Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MHPKSPTYSAPDPGLWPYLILDKVCAQV-DA-------DASQARLIKLT-NNAVFALP-----------NSHLVVRIAGSAAVGRSAGKVVDVARWLEHHDMPTVRLATDVPQPLDIEGHAVSLWELVSDTG-------RSATARDIGHILRLFHSLNDAPDLPPWNTLGLIRSRLESADVL--------SSA-------EHGFLVETADSIAADLDEVDFVLAPGPIHGDPFVGNLIPGPDG-PVLCDFDSTCVGPREWDLTPADVGRLRF-R--------------YPGDYHGQLVEAYGV--DV-----------LTWAGFPVFRRLRELKLVCSVLPVLATNPSVREQWRHRFDTFRSGDLEARWTTYR 1NW1 Chain:A ((50-399)) --------------PELKERAHMLCARFLGGAWKTVPLEHLRISRIKGGMSNMLFLCRLSEVYPPIRNEPNKVLLRVYFNPETESHLVAESVIFTLLSERHLG-PK-------LYGIF-SGGRLEEYIPSRPLSCHEISLAHMSTKIAKRVAKVHQLEVPIWKEPDYLCEALQRWLKQLTGTVDAEHRFDLPEECGVSSVNCLDLARELEFLRAHIS--LSKSPVTFCHNDLQEGNILLPK--RLVLIDFEYASYNYRAFDFANHFIEWTIDYDIDEAPFYKIQTENFPENDQMLEFFLNYLREQGNTRENELYKKSEDLVQETLPFVPVSHFFWGVWGLLQVELSP--------------------------

General information: TITO was launched using: RESULT: Template: 1NW1.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 : 1025 -23212 -22.65 -93.22 target 2D structure prediction score : 0.69 Monomeric hydrophicity matching model chain A : 0.61 3D Compatibility (PKB) : -22.65 2D Compatibility (Sec. Struct. Predict.) : 0.69 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.210

(partial model without unconserved sides chains): PDB file : Tito_1NW1.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1nw1-query.scw PDB file : Tito_Scwrl_1NW1.pdb: