Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNTSNRRMGLFYVITGATCWGIGGTVAKKLFQEYQIDVNWLVTTRLLTAGMLLLMLQLFRKDRSQVIEVWKHKASAGQLLIFGLLGMLAVQYTYMASIQHGNAAVATLLQYLSPVIVIIYTLLRKQTVLTKQDIITVVLALVGCFFLLTNGSMSQLSVPAAAVVWGVLSGFAAAFYTLYAV----------------GLLNKFDSLVVVGWAMIIGGFALGFIHPPWQLDFQRLTAEAYAYILFVILFGTMIAFWFFIKSLESLSPKETSLLGSLEPLSAVVTTVVWLKAPFGSFQWIGAICIIGITLILALHKEPSMESEKSILKIRNHANRDI 4HYJ Chain:A ((113-241)) ------------------------------------------------------------------------------------------------------------------------------TKLVIADVIMIVGGYIGESSINIAGGFTQLGL------WSYLIGCFAWIYIIYLLFTNVTKAAENKPAPIRDALLKMRLFILIGWAIYPIGYAVTLFAPGVEIQLVRELIYNFADLTNKVGFG-LIAF-FAVKTMSS------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4HYJ.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 : 302 -61254 -202.83 -542.07 target 2D structure prediction score : 0.79 Monomeric hydrophicity matching model chain A : 0.54 3D Compatibility (PKB) : -202.83 2D Compatibility (Sec. Struct. Predict.) : 0.79 1D Compatibility (Hydrophobicity) : 0.54 QMean score : 0.237

(partial model without unconserved sides chains): PDB file : Tito_4HYJ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4HYJ-query.scw PDB file : Tito_Scwrl_4HYJ.pdb: