Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKFSPLCWIVPSIYVIMKEGFKIGKGVFMLKLGVIGTGAISHHFIEAAHTSGEYQLVAIYSRKLETAATFASRYQNIQLFDQLEVFFKS-SFDLVYIASPNSLHFAQAKAALSAGKHVILEKPAVSQPQEWFDLIQTAEKNNCFIFEAARNYHEKAFTTIKNFLAD---KQVLGADFNYAKYSSKMPDLLAGQTPNVFSDRFAGGALMDLGIYPLYAAVRLFGK-ANDATYHAQQLDNSIDLNGDGILFYPD-YQVHIKAGKNITSNLPCEIYTTDGTLTLNTIEHIRSAIFTDHQGNQVQLPIQQAPHTMTEEVAAFAHMIQQPDLNLYQTWLYDAGSVHELLYTMRQTAGIRFEAEK 3E9M Chain:D ((2-320)) ---------------------------DKIRYGIMSTAQIVPRFVAGLRESAQAEVRGIASRRLENAQKMAKELAIPVAYGSYEELCKDETIDIIYIPTYNQGHYSAAKLALSQGKPVLLEKPFTLNAAEAEELFAIAQEQGVFLMEAQKSVFLPITQKVKATIQEGGLGEILWVQSVTAYPNV-------DHIPWFYSREAGGGALHGSGSYPLQYLQYVLGKEIQEVTGTATYQQGATDSQCNLALKFAEGTLGNIFINVGLKIPSEMTICGTKGQIVIPNFWKTDCAYYTDAQGNTVKWS-EQFTSEFTYEINHVNQCLQDKKLTSPVMTKELTIATVKIVESFYQEWFDN-----

General information: TITO was launched using: RESULT: Template: 3E9M.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain D - contact count / total energy / energy per contact / energy per residue : 1764 -77121 -43.72 -246.39 target 2D structure prediction score : 0.68 Monomeric hydrophicity matching model chain D : 0.68 3D Compatibility (PKB) : -43.72 2D Compatibility (Sec. Struct. Predict.) : 0.68 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.437

(partial model without unconserved sides chains): PDB file : Tito_3E9M.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3E9M-query.scw PDB file : Tito_Scwrl_3E9M.pdb: