Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSKQIIYPGAVIGIIGGGQLGKMMAVSAKQMGYKVAVVDPVKDSPCGQVADVEITAHYNDREAIRKLAEISDIITYEFENIDYDAL-HWLKDHAYLPQGSELLLITQNRETEKKAIQSAGCEVAPYSIVKTKNELKQAVQELRLPAVLKTCRGGYDGKGQFVIKEEAQMEQAAALLEHGTCILESWVSFKMELSVIVVRSVNGEISTFPTAENIHHNNILFQSIVPARVEKGIQQKAADLAVKLADELNLVGPLAVEMFLTEDGELLVNELAPRPHNSGHYTLDLCETSQFEQHIRAVCGLPLGKTDLLKPGMMVNLLGDEVKLVEEDPELLKEAKLYIYGKHEIKKGRKMGHITFMKQPEDEWIQEITNKWMNRDGGQAE 3ETJ Chain:B ((4-320)) -----------VCVLGNGQLGRMLRQAGEPLGIAVW--------PVG--LDAEPAA----------VPFQQSVITAEIERWPETALTRQLARHPAF-VNRDVFPIIADRLTQKQLFDKLHLPTAPWQLLAERSEWPAVFDRLGELAIVKRRTGG----GQWRLRAN-ETEQLPAEC-YGECIVEQGINFSGEVSLVGARGFDGSTVFYPLTHNLHQDGILRTSVAFPQANAQQQARAEEMLSAIMQELGYVGVMAMECFVTPQG-LLINELAPRVHNSGHWTQNGASISQFELHLRAITDLPLPQPVVNNPSVMINLIGSDVNY---DWLKLPLVHLHWYDK-EVRPGRKVGHLNL-------------------------

General information: TITO was launched using: RESULT: Template: 3ETJ.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 : 1658 -194558 -117.34 -623.58 target 2D structure prediction score : 0.46 Monomeric hydrophicity matching model chain B : 0.76 3D Compatibility (PKB) : -117.34 2D Compatibility (Sec. Struct. Predict.) : 0.46 1D Compatibility (Hydrophobicity) : 0.76 QMean score : 0.386

(partial model without unconserved sides chains): PDB file : Tito_3ETJ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3ETJ-query.scw PDB file : Tito_Scwrl_3ETJ.pdb: