Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKQNFAIVGLGRFGGSICRTLIEAGQEVLAIDSNEDRVNEYMNIATHAVVANAQDEMTLRSLGIRNFDHVIVAIGEDIQASILVTLMVKEMGVPNILAKAQNEYHARVLEKIGADRVVHPERDMGIRIAHNLVSKNILDYLELSDKYSLAEIRVSNPKFFNKTLAELNFRQRFDLTVVAIRRVDQTVIASPAADEYVRENDNLLVIGETGDVDILDDKMNQ 4J91 Chain:C ((8-214)) ---QFAVIGLGRFGGSICKELHRMGHEVLAVDINEEKVNAYASYATHAVIANATEENELLSLGIRNFEYVIVAIGANIQASTLTTLLLKELDIPNIWVKAQNYYHHKVLEKIGADRIIHPEKDMGVKIAQSLSDENVLNYIDLSDEYSIVEL-L---KLDSKSIIDLNVRAKYGCTILAIKH-HGDICLSPAPEDIIREQDCLVIMGHKKDI---------

General information: TITO was launched using: RESULT: Template: 4J91.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain C - contact count / total energy / energy per contact / energy per residue : 918 -163638 -178.25 -802.14 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain C : 0.88 3D Compatibility (PKB) : -178.25 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.88 QMean score : 0.575

(partial model without unconserved sides chains): PDB file : Tito_4J91.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4J91-query.scw PDB file : Tito_Scwrl_4J91.pdb: