Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MEARVIGLEKLGKHDVELVGGKNSSLGEMISHLSNAGVSVPGGFATTADAYREFLDQSG-LNARIQAE-------LAELN-------VDDVNALAETGAKIRQ-WIVETPLTPGLEQEIREAFAALSNGNPDIA-----------------------------------VAVRSSATAEDLPDAS--FAGQQETFLNIRGI-----DNVLIAVKEVFASLFNDRAIAYRVHQGFEHSLVALSAGVQRMV---RSETGAAGVMFTLDTESGFRDVVFITASYGLGEMVVQGAVNPDEFYLSKPLLNAGKHAVLRRNLGSKHQKMIYGEEGSAGKSVVVVDVEKQERQQFALNDHELQELAKQALIIEKHYGAPMDIEWAKDGDDGQIYIVQAR------PETVKSRQNVGTMERYLLKQKGTVLCEGRSI---------------GQRIGS----------GKVRIV-NSIKEMDKVQDGDVLVSDMTDPDWEPVMKRAAAIITNRGGRTCHAAIITRELGVPAIVGCGNATEVLTDGQEVTV-----SCAEGD-------TGFIYEGALDFEVQRNSIE-SMPKL--------SFKIMMNVGNPDRAFDFAQIPNEGIGLARLE---FIINRMIGVHPKALLNIESLPRETRAAVMTRTAGYASPVEFYVEKLVEGIATLAAAFADKPV--IVRMSDFKSNEYANLIG-------GKLYEPEEENPMLGFRGASRYISDNFRDCFELECRALKK----VRDEMGLTNI-QIMIPFVRTVSEAKRV----IELLAQNGLKRGEN-GLKVIMMCELPTNALLAEQFLEHFDGFSIGSNDLTQLTLGLDRDSG------------IVSHLFDERD-AAVKALLSMAIHACR--KAGKYVGICGQGPSDHPDLAKWLMEQGIESVSLNPDSVLDTWFFLAEEKIKQI 2R82 Chain:A ((18-856)) -----------------LLGGKGCNLAEM----TILGMPIPQGFTVTTEACTEYYNSGKQITQEIQDQIFEAITWLEELNGKKFGDTEDPLLVSVRSGARASMPGMMDTILNLGLNDVAVEGFAK-KTGNPRFAYDSYRRFIQMYSDVVMEVPKSHFEKIIDAMKEEKGVHFDTDLTADDLKELAEKFKAVYKEAMNGEEFPQEPKDQLMGAVKAVFRSWDNPEAIVYRRMNDIPGDW-GTAVNVQTMVFGNKGETSGTGVAFTRNPDTGEKGIYGRYLINAQGEDVVAGVRTP------QPITQ------LENDMPDCYKQFM-----------------------------------DLAMKLEKHFRDMQDMEFTIE--EGKLYFLQTRNGKRTAPAALQIACDL-VDEGMITEEEAVVRIEAKSLDQLLHPTFNPAALKAGEVIGSALPASPGAAAGKVYFTADEAKAAHEKGERVILVRLETSPEDIEGMHAAEGILTVRGGMTSHAAVVARGMGTCCVSGCG---EIKINEEAKTFELGGHTFAEGDYISLDGSTGKIYKG--DIETQEASVSGSFERIMVWADKFRTLKVRTNADTPEDTLNAVKLGAEGIGLCRTEHMFFEADRIMKIRKMIL----SDSVEAREEALNELIPFQKGDFKAMYKALEG-RPMTVRYLDPPLHEFVPHTEEEQAELAKNMGLTLAEVKAKVDELHEFNPMMGHRGCRLAVT--YPEIAKMQTRAVMEAAIEVKEETGIDIVPEIMIPLVGEKKELKFVKDVVVEVAEQVKKEKGSDMQYHIGTMIEIPRAALTADAIAEEAEFFSFGTNDLTQMTFGFSRDDAGKFLDSYYKAKIYESDPFARLDQTGVGQLVEMAVKKGRQTRPGLKCGICGEHGGD-PSSVEFCHKVGLNYVSCSP------------------

General information: TITO was launched using: RESULT: Template: 2R82.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 : 3382 105313 31.14 153.07 target 2D structure prediction score : 0.57 Monomeric hydrophicity matching model chain A : 0.71 3D Compatibility (PKB) : 31.14 2D Compatibility (Sec. Struct. Predict.) : 0.57 1D Compatibility (Hydrophobicity) : 0.71 QMean score : 0.286

(partial model without unconserved sides chains): PDB file : Tito_2R82.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2R82-query.scw PDB file : Tito_Scwrl_2R82.pdb: