Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MIDTAMARLNEGTIVIYALSVLFYFIDFLQHNRKAGKMAFWLLSIVWTLQTVYLAYFMWVTGRFPVLNVTEALYFYAWVLVTLSLVLTKLLRV---DFIVFFTN-----VIGFS--MIAIHTFSPTEQQSAAFS----GQLVSELLVIHITMAILSYGAFS--LSFVFSVLYMFQYHLLKKKKWGKWLLRIEDLSKLDYMAYVLNVIGVPMLLLSLILGVIWA----YVSLETLY----------WFDAKVLGSFVVLLLYSYYLYIRLIKELQGKVAALWNTACFLVLMI-----NYFLLGSLS---QFHWFS 2W18 Chain:A ((24-356)) NLQLVSELKNPSGSCSVDVSAMFWEKEPCIITACEDVVSLWKALDAWQWEKLYTWHF----AEVPVLQIVPVPDVYNLVCVALGNLEIREIRALFCEKQVLLKSGNIKAVLGLTKRRLVSSSGTLSDQQVEVMTFAEDGGGKENQFLMPPEETILTFAEVQGMQEALLGTTIMNNIVIWNLKT-GQLLKKMH-IDDASVCHKAYSEMGLLFIVLSPVFQLIVINPKTTLSVGVMLYCLPPGQAGRFLEGDVKDHCAAAILTSGTIAIWDL--LLGQCTALLPPVQHWSFVKWSGTDSHLLAGQKDGNIFVYHYS

General information: TITO was launched using: RESULT: Template: 2W18.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 : 1422 -156038 -109.73 -582.23 target 2D structure prediction score : 0.12 Monomeric hydrophicity matching model chain A : 0.67 3D Compatibility (PKB) : -109.73 2D Compatibility (Sec. Struct. Predict.) : 0.12 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.055

(partial model without unconserved sides chains): PDB file : Tito_2W18.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2W18-query.scw PDB file : Tito_Scwrl_2W18.pdb: