Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNIQDMILTLQKHWSSQGCVLMQAYDVEKGAGTMSPYTFLRSIGPEPWKVAYVEPSRRPADGRYGENP---NRLYQHHQFQVIIKPSP---------DNIQELYLDSLRALGIDPLEHDIRFVEDNWENPSLGCAG---LGWEVWLDG----MEITQFTY---FQ-QV--------GGLECKPVSVE-ITYGIERLASYIQDKENVFDLEWTSGFTVKDLFMMAEYEHSVYTFETSDVDMLFQLFSTYEKEAIKQMDNGLVHPAYDYVLKCSHTFNLLDAKGAISVTERTGYIARVRNLARKVAKTYYEEREKLGFPMLKGEGSSHE 1SES Chain:A ((243-391)) --------------------------------------------ALPLRYAGYAPAFRSEAGSFGKDVRGLMRVHQFHKVEQYVLTEASLEASDRAFQELLENAEEILRLLELP-----YRLVEV--ATGDMGPGKWRQVDIEVYLPSEGRYRETHSCSALLDWQARRANLRYRDPEGRVRYAYTLNNTALATPRILAML-------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 1SES.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 : 350 5168 14.76 44.17 target 2D structure prediction score : 0.59 Monomeric hydrophicity matching model chain A : 0.59 3D Compatibility (PKB) : 14.76 2D Compatibility (Sec. Struct. Predict.) : 0.59 1D Compatibility (Hydrophobicity) : 0.59 QMean score : 0.442

(partial model without unconserved sides chains): PDB file : Tito_1SES.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1SES-query.scw PDB file : Tito_Scwrl_1SES.pdb: