Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKTFFQFDELGTSYRNEIIGGLTTFLSMAYILFVNPITLALESVKDFPEALRIDQGAVFTATALASAAGCILM----GLIARYPIAIAPGMGLNAFFAFSVVLGMGI-SWQAALSGVFISGLIFVALSLTGF-REKIINAIPPE----LKLAVGAGIGLFITFVGLQGSGI-----ITANPSTLVTIGNIHSG-------------PVLLTIFGV-IVTVILMVLRVNAGVFIGMLLTAVAGMIFGLVPVPTQIIGSVPSLAPTFGQAWIHL-------PDIFSVQMLIVIL----------TFLFVGF--FDTAGTLVAVATQAGLMKENKLPRAGRALLADSSSIVIGAVLGTSTTT-----SYVESSSGVAAGARSGFAAIVTGILFLLATFFSPLLSVVTSNVTAPALIIVGALMVAPLGKIAWDKFEVAV--PAFLTMIMMPLTYSI-ATGIAIGFIFYPITM---------VCKGKAKEVHPIMYGLFV--VFILYFIFLK------- 4NNB Chain:A ((4-527)) TSLYITA---------APIGAVPKFLDPFEATFIP--SFLLEGFFDADRCASIAADLKTDGWEVVPAGGRLLQVGHAQPIAHFPKPWLAA--LSNKLARRIVLQLTTYGWIVSEQG----DLLWEHERQHHYLPPALIEAIEKESPALLKNMEEAGWIACAAGYWQAGKARSPYLPITPEAITEETIRSMRAGAAVVHLHTRDLSDRRRIEIPGLGVVTVGSQRNQIVLDDYDAIVPMVKKREPAAILNLSTSVRGDRHGARSKLRRAHLKFYDDVGSAPEVASLSPAAVVFQGGGGYDNAPDFLDAQFDHFERVGTRPEVEVFNHAIVDNATSLYRDRLLRTGKPVLFMLVAGVDQYRRDPITGEVEDDSLIARVVREEISSLLAD-------------ESADSHRRAVELAIGQLRPVVERLRASFPVSKISILLPGPMQNLLVDVALGLGLDGIRVGLEDGLTVNDARVPGGVRKARGTWEQVSLVREELLGRGATILTAAQVRDMFGLGI

General information: TITO was launched using: RESULT: Template: 4NNB.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 : 1963 -291023 -148.25 -709.81 target 2D structure prediction score : 0.35 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : -148.25 2D Compatibility (Sec. Struct. Predict.) : 0.35 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.210

(partial model without unconserved sides chains): PDB file : Tito_4NNB.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4NNB-query.scw PDB file : Tito_Scwrl_4NNB.pdb: