Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLHTTQLYQHVPETRWPIVYSPRYNITFMGLEKLHPFDAGKWGKVINFLKEEKLLSDSM-LVEAREASEEDLLVVHTRRYLNELKWSFAVATITEIPPVI---FLPNFLVQRKVLRPLRTQTGGTIMAGKLAVERGW--AINVGGGFHHCSSDRGGGFCAYADITLAIKFLFERVEGISRATIIDLDAHQGNGHERDFMDDKRVYIMDV--YNRHIYPGDRFAKQAIRRK-------VELEWGTEDDEYLDKVERNIKKSLQEHLPDVVVYNAGTDILEGDRLGGLSISPAGIVKRDELVFRMVRGRRVPILMVTSGGYQ-KRTARIIADSILNLFGLGLIGPESPSVSAQNSDTPLLPPAVP 4QA1 Chain:A ((19-314)) ------------------IYSPEYVSMCDSLAKIP-----KRASMVHSLIEAYALHKQMRIVKPKVASMEEMATFHTDAYLQHLQ-KVSQE---------EYGLGYDCPATEGIFDYAAAIGGATITAAQCLIDGMCKVAINWSGGWHHAKKDEASGFCYLNDAVLGILRLRRKFE---RILYVDLDLHHGDGVEDTFSFTSKVMTVSLHKFSPGFFPGTGDVSDVGLGKGRYYSVNVPIQDGIQDEKYYQICESVLKEVYQAFNPKAVVLQLGADTIAGDPMCSFNMTPVGIGK----CLKYILQWQLATLILGGGGYNLANTARC------------------------------------

General information: TITO was launched using: RESULT: Template: 4QA1.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 : 1476 -10474 -7.10 -38.65 target 2D structure prediction score : 0.59 Monomeric hydrophicity matching model chain A : 0.69 3D Compatibility (PKB) : -7.10 2D Compatibility (Sec. Struct. Predict.) : 0.59 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.419

(partial model without unconserved sides chains): PDB file : Tito_4QA1.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4QA1-query.scw PDB file : Tito_Scwrl_4QA1.pdb: