Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKFAVIVLPGSNCDIDMYHAVKDELGHEVEYVWHEE--TSL--DGFDGVLIPGGFSYGDYLRCGAIARFANIMPAVKQAAAEGKPVLGVCNGFQILQELGLLPGAMRRNKDLKFICRPVELIVQ------------------------------NDETLFTASYEKGESITIPVAHGEGNFYCDDETLATLKENNQIAFTYGSNINGSVSDIAGVVNEKGNVLGMMPHPERAVDELLGSADGLKLFQSIVKNWRETHVTTA 4WIN Chain:A ((19-243)) DKILVLNFGSQY-FHLIVKRLNNI-KIFSETKDYGVELKDIKDMNIKGVILSGGPYSVTEA---GSPHL--KKEVFEYFLEKKIPIFGICYGMQEIAVQM---NGEVKKSKT-SEYGCTDVNILRNDNINNITYCRNFGDSSSAMDLYSNYKLMNETCCLFENIKS-DITTVWMNHNDEVTKIP---------ENFYLVSS--SENC---LICSIYNKEYNIYGVQYHPEVYESL-DG----ELMFYNFAYNICKC-----

General information: TITO was launched using: RESULT: Template: 4WIN.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 : 1166 -126183 -108.22 -660.64 target 2D structure prediction score : 0.61 Monomeric hydrophicity matching model chain A : 0.61 3D Compatibility (PKB) : -108.22 2D Compatibility (Sec. Struct. Predict.) : 0.61 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.315

(partial model without unconserved sides chains): PDB file : Tito_4WIN.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4WIN-query.scw PDB file : Tito_Scwrl_4WIN.pdb: