Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAFRKPDEIAEAAIEAGM-KKIKLPLPSLLVLGFLGGAFIALGYLLDIRVI---GDLPKEWGSLSSLIGAAVFPVGLILVVLAGAELITGNMMSVAMALFSRKISVKELAINWGIVTIMNLIGAL-FVAYFFGHLVGLTETGPYLEKTIAVAQGKLDMSFGKVLISAIGCNWLVCLAVWLSFGAQDAAGKILGIWFPIMAFVAIGFQHVVANMFVIPAAIFAGSFTWGQF--------------------IGNIIPAFIGNVIGGAVFVGLIYFIAYHKKDRSRKEMKQVS 3Q7K Chain:H ((12-275)) -----PAAMAKVAEEAGVYKATKHPLKTFY-LAITAGVFISIAFVFYITATTGTGAMPY---GMAKLIGGICFSLGLILCVICGADLFTSTVL-IVVAKASGRITWGQLAKNWLNVYFGNLIGALLFVLLMWLSGEYMTANGQWGLNVLQTADHKMHHTFIEAVCLGILANLMVCLAVWMSYSGRSLMDKAFIMVLPVAMFVASGFEHSIANMFMIPMGIVIRDFATPEFWTAVGSSPESFSHLTVMSFITDNLIPVTIGNIIGGGLLVGLTYW-----------------

General information: TITO was launched using: RESULT: Template: 3Q7K.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain H - contact count / total energy / energy per contact / energy per residue : 1113 -170358 -153.06 -712.79 target 2D structure prediction score : 0.69 Monomeric hydrophicity matching model chain H : 0.76 3D Compatibility (PKB) : -153.06 2D Compatibility (Sec. Struct. Predict.) : 0.69 1D Compatibility (Hydrophobicity) : 0.76 QMean score : 0.373

(partial model without unconserved sides chains): PDB file : Tito_3Q7K.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3Q7K-query.scw PDB file : Tito_Scwrl_3Q7K.pdb: