Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNFLGGSLRSGGGHRRDKGFSAKNKVQQYHGDGSESIILVGRPFRVLQKISDVPPPYMVGRQRST---KYGEGGSSYVYLVENTNHLPEFPRHLALKRSFFG-VDQVTEAHKEVDIVSHIE-DKNIVRVYHSEI-SRSEGRLGVSIAMEYC-SNNLYRRIRSSAGTGPGTRLTEAEICHVMFAVTSAVGYLHAQQPPITHRDIRPENILINNKHAGPTAYKLTNFGNATTEAYQCETREEANMAIADIQMHTNPAFRAPEMADPWSKKRICEKTDMWAMGVLLYYMMYLCLPFDPS-TTIGKENWVVTFPSQAMTSYTTSLRVMAEHLLDPDPCSRWDVFALTNYMRFDEDCSRHLGTFCFTKTEWPEGWEEQDVKVLGRAPPPKAPPVSYNEPGHEQLDSRGLSGQERVYGHVNRHQPPDDRGNGRDNAVVDSDAVQEAMIVLGGDPADDDPAVAECRHQIIMEQQEAWRRAKAAAGLRDSPPMEPQESSAAPAPTRANNGAERDVFDDLFASASPTVFPTSQAPPVMSPSAPPATHQPPEKDAFSASDLFSTSAPQLHPSYPMMSTYGQAPQQMAMGGWGSGAPVMGGGGYPMQQPQNQQQASWGYGVSNANNYAPPPPPPQQQQQPFTNFLAPVPGQQPSQQPETSQPPTARATAKRDPFADLFN 5I3O Chain:A ((3-273)) --------------------------------------------------------FAVGRHQVTLEESLAEGGFSTVFLVRTHGGI-----RCALKRMYVNNMPDLNVCKREITIMKELSGHKNIVGYLDCAVNSISDNVWEVLILMEYCRAGQVVNQMNKKLQTG----FTEPEVLQIFCDTCEAVARLHQCKTPIIHRDLKVENILLNDG----GNYVLCDFGSATNKFLN-PQKDGVNVVEEEIKKYTTLSYRAPEMINLYGGKPITTKADIWALGCLLYKLCFFTLPFGESQVAICDGNF--TIPDN--SRYSRNIHCLIRFMLEPDPEHRPDIFQVSYF-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5I3O.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 : 1328 -14224 -10.71 -54.08 target 2D structure prediction score : 0.70 Monomeric hydrophicity matching model chain A : 0.67 3D Compatibility (PKB) : -10.71 2D Compatibility (Sec. Struct. Predict.) : 0.70 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.376

(partial model without unconserved sides chains): PDB file : Tito_5I3O.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5I3O-query.scw PDB file : Tito_Scwrl_5I3O.pdb: