Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRGFFGKAIFVVLAVFIMMPLLGIEAVRASELQQHVYDRAHLLSKAEIGKLESLSAKLGAKRDTDFIIITTKSTNGEDIADYTGDFYDRYGKGSTAILTIDMTNREVFIAGFKKAEQYLDNSRLNSIRNTISSDLSNENYFEAFETYIQLSYKDMGIKPGVNPDNIFFTWWFQLIAAIAVGGIAVSIMLYHAGGKVTVNGSTYMDQRTSDVIDQYDTYIRTTVTRERKPSDKDSGSDGGVTKGGTSYSGSRGSF 3L9A Chain:X ((9-88)) ---------------------------------------------------------------RDFFVITNSEYTFAG---------VHYAKG--AVLHVSPTQKRAFWV-IADQENFIKQVNKNI---EYVEKNASPAFLQRIVEIYQVKFEGKNVH------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3L9A.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain X - contact count / total energy / energy per contact / energy per residue : 326 -40476 -124.16 -505.94 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain X : 0.56 3D Compatibility (PKB) : -124.16 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.56 QMean score : 0.517

(partial model without unconserved sides chains): PDB file : Tito_3L9A.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3L9A-query.scw PDB file : Tito_Scwrl_3L9A.pdb: