Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MEVNKESLVADELHRMFLAGELQITVEE-----DINNISERLRNGDLSLDRLSGEDVFIKETVNEALRRVEQ 4AYB Chain:Q ((34-65)) ---------------------PKLSIQDIELLMKNTEIWDNLLNGKISVDEAK-------------------

General information: TITO was launched using: RESULT: Template: 4AYB.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain Q - contact count / total energy / energy per contact / energy per residue : 22 -2717 -123.48 -100.61 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain Q : 0.64 3D Compatibility (PKB) : -123.48 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.536

(partial model without unconserved sides chains): PDB file : Tito_4AYB.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4AYB-query.scw PDB file : Tito_Scwrl_4AYB.pdb: