Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNHIKWLSDLKKAGLLALGKGVITLLKRFSLVIVTLMMSIVVVLAAAKESPGDHVISFDEPIILMISIGIVVFLLIPPLVMSFFGNLVVRIISGVYQCFIVFTFLGLIPIGFLIPNGFLTILVSIAGTLVSIASVAVTLCIGKNKKDI 4CXF Chain:B ((2-30)) ADVEEWLTHARKVTQEASIGVDVTSIQEC-----------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4CXF.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 8 276 34.44 9.50 target 2D structure prediction score : 0.59 Monomeric hydrophicity matching model chain B : 0.36 3D Compatibility (PKB) : 34.44 2D Compatibility (Sec. Struct. Predict.) : 0.59 1D Compatibility (Hydrophobicity) : 0.36 QMean score : 0.294

(partial model without unconserved sides chains): PDB file : Tito_4CXF.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4CXF-query.scw PDB file : Tito_Scwrl_4CXF.pdb: