Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MIRIENLSVSYKDTLALKDISLVLHGPTITGIIGPNGAGKSTLLKGMLG-----IIPH----QGQAFLDDKEVKK-SLHRIAYVEQKI--NIDYNFPIKVKECVSLGLFPSIPLFRSLKAKHWKK--VQEALEIVGLADYAERQISQLSGGQFQRVLIARCLVQ-----EADYILLDEPFAGIDSVSEEIIMNTLRDLKKAGK-TVLIVHHDLSKIPHYFDQV-LLVNREVIAFGPTKETFTETNLKEAYGNQLFFNGGDL 5B57 Chain:C ((1-257)) MLTAHHLDVA--HGTILRDLSLSIEPGRVTALLGRNGAGKSTLLKTFAGELTGSVA--GVRVTGDVTLNGEPLARIDAPRLACLRAVLPQAAQPAFPFSVDEIVLLGRYPHA--RRSGATSHRDRDIAWRALERAGADALVGRDVTTLSGGELARVQFARVLAQLWPDH-PRYLLLDEPTAALDLAHQHRLLDTVRAVAREWQLGVLAIVHDPNLAARHADAIAMLADGTIVAHGAPRDVMTPAHIAQCYG----------

General information: TITO was launched using: RESULT: Template: 5B57.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain C - contact count / total energy / energy per contact / energy per residue : 1140 -55299 -48.51 -247.98 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain C : 0.76 3D Compatibility (PKB) : -48.51 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.76 QMean score : 0.455

(partial model without unconserved sides chains): PDB file : Tito_5B57.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5B57-query.scw PDB file : Tito_Scwrl_5B57.pdb: