Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MFTAKLIKGKTYNVMGITFRAGVSQTVPKKLYEYLNENPYFILTQELN-----------NQKDDPINYTESELKGMNKAEHESIISNLGRNPSDFKNADERIAYILKQIDNKGE 3OBA Chain:A ((925-992)) -----------------------SKDVEEFVYDYPQENGNHTDTHFLNIKFEGAGKLSIFQKEKPFNFKISDEYGVDEAAHACDVKRYGRH-----------------------

General information: TITO was launched using: RESULT: Template: 3OBA.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 : 116 10388 89.55 182.24 target 2D structure prediction score : 0.33 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : 89.55 2D Compatibility (Sec. Struct. Predict.) : 0.33 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.340

(partial model without unconserved sides chains): PDB file : Tito_3OBA.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3OBA-query.scw PDB file : Tito_Scwrl_3OBA.pdb: