Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ------------------------------MQKFMNGWVNGFIGVAIFAGSLPATR-VAVTGFEPGFLTAARAVIA-GVLGLILIFLLKEKKP--AKQDWW---PLAIVALGVV-VGFPLFTALAL-QYMNAAHSIVF------VSLLPLATAIFAVV-----RGGEKPNLFFWI---------FAVLGSLVV-F-TYMFFLSGEASFGIGDLYMLIAIILCGFGYAEGG--VLSKKIGGWQVI-----------CWALILALPI-------------------MLLATLFYMP-------------------VSFQDVS---------------TSAVAGLVYVSLFSMLI--GFFF-WYKGLAQGGIA-AISQLQLLQPLMGLAI--AALLL-HEHVSWSMLMVTA-VTILCVAAAKKFA---- 4QT9 Chain:A ((19-432)) LSDDALMDTVQRRTFLYFWEGAEPNSGLAPERYHVDGVYPQNDANVVTSGGSGFGIMAILAGIDRGYVTREEGLARME---RIVSFLEKADRFHGAYPHWWYGDTGKVKPFGQKDNGGDLVETAFLMQGLLAVHQYYANGNDKEKAIAQRIDRLWREVDWDWYRKGGQNVLYWHWSPTYGWEMDFPIHGYNECMIMYILAAASPTHG---------VPAAVYHDGWAQNGAIVSPHKVEGIELHLRYQGTEAGPLFWAQYSFLGLDPVGLKDEYCPSYFHEMRNLTLVNRAYCIRNPKHYKGFGPDCWGLTASYSVDGYAAHSPNEQDDKGVISPTAALSSIVYTPEYSLQVMRHLYNMGDKVFGPFGFYDAFSETDNWYPQRYLAIDQGPIAVMIENYRTGLLWKLFMSHPDVQAGLTKLGFNTN

General information: TITO was launched using: RESULT: Template: 4QT9.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 : 1354 -146790 -108.41 -533.78 target 2D structure prediction score : 0.40 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : -108.41 2D Compatibility (Sec. Struct. Predict.) : 0.40 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.074

(partial model without unconserved sides chains): PDB file : Tito_4QT9.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4QT9-query.scw PDB file : Tito_Scwrl_4QT9.pdb: