Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -------------------MANEETVGLRIIEEAFKLPMVKVDRRAFLIQTFQGKVSDIEGLIEK-----GPQAFLSKEMLD---REAQKCIQSITLKS-SAVSLATGLPGGIAM--AATIPADLLQ-----FFGYSL-------------------RLAQEISYIYGF-KDLMGENGE----LSEEAKNTLILYLGIMLG-VTSAGSAVRAMS-GKLSTQALKKIPQKALTQTLYYPVIKRVLGIFGTKLTKNTFAKGISKAVPVVGGVVSGGINYLSMKPMATKLQTELGKNVAYTEESLQQDLDILEGEFEEVSSDIASSDTVLSQLERLSHLLETNMITEEEFQQLKQELLKK 4B46 Chain:A ((1-367)) MKLAMIGFGQAGGKVVDKFVEYDRERNAGIVRAAVAVNSAKADLLGL--KNIPKDQRVLIGQSRVKGHGVGADNELGAEIAEEDIDEVQGAIDSIPVHEVDAFLVVSGLGGGTGSGGAPVLAKHLKRIYTEPVYGLGILPGSDEGGIYTLNAARSFQTFVREVDNLLVFDNDAWRKTGESVQGGYDEINEEIVNRFGVLFGSVVDSSEIINTLAGGGVSTVGYASEGVTAHTTNRITSLVRKAAL---GRLTLPCEIEGAERALLVLAGP-PEHLNRKGIERGRKWIEEQTGS------------MEVRGGDYPIPGAEKVAGVILLSGV--------TNVPRIKELQQVAIEAQD-

General information: TITO was launched using: RESULT: Template: 4B46.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 : 1496 7678 5.13 28.54 target 2D structure prediction score : 0.39 Monomeric hydrophicity matching model chain A : 0.68 3D Compatibility (PKB) : 5.13 2D Compatibility (Sec. Struct. Predict.) : 0.39 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.320

(partial model without unconserved sides chains): PDB file : Tito_4B46.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4B46-query.scw PDB file : Tito_Scwrl_4B46.pdb: