Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAVFTALSATQLAPWLQR-YPLG------QIVDLQGIVSGIDNTNYFLTTT---------RGAYVLTIFEHL-SARALPFYLDFMRHLAARRMPVPVPVAQSDGALFSLLRGKPAALVSRLEGAVQMA---PAAHHCAEAGRMLARMHLAGKTFAAAAPQN--PRGLAWQCEAARAIDP----FLRPA------QRRLLHHELAFQHSIQASAEY--ARLPAGICHGDLFRDNVFFVTQQGDSAGHPCRLSGFFDFYFAGLDKWLFDIAVCINDWCVMPA-----------SGQYEEARVRAFLTAYQAVRAFTP-----LEA-VYWPALLRAAALRFWLSRLHDFYVPRPAKILNVHDPAYFERILRTFIAKRL 1NW1 Chain:A ((53-419)) --------KERAHMLCARFLGGAWKTVPLEHLRISRIKGGMSNMLFLCRLSEVYPPIRNEPNKVLLRVYFNPETESHLVAESVIFTLLSERHLG-PKLYGIFS----------GGRLEEYIPSRPLSCHEISLAHMSTKIAKRVAKVHQLEVPIWKE-PDYLCEALQRWLKQLTGTVDAEHRFDLPEECGVSSVNCLDLARELE-F--L--RAHISLSKSPVTFCHNDLQEGNILLPK-----------RLVLIDFEYASYNYRAFDFANHFIEWTIDYDIDEAPFYKIQTENFPENDQMLEFFLNYLREQGNTRENELYKKSEDLVQETLPFVPVSHFFWGVWGLLQVELSPV-GFGFADYGRDRLSLYFKHK-

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 : 1191 -62725 -52.67 -219.32 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : -52.67 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.349

(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: