Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLIRNPFKDKYYSHDRRALNMLALRVPGLAFILMIYIASIVLQFVSGGWSILLLYAFTILIAIFALLHWHSYRWVKKRVILYFAVQGLITFALANLMTGFFILVIIGLYAFLIGQIIGMADRRRTFLILYLLLLLVINSAYHLHKGEVLHFIVIAAPIMIVIITYAATFFAQVDEKIKAQLTLERLELAHQQVEQLTLQNERQRMARDLHDTLAQGLVSLNMQLDAIHVHLAKGNTERAKEIIQQSMKRVKSTIADARSAIDDLRSKSEEIGV---LKERITSLMDHFIESTGMACLLDYRLHQVLDVRTAENCYYIIGECMTNAAKHAEAK-TIWISIWDDEKGRLHLTVKDNGKGFDVEKGK-----------KKRGHYGL---LGIQERVRAINGQFNIKSTKLKGTQIEITVPIQGEMQDE 4FPP Chain:A ((43-247)) ------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PDFAAMLAARLCHDFISPASAIVSGLDLLEDPSAQDMRDDAMNLIASSARKLADLLQFTRVAFGA-S-ASAENFDSRELEKLAQGVFAHVRPTLD----WQIE--PQAMN---KPSSRAVLNIAQIAASALPAGGVATVKGVAAD-GRFSIIADAKG--PRARLRPEVLAGLKGEPLAEGLGGPWVQAAYLNALVRAAGGQIAVEIGE-DRASIAAWVPA-------

General information: TITO was launched using: RESULT: Template: 4FPP.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain A - contact count / total energy / energy per contact / energy per residue : 790 -69728 -88.26 -372.87 target 2D structure prediction score : 0.69 Monomeric hydrophicity matching model chain A : 0.51 3D Compatibility (PKB) : -88.26 2D Compatibility (Sec. Struct. Predict.) : 0.69 1D Compatibility (Hydrophobicity) : 0.51 QMean score : 0.378

(partial model without unconserved sides chains): PDB file : Tito_4FPP.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4FPP-query.scw PDB file : Tito_Scwrl_4FPP.pdb: