Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSAQSKVLITGASSGIGSVYADRFAQRGYHLILVARDTNRLDKISKDLQEKYGLQVEFIQADLSNDQDIRKI-EDVLKNDADIEILVNNAGIALNGNFLTQDRN-EIEKLLTLNITAVVRLSHAMSQSLIRKGKGAIINLGSVLGLAPEFGSTIYGASKSFIQFFSQGLHLELKDHGVHVQAVLPSATKTEIWERSGID--------LSQVPPLMDVNDLVDAALIGFDRKETITIPVLKDENQWNNFEKSRMTLLPNFSSAEVAQRYKN 4QEC Chain:A ((2-220)) ---KKNVLITGGFKGIGKQVALEFLKNDYHVCITSRYFEKEKRIPH-LFSSYEENISFYQLDVTDEEQVNEIINKIVKKFGRLDVLVNNAGISLSDGLLTETKTTDFNKMINTNILGTYFCMKYALKHMQKVSCGAIVNISSITGLSGFPYSILYGSTKHAVIGLTKGAAVEFADKGIKINAVAPGIIKTETLQKE-IDSGEFSEDSISSIHPMQKLGTTLDVA----------------------------------------------

General information: TITO was launched using: RESULT: Template: 4QEC.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 : 961 -54773 -57.00 -262.07 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain A : 0.76 3D Compatibility (PKB) : -57.00 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.76 QMean score : 0.552

(partial model without unconserved sides chains): PDB file : Tito_4QEC.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4QEC-query.scw PDB file : Tito_Scwrl_4QEC.pdb: