Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MASRPVLATGITTELKIRGKSMNILTDKAHYESHLEAYIVQKLQAQGWVVGQSKNYHTEYALYPEDLITWIQATQPEKWEKLQALNGSNTEKRIIDRLDDELNKKGTIHIFRNGFSMAGAGTIDLSESAPEDGRNQAVIDRYNANILRVVPQLKYHPSKDAGILDLVFFINGLPMATVEIKTEFNQSLEDAIEQYKNDRKPIDPKTRRKEPLLTPKRGAIVHFALSESEIAMTTALDGESTYFLPFNKGNQGHAGNPPADVAKGEDYPVAYFWDYVCQRDNWLKIFHNFVYVEKKNKVDLYGNWTVQERLIFPRYHQFDAVNKIIADVQEKGVGLNYLCEHSAGSGKTSTISWVCHSLVRLRHNDGTPFYNSVIVVTDRTVLDNQLQEAIQQ--LDHQKGLIAAINRDDKEHAGKSKSKQLEDALLSNKQIIIVTIQTFPHVMEAILTNTSLSDRNYGIVIDEAHTSQTGSTASKLQATLALQSGEAMANLTVEELLEQIQKARVQSKNISHFAFTATP-KHSTKMLFGRTKNGEPASDDNLPEPFHLYPQRQAIEEGFILDVLQGYVPYKTAFKLGGEAVDDDKRVNSKAAKKALARWMALHATNVTQKVQFIIQHFHHNVANLLNGQAKAMIVTSSRPAAARYKIALEKYIDDNPEY---SAYRVLVAFSGKLTGKQISHEADGDSENGVLFQVGEDAEFTEANMNADAPNSDLRIAFD--RPEYRLMVVANKFQTGFDQ---PKLCAMY---IDKVIANEVEVVQTLSRLNRTTTGKDQTFVIDFVNDPEWILKCFKKYDNGAKMVDVQDP---NVVYTIKDNIEELDLITEDDLEEFKAARFKTIRDISNHDFKETTHPDLFKATDRVARLFNQ---KLKMLKQAIELQETAFDQAKADGNDE--------GAEKAEFERKQLDVELQTLMRFKG-NLDKFSRIYSYVAQLID-FGDPELENFSAFTKLLSKRLNGMSAKEIDISGLVLTGFGIFKKKLKTDDTDHPEADEPQPLAPIQGTANGDLQPTKMTYLKEVIELIAQTFGDISTREEQVVYINHLVTIL---------RNNDVVMA---QIENNPESTALQGNLPSATKGAIIQALTSHQDLSALLLKTDAQAMQNVIKVLYKLLKDGETIDVHRLT 5AOR Chain:A ((119-1158)) -----------------LGEAYRPLEQRDMNEA--EAFDVNAAIHGNWTIENAKERLNIYKQTNNI-------RDDYKYTPV----GPEHARSFLAELSIYVPALNRTVTARESGSNKKSASKSCALSLVRQLFHLNVIEPFSGT-LKKDEQLKPYP--------------------VKLSPNLINKIDEVIKGL--DLPVVNPRNIKIE--------------LDGPPIPLIVNLSRIESSVIPWAPPQANWNTWHACNIDEGELATT--------SIDDLSMDYERSLRDRRQNDNEYRQFLEFREKL-----PIAAMRSEILTAINDNPVVIIRG---NTGCGKTTQI---AQYILDDYICSGQGGYANIYVTQPRRISAISVAERVARERCEQLGDTVGYSVRFESVFPRPYG------------AILFCTVGVLLRKLEAGLRGVS------HIIVDEIHE---RDVNSDFLLVILRDMVDTYPDL----------HVILMSATIDTTKFSKYFGICPVLEVPGRAFPVQQFFLEDIIQMTDFVPSAESRRKRKEVEDEEQLLSEDK----DEAEINYNKVCEDKYSQKTRNAMAMLSESDVS--FELLEALLMHIKSKNIPG---AILVF---LPGWNLIFALMKFLQNTNIFGDTSQYQILPCHSQIPRDEQRKVFEPVPEGVTKIILSTNIAETS-------ITIDDIVFVIDICKARMKLFTSHNNLTSYATVWASKTNLEQRKGRAGRVRPGFCFTLCSRARFQALEDNLTPEMFRTPLHEMALTIKLLRLGSIHHFLSKALEPPPVDAVIEAEVLLREMRCLDAND-ELTPLGRLLARLPIEPRLGKMMVLGAVFGCADLMAIMASYSSTFSEVFSLDIGQRRLANHQKALSGTKCSDHVAMIVASQMWRREKQRGEHMEARFCDWKGLQMSTMNVIWDAKQQLLDLLQQAGFPEECMISHEVDERIDG-DDPVLDVS-LALLCLGLYPNICVHKEKRKVLTTESKAALLHKTSVNCSNLAVTFPYP---FFVFGEKIRTRAVSCKQLSMVSPLQVILFGSRKIDLAANNIVRVDNWLNFDIEPELAAKIGALKPALEDLITVACDNPSDI--LRLEEPYAQLVKVVKDLCV--KSAGDFGLQR--

General information: TITO was launched using: RESULT: Template: 5AOR.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 : 5299 77123 14.55 79.75 target 2D structure prediction score : 0.51 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : 14.55 2D Compatibility (Sec. Struct. Predict.) : 0.51 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.198

(partial model without unconserved sides chains): PDB file : Tito_5AOR.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5AOR-query.scw PDB file : Tito_Scwrl_5AOR.pdb: