Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKIYGIYMDRPLSQEENERFMSFISPEKREKCRRFYHKEDAHRTLLGDVLVRSVISRQYQLDKSDIRFSTQEYGKPCIPDLPDAHFNISHSGRWVICAFDS----QPIGIDIEKTKPISLEIAKRFFSKTEYSDLLAKDKDEQTDYFYHLWSMKESFIKQEG--KGLSLPLDSFSVRLHQDGQVSIELPDSHSPCYIKTYEVDPGYKMAVCAAHPDFPEDITMVSYEELL 4QVH Chain:A ((399-553)) ------------------PPGLTPLPEEAPLIARSV-AKRRNEFITVRHCARIALDQL-GVP--PAPILKGDKGEPCWPD--GMVGSLTHCAGYRGAVVGRRDAVRSVGIDAEPHDVLPNGVLDAISLPAERADMPRTM-PAALHWDRILFCAKEATYKAWFPLTKRWLGFEDAHITFET--------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4QVH.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 : 571 -46767 -81.90 -313.87 target 2D structure prediction score : 0.62 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : -81.90 2D Compatibility (Sec. Struct. Predict.) : 0.62 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.518

(partial model without unconserved sides chains): PDB file : Tito_4QVH.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4QVH-query.scw PDB file : Tito_Scwrl_4QVH.pdb: