Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -MSIEIIISLGIYFIAMLLIGWYAFKKTTDINDYMLGGRGLGPFVTALSAGAADMSGWMLMGVPGAMFATGLSTLWLALGLTIGAYSNYLLLAPRLRAYTEAADDAITIPDFFDKRFQHSSSLLKIVSALIIMIFFTLYTSSGMVSGGRLFESAFGADYKLGLFLTTAVVVLYTLFGGFLAVSLTDFVQGAIMFAALVLVPIVAFTHVGGVAPTFHEIDAVNPHLLDIFKGASVISIISYLAWGLGYYGQPHIIVRFMAIKDIKDLKPARRIGMSWMIITVLGSVLTGLIGVAYAHKFGVAVKDPEMIFIIFSKILFHPLITGFLLSAILAAIMSSISSQLLVTASAVTEDLYRSFFRRKASDKELVMIGRLSVLVIAVIAVLLSLNPNSTILDLVGYAWAGFGSAFGPAILLSLYWKRMNEWGALAAMIVGAATVLI---WITTGLAKSTGVYEI---IPGFILSMIAGIIVSMITKRPAKASYRLFGVMEKLLKRKK- 3ZHE Chain:A ((2-400)) QKSDEVTEKFKRYCNQLEKYG-----QTENVHS---------PVMAMLRRKGRKQLIEIMKRDGDC--TSSINKLWIVG-------------------YYHPFQFFIRDKE---KNMAIAVLLTMFCGELQEMLSLP------------------DDKYPALWNMYIGDFHRYMPDEEIQKCLAVGYYSRAIDLDP-------------NQGRAFHVLAGLRADL----NVAQKLRLMILGQLADAPYKKGTELLEYLKFPQKESTDKLMVDFVIWALNEKSKRMDYQMTGIKIVNEFKAEIEQK-------LEFDWSLIMSTCRLASKLAMKKFG--FQQFYNCFDTISTLYITIYSRTISSKCLLA--EAISWISDSAEILGHLDEQK-----------------NEPHFQKLSVFAKTKWNELNDLVMNHINSVFTSMSLTINPSISMTSFLLNGPISEPNVEFLSQLINYLVSVEFPPMEIIHDREESGPLLRRIN

General information: TITO was launched using: RESULT: Template: 3ZHE.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 : 1656 -270571 -163.39 -692.00 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain A : 0.58 3D Compatibility (PKB) : -163.39 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.58 QMean score : 0.367

(partial model without unconserved sides chains): PDB file : Tito_3ZHE.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3ZHE-query.scw PDB file : Tito_Scwrl_3ZHE.pdb: