Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDESGGEARAYMLGSGIVVKTQRPHRLRPRTSLEKEAHVLSLLAGP-LAGRIPRLFGYGREDTAAGPVEFLVMSRIRGCAALHA-----GLPAREALLASLADVLRSVHAADVTGLRDSGLLPADVDSAALRGRLQLGFADACDGFAAHRDRYA-GAGAPERIAIAAVDALAG---LTDESPVLLHSNPGPTHVFVGDGGLCTGLIDFGDAYASHPALDLRSWP-------DPADRIVLHEAYTGGRPTT-RGFDAVWTVVMILADLNAMLHRADLAEAAGRDLALRLAQL 3HAM Chain:A ((25-277)) --SSGDDSDTFLCNEQYVVKVPKRDS--VRISQKREFELYRFLENCKLSYQIPAVVYQ--------SDRFNIMKYIKGERITYEQYHKLSEKEKDALAYDEATFLKELHSIEIDCS---VS--LFSDA--LVNKKDK-FLQDKKLLISILEKEQLLTDEMLEHIETIYENILNNAVLFKYTPCLVHNDFSANNMIFRN-NRLFGVIDFGDFNVGDPDNDFLCLLDCSTDDFGKEFGRKVLKYYQHKAPEVAERKAELNDVYWSIDQIIYGYERK-----------------

General information: TITO was launched using: RESULT: Template: 3HAM.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 : 966 5341 5.53 22.73 target 2D structure prediction score : 0.57 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : 5.53 2D Compatibility (Sec. Struct. Predict.) : 0.57 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.331

(partial model without unconserved sides chains): PDB file : Tito_3HAM.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3ham-query.scw PDB file : Tito_Scwrl_3HAM.pdb: