Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MEDVQAVRGYLERSGWLEGIREVRFLAAGEYNENHYVRASGGEYVLRINHGSQLGLGREQIGYEFSVLSAVAPSGVTPRPYRVDPWPEGLSGGTLLMDYLPGR-PLDY------SHDLERAARILARVHALPPDDGLIRQDRAVLDIVAESEGLLDRYPDHPR--PEMRDRLLAYRDDVLTLNERSRDFLASEPPVMVNTEVNSGNFIMSHMDGRHGKGDFLVDWEKAVVSTRHQDLGHFLAPTTTLWKTDTQLDREQREAFLSAYRRELLLLGAAAPDMDALREGSAILERTILLRALSWSHMAYCEYT-RAERAIRNADTLAKIRQYLDNAECFLTWKE 3DXQ Chain:B ((3-293)) ---TDEARAKLAAIPMLAGYTGPLERLGGLTNLVFRA----GDLCLRIP----------NRANEAVAAREAAKAGVSPEVLHVDPA-----TGVMVTRYIAGAQTMSPEKFKTRPGSPARAGEAFRKLHGSGAVFPFRF--E----LFAMIDDYLKVLSTKNVTLPAGYHDVVREAGGVRSALA-----AHPLPLAACHCDPLCENFLDTG------ERMWIVDWEYSGMNDPLWDLGDLSVEG--------KFNANQDEELMRAYFGGEAR--------PAERGRVVIYKAMCDLLWTLWGLIQLANDNPVDDFRAYADGRFARCKALMETP-EFSRH--

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 B - contact count / total energy / energy per contact / energy per residue : 1319 -52314 -39.66 -191.63 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain B : 0.66 3D Compatibility (PKB) : -39.66 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.345

(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: