Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTSPAALITAAEKTWPDLDYRDPAIPRQGMDHHVAVLGDHILRASVTDAYRAQAPTESAVLAELAPLTDTRLPLVLRHTDDWSFTLHPLIPGRALDAAHWGRLPRSERGQLTDQLASLLTALHSRDIAASPYRDVEPWFHGPAPNPAPRALPAKVDLLREQVTELDLDREDRRVIGEILAGMDDLLDRAH-HAHRARLVHGDLYPAHLLWSSGHGLGAIDFSDMNLGDPAVDFAHLSDISPELPDEVLARTGLDHDPGILDRAWAYKRWDAVFLLVDHLRTGHTGAATAHSLFDAARHPTRPGAR 3HAV Chain:A ((71-235)) ----------------------------------------------------------------------QIPAVVYQSD--RFNIMKYIKGERITYEQYHKLSEKEKDALAYDEATFLKELHSIEIDCSV-----SLFSDALVNKKDKFLQDKKLLISILEKEQLLTDE---MLEHIETIYENILNNAVLFKYTPCLVHNDFSANNMIFRNNRLFGVIDFGDFNVGDPDNDFLCLLDCSTD---------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3HAV.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 : 461 -35688 -77.41 -221.66 target 2D structure prediction score : 0.66 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : -77.41 2D Compatibility (Sec. Struct. Predict.) : 0.66 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.216

(partial model without unconserved sides chains): PDB file : Tito_3HAV.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3hav-query.scw PDB file : Tito_Scwrl_3HAV.pdb: