Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MPIYNAPLADMKFILNDVFKAEQFWQANEKLAH-VDAATAEAILEEMAKFAQNVTHPLNRTGDEEGARYENGEVFTPAGFKDAFRQYAEGGWIGLGADEEWGGQGMPKMLTVLADEM-----LFATNPSFMLYPLLSV---GAGMALSSYASQEQKETYLPKIYSGE----WSGTMCLTEPHAGTDLGIIKTKAERNEDGTYNITGTKIFITGGDNDLAENIIHLVLAKTPDAPAGSRGISLFIVPKYLVNEDGSLGDRNHVGPGSIEHKMGIKASATCVMNFDGAKGYLVGKENEGLAAMFVMMNYERLSMGIQGLGASEFAYQNAAQYATARLQGRSAAGVQSPSKPADSILVHGDVRRMLLNVRANNEASRAFAVYVGQQLDITKFSTDAEAVKKANDRVALLTPIAKAYLTDTAFQATLDAQMVFGGHGYIREWGMEQCIRDLRIAQIYEGTNGVQSQDLIGRKTIKCGGAFIAEYITEIRDFANDLDTDLNFIKDA--TLDAATEIEAITQFIIEQAAENVEFPNSAAVDYLHAVGLLSFSYMFAKIAAAAKDKSGDFYQNKLALAQYFVERILPDIDARIAKIKAGSDLIMGFSEDYFTNQA 3DJL Chain:A ((18-520)) -SNLYLSDGALCEAVTREGAGW-DSDFLASIGQQLGTAES----LELGRLA-NVNPPELLRYDAQGRRL--DDVRFHPAWHLLMQALCTNRVHNLAWEEDARS-G-AFVARAARFMLHAQVEAGSLCPITMTFAATPLLLQMLPAPFQDWTTPLLSDRYDSHLLPGGQKRGLLIGMGMTEKQGGSDVMSNTTRAERLEDGSYRLVGHKWFFSVPQ---SD--AHLVLAQTAG------GLSCFFVPRFLPD-----GQRNAIRLERLKDKLGNRSNASCEVEFQDAIGWLLGLEGEGIRLILKMGGMTRFDCALGSHAMMRRAFSLAIYHAHQRHVFG------------NPLIQQPLMRHVLSRMALQLEGQTALLFRLARAWDRRADA-------KEALWARLFTPAAKFVICKRGMPFVAEAMEVLGGIGYCEESELPRLYREMPVNSIWEGSGNIMCLDVL-RVLNKQAGVY--DLLSEA---FVE------VKGQDRYFDRAVRRLQQQLR----------KPAEELGREITHQLFLLGCGAQMLKYASP-------------PMAQAWCQVMLDTRGG------------------------

General information: TITO was launched using: RESULT: Template: 3DJL.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 : 2701 -60066 -22.24 -123.09 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain A : 0.70 3D Compatibility (PKB) : -22.24 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.70 QMean score : 0.461

(partial model without unconserved sides chains): PDB file : Tito_3DJL.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3DJL-query.scw PDB file : Tito_Scwrl_3DJL.pdb: