Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKIYGIYMDRPLSQEENERFMSFISPEKREKCRRFYHKEDAHRTLLGDVLVRSVISRQYQLDKSDIRFSTQEYGKPCIPDLPDAHFNISHSGRWVICAFDSQPIGIDIE-----KTKPISLEIAKRFFSKTEYSDLLAKDKDEQTDYFYHLWSMKESFIKQEGKGL-SLPLDSFSVRLHQDGQVSIELPD-SHSPCYIKTYEVDPGYKMAVCAAHPDFPEDITMVSYEELL 1QR0 Chain:A ((105-211)) --------------------------------------------------------------------------------------------------------GIDIEKTKPIS-----LEIAKRFFSKTEYSDLLAKDKDEQTDYFYHLWSMKESFIKQEGKG-LSLPLDSFSVRLHQDGQVSIELPDS-HSPCYIKTYEVDPGYKMAVCAAHPDF-------------

General information: TITO was launched using: RESULT: Template: 1QR0.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 : 292 -24672 -84.49 -246.72 target 2D structure prediction score : 0.78 Monomeric hydrophicity matching model chain A : 0.73 3D Compatibility (PKB) : -84.49 2D Compatibility (Sec. Struct. Predict.) : 0.78 1D Compatibility (Hydrophobicity) : 0.73 QMean score : 0.388

(partial model without unconserved sides chains): PDB file : Tito_1QR0.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1QR0-query.scw PDB file : Tito_Scwrl_1QR0.pdb: