Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MQLQVMNSPFNQEQAELLNRLLPTLTESQKIWLSGYLSAQSVSAQEAAGTPAAAVSAEAPAPAVSKEVTVLYGSQTGNAQGLAENAGKQLEQSGFQVTVSSMSDFKPNQLKKVTNLLIVVSTHGEGEPPDNALSFHEFLHGRRAPKLEDLRFSVLALGDSSYEFFCQTGKEFDQRLEELGGKRISPRVDCDLDYDEPAAEWLEGVLKGLNEAGGGSAAPAPAAASQTGESSYSRTNPFRAEVLENLNLNGRGSNKETRHVELSLEGSGLTYEPGDSLGVYPENDPELVELLLKEMNWDPEEIVTLNKQGDVRPLKEALISHYEITVLTKPLLEQAAQLTGNDELRELLAPGNEENVKAYIEGRDLLDLVRDYGPFSVSAQEFVSILRKMPARLYSIASSLSAN---PDEVHLTIGAVRY-DAHGRERKGVCS-ILCAERLQPGDTLPVYVQHNQNFKLPKDPETPIIMVGPGTGVAPFRSFM-----QEREETGAEGKAWMFFGDQHFVTDFLYQTEWQNWLKDGVLT--KMDVAFSRDTE----EKVYVQHRMLEHSAELFEWL-QEGAAVYICGDEKHMAHDVHNTLLEIIEKEGNMSREEAEAYLADMQQQKRYQRDVY 3W5V Chain:C ((92-293)) ------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------VRLYSIASSAIGDFGDSKTVSLCVKRLIYTNDAGEIVKGVCSNFLC--DLQPGDNVQITGPVGKEMLMPKDPNATIIMLATGTGIAPFRSFLWKMFFEKHDDYKFNGLGWLFLGVPT-SSSLLYKEEFGK-MKERAPENFRVDYAVSREQTNAAGERMYIQTRMAEYKEELWELLKKDNTYVYMCG-LKGMEKGIDDIMVSLAEKDG-------------------------

General information: TITO was launched using: RESULT: Template: 3W5V.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 : 742 20172 27.19 109.04 target 2D structure prediction score : 0.62 Monomeric hydrophicity matching model chain C : 0.62 3D Compatibility (PKB) : 27.19 2D Compatibility (Sec. Struct. Predict.) : 0.62 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.460

(partial model without unconserved sides chains): PDB file : Tito_3W5V.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3W5V-query.scw PDB file : Tito_Scwrl_3W5V.pdb: