Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MIMDDKEILQLLRNDF-GVSVCNLKRVKSGNIKTVFSFTYERKEYVIRFSKGN---NEFETEQFLYKLTHK----NDHMARLIKIGTYKNLYYSITERVKGCPLKEL-----NLSKVKTIIPQLIESVTCIHQTDLTPSCGYGWIKDGNGCFSSFRELIETHFKQEQNGFWNDWYTLFEDSFLDYDSFMTLYKEMVRLSPYSDGQRFLTHGDFHFSNIFSDG-KMITGIIDWGNVMYGDFILDIAMLHMLY---PSLNFKEAFKNYYNTHQIKVENYDKRFICMSLFKGLDTLRFAAKTGDRPFYKSLLNYLQELIAQKKAEDSSYFSHSYKK 5IQI Chain:C ((9-289)) -ATNVKAMKYLIEHYFDNFKVDSIEIIGSGYDSVAYLVN---NEYIFKTKFSTNKKKGFAKEKAIYNFLNTNLETNVKIPNIEYSYISDELSILGYKEIKGTFLTPEIYSTMSEEEQNLLKRDIASFLRQMHGLDYTD---ISECTID-NKQNVLEEYIL-----LRE----TIYNDLTD--IEKDYIESFMERLNAT-TVFEGKKCLCHNDFSCNHLLLDGNNRLTGIIDFGDSGIIDEYCDFIYLLEDSEEEIGTNFGEDILRMYGNI--DIEKAKEYQDIVEEYYPIETIVYGIKNIKQE------------------------------

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 : 1151 21664 18.82 82.06 target 2D structure prediction score : 0.65 Monomeric hydrophicity matching model chain C : 0.67 3D Compatibility (PKB) : 18.82 2D Compatibility (Sec. Struct. Predict.) : 0.65 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.424

(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: