Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKLVTAIVKPFKLDDVREALSDIGVQGITVTEVKGFGRQKGHTELYRGAEYVVDFLPKVKIEIAISDEMVDAVIESITRVASTGKIGDGKIFLTNLEQVIRIRTGETGPDAV 4CO2 Chain:B ((1-112)) MKLVMAIIKPFKLDEVREALTSLGIQGLTVSEVKGFGRQKGQTEIYRGAEYSVSFLPKVKVEVAVSDDQYEQVVEAIQKAANTGRIGDGKIFVLDIAQAVRIRTGETNTEAL

General information: TITO was launched using: RESULT: Template: 4CO2.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 : 434 -60055 -138.37 -536.20 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain B : 0.94 3D Compatibility (PKB) : -138.37 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.94 QMean score : 0.587

(partial model without unconserved sides chains): PDB file : Tito_4CO2.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4CO2-query.scw PDB file : Tito_Scwrl_4CO2.pdb: