Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKHEKLKQLSPLL---KQAISFQPMTSGFSGDRTFLVTTPSEKLVLKLSDIQK-YASLKKKTSILQNLKKR---GVLCSEVMEVGVSAEQNCTFRIFPFIEGENARASI-RLLTEEEQYKIGRRAGRDLRIMHTCDAPTYVA----PWDDRVLAKHERYVYAYQSSG--VAFSHDQFVLDFIQSHADVVKERPNQFQHDDFHVGNIIIQR-HQYAGVIDFDQSDWGDPIHDFYKLSLFS-RESSIPFSAGQLDAYLSTQTTHDFWLLFSIYTAMSCFSSIVWTLSYDPGHVKDMVNRVERMLTDHKRFTQLTPVWYTDWLDSCV 5IQI Chain:C ((12-288)) --VKAMKYLIEHYFDNFKVDSIEIIGSGYDS-VAYLVNN---EYIFKTKFSTNKKKGFAKEKAIYNFLNTNLETNVKIPNIEYSYIS--DELSILGYKEIKGTFLTPEIYSTMSEEEQNLLKRDIASFLRQMHGLDYTDISECTIDNKQNVL-EEYILLRETIYNDLTDIEKDYIESFMERLNAT--TVFEGKKCLCHNDFSCNHLLLDGNNRLTGIIDFGDSGIIDEYCDFIYLLEDSEEEIGTNFGEDILRMYGN-IDIEKAKEYQDIVEEYYPIETIVYGIKNIKQ-----------------------------------

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 : 1145 -16189 -14.14 -62.03 target 2D structure prediction score : 0.57 Monomeric hydrophicity matching model chain C : 0.66 3D Compatibility (PKB) : -14.14 2D Compatibility (Sec. Struct. Predict.) : 0.57 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.245

(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: