Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNNIKESVQKLLGEELIVFELKGKGACNNAYYVETQSGKKFIIKEERPNGELKEQNSLAVEAHVIKQLSNLNFSAPLAKVYFISKEPNMFGYVYIEGDLLIDAWKKLTEEERIGICQNLGVFHAELEQRVTEAMAREMGVQINTYIGLHPEVEEEYSKILTFTDIPNGWKTLAQKTKTIFDKTLELGVF-----QFLHNDAHHENIIVKDGEITGIIDFGDSEYGEIAREFSRYIRDFPDHA-EYIIKAYEKASGHKLSRE--RLISNSFLSGLMDNVEDYRKGGEDCIRAEKAVSKYEDIFT----- 3HAM Chain:A ((1-299)) MVNLDAEIYEHLNKQIKINELRYLSSGDD--SDTFLCNEQYVVKVPKRD---SVRISQKREFELYRFLENCKLSYQIPAVVYQSDRFNIMKYIK-GERITYEQYHKLSEKEKDALAYDEATFLKELHSIEIDCSVSLFSDALVNKKDKFLQDKKLLISILEKEQLLT--DEMLEHIETIYENILNNAVLFKYTPCLVHNDFSANNMIFRNNRLFGVIDFGDFNVGDPDNDFLCLLDCSTDDFGKEFGRKVLKYYQHKAPEVAERKAELNDVYWSIDQIIYGYERK-DREMLIKGVSELLQTQAEMFIF

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 : 1252 -35788 -28.58 -125.13 target 2D structure prediction score : 0.62 Monomeric hydrophicity matching model chain A : 0.68 3D Compatibility (PKB) : -28.58 2D Compatibility (Sec. Struct. Predict.) : 0.62 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.454

(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: