Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDTPDENGYVADDYRITYLEAHIKAMRDAIYKDGVDLLGYTTWGCIDSVSAGTGEMNKRYGFIYVDRDNVGNGALKRSKKKSFYWYKDVIDSNGVSIE 4ZE5 Chain:A ((391-485)) FDTLEPGDIVNDDYRIDYLRRHVQEIQRAI-TDGVDVLGYCAWSFTDLLSWLNG-YQKRYGFVYVNRDDESEKDLRRIKKKSFYWYQRVIETNGAEL-

General information: TITO was launched using: RESULT: Template: 4ZE5.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 : 281 -9001 -32.03 -94.74 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain A : 0.88 3D Compatibility (PKB) : -32.03 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.88 QMean score : 0.334

(partial model without unconserved sides chains): PDB file : Tito_4ZE5.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4ZE5-query.scw PDB file : Tito_Scwrl_4ZE5.pdb: