Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSAFTLYPAIDMRNGKCVRLVQGDYNKETIYGDSPYDMAELFEKEGAEWIHLVDLDGAKEGKRVNDRHVIEIAQKLNLKVEIGGGIRSENDVYEYLSAGVERVILGSSAVSNPPFVKKMLKQYGEKIAIGLDARNGFVSTEGWLETSTLKATELGKELANEGAEVFIFTDIATDGMLSGPNVKSTVELAKETGKSVIASGGVSSVADLEALARNEADGVSGAIIGKALYTNQFTLSEALERVKRK 4TX9 Chain:A ((8-248)) LSRLELLPAVDVRDGQAVRLVHGESGTETSYG-SPLEAALSWQRAGAEWLHLVDLDAAF-GTGDNRELVRQVTEAMDIKVELSGGIRDDASLAAALATGCTRVNLGTAALESPEWVAKVIAEHGDRIAVGLDVRGTTLKGRGWTSEGG-DLYEALERLDKEGCARYVVTDIAKDGTLQGPNLELLRNVCAATDRPVVASGGVSSLDDLRAIAELVPLGVEGSIVGKALYAKAFTLEEALEAVAQ-

General information: TITO was launched using: RESULT: Template: 4TX9.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 : 1417 -110503 -77.98 -458.52 target 2D structure prediction score : 0.75 Monomeric hydrophicity matching model chain A : 0.84 3D Compatibility (PKB) : -77.98 2D Compatibility (Sec. Struct. Predict.) : 0.75 1D Compatibility (Hydrophobicity) : 0.84 QMean score : 0.678

(partial model without unconserved sides chains): PDB file : Tito_4TX9.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4TX9-query.scw PDB file : Tito_Scwrl_4TX9.pdb: