Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNHQAAGGQLVGNIYFERMFIMFHVFYEFQFVEIVKEF----FELPYKSDNSLSF----DSAFQNCAKPE----WNKIKNKKRNFTSVAKQEFDFFRITNSPEYVPANNEIFSEVGYIKLLNKFMKYAITFDDVTIKKFFQYEEFSRDLI--SELVNFMMTQSKPYKLTNDAQFVLEKIELITDDNGIFKLGQIGWKSQKRLIPLLKKEKETLSPINIASILFELWSTKKIAPCPLDPTK----IKEKEKKKEKVEKQEKDNKHSNLYIEVNLDYPEDVPFPNGNYYTLYIKNKRNSLYYGEWDGLKHVAKEKKGIFKKVKGDLYQEIEKIRKNQEISQERNLYIVVNKENISIIHSNIEFWSSFENKVRSVKSKLSTLAHQNKIIGYEASTLEEQTIFNDFLPSWKWQLLSPEIDLDRHLFELETE 4DAP Chain:A ((1-234)) ----------------------MEFSPPLQRATLIQRYKRFLADVITPDGRELTLHCPNTGAMTGCATPGDTVWYSTSDNTKRKY----PHTWELTQ-SQSGAFICVN---------TLWANRLTKEAILNE--SISELSGYSSLKSEVKYGASRIDFMLQADS----RPDCYIEVKSVTLAENEQGYF-PDAVTERGQKHLRELMSVAAEGQRAVIFFAVLHS--AITRFSPARHIDEKYAQLLSEAQQRGVEILAYKAEISAEGMALKKSLPVTL------------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4DAP.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 : 1064 44567 41.89 208.26 target 2D structure prediction score : 0.40 Monomeric hydrophicity matching model chain A : 0.61 3D Compatibility (PKB) : 41.89 2D Compatibility (Sec. Struct. Predict.) : 0.40 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.211

(partial model without unconserved sides chains): PDB file : Tito_4DAP.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4DAP-query.scw PDB file : Tito_Scwrl_4DAP.pdb: