Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTWRKSYERWKQTEHLDLELKERLIELEGDEQALEDCFYKDLEFGTGGMRGEIGAGTNRMNIYTVRKASAGFAAYISKQGEEAKKRGVVIAYDSRHKSPEFAMEAAKTLATQGIQTYVFDELRPTPELSFAVRQLNAYGGIVVTASHNPPEYNGYKVYGDDGGQLPPKEADIVIEQVNAIENELTITVDEENKLKEKGLIKIIGEDIDKVYTEKLTSISVHPELSEEVDVKVVFTPLHGTANKPVRRGLEALGYKNVTVVKEQELPDSNFSTVTSPNPEEHAAFEYAIKLGEEQNADILIATDPDADRLGIAVKNDQGKYTVLTGNQTGALLLHYLLSEKKKQGILPDNGVVLKTIVTSEIGRAVASSFGLDTIDTLTGFKFIGEKIKEYEASGQYTFQFGYEESYGYLIGDFARDKDAIQAALLAVEVCAFYKKQGMSLYEALINLFNEYGFYREGLKSLTLKGKQGAEQIEAILASFRQNPPQKMAGKQVVTAEDYAVSKRTLLTESKEEAIDLPKSNVLKYFLEDGSWFCLRPSGTEPKVKFYFAVKGSSLEDSEKRLAVLSEDVMKTVDEIVESTAK 3I3W Chain:A ((3-426)) -----------------------------------------KYFGTDGIRGEVANS--TITVEFTQKLGNAVGSLINQKN---YPKFVIVGQDTRSSGGFLKFALVSGLNAAGIDVLDL-GVVPTPVVAFMTVKHRAAAGFVITASHNKFTDNGIKLFSSNGFKLDDALEEEVEDMIDGD--FIYQP-Q-----FKFGSYKIL-ANAIDEYIESIYSRFAK--F-VNYKGKVVVDCAHGAASHNFEALLDKFGIN---YVSIASNPDGLNINV-GCGATC---VSNIKKAVKEQKADLGISLDGDADRIIIVDEN--G--QEIDGDGILNILAQYSDICGG-------TNGIVGTQMTNMSYENHYRANKIPFIRSKVGDRYVLEDLVK------YGYKIGGESSGHVINLNFGTTGDGLFTAIQLLAIFSQ---ADKPVSEFKLQGE-L---MQ--QTLINVPLTK----K--VAREDLQKV--------------------------------ASDVNDVEKRLGNRGRVLLRPSGTEPVLRVMVEADDKSL---------------------------

General information: TITO was launched using: RESULT: Template: 3I3W.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 : 2577 -189727 -73.62 -447.47 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain A : 0.68 3D Compatibility (PKB) : -73.62 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.455

(partial model without unconserved sides chains): PDB file : Tito_3I3W.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3I3W-query.scw PDB file : Tito_Scwrl_3I3W.pdb: