Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ------------MPLISIDSRKHLFYEEYG--QGIPIIFIHP-PGMGRKVFYYQRLLSKHFRVIFPDLSGHGDSDHIDQPA--SISYYANEIAQFMDALHIDKAVLFGYSAGGLIAQHIGFTRPDKVSHLILSG-------------------AYPAVHNVIGQK---------LHKLGMYLLEKNPGLLMKILAGSHTKDRQLRSILTDHMKKADQ---------AHWHQYYLDSLGY-----NCIEQLPRLEMPMLFMYGGLRDW--TFTNAGYYRRSCRHAEFFRLEYQGHQLPTKQWKTCNELVTGFVLTHHS 1QTR Chain:A ((4-317)) LRGLYPPLAAYDSGWLDTGDGHRIYWELSGNPNGKPAVFIHGGPGGGISPHHRQLFDPERYKVLLFDQRGCGRSRPHASLDNNTTWHLVADIERLREMAGVEQWLVFGGSWGSTLALAYAQTHPERVSEMVLRGIFTLRKQRLHWYYQDGASRFFPEKWERVLSILSDDERKDVIAAYRQRLTSADPQVQLEAAKLWSVWEGETVTLLPSR-ESASFGEDDFALAFARIENHYFTHLGFLESDDQLLRNVPLIRHIPAVIVHGRYDMACQVQNAWDLAKAWPEAELHIVEGAGHS--YDEPGILHQLMIATDRFAGK

General information: TITO was launched using: RESULT: Template: 1QTR.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 : 1266 -42084 -33.24 -166.34 target 2D structure prediction score : 0.57 Monomeric hydrophicity matching model chain A : 0.67 3D Compatibility (PKB) : -33.24 2D Compatibility (Sec. Struct. Predict.) : 0.57 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.264

(partial model without unconserved sides chains): PDB file : Tito_1QTR.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1QTR-query.scw PDB file : Tito_Scwrl_1QTR.pdb: