Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKTIQIAIDGPASSGKSTVAKIIAKDFGFTYLDTGAMYRAATYMALKNQLGVEEVEALLALLDQHPISFGRSETGDQLVFVGDVDITHPIRENEVTNHVSAIAAIPEVREKLVSLQQEIAQQGGIVMDGRDIGTVVLPQAELKIFLVASVDERAERRYKENIAKGIETDLETLKKEIAARDYKDSHRETSPLKQAEDAVYLDTTGLNIQEVVEKIKAEAEKRM 1KDO Chain:B ((122-223)) ------------------------------------------------------------------------------------------------------------------------ELPGLIADGRDMGTVVFPDAPVKIFLDASSEERAHRRMLQLQEKGFSVNFERLLAEIKERDDRDRNRAVAPLVPAADALVLDSTTLSIEQVIEKALQYARQK-

General information: TITO was launched using: RESULT: Template: 1KDO.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 267 -12722 -47.65 -124.72 target 2D structure prediction score : 0.73 Monomeric hydrophicity matching model chain B : 0.63 3D Compatibility (PKB) : -47.65 2D Compatibility (Sec. Struct. Predict.) : 0.73 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.470

(partial model without unconserved sides chains): PDB file : Tito_1KDO.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1KDO-query.scw PDB file : Tito_Scwrl_1KDO.pdb: