Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTKKSNKIAALDTEYA--KKKYAEFQQQQRQLIFRRRRLAAIFVGALVIFAIIGVQIFHDMQRMHQLNELRVEANTEMKEVNADVDQLHQDVSLLKDDEYVAKLARSKFFYSKDGEKVYPILESNTDSSTNETDQSTSSTTAK 1WA8 Chain:B ((601-695)) MTEQQWNFAGIEAAASAIQGNVTSIHSLLDEGKQSLTKLAAAWGG----------------SGSEAYQGVQQKWDATATELNNALQNLARTISEAGQ-------------------------------AMASTEGNVTGMFA-

General information: TITO was launched using: RESULT: Template: 1WA8.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 224 25751 114.96 276.89 target 2D structure prediction score : 0.69 Monomeric hydrophicity matching model chain B : 0.63 3D Compatibility (PKB) : 114.96 2D Compatibility (Sec. Struct. Predict.) : 0.69 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.568

(partial model without unconserved sides chains): PDB file : Tito_1WA8.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1WA8-query.scw PDB file : Tito_Scwrl_1WA8.pdb: