Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSGAAEIIEAILGESGPDYESYSFEETPGDTRSDSHFVTVEYQGESYEVVVKLAPEV-D-STFAVEPFLHEYVAER--TDVPLPGILVFKEEPEQDVPPYFITERIHGDNLDE-HFESFSMDERGAIMFEIGEILGDMHSTIAFEGYGRLDLDDGRLIVRDLSWDWRAYFEELTQGHIDQLAETTFEDLQPTARERLADRLSVVPKQGTPRLVHDDFRPGNLLIEPDGPEISAVLDWEKTLAGDPLYNLAQIELLFIDSVFRDPDEREQLRERLYEGYGTETDFDADESYQACKPLYQFSTLVWRMAGFDSIYGDASPLARTRAEAYYREQFTNLARTLEPDR 5IQI Chain:C ((10-281)) --TNVKAMKYLIEHYFDNFKVDSIEIIGSGYDSVAYLVN----N---EYIFKTKFSTNKKKGFAKEKAIYNFLNTNLETNVKIPNIEYSYISD---ELSILGYKEIKGTFLTPEIYSTMSEEEQNLLKRDIASFLRQMHGL-DYTDISECTIDN-------KQNVLEEYI-LLRETIYNDLT-DIEKDYIESFMERLNAT---TVFEGKKCLCHNDFSCNHLLLDGNN-RLTGIIDFGDSGIIDEYCDFIYLLEDSEEE------IGTNFGEDILRMYGNIDI----EKAKEYQDIVEEYYPIETIVY-----------------------------------

General information: TITO was launched using: RESULT: Template: 5IQI.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain C - contact count / total energy / energy per contact / energy per residue : 1174 18325 15.61 68.63 target 2D structure prediction score : 0.66 Monomeric hydrophicity matching model chain C : 0.67 3D Compatibility (PKB) : 15.61 2D Compatibility (Sec. Struct. Predict.) : 0.66 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.310

(partial model without unconserved sides chains): PDB file : Tito_5IQI.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5iqi-query.scw PDB file : Tito_Scwrl_5IQI.pdb: