Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLYCIFLTYLIKYAIIISEKGGETMANTTMNPSTARKNFYQLLKEVNENHTEIEIISDRSGNNAVLIGLEDWRAIQETLFLEQTGT-LDKVRDREKDDSSFTNIDDIDWEAL 3G5O Chain:D ((7-79)) ------------------------L-MRILPISTIKGKLNEFVDAVSSTQDQITITKN-GAPAAVLVGADEWESLQETLYWLAQPGIRESIAEADADIA-------------

General information: TITO was launched using: RESULT: Template: 3G5O.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain D - contact count / total energy / energy per contact / energy per residue : 154 -17425 -113.15 -242.01 target 2D structure prediction score : 0.71 Monomeric hydrophicity matching model chain D : 0.63 3D Compatibility (PKB) : -113.15 2D Compatibility (Sec. Struct. Predict.) : 0.71 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.446

(partial model without unconserved sides chains): PDB file : Tito_3G5O.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3G5O-query.scw PDB file : Tito_Scwrl_3G5O.pdb: