Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTEKGVETMKIAVDAMGGDHAPQAIVEGVALAQQDFPEVEFLLYGKEAEIKKYLTNEKNITIIHTDEKINSDDEPVKAIRRKKTASMVLAAQAVKNGEADAVFSAGNTGALLAA-------GLFIVGRIKNIERPGLMSTLPVVGKEGAGFDMLDL----GANAENKPEHLLQYGILGSFYARKVRGIGRPRVALLN----NGTEATKGS---EVTKKAYELLQNETSL-NFIGNVEARELLN----GVADVVVT-DGFTGNAVLKSIEGTAMNMMNLLKSAILNEGIKGKMGAMLLKDGLRSLKAEMDYSKHGGAVLFGLKAPVIKTHGATGPDAVRYTIRQIHTMLETDVVGQLVEQFEKSEE 1PTM Chain:A ((100-276)) -------------------------------------------------------------------------------------TLARACDGCLNGEFAALITGPVHKGVINDAGIPFTGHTEFFEERSQAKK-VVMMLA-TEEL--RVALATTHLPLRDIADAITPALLHEVIAILHHDLRTKFGIAEPRILVCGLNPHAGEGGHMGTEEIDTIIPVLNELRAQ--GMKLNGPLPADTLFQPKYLDNADAVLAMYHDQGLPVLKYQ-------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 1PTM.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 : 491 5753 11.72 37.60 target 2D structure prediction score : 0.59 Monomeric hydrophicity matching model chain A : 0.57 3D Compatibility (PKB) : 11.72 2D Compatibility (Sec. Struct. Predict.) : 0.59 1D Compatibility (Hydrophobicity) : 0.57 QMean score : 0.436

(partial model without unconserved sides chains): PDB file : Tito_1PTM.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1PTM-query.scw PDB file : Tito_Scwrl_1PTM.pdb: