Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ------------------------MITQNKDILFRSPIMNKLMVYAYTGVVITMLFWGSAFNAMSYVIQYMPPLSAAAERFTIASLGLFILFA-----AIGKLSWAALR-----------QNLVIYLIIGIIGIAGFNLGCFYGLQTTSAVNGALIMATTPLITLLLTILLDGEKLTLNKFIGVVFGLSGVLFVISHGHISTLLHLKIAI---------------------GDLFILLGGVSFCL-----------------ANVLSRRYVKNATPLETTTFSMMFGALTLIILSVIFEHPSQAIAMAPITAHLAMGYV--IICSTMIAYLFWFNGIQKLGAGRASIFFNFVPV-----------FSMLVALLAGQSLNIWQLIGTALVMLGVMS---SGGFIQIKRPALIAKPCTK---- 3DUZ Chain:A ((2-440)) EHCNAQMKTGPYKIKNLDITPPKETLQKDVEITIVETDYNENVIIGYKGYYQAYAYNGGSLDPNTRVEETMKTLNVGKEDLLMWSIRQQCEVGEELIDRWGSDSDDCFRDNEGRGQWVKGKELVKRQNNNHFAHHTCNKSWRCGISTSKMYSRLECQDDTDECQVYI---LDAEGNPINVTVDTVLHRDGVSMILKQKSTFTTRQIKAACLLIKDDKNNPESVTREHCLIDNDIYDLSKNTWNCKFNRCIKRKRAKYTEGDTATKGDLMHIQEELMYENDLLKMNIELMHAHINKLNNMLHDLIVSVAKVDERLIGNLMNNSVSSTFLSDDTFLLMPCTNPPAHTSNCYNNSIYKEGRWSSQCIDFSNYKELAIDDDVEFWIPTIGNTTYHDSWKDASGWSFIAQQKSNLITTMENTKFGG

General information: TITO was launched using: RESULT: Template: 3DUZ.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 : 1109 -54837 -49.45 -171.36 target 2D structure prediction score : 0.27 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -49.45 2D Compatibility (Sec. Struct. Predict.) : 0.27 1D Compatibility (Hydrophobicity) : 0.65 QMean score : -0.037

(partial model without unconserved sides chains): PDB file : Tito_3DUZ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3DUZ-query.scw PDB file : Tito_Scwrl_3DUZ.pdb: