Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTAVEHILGEDWTVVPAGGSTGTAYYAKSDQRRLFLKRNSSP------------FLAVLSAQGI-VPKLVWTKRLENGDVLTAQQWLDGK-ALNPEE--MQHPRVAKLLSKIHHSSELLDMLLRIEKQTQMPTQILAKMKEKVKTTDDA--DCSLVIHKALKYLEDRLPYVYYSKPVVCHCDLVHHNWMLSKNGELYLVDWDNAKVGDPAMDIGRILQSY-IPKQEWDQWLSHYGEENNAHFMQRMHWYLMIDAIHGYTWNVRRDKMKVAHQHMSELQQLLDQVNDWNL 4R7B Chain:A ((38-281)) ---------EVLSVEQLGGMTNQNYLAKTTNKQYIVKFFGKGTEKLINRQDEKYNLELLKDLGLDVKNYLFDI----EAGIKVNEYIESAITLDSTSIKTKFDKIAPILQTIHTSAKELRG-------EFAPFEEIKKYESLIE--EQIPYANYESVRNAVFSLEKRLA-DLGVDRKSCHIDLVPENFIESPQGRLYLIDWEYSSMNDPMWDLAALFLESEFTSQEEETFLSHYESDQTPVSHEKIAIYKILQDTIWSLWTVYKEEQ----------------------

General information: TITO was launched using: RESULT: Template: 4R7B.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 : 945 36839 38.98 163.73 target 2D structure prediction score : 0.61 Monomeric hydrophicity matching model chain A : 0.70 3D Compatibility (PKB) : 38.98 2D Compatibility (Sec. Struct. Predict.) : 0.61 1D Compatibility (Hydrophobicity) : 0.70 QMean score : 0.341

(partial model without unconserved sides chains): PDB file : Tito_4R7B.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4r7b-query.scw PDB file : Tito_Scwrl_4R7B.pdb: