Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKLIEHYVALVKTGCAEYGQMNEMTLTEIADCLFCTERNAKLILHKLENSNWIIRESGAGRGRKSKIAFLRRPEELLLQTAKEYTMSGKLKKAKELLQQYQSAFPGLQNEYNMWLSEVFGFVTETGENGAKDVLRLFITPESVSSLDPCQIFLR--------SEGHFVKQIFDTLFTFDSD-MQEPKPHLVHGWEEVG-KKQWRFFLRKGVLFHNGQPLTSRDVAFTFQRFLELADNPYKWLLHGVKQVLEKGPYCVELILDKPN-ALLPYALCDERLSILPAEQG----------GGKNGTGPFQMNQQH-SGMLVLEANERYFKGR-------PYLDRVEFVFSEQAGE-MN---GFTIQ-E---K--------QTCPE--------QQTVFDERHVQYLSLNLKKKGPLQHRSFRKALRLLISSERLVREAGGHRRIPVTSFLHPS---------------------------------P---------FEWEGVSPSELLKKSGYE----------GETIVLYTF-SETDHREDAEWIQNICAQHGIRLTLQFCDAADLRRPEIVQMADIIHDSATFYQDSEFGFLHLLLSE------NSFLYQHLSEKLTQICSGMTERMFSMPDRCSRINILRDIDRQMIQELNAIPLYQNVLQVTSS-KNVKGLVLDEEGWIDLYSVWLSK 4ONY Chain:A ((33-594)) ---------------------------------------------------------------------------------------------------------------------HFPYTNPD--APKKGSLTVGV-VGTFDSLNPFVLKSMRTTARGLYNDGEFGNMVYQTLMLRSRDEPFTLYSLLAEKVAIDPERKWVEFTLNPKAKWSDGQPVTVDDVLFTYDILTEKGRPPYNSRMSRVAKIEKTGERSVRFTFNEKSDREFPMLIAGS-MPVLPKHAINRDTFGNSTLEPPIGSGPYVVASVQPGQRIVYKRNPDYWGKDLPSQRGFNNFDKISIEYYRNETSLFESFKKGILDIFIEGNPIRWEKLYDFPAVEQGKVIKDTFEKGTPADMLGFVFNTRR-PIFADRRVRQALGLLFDFEWANSNLFAGQYRRTQSFWEGSQLSSVGRPADARERELLAPFPGAVREDVMNGTWHPPVTDGSGHDRVPAKKAYDLLSQAGFQFKDGMAIDPTAKPFAFEIMTRSPDEEKIALAYQRNLSRLGIAVEIHTVDDAQYQQRLQTFDYDMILGALASSLSPGNEQWLRWGSASRDVQGSFNFAGVAD----PAVDAMIEALLAARNRADFVSAVRALDRVLISGDYYVPLYHLPYQWVARWDRIEHPQKTPLSGYQLPAWWHTS

General information: TITO was launched using: RESULT: Template: 4ONY.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 : 2137 -185009 -86.57 -412.05 target 2D structure prediction score : 0.54 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : -86.57 2D Compatibility (Sec. Struct. Predict.) : 0.54 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.411

(partial model without unconserved sides chains): PDB file : Tito_4ONY.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4ONY-query.scw PDB file : Tito_Scwrl_4ONY.pdb: