Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -MQIDIVQIVGLGLIATFLSLIVKEQKPTFAFLIVVFAGCAIFLYLVDQIYDIIRMIEKIAINANVNMVYVETILKIIGIAYIAEFGAQLTKDAGQGAIAS-KIELAGKILILVMAVPILTVII----ETILGLIPSMS 3C12 Chain:A ((50-187)) DQVLKGAALVGHNVLVPSAQVAIDATGSAKGVVAATSAG-FVNFEITDANGTFVKQLSVPASAAGEVSFAWDGTDANGNRMAAGKYGITATQTDTAGAKSKLATYVDAPVDSVTIGSDGLYLNLTGLGTSPLANVLRVS

General information: TITO was launched using: RESULT: Template: 3C12.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 : 591 -52883 -89.48 -400.63 target 2D structure prediction score : 0.17 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : -89.48 2D Compatibility (Sec. Struct. Predict.) : 0.17 1D Compatibility (Hydrophobicity) : 0.63 QMean score : -0.008

(partial model without unconserved sides chains): PDB file : Tito_3C12.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3C12-query.scw PDB file : Tito_Scwrl_3C12.pdb: