Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSNSHHATESLSQDKKHAGKVGKMKLKQLPLEYQKAIPVLKKLENAGYEAYFVGGSVRDILLNQPIHDVDIATSAFPEEIKQLFPKTIDIGI----EHGTVLVLENDEQYEITTFRTESTYQDYRRPDHVEFVR--SLSEDLKRRDFTINAFA----LKEDGEIIDLFDGLQDLEEQILRAVGNPHERFHEDALRMMRGLRFVSQLGFKLEEETFYAIKENHELLGKISVERINVEFIKMLLGNERAAGIHAFIETECYICCPGLKEEGEALLRLLNYHPSH 4WC4 Chain:A ((10-175)) ----------------------------------------------GLRAYIVGGVVRDILLGKEVWDVDFVVEGNAIELAKELARRHGVNVHPFPEFGTAHLKIGKLKLEFATARRET--------------EPASLKEDLIRRDFTINAMAISVNLEDYGTLIDYFGGLRDLKDKVIRVL-HPVS-FIEDPVRILRALRFAGRLNFKLSRST--------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4WC4.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 : 611 10319 16.89 72.67 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain A : 0.68 3D Compatibility (PKB) : 16.89 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.407

(partial model without unconserved sides chains): PDB file : Tito_4WC4.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4WC4-query.scw PDB file : Tito_Scwrl_4WC4.pdb: