Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ---------------MEEALARHDRFGEDFSKVFTIINSAEIPAVENSALYLFVGTSRAPDEASKYVRDRVAQNAQ---SSTLEETLHSIHEELKILSKKM----TREDPMNLD-PEIEAAL-YERDGGCCFITGRTAGVQPIYIIP--PSILEDKD--LQPGGYLRPLLEVSL-TKEGTEQMLNLLGLPGRENVLKNLILMEPSIRY-SFRHGYFEII---KSPYLEPPYLPTDAPKSKNGGWWLQPIAPQSEVPQIIPRNNELYKVPS------TINPISHPLPARLLLKTH-GIVSHPLHTIYIEEQIKAGWPVE----PEPKELNWVGRLLLQILLRLIPNFARIR-LYELIYKMVDYWDPSQKGSHVKFLPLGLVLKKGRENTENEAKALTLAEQYISISTPRLIDSVMVNKTSGFILMTKVVGRSLSSILHRITWEELEQIGKDLANFITELRRIPNSSKYLIA-DTRGGPISDHRFFYQTWGPFKTVSGFTDRLLQDVKGARDKPPLSFLYEKKHKVYFTHSD-IHMTNLFVTCGRLSGVVDWENAGFKPEYWEYIRAMWAYGADKHAKCLYGSAFGDKYKEEGGIEITAVWIGFSLTTFSGFSGLIFEQLIRLRNEYLPLAQGKISPDVNPGHLCSTAKTSYTSAFARWEAVPARPMPTSQSGPITAKDAFKG 1G5A Chain:A ((1-554)) SPNSQYLKTRILDIYTPEQRAGIEK-SEDWRQFSRRMDTH-FPKLMNELDSVYGNNEAL-LPMLEMLLAQAWQSYSQRNSSLKDIDIARENNPDWILSNKQVGGVCYVDLFAGDLKGLKDKIPYFQE----------LGLTYLHLMPLFKCPEGKSDGGYAVSSYRDV--NPALGTIGDLREVIAALHEAG----IS--AVVDFIFNHTSNEHEWAQRCAAGDPLFDNFYYIFPDRRMPDQYDRTLREIFPDQHPGGFSQLEDGRWVWTTFNSFQWDLN-YSNPWVFRAMAGEMLFLANLGVDILRM-DAVAFIWKQMGTSCENLPQAHALIRAFNAVMRIAAPAVFFKSEAIVHPDQVVQYIGQ--DECQIGYNPLQMALLWNTLATREVNLLHQALTYRHNLPEHTAWVNYVRSHDDI--------GWTFADEDAAYLGISGYDHRQFLNRFFVNRFDGSFARGVPFQYNPSTGDCRVSGTAAALVGLAQDDPHAVDRIKLL---------YSIALSTGGLPLIYLGDEVGTLN--------------DDDWSQDS-----------NKSDDSRWAHRPRYNEALYAQRNDP----------STAAGQIYQDLRHMIAVRQSNPRFDGG--------------------------------------------------

General information: TITO was launched using: RESULT: Template: 1G5A.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 : 2678 79872 29.83 157.54 target 2D structure prediction score : 0.65 Monomeric hydrophicity matching model chain A : 0.59 3D Compatibility (PKB) : 29.83 2D Compatibility (Sec. Struct. Predict.) : 0.65 1D Compatibility (Hydrophobicity) : 0.59 QMean score : 0.242

(partial model without unconserved sides chains): PDB file : Tito_1G5A.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1g5a-query.scw PDB file : Tito_Scwrl_1G5A.pdb: