Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSQLNVDLQEIAKFEALAAKWWDQHSEFRPLHQINPLRLNWIDERAGGLAGKKVLDVGCGGGILAESMARRGA-DVLGIDMGEAPLAVGRLHAQQENV-QNIEYRQIPVEELAQEQAGQYDVVTCMEMMEHVPDPASIVKACQTLVKPGGHVFFSTINRNPKSYLFAIIGAEYVLRMLPKGTHDYHKFIRPSEMAHDIRNAGLTLKEMTGLHYNPITKRYWLAPNVDVNYMVHTIKTGV 4QNU Chain:H ((121-275)) ------------------------------------------------LTGRTILDVGCGSGYHMWRMIGAGAHLAVGIDPTQLFLCQFEAVRKLLGNDQRAHLLPLGIEQLP--ALKAFDTVFSMGVLYHRRSPLEHLWQLKDQLVNEGELVLETLVIDGDENTVLVPGDRY-----A-QMRNVYFIPSALALKNWLKKCGFVDIRIADV----------------------------

General information: TITO was launched using: RESULT: Template: 4QNU.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain H - contact count / total energy / energy per contact / energy per residue : 709 -19326 -27.26 -126.31 target 2D structure prediction score : 0.61 Monomeric hydrophicity matching model chain H : 0.63 3D Compatibility (PKB) : -27.26 2D Compatibility (Sec. Struct. Predict.) : 0.61 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.566

(partial model without unconserved sides chains): PDB file : Tito_4QNU.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4QNU-query.scw PDB file : Tito_Scwrl_4QNU.pdb: