Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence FLLNRSSDLITTA---------SENYFIKIYGF--DKLPSIKFQLDFLSKCFKYGLPVAKVIQTNSKTSYFKIDKTYGILQEFLGGEQLRN---IKINRSVVTDIGFILGSIHKLSHRSNFIGKK---WKRYQWDLAQFNIVVKD---Y-HKIKNI----IPSWISDLIDEVITEWKSNKIKLAKLRKGSIHNDFQGRNILVAKDGKISIVDFGDAINSWYIADIAISLAHICFTV-------------K-QPSIFIKSFLRGYQKQFKLL---------KLEKDFLPLLMKMRAVTAIVEIQLLKGKKGIFHPPDNQLVNLLKYFKDTKAKNIF 1NW1 Chain:B ((86-392)) ---SNMLFLCRLSEVYPPIRNEPNKVLLRVYFNPETESHL-VAESVIFTLLSERHLG-PKLYGIFS----------GGRLEEYIPSRPLSCHEISLAHMSTK--IAKRVAKVHQLEVPIW-KEPDYLCEALQRWLKQ-LTGTVDAEHRFDLPEECGVSSVNCLDLARELEFLR-----AHISLSKSPVTFCHNDLQEGNILLPK--RLVLIDFEYASYNYRAFDFANHFIEWTIDYDIDEAPFYKIQTENFPENDQMLEFFLNYLREQGNTRENELYKKSEDLVQETLPFVPVSHFFWGVWGL--------------------------------

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 B - contact count / total energy / energy per contact / energy per residue : 847 -9773 -11.54 -42.67 target 2D structure prediction score : 0.59 Monomeric hydrophicity matching model chain B : 0.61 3D Compatibility (PKB) : -11.54 2D Compatibility (Sec. Struct. Predict.) : 0.59 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.225

(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: