Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLIRNPFKDKYYSHDRRALNMLALRVPGLAFILMIYIASIVLQFVSGGWSILLLYAFTILIAIFALLHWHSYRWVKKRVILYFAVQGLITFALANLMTGFFILVIIGLYAFLIGQIIGMADRRRTFLILYLLLLLVINSAYHLHKGEVLHFIVIAAPIMIVIITYAATFFAQVDEKIKAQLTLERLELAHQQVEQLTLQNERQRMARDLHDTLAQGLVSLNMQLDAIHVHLAKGNTERAKEIIQQSMKRVKSTIADARSAIDDLRSKSEEIGVLKERITSLMDHFIE---STGMACLLDYRLHQVLDVRTAENCYYIIGECMTNAAKHAEAK----TIWISIWDDEKGRLHLTVKDNGKGFDVEKGKKKRGHYGLLGIQERVRAINGQFNIKSTKLKGTQIEITVPIQGEMQDE 4R39 Chain:A ((17-222)) -------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------TELDRQLAEVQHRVKNHLAMIVSMIRIQSSQAG--GVGSQFDSLSRRVEALQLLYQEMDIA-GA-AKATDKIIPLGAYLGRIASAINHIDGRGAIKVNVQADT-VDVPVETAGRIGLLVSEVLTNALQHAFSDRASGVVQLRSSVMSGEQLRVTVEDDGRGIPEDCDWPNEGNLGSRIVRQLVQGLGAELNVTRG-GTGTIVNIDIPLSQQK---

General information: TITO was launched using: RESULT: Template: 4R39.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 : 996 -81491 -81.82 -409.50 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain A : 0.54 3D Compatibility (PKB) : -81.82 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.54 QMean score : 0.390

(partial model without unconserved sides chains): PDB file : Tito_4R39.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4R39-query.scw PDB file : Tito_Scwrl_4R39.pdb: