Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MFKKFLFQIHWFLGISAGLILSIMGVTGAIYSYDQQILKWVNTDSYVVQAQSSPKLTPAQLYQHFTTIQPEIKINSITIAKDATASSVVNIEKEGERRGYNMMVNPYTAQVLPEVQGRKLLLLIQQIHRNLTAGEFGKQITGACALMLIYFVLSGLYLRWPKKHSARQWLAVKPKLKGRNFIWDLHAVVGTWVIVFYLLFACTGLYWSYDWWRSGMFKVLGVEQPKMQGHGGSGRNKDQLPKIQLDNAQLITALNQTWSGFNNQIGRDYSTLTVNLPKKDDGKIELSFVDATPQHERARNQAVYNYKTANIEKMELYEDKKLNQKIMSSMLPVHRGSFFGPVYQFVAMLASLAMPLFFVTGWMLYLKRRKQKKLTQAARQSLAGHYIDQNAKPWLITYATQTGVAEQLAWRTATSLQEA-HQPVQVKSVQQLTEADLQQHEQIL-FVISTYGTGEAPDLASNFAKKLLKTN-LRLQHVKYAVLALGSKEYPDTYCSFGHTVDDWLKNNGAKALFDIIEVDNAN---PADIQNWNQALVKATKLDLHAVN-----------------I-------------------------------EKVFDNWTLQQRDLLNPNSLGQPAYNIELTANH-EAIWQAGDIAEIQPGNSPERINKFLQHHHILKNAVVDSLQV------SI-------------------E-------------------KALW------------------NKDLTGEIEP-----FANLDHLLEQLPTLPTREYSIASIPSQ--QVLRLVVRQQYDESDDLDLDLGLGLGLGLGLGLGSGWLTQHTEINQ------------NVALRIRTNE--------------SFHLIDD-NRPIICIGNGTGIAGLMSLLHTRTRH-------NYTENWLIFGERQRAHDFFYASTIEAWQTM-GMLKRLDLAFSRDQE-QRVYVQDIIQQNAAELINWIERGAVLYVCGSI-DGMASGVDQALIHILGEEQ----------VDELRQQGRYRRDVY 2BPO Chain:B ((44-682)) -------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------VVTENNKNYLVLYASQTGTAEGFAKAFSKELVAKFNLNVMCADVENYDFESLNDVPVIVSIFISTYGEGDFPDGAVNFEDFICNAEAGALSNLRYNMFGLGNSTYEF-FNGAAKKAEKHLSAAGAIRLGKLGEADDGAGTTDEDYMAWKDSILEVLKDELHLDEQEAKFTSQFQYTVLNEITDSMSLGEPSAHYLPSHQLNRNADGIQLGPFDLSQPYIAPIVKSRELFSS-NDRNCIHSEFDLSGSNIKYSTGDHLAVWPSNPLEKVEQFLSIFNLDPETIFDLKPLDPTVKVPFPTPTTIGAAIKHYLEITGPVSRQLFSSLIQFAPNADVKEKLTLLSKDKDQFAVEITSKYFNIADALKYLSDGAKWDTVPMQFLVESVPQMTPRYYSISSSSLSEKQTVHVTSIVENFPNP-------ELPDAPPVVGVTTNLLRN-IQLAQNNVNIAETNLPVHYDLNG-PRKLFANYKLPVHVRRSNFRLPSNPSTPVIMIGPGTGVAPFRGFIRERVAFLESQKNVSLGKHILFYGSRNTDD-FLYQDEWPEYAKKLDGSFEMVVAHSRLPNTKKVYVQDKLKDYEDQVFEMINNGAFIYVCGDAKGMAKG-VSTALVGILSRGKSITTDEATELIKMLKTSGRYQEDVW

General information: TITO was launched using: RESULT: Template: 2BPO.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 2500 13760 5.50 29.66 target 2D structure prediction score : 0.55 Monomeric hydrophicity matching model chain B : 0.60 3D Compatibility (PKB) : 5.50 2D Compatibility (Sec. Struct. Predict.) : 0.55 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.389

(partial model without unconserved sides chains): PDB file : Tito_2BPO.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2BPO-query.scw PDB file : Tito_Scwrl_2BPO.pdb: