Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNIIQGNLVGTGLKIGIVVGRFNDFITSKLLSGAEDALLRHGVDTNDIDVAWVPGAFEIPFAAKKMAETKKYDAIITLGTVIRGATTHYDYVCNEAAKGIAQAANTTGVPVIFGIVTTENIEQAIERAGTKAGNKGVDCAVSAIEMANLNRSFE 1NQU Chain:B ((1-153)) MQIYEGKLTAEGLRFGIVASRFNHALVDRLVEGAIDCIVRHGGREEDITLVRVPGSWEIPVAAGELARKEDIDAVIAIGVLIRGATPHFDYIASEVSKGLANLSLELRKPITFGVITADTLEQAIERAGTKHGNKGWEAALSAIEMANLFKSL-

General information: TITO was launched using: RESULT: Template: 1NQU.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 : 823 -116499 -141.55 -761.43 target 2D structure prediction score : 0.73 Monomeric hydrophicity matching model chain B : 0.89 3D Compatibility (PKB) : -141.55 2D Compatibility (Sec. Struct. Predict.) : 0.73 1D Compatibility (Hydrophobicity) : 0.89 QMean score : 0.563

(partial model without unconserved sides chains): PDB file : Tito_1NQU.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1NQU-query.scw PDB file : Tito_Scwrl_1NQU.pdb: