Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MGLRKTYAKPYSRGISSPLEALRISPVVLSALKGLLSPDTLSRLTPL-GGFEARVYTDGERVYKVYQPGEA-HLAALEAERM---ARAGLGSFVLGVAQVEGQGILVIRHFPGK-PFSPESF--TPKALAALSHLFLSLHRLPEPGYVEREELSERLERFAESLGSVPE-ALS---LIKALMREV-TW--VAGVEKRFCHRDAWAGNLLLKTQENPSHDDPEVLLVDWVRSGGDDPARDLALLKTGS-LDLLGEKRAREALFRLVQFYPK-----EVRERLAFYVPLTYLHDLHWFRTKK---P-E-GFLEALADKLPRALSFFQDCFPLRNRAC 3DXQ Chain:A ((19-288)) ----------------------------------------YTGPLERLGGLTNLVFRAGDLCLRIPGK---YINRANEAVAAREAAKAGVSPEVLHVDPA--TGVMVTRYIAGAQTMSPEKFKTRPGSPARAGEAFRKLHGSGAVFPF-RFELFAMIDDYLKVLS--NVTLPAGYHDVVREAGGVRSALAAHPLPLAACHCDPLCENFLDTGE--------RMWIVDWEYSGMNDPLWDLGDLSVEGKFNANQD-------EELMRAYFGGEARPAERGRVVIYKAMCDLLWTLWGLIQLANDNPVDDFRAYADGRFARCKALMETP--------

General information: TITO was launched using: RESULT: Template: 3DXQ.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 : 1100 -21804 -19.82 -91.61 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -19.82 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.324

(partial model without unconserved sides chains): PDB file : Tito_3DXQ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3dxq-query.scw PDB file : Tito_Scwrl_3DXQ.pdb: