Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSDGKKHVVIIGGGITGLAAAFYMEKEIKEKNLPLELTLVEASPRVGGKIQTVKK--DGYIIERGPDSFLERKKSAPQLVKDLGLEH-LLVNNATGQSYVLVNRTLHPMPKGAV-MGIPTKIAPFVSTGLFSLSGKARAA--MDFIL-PASKTKDDQSLGEFFRRRVGDEVVENLIEPLLSGIYAGDIDKLSLMSTFPQFYQTEQKHRSLILGMKKTRPQGSGQQLTAKKQGQFQTLSTGLQTLVEEIEKQLKLTKVYKGTKVTKLSHSGSCYSLELDNGVTLDADSVIVTAPHKAAAGMLSELPAI----SHLKNMHSTSVANVALGFPEGSVQMEHEGTGFVISRNSDFAITACTWTNKKWPHAAPEGKTLLRAYVGKAGDESIVDLSDNDIINIVLEDLKKVMNIN-GEPEMTCVTRWHE------SMP-QYHVGHKQRIK-ELREALASAYPGVYMTGASFE---GVGIPDCIDQGKAAVSDALTYLFS 4I59 Chain:A ((13-461)) ---PDVDVIIIGAGISGSAAAKALHDQ------GASVLVVEANDRIGGRTWTEQEGAPGGPIDYGGMFIGETHTHLIELGTSLGLEMTPSGKP-GDDTYIV-AGNVLRAPDDQLDPNLPF-VPEFLS-SLKALDELADSVGWDQPWASPNAAALDSKTVATWLAETIESEEVRRLHTVIVNTLLGADPYEVSLLYWAYYVSECE----GIQ-SLMG-----------TRDGAQWAWWFGGAAQVSWRIADAIGRDKFLLEWPVDRIEHDESGVTLFS-GQRSLRARHIVIAMSPLAANQIRFEPALPTSRAQLQARAPMGRYYKVQARYPSS-FWVEQGYSGALLDTE---DVGVFLLDGTK----PTDTLATLIGFIGGSNYDRWAAHTPQERERAFLDLLVKAFGPQAADPSYFHETDWTQQEWAKGGPVTYMPPGVLANFGAALRDP----VGKVHFAGTEASFQWSGYMEGGVRAGQKAAAAIAEEL--

General information: TITO was launched using: RESULT: Template: 4I59.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 : 2711 -212384 -78.34 -498.55 target 2D structure prediction score : 0.57 Monomeric hydrophicity matching model chain A : 0.70 3D Compatibility (PKB) : -78.34 2D Compatibility (Sec. Struct. Predict.) : 0.57 1D Compatibility (Hydrophobicity) : 0.70 QMean score : 0.449

(partial model without unconserved sides chains): PDB file : Tito_4I59.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4I59-query.scw PDB file : Tito_Scwrl_4I59.pdb: