Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNEFMKKFSLTKPIIQAPMAGGITKPRLASAVSNQGALGSLASGYLTPDLLEQQIKEIFELTDAPFQINVFVPLGLEMPPKDQIKKWKENIPLANQVNQFTSVQEEWDDFYQKIDLILKYKVKACSFTFDLPPEDAVKELKTAGCCLIGTASTVEEALLMEERGMDIVVLQGSEAGGHRGAFLPSKGESAVGLMALIPQAADALSVPVIAAGGMIDHRGVKAALTLGAQGVQIGSAFLICHESNAHPVHKQKILEANEADTKLTTLFSGKEARGIVNKWMEENEQFETQTLPYPYQNTLTKA--MRQKASLQNNHDQMSLWAGQGIRSLTEEISVKQLLNQLCQEDIKI 4IQL Chain:A ((21-324)) MNRICELLGIEHPIISGGMV-WCSGWKLASAVSNCGGLGLIGAGSMHPDNLEHHIRSCKAATDKPFGVNVPLLYPE---------------------------------MDKIMEIIMREHVPVVVTSAGSP-KVWTAKLKAAGSKVIHVVSSATFARKSEAAGVDAIVAEGFEAGGHNGRE-------ETTTLCLIPEVVDAVNIPVVAAGGIASGRAVAAALALGADAVQVGTRFALSEESSAHEDFKAHCRRSVEGDTMLSLKA-VSPTRLLKNKFYQDVFAAEQRGASVEELRELLGRGRAKQGIF-EGDLHEGELEIGQAVSQISHAETVAEIMVDLVDGYKR-

General information: TITO was launched using: RESULT: Template: 4IQL.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 : 1925 -142088 -73.81 -470.49 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain A : 0.73 3D Compatibility (PKB) : -73.81 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.73 QMean score : 0.474

(partial model without unconserved sides chains): PDB file : Tito_4IQL.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4IQL-query.scw PDB file : Tito_Scwrl_4IQL.pdb: