Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTAANQETILELRDVKKYFPIRSGLFQRKVGDVKAVDGVSFSLKKGETLGIVGESGCGKSTAGRTMIRLYKPTEGQILFKGQDISNLSEEKLRKS---VRKNIQMVFQDPFASLN--PRKTLRSIIKEPFNTHNMYTMRERNEKVEELLARVGLHPSFAGRYPHEFSGGQRQRIGIARALTLNPELIIADEPVSALDVSIQAQVINLMEELQEEFNLTYLFISHDLSVVRHISDRVGVMYLGKMMELTGKHELYDNPLHPYTQALLSSVPVTRKRGSVKRERIVLKGELPSPANPPKGCVFHTRCPVAKPICKEQIPEFKEAAPSHFVACHLYS 5DGX Chain:A ((29-238)) ------------------------------GEHKVLSGVSVDIKAGQTVAFVGKSGSGKTTLTSIISRFYTQHEGEILLDGVDTRELTLENLRSHLSIVSQNVHLFDDTVYNNIAFG--EVSEEEVIDALKRANAY------EFVQEL--SDGINTNI-GNNGSKLSGGQRQRISIARALLKNAPVLIFDE----------------LESLTK--SCTTIVIAHRLSTVEN-ADKIVVMDGGRVVE-SGKHQ----------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5DGX.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 : 836 -80427 -96.20 -432.40 target 2D structure prediction score : 0.49 Monomeric hydrophicity matching model chain A : 0.68 3D Compatibility (PKB) : -96.20 2D Compatibility (Sec. Struct. Predict.) : 0.49 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.543

(partial model without unconserved sides chains): PDB file : Tito_5DGX.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5DGX-query.scw PDB file : Tito_Scwrl_5DGX.pdb: