Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -------------------------------------MKRNGIVSALCFIGF------LAAEA----PDISVAEALVLLSI------------LFFVPGI---FPFVFRQSP--------VRAAQFMENGLIQCYPVAAFFAVLALVTEVGGFALI------WWMYTV------------FNALYAILRLWETKIHRIEET---SVLFG-LIYLAG---GGFWFFAYAAHLQIM------------QFG--PLIILLTAVHFHYSAFLIPIF--N-GLLGRT-IRKHRMLYSWITWVILLSPLLIALGITYSKTLDVI----------AVSIYMAAIYLHAFL-VFTAAF---------RTKTGTFLIRLSSAVLM-ITIAF----------------SMIYSFGVFRQEVTLTINQMIWIHG---FVNAFGVILPALIGWRIE------DAKPFDAD--------SVKTFSRIYGKRKIGEEFLANI------QAENNARYSGLVDDMGSLRS----KDFSP----EKLAPLILSFYEQTI-EYNIKAKV-TWSTWFRPLA------IIYEWFSRRIGQIHLSTNPDWYRMYSKIKGVHSKKDGRERVRAWIRTNEKNETI-FTAL--YSVYRSNGEGYMNISLPLPFSSMTGILKPYHH-QEKLVLTSRRRKSR---AGDEGIYLQTRAGTCPLP-LSETFLIEAV-----HDNKLTAVHHMWLFG-IKFLTVH-YSITHINQPIERT 4O5P Chain:A ((3-813)) NFGFHIAPTHPVAGRLTYDSKKLSENILKQQSDERVFSRAQCCKAIHITLGFDGTNNNDKADGSSVSPSCSNVARLIHASIGSGDDINSRGIFKYYCPGVGTVFPDIKEFTPSNMGLIGAEGGENRINWGLVQLVDALFYTLLKSRLKLNDVQGLVEEMSTNWTVSTLTGGLLENGEKKRRAALEPKLKELEEKLRQRQNSGQKPHILAMRLYIYGFSRGAAEARAFANWLQELTRVSDADGRVEYRFAGLPISIEFLGLFDTVAAVGLPFAAGHMDWADDTMRLPDEALPEDCSFLKRCVHLVSCHEQRASFPLDSIRRRDMNGRRTGPSCYRKWTVEYAYPGVHSDVGGGYGVGNQGKAVGGSEFLLSQIALQHMYAEAFEAGAPLQVPEWRVMVPKIEAEFSVS-EELATRFNAWQAQAKAGPLEEVIRRETALITAWRIDRYAGGLRNKAFFANVPPDMPEAQQKAWEALHKRRSREYAAAQQLPPMSAAEQAEWDRNVALIGGEDQLRDLRVEKQFDPPLDQRQLLGAAAEFAHDYKGDWGVLDDGMTVGGVIDLLLGGTVFLINEEDEAEEYSQIHRDGSARYHQLFSAPDRV---APGQEKLVALFDEQVHDSRAPFTDYFRYRLVHFDNESNKRLSVLATAGRVVGV----GVMLASVGLSVKRRDPRMLLGGLPEISAFDPLTGIALPMVGGAALDNLRAFTREPGDKVEQIGQLPPPPPLAVAAVQSPALQQVLLAQQTV

General information: TITO was launched using: RESULT: Template: 4O5P.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 : 2830 -109499 -38.69 -203.53 target 2D structure prediction score : 0.40 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : -38.69 2D Compatibility (Sec. Struct. Predict.) : 0.40 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.214

(partial model without unconserved sides chains): PDB file : Tito_4O5P.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4O5P-query.scw PDB file : Tito_Scwrl_4O5P.pdb: