Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MVFDVWKSLKKGEVHPVYCLYGKETYLLQETVSRIRQTVVDQETKD-----FNLSVFDLEE---DPLDQAIADAET---FPFMGERRLVIVKNPYFLTGEKKKEKIEHNVSALESYIQSPAPYTVFVLLAPYEKLDERKKLTKALKKHAFMMEAKELNAKETTDFTVNLAKTEQKTIG-TEAAEHLVLLVNGHLSSIFQEIQKLCTFIGDREEITLDDVKMLVARSLEQNIFELINKIVN----RKRTESLQIFYDLLKQNEEPIKIMALISNQFRLILQTKYFAEQGYGQKQIASNLKVHPFRVKLAMDQARLFSEEELRLIIEQLAVMDYEMKTGKKDKQLLLELFLLQLLKRNEKNDPHY 1SXJ Chain:E ((27-351)) -----KSLSDQPRDLPHLLLYGPNGTGKKTRCMALLESIFGPGVYRNVVSSPYHLEITPS-NDRIVIQELLKEVAQMEQ-----RYKCVIINEANSLTK--------DAQAALRRTMEKYSKNIRLIMVCD--SM---SPIIAPIKSQCLLIRCPAPSDSEISTILSDVVTNERIQLETKDILKRIAQASNGNLRVSLLMLESMALNNE----LALKSSSPIIKPDWIIVIHKLTRKIVKERSVNSLIECRAVLYDLLAHCIPANIILKELTFSLL----------------------------------DVETLNTTNKSSIIEYSSVFDERLSLGN-KAIFHLEGFIAKVMC---------

General information: TITO was launched using: RESULT: Template: 1SXJ.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain E - contact count / total energy / energy per contact / energy per residue : 1039 -3052 -2.94 -11.10 target 2D structure prediction score : 0.60 Monomeric hydrophicity matching model chain E : 0.66 3D Compatibility (PKB) : -2.94 2D Compatibility (Sec. Struct. Predict.) : 0.60 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.532

(partial model without unconserved sides chains): PDB file : Tito_1SXJ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1SXJ-query.scw PDB file : Tito_Scwrl_1SXJ.pdb: