Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MEKNWERFVKVEKVNIGEVTDIMKNMEKDIKITGYKLISKGQRNTNYMVNTL-TDKLFLRICADEN--LS-KNEEAAFKILKE-K--ITMPRLVLTFSQIVKSQKKRIMIYEYIDSITGDEYLEK---------NNRFSEKLLKNIAFILAELHNIKILSLKGIN-S---LPSLKECFEMLMENSVLRKRMGIDSIKKLNAVIEKYKEEIEKKRENFLVHCDFKTSNLIMDK-DEKIYVTDWEYLGCGNRYFDIGLFFRYKNYFTKKDMEIFCEEYNRNAEISLDENWIEMGVLCNIVSLMEMLSREEDAFEKNNDIKNLIEKEIKFLIEK 5IWU Chain:A ((4-253)) --------------DIKQVIEIAKKHNLFLKEETIQFNESGLDFQAVFAQDNNGIDWVLRLPRREDVMPRTKVEKQALDLVNKYAISFQAPNWI-IY-------TEELIAYKKLDGVPAGTIDHNIGNYIWEIDINNVPELFHKSLGRVLAELHSIPSNKAAALDLVVHTPEEARMSMKQRMDAVRAKFGVGENLWNRWQAWLNDD---DMWPKKTGLIHGDVHAGHTMIDKDANVTGLIDWTEAKVTDVSHDFIFNYR---AFGEEGLEALILAYKE-----------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5IWU.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 : 927 -1385 -1.49 -6.05 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain A : 0.67 3D Compatibility (PKB) : -1.49 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.349

(partial model without unconserved sides chains): PDB file : Tito_5IWU.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5iwu-query.scw PDB file : Tito_Scwrl_5IWU.pdb: