Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTYFELVRSMDVLEKITLPGKPKYLKLAE-DFDFYELFKKIENQFSTCFIFESLGEEDYLSRHHIIGFDPEKFFYSTAVNELCVKDCTTNTILKYSCDHAYYKLREIVPQ-N---IIS-KHYSGGLVGFIGYNAISFFEPTLDVKNN-EDFETFKFGLYLDGLVYDKLTGEIFYFYYKES---------R-FNEILDI-------LNSDINYN-N--NIKVQYLGNSVTKEEYENSVYKVKEYIKSGLIFQCEVGFKTDYIITGNHLEIYSKLREVNPSPHMYFMKFD------DQKIIGASPELLFRLHNKEMETFPLAGTAKRGKDEIEDRKYARKLLNDPKEIAEHNMLVDLHRNDIGRVAQFGTVKVRKLMDIKRFSHIQHISSEIVGIIKEDEDMFSALASNFPAGTLSGAPKIEAMKIIDEIESSGRGVYGGAIGEFCFNGDCTFAIPIRSIFIKADRAYIQTCGGNVFDSNPEDEYIEIERKLAAMKTVLKNFEV 5CWA Chain:A ((21-506)) ---------------AEHRVVPVTRKVLADSETPLSAYRKLAANRPGTFLLESAENGRSWSRWSFIGAGAPTALTVREGQAVWLGAVP---KDAPTGGDPLRALQVTLELLATAD-PGLPPLSGGMVGFFAYDMVRRLERLPERAVDDLCLPDMLLLLATDVAAVDHHEGTITLIANAVNWNGTDERVDWAYDDAVARLDVMTAALGQPLPSTVATFSRPEPRHRAQRTVEEYGAIVEYLVDQIAAGEAFQVVPSQRFEMDTDVDPIDVYRILRVTNPSPYMYLLQVPNSDGAVDFSIVGSSPEALVTVHEGWATTHPIAGTRWRGRTDDEDVLLEKELLADDKERAEHLMLVDLGRNDLGRVCTPGTVRVEDYSHIERYSHVMHLVSTVTGKLGEGRTALDAVTACFPAGTLSGAPKVRAMELIEEVEKTRRGLYGGVVGYLDFAGNADFAIAIRTALMRNGTAYVQAGGGVVADSNGSYEYNEARNKARAVLNAIAAAE-

General information: TITO was launched using: RESULT: Template: 5CWA.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 : 2608 30548 11.71 68.04 target 2D structure prediction score : 0.50 Monomeric hydrophicity matching model chain A : 0.70 3D Compatibility (PKB) : 11.71 2D Compatibility (Sec. Struct. Predict.) : 0.50 1D Compatibility (Hydrophobicity) : 0.70 QMean score : 0.426

(partial model without unconserved sides chains): PDB file : Tito_5CWA.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5CWA-query.scw PDB file : Tito_Scwrl_5CWA.pdb: