Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRKDDKIKMALDLLPKSMFEAIDLLPDASTPVTLFTRHSLRELVDGQG-LAG-YDLQLTPQGRELAQEWGSYLIKNTDRVIQHCISSPIQRCVDTAALMIEGADGVSPEPNTHTIEIVEQGLLVEPGSFVLDIQQAAPYFRKQGALGFINSFVN----------------------------NTLPGMKHPITGVLDVLELIYQTHPK---TKSGLSLAVSHDTIIAAIVAVISGNNQIQKADWP-AMMEGLFVWFEGDEFPNCKLKWIWRGKTYELNVSEFHKVQ 4ODI Chain:B ((15-232)) -------------------------AK-AKYTLVLIRHGESTW-NKENRFTGWTDVPLSPVGEQEAVEAAKALKEKGF-EFDVAYTSVLQRAVVTCWTVLKGTDMCHIP-----V--KSSWRLNERHYGALQGLNKAETAAKHG-DEQVKIWRRSYDIPPPPLEKSDKRWPGNDAVYKMVPNEALPLTECLKDTVERVLPFWF-DHIAPSIMEGKRVLVAAHGNSLRGLVKHLDKMSDEA--VLELNIPTGVPLVYE-----------------------------

General information: TITO was launched using: RESULT: Template: 4ODI.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 : 858 -9505 -11.08 -51.66 target 2D structure prediction score : 0.66 Monomeric hydrophicity matching model chain B : 0.64 3D Compatibility (PKB) : -11.08 2D Compatibility (Sec. Struct. Predict.) : 0.66 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.352

(partial model without unconserved sides chains): PDB file : Tito_4ODI.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4ODI-query.scw PDB file : Tito_Scwrl_4ODI.pdb: