Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -METTKLGNLKLYGAGHAAGGAYHNVSIKGEGIVGEGLSAVGCRIYGTGLFLGKAETERLRV----LGESECKG-DLTAGKIN--IYGTMKVSGS----LQFDRFNLKGQTEIGGNMTGESCDVKGKLSVIGDCETEMFHVTGCVDVSGLLNSGEIKLGLSH-DISHVQEIGGTTITVKRRASFFSR--KKGKLIADV----IEGDRVYLENTEAAVVRGKEVIIGPGCSIGTIEYEYKCECDPHSQIKEKTKL 3DU1 Chain:X ((0-236)) HMNVGEILRHYAAGKRNFQHINLQEIELTNASLTGADLSYADLRQTR----LGKSNFSHTCLREADLSEAILWGIDLSEADLYRAILREADLTGAKLVKTRLEEANLIKASLCGANLN--SANLSRCLLFQADLRPSSNQRT---DLGYVLLTG---ADLSYADLRAASLHHANLDGAKLCRANFGRTIQWGNLAADLSGASLQGADLSYANLESAILRKANLQGADLTGAILKDAELKGAIMPDGSIH-----

General information: TITO was launched using: RESULT: Template: 3DU1.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain X - contact count / total energy / energy per contact / energy per residue : 1377 -122522 -88.98 -562.03 target 2D structure prediction score : 0.46 Monomeric hydrophicity matching model chain X : 0.70 3D Compatibility (PKB) : -88.98 2D Compatibility (Sec. Struct. Predict.) : 0.46 1D Compatibility (Hydrophobicity) : 0.70 QMean score : 0.192

(partial model without unconserved sides chains): PDB file : Tito_3DU1.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3DU1-query.scw PDB file : Tito_Scwrl_3DU1.pdb: