Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -----------------------------MFTRTVQTLKNSTDLVQRFALPE--IWEDFELRRLSNKDRYKHYILIFKNVVSQKKDWEDVKVVAEIQERNH-NLRFNIKISK----QYPELAA-YEKLLEAKINAIINQSSLVIS------ 3NQN Chain:A ((4-158)) LSAEQSFTLRHPHGQAAALAFVREPAAALAGVRFLRGLDSDGEQVWGELLVTVPLLGEVDLPFRSEIVRTPQGAELRPLTLTGERAWVAVSGQATAAEGGEMAFAFQFQAHLAEGWGGAAFEKMVQAAAGRTLERVAKALPEGLAAGLPPA

General information: TITO was launched using: RESULT: Template: 3NQN.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 : 449 747 1.66 6.92 target 2D structure prediction score : 0.42 Monomeric hydrophicity matching model chain A : 0.60 3D Compatibility (PKB) : 1.66 2D Compatibility (Sec. Struct. Predict.) : 0.42 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.326

(partial model without unconserved sides chains): PDB file : Tito_3NQN.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3NQN-query.scw PDB file : Tito_Scwrl_3NQN.pdb: