Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNEQASQNYSFQAEVAQLLHLVTHSLYSNPEIFLRELISNASDACDKLRFEGINHPEYYENDPNLHVRISLNKEDKTLTISDNGIGLSQQEAIDNLGTIAKSGTKDFMSKLTGDQQADAQLIGQFGVGFYSGFIVADKITVESRRAGLDASEGVRWISGGTGEFEVQQIDKASRGTDIILHLRDNALDYLESYKVKQIVNKYSDHISLPIEMQKEVWQEEEAAEGEEPKGGQMVRTDEWEAINSASALWTRNKSEVTEEQYVEFYKNLTHDFEAPLAWAHNRVEGSTEYTQLLYIPSKAPHDIFTREAKAGIKLYVKRVFIMDDADNLIPNYLRFVQGVVDSADLPLNVSRELLQESRDVKTIREGNARRVLTLLDGLAKSEDEKDQEKFKTFYTEFGSVLKEGL---GEDFGNRERILKLLRYATSTNDE-VTTSFADYKARMKEGQKAIYYVTAESLAAAKNSPQLELFKKKGIEVLLMAERVDEWAMNFVHEFDGTPLKNVSKGAVDLGDLQDAEEKKALEQAAEQFKPVVEKLSDSLKAKTKEVRVTTRLVDSPACLVTSEGELSPQLIR--MLKQAGQAVPEIKPILEINPEHPLVKKLEGSEQFD-DLANV----IFDQAVIAEGGLPEDPAAYVKRINSLLLK 4J0B Chain:A ((31-642)) --------HEFQAETKKLLDIVARSLYSEKEVFIRELISNGSDALEKLRHRMITAGG---DTAPMEIHLQTDSVKGTFTIQDTGVGMNKEDLVSNLGTIARSGSKAFLDALQNQAEASSSIIGQFGVGFYSAFMVADKVEVYSQSAEADAP-GYKWSSDGSGVFEVAEASGVRQGTKIVLHLKDDCKEFSSEDRVKEVVTKYSNFVSFPIFLNG-------------------------RRLNTLQALWMMEPKDISEWQHEEFYRYVAQAYDKPRYTLHYRADAPLNIRSIFYVPEMKP-------MGSSVALYSRKILIQTKATDILPKWLRFLRGVVDSEDIPLNLSRELLQESALIRKLRDVLQQRVIRFLLDQSK----KDPEKYARFFEDYGLFMREGIVTTGEQ-SVKEDIAKLLRFESSALPAGQQTSLMEYSSRMKAGTRNIYYLCAPNRHLAEHSPYFEAMK--DMEVLFCFEQFDELTLLHLREFDRKKLISAET-------------RLSSEQAED----LLAWMRNALVQRVTNIKVTPRLDTHPAMITVLEMGAARHFLRTQ---------QILQPTLEINTGHDLIKKLHALKDSNPELAQLLLEQIYDNAMIA-AGLNEDPRPMISRLNQLLTR

General information: TITO was launched using: RESULT: Template: 4J0B.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 : 2782 -125806 -45.22 -224.25 target 2D structure prediction score : 0.59 Monomeric hydrophicity matching model chain A : 0.79 3D Compatibility (PKB) : -45.22 2D Compatibility (Sec. Struct. Predict.) : 0.59 1D Compatibility (Hydrophobicity) : 0.79 QMean score : 0.445

(partial model without unconserved sides chains): PDB file : Tito_4J0B.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4J0B-query.scw PDB file : Tito_Scwrl_4J0B.pdb: