Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAKALITYASMSGNTEDIAFIIKDTLQEYELDIDCVEINDMDASCLT-SYDYVLIGTYTWGDGDLPYEAEDF---FEEVKQIQLNGLKTACFGSGDYSYPKFCEAVNLFNVMLQEAGAAVYQETLKIELAPETDEDVESCRAFARGFLAWADYMNKEKIHVS 3F6S Chain:I ((2-145)) -SKVLIVFGSSTGNTESIAQKLEELIAAGGHEVTLLNAADASAENLADGYDAVLFGCSAWGMEDLEMQ-DDFLSLFEEFDRIGLAGRKVAAFASGDQEYEHFCGAVPAIEERAKELGATIIAEGLKME--GDASNDPEAVASFAEDVL--------------

General information: TITO was launched using: RESULT: Template: 3F6S.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain I - contact count / total energy / energy per contact / energy per residue : 778 -110452 -141.97 -788.94 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain I : 0.76 3D Compatibility (PKB) : -141.97 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.76 QMean score : 0.530

(partial model without unconserved sides chains): PDB file : Tito_3F6S.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3F6S-query.scw PDB file : Tito_Scwrl_3F6S.pdb: