Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MYIMKQSGWLELICGSMFSGKSEELIRRVKRATYAKQEVRVFKPVIDNRYSEAAVVSHNGTSMTSYAISSAADIWDHISESTDVVAVDEVQFFDQEIVEVLSSLADKGYRVIAAGLDMDFRGEPFGVVPNIMAIAESVTKLQAVCSVCGSPASRTQRLIDGKPASYDDPVILVGAAESYEARCRHHHEVPGKSKK 1W4R Chain:F ((19-187)) ------RGQIQVILGPMFSGKSTELMRRVRRFQIAQYKCLVIKYAKDTRY--------------ALPACLLRDVAQE-ALGVAVIGIDEGQFFP-DIVEFCEAMANAGKTVIVAALDGTFQRKPFGAILNLVPLAESVVKLTAVCMECFREAAYTKRL------GTEKEVEVIGGADKYHSVCR-----------

General information: TITO was launched using: RESULT: Template: 1W4R.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain F - contact count / total energy / energy per contact / energy per residue : 819 -111277 -135.87 -713.31 target 2D structure prediction score : 0.49 Monomeric hydrophicity matching model chain F : 0.77 3D Compatibility (PKB) : -135.87 2D Compatibility (Sec. Struct. Predict.) : 0.49 1D Compatibility (Hydrophobicity) : 0.77 QMean score : 0.425

(partial model without unconserved sides chains): PDB file : Tito_1W4R.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1W4R-query.scw PDB file : Tito_Scwrl_1W4R.pdb: