Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSAQLFVVATPIGH--L-DDMTFRAIDILKSVSVVAAEDTRQSAQLFKHYNIS-----TPLTACHDHNESNKIEQLVQKLLAGENIALISDAGTPLISDPGFKLVRAAQEHGIRVVPVPGACAAIAALSAVGLPSDRFSFEGFLPSKASQRITQLEKLK----NETQTLIFYEAPHRILECVKNMAEVFGENRPVGFAREITKTFETIKKMTLKDLVSFIENDHNQEKGEIVLVVGGAPEKTDQEQEKLDELLKRLLQDLSVKAASQLAADLTGIKKKVAYQRALELTQS 1WYZ Chain:C ((2-235)) -ETALYLLPVTLGDTPLEQVLPSYNTEIIRGIRHFIVEDVRSARRFLKKVDREIDIDSLTFYPL----SPEDISGYLKPLAGGASMGVISE-------DPGADVVAIAQRQKLKVIPLVGPSSIILSVMASGFNGQSFAFHGYLPIEPGERAKKLKTLEQRVYAESQTQLFIETPYRNHKMIEDILQNCRPQTKLCIAANITCEGEFIQTRTVKDWKGHIP---ELSKIPCIFLLYKL----------------------------------------------------

General information: TITO was launched using: RESULT: Template: 1WYZ.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain C - contact count / total energy / energy per contact / energy per residue : 853 -20907 -24.51 -99.08 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain C : 0.74 3D Compatibility (PKB) : -24.51 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.74 QMean score : 0.636

(partial model without unconserved sides chains): PDB file : Tito_1WYZ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1WYZ-query.scw PDB file : Tito_Scwrl_1WYZ.pdb: