Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKALIYARVSTNKEQQETSLKRQEEELTAIAAENGMEVVKVISEKASGYE-MDRDGVFELLDEIKNADIDVILVQDETRLGRGNAKI-ALLHCIYREGVKVYTTAHRGELE-------LSEADSMVLEIVSIVEEYQRKIHNMKIRRGMKRAVKNGFKPQKNLKNQHGNSGKEKIEVPISEIVRLRANKLTFAEIAATLRGFGYDVSKATVHRRFQEYIENEETAE 3PKZ Chain:A ((1-124)) -MIIGYARVSSLDQ----NLERQLENLKTFGAE------KIFTEKQSGKSIENRPILQKALNFVEMG--DRFIVESIDRLGRNYNEVIHTVNYLKDKEVQLMITSLPMMNEVIGNPLLDKFMKDLIIRILAMVSEQE-----------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3PKZ.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain A - contact count / total energy / energy per contact / energy per residue : 474 -7826 -16.51 -68.05 target 2D structure prediction score : 0.71 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -16.51 2D Compatibility (Sec. Struct. Predict.) : 0.71 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.411

(partial model without unconserved sides chains): PDB file : Tito_3PKZ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3PKZ-query.scw PDB file : Tito_Scwrl_3PKZ.pdb: