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:A ((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 A - contact count / total energy / energy per contact / energy per residue : 787 -9548 -12.13 -45.47 target 2D structure prediction score : 0.65 Monomeric hydrophicity matching model chain A : 0.60 3D Compatibility (PKB) : -12.13 2D Compatibility (Sec. Struct. Predict.) : 0.65 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.206

(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: