarHBondContact O-CD1 3.31Å; C106-L110 WeakPolarHBondContact O-CG 3.38Å; C106-L110 PolarHBondContact O-N 2.89Å
107E90.6Very high86Confident132 Ų132108.9 Ų108.962%0.61760%0.597SS**Hα-helixtrans-58.3-47.4174.9-73171.2176.500111.6G103 R104 M109 L110 D111G103-E107 WeakPolarHBondContact O-CG 3.2Å; G103-E107 PolarHBondContact O-N 3.33Å; R104-E107 PolarHBondContact O-N 3.34Å; E107-M109 VanDerWaalsContact C-N 3.28Å; E107-M109 PolarHBondContact O-N 3.34Å; E107-L110 PolarHBondContact O-N 3.04Å; E107-L110 VanDerWaalsContact O-N 3.13Å; E107-D111 PolarHBondContact O-N 3.01Å
108V88.6Confident85.3Confident112 Ų112111.4 Ų111.468%0.67961%0.608SS**Hα-helixtrans-61.6-35.4176.2171.30000112.3R104 T105 L110R104-V108 WeakPolarHBondContact O-CG2 3.5Å; R104-V108 PolarHBondContact O-N 3Å; R104-V108 VanDerWaalsContact O-N 3.09Å; T105-V108 PolarHBondContact O-N 3.41Å; V108-L110 VanDerWaalsContact C-N 3.35Å
109M82.4Confident84.5Confident148 Ų148112.9 Ų112.973%0.72962%0.623SS**Hα-helixtrans-75.1-25177.3-69.9-17973.700113.3T105 C106 E107T105-M109 HydrophobicContact CG2-SD 4.32Å; T105-M109 VanDerWaalsContact O-CG 3.31Å; T105-M109 WeakPolarHBondContact O-CG 3.36Å; T105-M109 PolarHBondContact O-N 3.2Å; C106-M109 PolarHBondContact O-N 2.97Å; E107-M109 VanDerWaalsContact C-N 3.28Å; E107-M109 PolarHBondContact O-N 3.34Å
110L80.1Confident83.6Confident137 Ų137112.7 Ų112.772%0.71762%0.624SS**Hα-helixtrans-90.3-22.8-177.3-72.5167.3000113.2C106 E107 V108 P112C106-L110 WeakPolarHBondContact O-CB 3.48Å; C106-L110 WeakPolarHBondContact O-CD1 3.31Å; C106-L110 WeakPolarHBondContact O-CG 3.38Å; C106-L110 PolarHBondContact O-N 2.89Å; E107-L110 PolarHBondContact O-N 3.04Å; E107-L110 VanDerWaalsContact O-N 3.13Å; V108-L110 VanDerWaalsContact C-N 3.35Å; L110-P112 VanDerWaalsContact C-CD 3.41Å; L110-P112 WeakPolarHBondContact O-CD 3.04Å
111D69Low82.7Confident134 Ų134118.2 Ų118.272%0.71764%0.642SS**SBendtrans-98.783.9165.4-93.2-24.5000109.7E107 Q113E107-D111 PolarHBondContact O-N 3.01Å; D111-Q113 PolarHBondContact O-N 3.01Å
112P62.1Low81.7Confident110 Ų110121.5 Ų121.571%0.71467%0.665SS**  trans-62.8113.3170.327.8-32.4000107.6L110L110-P112 VanDerWaalsContact C-CD 3.41Å; L110-P112 WeakPolarHBondContact O-CD 3.04Å
113Q63.3Low80.5Confident187 Ų187123.3 Ų123.387%0.87468%0.677SS**  trans-53.8136168.7-74.6-166.2-66.300109D111D111-Q113 PolarHBondContact O-N 3.01Å
114P57.4Low79.2Confident201 Ų201131.5 Ų131.5100%1.30571%0.707SS**  trans-63.80176.627.6-34.3000112.8

Retrieved 114 of 114 residues in 690.1 ms (Link to these results)