Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTAANQETILELRDVKKYFPIRSGLFQRKVGDVKAVDGVSFSLKKGETLGIVGESGCGKSTAGRTMIRLYKPTEGQILFKGQDISNLSEEKLRKSVRKNIQMVFQDPFASLNPRKTLRSIIKEPFNTHNMYTMRERNEKVEELLARVGLHPSFAGRYPHEFSGGQRQRIGIARALTLNPELIIADEPVSALDVSIQAQVINLMEELQEEFNLTYLFISHDLSVVRHISDRVGVMYLGKMMELTGKHELYDNPLHPYTQALLSSVPVTRKRGSVKRERIVLKGELPSPANPPKGCVFHTRCPVAKPICKEQIPEFKEAAPSHFVACHLYS 1OXU Chain:B ((14-266)) ----------------------------KKGKVVALDNVNINIENGERFGILGPSGAGKTTFMRIIAGLDVPSTGELYFDDRLVASNGKLIVPPEDRK-IGMVFQT--WALYPNLTAFENIAFPLTNMKM-SKEEIRKRVEEVAKILDIH-HVLNHFPRELSGGQQQRVALARALVKDPSLLLLDEPFSNLDARMRDSARALVKEVQSRLGVTLLVVSHDPADIFAIADRVGVLVKGKLVQVGKPEDLYDNPVSIQVASLIGE--INELEGKVTNEGVVI-GSLRFPVS----------------------------------------

General information: TITO was launched using: RESULT: Template: 1OXU.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 1172 -140608 -119.97 -555.76 target 2D structure prediction score : 0.57 Monomeric hydrophicity matching model chain B : 0.72 3D Compatibility (PKB) : -119.97 2D Compatibility (Sec. Struct. Predict.) : 0.57 1D Compatibility (Hydrophobicity) : 0.72 QMean score : 0.469

(partial model without unconserved sides chains): PDB file : Tito_1OXU.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1OXU-query.scw PDB file : Tito_Scwrl_1OXU.pdb: