Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence --------------------------------------------------------------------------MFKDKNKIIKSVEKINKLEEGLSLFEEGDEE--------YLSVLVKIQGLYDEISDTALECFKEMTTKIRKTGQKRIIKGIDQLP--HTIKENIADQVNDFKGGAI------- 4LEU Chain:A ((71-252)) KLIGKEALFVILGLKRLKEDDEKLDKFIKTHVFRLLKLDMLAVIGELERQEETALAIKMFEVIQKQEWYQPDVFMYKD---LIVSLAKSKRMDEAMALWEKMKKENLFPDSQTYTEVIRGFLR--DGCPADAMNVYEDMLKSPDPPEELPFRVLLKGLLPHPLLRNKVKKDFEELFPEKHAYDPPEE

General information: TITO was launched using: RESULT: Template: 4LEU.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 : 327 33295 101.82 365.88 target 2D structure prediction score : 0.76 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : 101.82 2D Compatibility (Sec. Struct. Predict.) : 0.76 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.635

(partial model without unconserved sides chains): PDB file : Tito_4LEU.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4LEU-query.scw PDB file : Tito_Scwrl_4LEU.pdb: