Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKIVGALAVFVITYALFSAAGYLFPVDQEWYNSLKKPDWTPSGTAIGIIWAILFALISLSAAIVYAAFSFKGAKSFWFTLLINYVLNQAFSYFQFTQKNLLAASLDCLLVAITAIVLLIIAK------KYSRAASYLLLPYFLWSAFATFLSFTINSMNL 5DUO Chain:A ((28-150)) ----------------------------DEWYDNLNKPWWNPPRWVFPLAWTSLYFLMSLAAMRVAQLEGSGQALAFYAAQL---AFNTLWTPVFFGMKRMATA------LAVVMVMWLFVAATMWAFFQLDTWAGVLFVPYLIWATATTGLNFEAMRLN-

General information: TITO was launched using: RESULT: Template: 5DUO.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 : 408 -79870 -195.76 -682.65 target 2D structure prediction score : 0.79 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -195.76 2D Compatibility (Sec. Struct. Predict.) : 0.79 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.430

(partial model without unconserved sides chains): PDB file : Tito_5DUO.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5DUO-query.scw PDB file : Tito_Scwrl_5DUO.pdb: