Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDIADQTFVKKVNQKLLLKEILKNSPISRAKLSEMTGLNKSTVSSQVNTLMKENLVFEIGQGQSSGGRRPVMLVFNKKAGYSIGIDVGVDYISGILTDLEGTIILDQHHHLESNSP-EITKDILIDMIHHFITRMPQSPYGLIGIGICVPGLIDKN-QKIVFTPNS-NWRDIDLKSFIQEKFNVPVFIENEANAGAYGEKVFGAAKNHNNIIYASISTGIGIGVIINNHLYRGVSGFSGEMGHMTIDFNGPKCSCGNRGCWELYASEKALLKSLQTKE-KKVSYQDIIDLAHLNDIGTLNALQNFGFYLGIGLTNILNTFNPQAIILRNSIIESHPM-VLNSIRSEVSSRVYPQLGNSYELLPSSLGKNAPALGMSSIVIEHFLDIVKM 3VOV Chain:A ((2-299)) --------------------------------------------------------------------------------KVVGLDLGGTKIAAGVFDG-KRLLSKVVVPTPKEGGERV-AEALAEAAERAERE---AGVRGEAIGLGTPGPLDFRRGVIR---NIPGVQDFPIRRILEEATGRPVFLENDANAAALAEHHLGAAQGEESSLYLTVSTGIGGGVVLGGRVLRGERGQGGELGHLTLLPGGPACGCGLEGCLEALAAGRALERDATYAFQRPVDTRELFRLFQAGDPKAERLVLQAARYVGIGLASLVKAFDPGVVVLGGGVALNAPEGYWEALLEAYRRYL-Q-GWEAPPLRRARLGAEAGLLGAALTAYLEVKD----

General information: TITO was launched using: RESULT: Template: 3VOV.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 : 1788 -205461 -114.91 -708.48 target 2D structure prediction score : 0.67 Monomeric hydrophicity matching model chain A : 0.70 3D Compatibility (PKB) : -114.91 2D Compatibility (Sec. Struct. Predict.) : 0.67 1D Compatibility (Hydrophobicity) : 0.70 QMean score : 0.512

(partial model without unconserved sides chains): PDB file : Tito_3VOV.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3VOV-query.scw PDB file : Tito_Scwrl_3VOV.pdb: