Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDIESILKNIIKIEPITTGKSNDKKYLLVLK--------NGTLLFERVGPISR-YDRFKMMYDELIDLKSLNEPGVPIPYFV-TKEDDTAVLLTSYSKGIPLNEVITDKNCSLDRVKELGRKAGNLLASVHTLSPLVPTD-SGDYDVLFKNILSDYVNLS-------LYL------KHEQDMISFVLNHMKEV--MTARPITYIHGNFDERILWVSPTDRIFFVDTCDISSFDPFYDFKNIGV-ITRF----------------ENIEFAKSIIDSYTQGHPTDEFWLAFELYNAFKLMSTTIELIKEGKEKEAIDKFETVADDFHGFKEDEIGKPKWY 1NW1 Chain:B ((74-356)) --------EHLRISRIKGG-MSNMLFLCRLSEVYPPIRNEPNKVLLRVYFNPETESHLVAESVIFTLLS---ERHLG-PKLYGIF---SGGRLEEYIPSRPLSCHE--I-----SLAHMSTKIAKRVAKVHQLEV-PIWKEPDYLCEALQRWLKQLTGTVDAEHRFDLPEECGVSSVNCLDLARELEFLR-AHISLSKSPVTFCHNDLQEGNILLPK--RLVLIDFEYASYNYRAFDFANHFIEWTIDYDIDEAPFYKIQTENFPENDQMLEFFLNYLRE-----------------------------------------------------------

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 : 779 -11586 -14.87 -55.17 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain B : 0.60 3D Compatibility (PKB) : -14.87 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.212

(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: