Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRVLVIMDPIETVNLK-KDSTMAMLWAASRRGHELGYALQQDLYIDQGKAYGLISPLKVFEDYNHYYELGEKKKESIAAYDVVLMRKDPPFDMNFVYTTYVLEQAEREGSWII-NKPQSLRDCNEKLFATQFPE----LQVPTLVTSQQS-------LIREFITEH-GDVIVKPLDGMGGMGIFRLYQDGVNIGSTLEMLTELGTRPIMAQRYIPEIVEGDKRILMVNGEPIPYCLARIPQNGEVRGNL---AAGG--LGQA----RPLTENDKLIAAKVGPFLREKGLVFVGLDVIGN-----YVTEINVTSPTCIR-----EIDAQFGTSIADDLFDVLEAGRPA 4C5C Chain:A ((27-327)) DKIAVLLGGTSAEREVSLNSGAAVLAGLREGGIDAYPVDPKEVDVTQ------------------LK---------SMGFQKVFIALHGRGGE----DGTLQGMLELMGLPYTGSGVMASALSMDKLRSKLLWQGAGLPVAPWVALTRAEFEKGLSDKQLAEISALGLPVIVKPSREGSSVGMSKVVAENA-LQDALRLAFQHD-EEVLIEKWLSGP---EFTVAILGEEILP-SIRIQPS-GTFYDYEAKYLSDETQYFCPAGLEASQEANLQALVLKAWTTLG--CKGWGRIDVMLDSDGQFYLLEANTS-PGMTSHSLVPMAARQAGMSFSQLVVRILE-----

General information: TITO was launched using: RESULT: Template: 4C5C.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 : 1343 17083 12.72 63.74 target 2D structure prediction score : 0.54 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : 12.72 2D Compatibility (Sec. Struct. Predict.) : 0.54 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.382

(partial model without unconserved sides chains): PDB file : Tito_4C5C.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4C5C-query.scw PDB file : Tito_Scwrl_4C5C.pdb: