Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSTKPFYRDTWAEIDLSAIKENVSNMKKHIGEHVHLMAVVKANAYGHGDAETAKAALDAGASCLAVAILDEAISLRKKGLKAPILVLGAVPPEYVAIAAEYDVTLTGYSVEWLQEA-ARHTKKGSLHFHLKVDTGMNRLGVKTEEEVQNVMAILDRNPRLKCKGVFTHFATADEKERGYFLMQFERFKELIAPLPLKNLMVHCANSAAGLRLKKGFFNAVRFGIGMYGLRPSADMSDEIPFQLRPAFTLHSTLSHVKLIRKGESVSYGAEYTAEKDTWIGTVPVGYADGWLRKLKGTDILVKGKRLKIAGRICMDQFMVELDQEYPPGTKVTLIGRQGDEYISMDEIAGRLETINYEVACTISSRVPRMFLENGSIMEVRNPLLQVNISN 3UW6 Chain:A ((4-379)) -----FHRDTWAEVDLDAIYDNVENLRRLLPDDTHIMASVCGNAYGHGDVQVARTALEAGASRLAVAFLDEALALREKGIEAPILVTGASRPADAALAAQQRIALTVFRSDWLEEASALYSGPFPIHFHLYMDTGMGSLGVKDEEETKRIVALIERHPHFVLEGLWTWFAT-------YFSYQYTRFLHMLEWLPSRPPLVHCANSAASLRFPDRTFNMVQFGIAMYGLAPSPG-----PYPLKEAFSLHSRLVHVKKLQPGEKVSFGATYTAQTEEWIGTIPIGYKDGWLRRLQHFHVLVDGQKAPIVGRILGDMCMIRLPGPLPVGTKVTLIGRQGDKVISIDDVARHLETINYEVPCTISYRVPRIFFRHKRIMEVRN---------

General information: TITO was launched using: RESULT: Template: 3UW6.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 : 2013 -278199 -138.20 -766.39 target 2D structure prediction score : 0.54 Monomeric hydrophicity matching model chain A : 0.86 3D Compatibility (PKB) : -138.20 2D Compatibility (Sec. Struct. Predict.) : 0.54 1D Compatibility (Hydrophobicity) : 0.86 QMean score : 0.543

(partial model without unconserved sides chains): PDB file : Tito_3UW6.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3UW6-query.scw PDB file : Tito_Scwrl_3UW6.pdb: