Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKIKTISGAERLSLKRSIDAGTEEQRKTVRSIIEDVKANGDQAVRSYTAKFDCIEIDSPLVTKEEFEEAYTSLDSRLLQVI---------------RQAIENIREYHERQLQSSWFYHRKDGTMLGQKVTALD----SAGVYVPGGTAAYPSSVLMNVIPALVAGVERIVLVTPPGKDGLLSPGVLVAAAELGIKDIYK--MGGAQAIA--ALAYGTETIEPVDKITGPGNIYVALAKREVFGDVDIDMIAGPSEIVVLADE---TAIPSEIAADL-----LSQAEHDKLS-SCVFVTDSMA------LAETVSAEVNKQLETLPRRE--------IAEASVRDYGCIYVAETMVEAIETVNTLAPEHLEIITQSPEALLGSIKHAGAIFLGRYSPEPVGDYFAGPNH--------VLPTNGTARFSSPLNVTDFQKKSSIISYSQSAFEEHAESIAAFARLEGLEAHARSIEARERRISK 4UOX Chain:A ((7-459)) SASALACSAHALNLIEKRTLDHEEMKALNREVIEYFKEHVNPGFLEYRKSV-TAGGDYGAVEWQAGSLN-TLVDTQGQEFIDCLGGFGIFNVGHRNPVVVSAVQNQLAKQPLHSQELLDPLRAMLAKTLAALTPGKLKYSFFCNSGTESVE--AALKLAKAYQSPRGKFTFIATSGAFHGKSLGALSATAKSTFRKPFMPLLPGFRHVPFGNIEAMRTALNECKKT-GDDVAAVILEPIQGEGGVILPPPGYLTAVRKLCDEFGALMILDEVQTGMGRTGKMFACEHENVQPDILCLAKALGGGVMPIGATIATEEVFSVLFDNPFLHTTTFGGNPLACAAALATINVLLEQNLPAQAEQKGDMLLDGFRQLAREYPDLVQEARGKGMLMAIEFVDNEIGYNFASEMFRQRVLVAGTLNNAKTIRIEPPLTLT----------------IEQCELVIKAAR-KALAAMRVSVEEA------

General information: TITO was launched using: RESULT: Template: 4UOX.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 : 2029 5948 2.93 14.91 target 2D structure prediction score : 0.51 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : 2.93 2D Compatibility (Sec. Struct. Predict.) : 0.51 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.292

(partial model without unconserved sides chains): PDB file : Tito_4UOX.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4UOX-query.scw PDB file : Tito_Scwrl_4UOX.pdb: