Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSADTQHFTGTDQYIATDSLKLAVKAARALQKPLLVKGEPGTGKTLLAEQVAESLGLKLITWHIKSTTKAQQGLYEYDAVSRLRDSQLGDDRVYDIKNYIKPGKLWEAFTSEERCVLLIDEID---KADIEFP-------NDLLHELDKMSFYVYETGETITATQRPIVIITSNNEKELPDAFLRRCFFH---YIEFPDEATMREIISVHFPNISVTLVNEALQVFFKLREIPNLKKPPSTSELIDWLSLLMADDMPEDVLRNRDTSKAIPPLYGALIKNEQDVQLLERLAFMSRR 4Z8X Chain:A ((52-235)) -------------------------------KGVLLYGEPGVGKTLLAKAIAGEAHVPFISVSGSDFVEMFVGV----GAARVRD-------------------LFETAKKHAPCMIFIDEIDAVGR------DEREQTLNQLLVEMDG-----FDTSDGI------IVIAATNRPDILDPALLRPGRFDRQIFIPKPDVRGRYEILKVHARN-----------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4Z8X.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 : 531 -20758 -39.09 -160.91 target 2D structure prediction score : 0.76 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : -39.09 2D Compatibility (Sec. Struct. Predict.) : 0.76 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.550

(partial model without unconserved sides chains): PDB file : Tito_4Z8X.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4Z8X-query.scw PDB file : Tito_Scwrl_4Z8X.pdb: