Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MQYQMITREQCLYWDQEDELKKFKDEFALPEGVIYLDGNSLGARPKKSLAVAQHIISQEWGEDLINSWN-KADWWGLPTRLGDKVAKLVGAEQGEVVISDSTTLNLFKVLSAAVKIQAD-KFPEHKIIVAEKDAFPTDIYIIEGFIDLIQKGYQVELID--------GVEDLSRALEKDVAVVVLSHVNYRTGYFYDMASINEQIHSK----------DALVIWDLCHSVGAVPMHLNQTDSDFAIGCTYKYLNGGPGSPALLWVNEKH-RDQFWQPLSGWWSHKKPFDMAQHYEPANSIRRYLCGTQPVISMSLIECGVDIFLHADMQKIREKSLKLTDLFIQLVHQECSEFGFELITPLD---HKHRGSHVSYRHEF-G-------YEIIQALIARGVIGDYRE------------------PAVLRFGITPLYLGFEDIWNAVQHLKATMLNSEWKNKEYLVRGEVT 3A9Z Chain:B ((18-429)) -------------------------------RKVYMDYNATTPLEPEVIQAVT-EAMKEAWGNPSSSYVAGRKAKDIINTARASLAKMIGGKPQDIIFTSGGTESNNLVIHSTVRCFHEQ---TRPHFITCTVEHDSIRLPLEHLVEDQVA--EVTFVPVSKVNGQVEVEDILAAVRPTTCLVTIMLANNETGVIMPISEISRRIKALNQIRAASGLPRVLVHTDAAQALGKRRVDVEDLGVDFLTIVGHKFY--GPRI-GALYVRGVGKLTPLYP---MLFGGG-------------QERNFRPGTENTPMIAGLGKAADLVSE-NCETYEAHMRDIRDYLEERLEAE---FGKRIHLNSRFPGVERLPNTCNFSIQGSQLRGYMVLAQCQTLLASVGASCHSDHEDRPSPVLLSCGIPVDVARNAVRLSVGR-STTRAEVDLIVQDLKQAVNQLE-------------

General information: TITO was launched using: RESULT: Template: 3A9Z.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 : 1869 -6300 -3.37 -18.21 target 2D structure prediction score : 0.65 Monomeric hydrophicity matching model chain B : 0.65 3D Compatibility (PKB) : -3.37 2D Compatibility (Sec. Struct. Predict.) : 0.65 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.463

(partial model without unconserved sides chains): PDB file : Tito_3A9Z.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3A9Z-query.scw PDB file : Tito_Scwrl_3A9Z.pdb: