Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MPPERPENDKTQKAKDNITGQISKYEKIVSYEGREAANNGGLRKALEDFARTGEKVGTKNPSNHIQKARDILRGLDNQEKLLQKSTINSQDKAVLQQRIQSLRNEIEPSLKRAITKQNELN 2DCU Chain:A ((161-251)) -----------RQIKEFIKGTVAENAPIIPISALHGANIDVLVKAIEEFIPTPKRDSNKPPKMLVLRSFDVNKPGTPPEKLVG----GVLDGSIVQGKLK-VGDEIE--------------

General information: TITO was launched using: RESULT: Template: 2DCU.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 : 152 -4786 -31.49 -52.59 target 2D structure prediction score : 0.33 Monomeric hydrophicity matching model chain A : 0.72 3D Compatibility (PKB) : -31.49 2D Compatibility (Sec. Struct. Predict.) : 0.33 1D Compatibility (Hydrophobicity) : 0.72 QMean score : 0.142

(partial model without unconserved sides chains): PDB file : Tito_2DCU.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2DCU-query.scw PDB file : Tito_Scwrl_2DCU.pdb: