Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKFPKKLLPIAVLSSIAFSSLASGSVPEASAQEKKKGNQDEIKNVIVLIGDGMGVSYTSAYRYLKDNKK---------TKVVEPTAFDQYLV-GQQTTYPDDPEQNVTDSAAAATAMSAGIKTYNNAIA-VDNDGS---EAKTVLEAAKEKGKATGLVATSEITHATPASFGSHDHSRKNMNSIADDYFDEMVNGKHKIDVLLGGGKSNFDRKDRN---LIKEFKKAGYSYVDDRKDMLKNKDSQVLGLFA-----DGGLPKKIDRTKDIPSLKDMTNTAIKKLNKDKD---GFFLMVEGSQIDWAGHDNDIVGAMSEMEDFEQAYKAAIDFAKKD-KHTLVVATADHSTGGYSIGADGIYNWFSEPIKAAKRTPDFMAEKIADGADVEKTLKTYIDQKK--LALTKAEIQSVEEAAKSKEVLDIDNAIENIFNKRSHTGWTTGGHTGEDVPVYAYGPSSETFAGQIDNTEIAKNVFKALQYNIKINDK 2X98 Chain:B ((6-416)) --------------------------------------------NAIAYIVDGMGQTQISAARYLNAYKTAPERFPLNVSPAETPTGFDAFSSRGSMTTFPDDPYETTTDSAAAATAFASGVKTYNGAIGGVQTSGGGFQRVDTVLERASAQGYATGLITTTEATHATPAAFAAHVEDRGNQTEIARQYIEET-----QPDVILGGQRRDFEADASNGGTLVDAARDNGYTIAETAAELDAVDDPPVLGLFSQESHLDYYLDRKNDPENTQPNLDAMVDAGVDLLS--GDPDKGFFLLVESGRVDHAGHAN-YPAQVAEQYEATQVAGQLVEYAETTAEPTFLVSTGDHECGGLTLGRDSPYEVEYDVLAAQKATTSRLRDLLA-GVRSADELESIVAAHTGITALTDREVAKLRDAPGS---------ISTILAERAGIAFTTDGHTGTDVPVFAHGPNAARFDAARDNT-------------------

General information: TITO was launched using: RESULT: Template: 2X98.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 : 2375 -101639 -42.80 -266.77 target 2D structure prediction score : 0.70 Monomeric hydrophicity matching model chain B : 0.76 3D Compatibility (PKB) : -42.80 2D Compatibility (Sec. Struct. Predict.) : 0.70 1D Compatibility (Hydrophobicity) : 0.76 QMean score : 0.464

(partial model without unconserved sides chains): PDB file : Tito_2X98.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2X98-query.scw PDB file : Tito_Scwrl_2X98.pdb: