Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKFSPLCWIVPSIYVIMKEGFKIGKGVFMLKLGVIGTGAISHHFIEAAHTSGEYQLVAIYSRKLETAATFASRYQNIQLFDQLEVFFKS-SFDLVYIASPNSLHFAQAKAALSAGKHVILEKPAVSQPQEWFDLIQTAEKNNCFIFEAARNYHEKAFTTIKNFLAD---KQVLGADFNYAKYSSKMPDLLAGQTPNVFSD-RFAGGALMDLGIYPLYAAVRLFGKANDATYHAQQL--DNSIDLNGDGILFYPD-YQVHIKAGKNITSNLPCEIYTTDGTLTLNTIEHIRS---A-----IFTDHQGN-QVQ---LP----IQQAPHTMTEEVAAFAHMIQQPDLNLYQTWLYDAGSVHELLYTMRQTAGIRFEAEK 3DB2 Chain:A ((2-348)) -------------------------MYNPVGVAAIGLGRWAYVMADAYTKSEKLKLVTCYSRTEDKREKFGKRYNC-AGDATMEALLAREDVEMVIITVPNDKHAEVIEQCARSGKHIYVEKPISVSLDHAQRIDQVIKETGVKFLCGHSSRRLGALRKMKEMIDTKEIGEVSSIEAVFSNERG-L-EL--KKGNWRGEPATAPGGPLTQLGVHQIDNLQFLLGPVARVFNFGKPMYTEVENITVNQTLLEFEDGKQAYLGTNWACPGVFSINVYGTKANLFYQLDFSWWSNSDVTDEHSTLIKREFAS---NRILRDVKVDFESVDHLRVEVEEVADVIRNGG--ETEIGAEASLRNLAVVLAAVKSVHEKRPVE-

General information: TITO was launched using: RESULT: Template: 3DB2.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 : 1805 -68131 -37.75 -214.92 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -37.75 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.393

(partial model without unconserved sides chains): PDB file : Tito_3DB2.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3DB2-query.scw PDB file : Tito_Scwrl_3DB2.pdb: