Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ----MNKTTNGWINGFIGVLIFS--GSLPATRLAVSDFDPLFLTVCRAAIAGVLAGGLLLIFRQQHPAKRDLIS-------LLVVAFGVVIGFPLLTAL---ALQHVTSAHAIVFIGLLPLATAVFGVLRGGERPRPVFWIF------------------SAAGSLLVAGFALIQGGGSSPLGDAYMLASIVVCGLGYAEGAKLSRRLGNWQVISWALVLSLPLMLPLSFFFTP-----DSWSAIG-VPALLSLAYVS-------LFSMLIGF------VFWYRGLAQGGIAAVGQLQLLQPFFGLLLASVI-LHEKVGWALVAVNIAVIMCVA------AARRFAK---------------------------------------------------- 4OYF Chain:A ((9-416)) EYPVLQKILIGLILGAIVGLILGHYGYAHAVHTYVKPFGDLFVRLLKMLVMPIVFASLVVGAASISPARLGRVGVKIVVYYLLTSAFAVTLGIIMARLFNPGAGIHLAVGGQLVHILLDIVPTNPFGALANGQVLPTIFFAIILGIAITYLMNSENEKVRKSAETLLDAINGLAEAMYKIVNGVMQYAPIGVFALIAYVMAEQGVHVVGELAKVTAAVYVGLTLQILLVYFVLLKIYGIDPISFIKHAKDAMLTAFVTRSSSGTLPVTMRVAKEMGISEGIYSFTLPLGATINMDGTALYQGVCTFFIANALGSHLTVGQQLTIVLTAVLASIGTAGVPGAGAIMLAMVLHSVGLPLTDPNVAAAYAMILGIDAILDMGRTMVNVTGDLTGTAIVAKTE

General information: TITO was launched using: RESULT: Template: 4OYF.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 : 1122 -220640 -196.65 -768.78 target 2D structure prediction score : 0.52 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : -196.65 2D Compatibility (Sec. Struct. Predict.) : 0.52 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.200

(partial model without unconserved sides chains): PDB file : Tito_4OYF.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4OYF-query.scw PDB file : Tito_Scwrl_4OYF.pdb: