Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSIIGRFKDIMSANINALLDKAENPEKMVDQYLRNMNSDLAKVKAETAAVMAEEQRAKREYHECQADMEKMESYAMKALQAGNESDARKFLERKTSLESKLSELQAANQIAATNAAQMRKMHDKLVSDIGELEARKNMIKAKWAVAKTQERMNKLGASVSSTSQSMSAFGRMEDKVNKALDQANAMAELNSAPQDDMADLSAKYDTGGSSQVDDELAALKAKMMLDK 4OVU Chain:B ((458-567)) -------------------EKSREYDRLYEEYTRTSQ----EIQMKRTAIEAFNETIKIFEEQCQTQERYSKEYIEKF----NEKEIQRIMHNYDKLKSRISEIIDSRR-------RLEEDLKKQAAEYREIDKRMNSIK---------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4OVU.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 : 164 -5472 -33.37 -51.62 target 2D structure prediction score : 0.82 Monomeric hydrophicity matching model chain B : 0.64 3D Compatibility (PKB) : -33.37 2D Compatibility (Sec. Struct. Predict.) : 0.82 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.560

(partial model without unconserved sides chains): PDB file : Tito_4OVU.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4OVU-query.scw PDB file : Tito_Scwrl_4OVU.pdb: