Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MGRIKNKQFAVIGLGRFGGSICKELHRMGHEVLAVDINEEKVNAYASYATHAVIANATEENELLSLGIRNFEYVIVAIGANIQASTLTTLLLKELDIPNIWVKAQNYYHHKVLEKIGADRIIHPEKDMGVKIAQSLSDENVLNYIDLSDEYSIVELLATRKLDSKSIIDLNVRAKYGCTILAIKHHGDICLSPAPEDIIREQDCLVIMGHKKDIKRFENEGM 1LSU Chain:A ((11-144)) ------KQFAVIGLGRFGGSIVKELHRMGHEVLAVDINEEKVNAYASYATHAVIANATEENELLSLGIRNFEYVIVAIGANIQASTLTTLLLKELDIPNIWVKAQNYYHHKVLEKIGADRIIHPEKDMGVKIAQSLSDEN----------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 1LSU.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 : 628 -110465 -175.90 -824.37 target 2D structure prediction score : 0.74 Monomeric hydrophicity matching model chain A : 0.81 3D Compatibility (PKB) : -175.90 2D Compatibility (Sec. Struct. Predict.) : 0.74 1D Compatibility (Hydrophobicity) : 0.81 QMean score : 0.595

(partial model without unconserved sides chains): PDB file : Tito_1LSU.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1LSU-query.scw PDB file : Tito_Scwrl_1LSU.pdb: