Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAKALITYASMSGNTEDIAFIIKDTLQEYELDIDCVEINDMDASCLT-SYDYVLIGTYTWGDGDLPYEAEDF---FEEVKQIQLNGLKTACFGSGDYSYPKFCEAVNLFNVMLQEAGAAVYQETLKIELAPETDEDVESCRAFARGFLAWADYMNKEKIHVS 3F6S Chain:D ((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 D - contact count / total energy / energy per contact / energy per residue : 779 -108464 -139.23 -774.74 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain D : 0.76 3D Compatibility (PKB) : -139.23 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.76 QMean score : 0.551

(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: