Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence KQIAQLKEYLRNPPCKVTIYAPPLKQGQTQLRTVMGFASAGKN----EDVPVKIASTGHTY--QCRTDATCEEPVCHGLPNGWTYEGVY 1LDJ Chain:B ((1-88)) KKRFEVKKWNAVALWAWDIVVDNCAICRNHIMDLCIECQANQASATSEECTVAWGVCNHAFHFHCISRWLKTRQVCPLDNREWEFQKY-

General information: TITO was launched using: RESULT: Template: 1LDJ.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 256 -15239 -59.53 -185.84 target 2D structure prediction score : 0.41 Monomeric hydrophicity matching model chain B : 0.68 3D Compatibility (PKB) : -59.53 2D Compatibility (Sec. Struct. Predict.) : 0.41 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.191

(partial model without unconserved sides chains): PDB file : Tito_1LDJ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1ldj-query.scw PDB file : Tito_Scwrl_1LDJ.pdb: