Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MEAVIDDEGLEPAAVRQRTERGVWSPSNNSRHDSAGIRDELAGIGEQIKTLQFQLSSNLSPETKVSEVVTQTLWDLLWRLRTFLFLASPSAAHQWRIGGALFNVYYRRHYGRDAAHVAIALRLYLVLLRFTAVCPAAALHGCLTLFGVLAVLNDPRLRPWKDTSERLLEGFLFVSRALHRSENNVFAQLINVAFELLSEVTAHFNGSAAETESALFLQLSVEPAAELLSQTEGSLPPSASPKSASGAESRARRLQELFSTCTCVETPYEARCIQVCLLRLVVRLSEERLLLSLSPDRVGLLCDVACHLVSSAVPGAEGGVVNRVQHDAAWHTLRHFAVVDRRLLPHIQGPLILSVLAAQWSRRGAQTCSSIFNITVAEKALFDWCRRLSTEELDSLVVAAYHRGGVGPDGQDAMTECLAQMWEVGVQWCADLYTSPSTAVDGIVANTASCSASSVSAMVTLQQWVWLCERVFRSTVAQRSAFAGLTQMGEPKLLAAYDHQLQLLVSELPLSSLTASLLCTQLPSFAVESELAFLPSRILSFFNGQALIACVAEVVDRAKNCIDVSAYRLLEANALAVQSRLKVSSSVVQCDAAAFQSALAETLQVMQHHDAPSYSLLVQAIIVLVHAFPVDSENGEVRKSDTVARVMQALDNSISSRHNGSYAALEVAAPLWHMLDRETAATLFRAGSGLGWTRRLLALPPQTATSATTAELFLCRAAGLAEALQHALEETMLRDGASTSRSTSHSPAPKALPGAVAARGQMPGRLRRVYESIASHFPVVVQLLQTLGALLTTLQRDAQWWRCMRNGKGGTYAEASGAIVALGNFFRHATSILVLLLDAKYRFAVIAGSEAGKGCNGALAGAAPICERSSTTKQPLAQAATVVDVDDDDNADGVFEDNEEAKKPHRHRKATASGATLSSKTGKASAKAAVGGAPQASNLSQQSIAKTKQLEKIVQLNRSKLLPALLAFTRRFVYEGKGRGASPDADEVQNEDGRSSQRAAGSVRNHASALECALLSLAYTSLALSPPFSLNDVNELFSLASVGAYNVKDSILYCALRELVLWSPQLACRECEAGDSAMPTLLLVRLSGTEQLLSTVLSARRDGNTTYIAECGAQILQLLWFGRRFFQRAGDTRAEAADKPEREQRLSLTDASAAVQEDCMAASERVTQEGYAWLCLCFDLYAVYHSVRPAHNDTALAVMGLCVETARGVMAVFSWSATDLLRFRERPFVFSSFFKAIVDKEDRDMKVILTSSLDVLGRYVISAGVDQAGGGTVAATATMSTVVPGDGVTRAKLKHLMDQEKIADWRAAAGALAYALYAYGGKPAAKQMLYLAEAASYAKKSIQDVPSMVRSTIHFVAFHIVSLEADAQMLAYDRRCHSGRDHRRCLSGAAAVHAPLAVVGGSAHSLFVCDRSEGGDGAEAVGVEDASTSPPERTTTGELHAAEGDGGDASASKEVLDGIAFSVFERALEQLVTLGEAAETASAVENSLRKPVVRAVAAEELRKNMFAVLDAVYKAIRIEPAVACRSEGADATDKEEASAAPPVSLRTRRRWLLGLASFIRFMGPQTTPIALMLPTLLGHCARFPSLLPSVCIVWRELICACTDEYLAESAAAIVLSLVSLEQQAALESESKGLLLCALRHLYTRTEAAEFWDSYKVVLGTFSELVRATLHSRHSGCAEAAERSEESRRDSAHVLLLGFASVMRSGSLQSSTVFVRALYQYLCAADEATRRQLSHAAADHPEVLQTLLRCTEADADSALYAMRCISILGAVAAPNAAASTGARWATKTADDERRSSLALSSASALDAWNRMTWTQSFYLDAETVLNWRKFSFTLLRDYFPRVFASTADPVLHNCIAFAVQELIRASTRQERLQHKGVELRREDIVHVDELDRYIWWMRLTPHVKQLLGGFTTTRYSLTVNWQTRLRSPEYTPSLEYRRWLFAFFNHLVMSCEGWFAEMVQPLRNVAKKNASLVLYLLPYLVVHILESGKVEDVQYIEHEVKAVLEAAAGGPNVAVLSLRSQSIYEASPETLSQEEPREHAHTVLSLLEDVEQLRWTLLRNRGRVTCVFEPQEQTESLCIRLAEMYGDFLRGIPWPLRCRAALRIGSHIRALRSVESQRRIPGLASVIAAVPLQRIFAALKDRESSRSIHRASPGLSLEDTAFSFENNGDWLSALGSSELVLQHRPHSGQHQLTALHCMNELGELYMTSRYAASLLASASVSDSDVRGFEAKECLSGAALKGRSTFSQMVSEAPGGAAAVSDFAQLRHHVQAYANEAAWRLGQWDTLLPSSTAASAAT---APVNSGMPTVGSDGGRSVSLAMPAAYLQRALSGNGSLAFVRCVTD-----KERAKVVPLVRTPCQEDLTAQGYTVTLLLH------ALGDVDAVSELCARAFITNGSGHHCCGDGSDASQSSAPMMKLAAPLL----PSSVKEEIASLLSRRESYVEDTIAAREPLLALHRLIYRELDMPQKVAETWLKQSELLRNGGLGEAALTAARQAAFECREHVTATSYYVLVANLLHDTQSPTPAMEFARECVADARIPATTRAQLQILLTNWLIETGSERPEHIFAEYEKARELDRKSELVHHQMALFYDHLHTLASNASEGAAAQLTAAATSPTSSSTANVSAAVMYNAALQHQKEMVDS------IQRCATRAIVHFGEALLRGVEKA--------SVSLPRMLTLWLDSAVFLGGLMGTTVGKLDGTTSAVLGEMNNRIREFVLSTVRPVIPPAVVMTALPQLLSRLGHPVTAVRNVLTDIVLHLMDHFPQQCLWLVLPMALSKEGPKEVVETQIIKPFADNPRNERVLRHAKILCDTLLTIC------------NCSASLFPKEKGLTQLSPVQKITPML--------------ATAKFIVPVLSNLTPDIRASSSEDVFPTAPCFDHFDDRV-------------------------------------------------VVMRSLQKPKRIWVHTNDGREMSFLCKAKDEPRKDIRMMEVAALMNSFFLSDPEAKRKRFSLRRYAITALSDDCAVIEWLNDTTPLAKVAMECYALDRSGVHISSVKKWMALV-----DEKKMSKMELFTKYILPEAPPVMHQWLDRTFASNQSWYEARTLFTQSTALWSIAGHIVGLGDRHAENLMIDMERGELMHVDFACMFDKGEKLEV-PEQVRFRLTQNLTDVMGVLGAYGPFQATCEVALRCEMKNKSAVMSIIETLLHEPLMEWRRQSSRSHSSNGPKQLMERVARRLDGFLDLYSVPAQRDTLSLNVESQVAKLIHHSSDLNNLSQMYIWWMAWI 4JSP Chain:A ((10-1174)) -------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------ERAAKCRAYAKALHYKELEFQKGPTPAILESLISINNKLQQ-PEAAAGVLEYAMKHFGELEIQATWYEKLHEWEDALVAYDKKMDTNKDDPELMLGRMRCLEALGEWGQLHQQCCEKWTLVNDETQAKMARMAAAAAWGLGQWDSMEEYTCMIPRDTHDGAFYRAVLALHQDLFSLAQQCIDKARDLLDAELTAMAGESY---SRAYGAMVSCHMLSELEEVIQYKLVPERREIIRQIWWERLQGCQRIVEDWQKILMVRSLVVS----PHEDMRTWLKYASLCGKSGRLALAHKTLVLLLGVDPSRQLDHPL---------PTVHPQVTYAYMKNMWKSAR-KIDAFQHMQHFVQTMQQQAQHAIATE---DQQHKQELHKLMARCFLKLGEWQLNLQGINESTIPKVLQYYSAATEHDRSWYKAWHAWAVMNFEAVLHYKHQNQARDEKKKVTEDLSKTLLMYTVPAVQGFFRSISLSRGNNLQDTLRVLTLWFDYGHW--------------------PDVNEALVEGVKA-----IQIDTWLQVIPQLIARIDTPRPLVGRLIHQLLTDIGRYHPQALIYPLTVASKSTTTARHNAANKILKNMCE--HSNTLVQQAMMVSEELIRVAILWHEMWHEGLEEASRLYFGERNVKGMFEVLEPLHAMMERGPQTLKETSFNQAYGRDLMEAQEWCRKYMKSGNVKDLTQAWDLYYHVFRRISKQLPQLTSLELQYVSPKLLMCRDLELAVPGTYDPNQPIIRIQSIAPSLQVITSKQRPRKLTLMGSNGHEFVFLLKGHEDLRQDERVMQLFGLVNTLLANDPTSLRKNLSIQRYAVIPLSTNSGLIGWVPHCDTLHALIRD--YREKKKILLNIEHRIMLRMAPDYDHLTLMQKVEVFEHAVNNTAGDDLAKLLWLKSPSSEVWFDRRTNYTRSLAVMSMVGYILGLGDRHPSNLMLDRLSGKILHIDFGDCFEVAMTREKFPEKIPFRLTRMLTNAMEVTGLDGNYRITCHTVMEVLREHKDSVMAVLEAFVYDPLLNWRLMDTNTALNKKAIQIINRVRDKLTG-------RDFSHDDTLDVPTQVELLIKQATSHENLCQCYIGWCPFW

General information: TITO was launched using: RESULT: Template: 4JSP.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 : 4023 26535 6.60 28.08 target 2D structure prediction score : 0.59 Monomeric hydrophicity matching model chain A : 0.55 3D Compatibility (PKB) : 6.60 2D Compatibility (Sec. Struct. Predict.) : 0.59 1D Compatibility (Hydrophobicity) : 0.55 QMean score : 0.335

(partial model without unconserved sides chains): PDB file : Tito_4JSP.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4JSP-query.scw PDB file : Tito_Scwrl_4JSP.pdb: