Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRNRKLGIDYSSDDFEGCPVETTLDIIGGKWKGILLYHLIDGKKRFNEFRKLYPKITQRMLTLQLRELERDGVIHREVYKQVPPKVEYSLTEFGRTLEPVILHMKDWGEKYKDRIDKLEAARKAEDKI 4A5M Chain:F ((14-110)) -----------------CPVEFTLDVIGGKWKGILFYHMIDGKKRFNEFRRICPSITQRMLTLQLRELEADGIVHREVYHQVPPKVEYSLTEFGRTLEPIVLQMKEWGESNRDV--------------

General information: TITO was launched using: RESULT: Template: 4A5M.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain F - contact count / total energy / energy per contact / energy per residue : 284 -47802 -168.32 -492.80 target 2D structure prediction score : 0.52 Monomeric hydrophicity matching model chain F : 0.88 3D Compatibility (PKB) : -168.32 2D Compatibility (Sec. Struct. Predict.) : 0.52 1D Compatibility (Hydrophobicity) : 0.88 QMean score : 0.461

(partial model without unconserved sides chains): PDB file : Tito_4A5M.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4A5M-query.scw PDB file : Tito_Scwrl_4A5M.pdb: