Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MQLSKLLDHWFPHPFVSFLIIIFWLMLAHSLDASDLLMAVILGLVIPRLVRPFITRTPHIHWKPAIKLCFVVLWDIIISNFRVAKLVLGPPKKLHPKWYRVPLETEHEQVNSLLAMIITTTPGTVSAGIDQERGDILVHSLSTENTESDVQDIKQRYEAPLIEIFDVKSKSEDNA 3DOH Chain:A ((36-94)) -------------------------------------------------------------------------------------------QKLSPDQFSVKVKTGDTYSSRTITKVYANNSGGLSFSIFNNRGKYVVLELSTEDLHSNT-------------------------

General information: TITO was launched using: RESULT: Template: 3DOH.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 : 172 -4117 -23.94 -69.78 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain A : 0.53 3D Compatibility (PKB) : -23.94 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.53 QMean score : 0.264

(partial model without unconserved sides chains): PDB file : Tito_3DOH.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3DOH-query.scw PDB file : Tito_Scwrl_3DOH.pdb: