Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MVSIRRSFEAYVDDMNIITVLIPAEQKEIMTPPFRLETEITDFPLAVREEYSLEAKYKYVCV--SDHPVTFGKIHCVRASSGHK--TDLQIGAVIRTAAFDDEFYYDGELGAVYTADHTVFKVWAPAATSAAVKLSHPNKSGRTFQMTRLEK--GVYAVTVTGDLHGYEYLFCI----CNNSEWMETV--DQYAKAVTVNGEK-------GVVLRPDQMKWTAPLKP-FSHPVDAVIYETHLRDFSIHENS-GMINKGKYLALTETDTQTANGSSSGLAYVKEL---GVTHVELLPVNDFAGVDEEKP-----------------------------LDAYNWGYNPLHFFAPEGSYASNPHDPQTRKTELKQMINTLHQHGLRVILDVVFNHVYKRE----NSPFEKTVPGYFFRHDECGMPSNGTGVGNDIASERRMARKFIADCVVYWLEEYNVDGFRFDLLGILDIDTVLYMK---EKATKAKPG-----ILLFGEGWDLATPLPHEQKAALANAPRMP--GIGFFNDMFRDAVKGNT-------------FHLKATGFALGN--------GESAQAVMHGIAGSSGWKALA------------------PI--VPEPSQSINYVESHDNHTFWDKMSFALPQENDSRKRSR-QRLAAAIILLAQGVPFIHSGQEFFRTKQGVENSYQSSDSINQLDWDRRETFKEDVHYIRRLISLRKAHPAFRLRSAADIQRHLECLTLKEHLIAYRLYDLDEVDEWKDIIVIHHASPDSVEWRLPNDIPYRLLCDPSGFQEDPTEIKKTVAVNGIGTVILYLASDLKSFA 4J3U Chain:A ((77-731)) -----------------------------------LQPESAGLPETVTQKFPFISSYRAFRVPSSVDVASLVKCQLVVASF---DVTGLQLPGVL-----DDMFAYTGPLGAVFSEDSVSLHLWAPTAQGVSVCF-FDGPAGPALETVQLKESNGVWSVTGPREWENRYYLYEVDVYHPTKAQVLKCLAGDPYARSLSANGARTWLVDINNETLKPASWDELADEKPKLDSFSDITIYELHIRDFSAHDGTVDSDSRGGFRAF-------AYQASAGMEHLRKLSDAGLTHVHLLPSFHFAGVDDIKSNWKFVDECELATFPPGSDMQQAAVVAIQEEDPYNWGYNPVLWGVPKGSYASDPDGP-SRIIEYRQMVQALNRIGLRVVMDVVYNHLDSSGPCGISSVLDKIVPGYYVRRDTNGQIENSAAM-NNTASEHFMVDRLIVDDLLNWAVNYKVDGFRFDLMGHIMKRTMMRAKSALQSLTTDAHGVDGSKIYLYGEGWDFAE-VARNQRGINGSQLNMSGTGIGSFNDRIRDAINGGNPFGNPLQQGFNTGLFLEPNGFYQGNEADTRRSLATYADQIQIGLAGNLRDYVLISHTGEAKKGSEIHTFDGLPVGYTASPIETINYVSAHDNETLFDVISVKTPMILSVDERCRINHLASSMMALSQGIPFFHAGDEILRSKSIDRDSYNSGDWFNKLDF-----------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4J3U.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 : 2822 11532 4.09 21.39 target 2D structure prediction score : 0.68 Monomeric hydrophicity matching model chain A : 0.71 3D Compatibility (PKB) : 4.09 2D Compatibility (Sec. Struct. Predict.) : 0.68 1D Compatibility (Hydrophobicity) : 0.71 QMean score : 0.357

(partial model without unconserved sides chains): PDB file : Tito_4J3U.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4J3U-query.scw PDB file : Tito_Scwrl_4J3U.pdb: