Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRKNRILALFVLSLGLLSFMVTPVSAASKGNLLSPDRILTVAHRGASGYVPEHTILSYETAQKMKADFIELDLQMTKDGKLIVMHDEKLDRTTNGMGWVKDHTLADIKKLDAGSWFNEAYPEKAKPQYVGLKVPTLEEVLDRFG-KHANYYIETKSPDT-YPGMEEKLIASLQKHKLLGKHSKPGQVIIQSFSKESLVKVHQLQPNLPT-----VQLLEAKQMASMTDAALEEIKTYAVGAGPDYKALNQENVRMIRSHGLLLHPYTVNNEADMHRLLDWGVTGVFTNYPD-LFHKVKKGY 2PZ0 Chain:B ((11-251)) ------------------------------------KTLVIAHRGDSKNVPENTIAAFKRAMELGADGIELDVQLTKDGHLVVIHDETVDRTTNGEGFVKDFTLEEIKKLDAGIKFGE--------KFAGERIPTLYEVFELIGDKDFLVNIEIKSGIVLYPGIEEKLIKAIKEYNF------EERVIISSFNHYSLRDVKKMAPHLKIGLLYQCGLVEPWHMA---------LRMEAYSLHPFYFNIIPELVEGCKKNGVKLFPWTVDRKEDMERMIKAGVDGIITDDPETLINLVRKG-

General information: TITO was launched using: RESULT: Template: 2PZ0.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 1294 -119948 -92.70 -514.80 target 2D structure prediction score : 0.73 Monomeric hydrophicity matching model chain B : 0.73 3D Compatibility (PKB) : -92.70 2D Compatibility (Sec. Struct. Predict.) : 0.73 1D Compatibility (Hydrophobicity) : 0.73 QMean score : 0.599

(partial model without unconserved sides chains): PDB file : Tito_2PZ0.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2PZ0-query.scw PDB file : Tito_Scwrl_2PZ0.pdb: