Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKYQRMHLIFIRQYIKQIMEYKVDFVVGVLGVFLAQGLNLLFLNVIFQHIPFLEGWTFQEIAFIYGFSLIPKGMDHLFFDNLWALGQRLVRKGEFDKYLTRPINPLFHILVETFQIDALGELLVGGILLGTTVTSIVWTLPKFLLFLVCIPFA--------TLIYTSLKIATASIAFW---TKQSGAMIYIFYMFNDF---AKYPISIYNSLLRWLISFIVPFAFTAYYPASYFLQEKDVFFNVGGLMLISLVFFVISLKLWDKGLDSYESAGS 2X92 Chain:A ((423-501)) ---------------------------------------------------------------------------------------------------------------------------------------------------IVFLPFAFTMDKYRWSLFRGEVDKANWNCAFWKLRDEYSGIEPPVVRSEKDFDAPAKYHISADVEYLRYLVSFIIQFQF-------------------------------------------------

General information: TITO was launched using: RESULT: Template: 2X92.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 : 167 -14187 -84.95 -218.26 target 2D structure prediction score : 0.40 Monomeric hydrophicity matching model chain A : 0.47 3D Compatibility (PKB) : -84.95 2D Compatibility (Sec. Struct. Predict.) : 0.40 1D Compatibility (Hydrophobicity) : 0.47 QMean score : 0.051

(partial model without unconserved sides chains): PDB file : Tito_2X92.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2X92-query.scw PDB file : Tito_Scwrl_2X92.pdb: