Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKMLLFLIIAAVSMLTIAGCSSQSSSADGKVTLKFFHRWPKEPEKSYFEEVVKEFEKDHPDIDIQIEAVLNDSYKDKIKVMLGTTSPPDIYFS----WSDEFAFKFIRGNKALDLSSYYKNDTDWSSQLVQSQITPFTYENKQYGVPWQMDAKSFFYNKDIFQKLNL---DPPKTWDELIDVSKKLKEHGYTPISFGTKATWTISHYIGTLNQRMVDEKTREKDYNAKTGEFTDEGYVKALEKLQELMPYFNKHVNSVDH--EYVRQQFKSGKSAMIYAETAEIKLVEPVNLGMFPFPEISGQKG-------SSEALTGAPEGFMISSRTKHPKEAMEFLQFLTSKRMGEKLVKDVGKYSAVQGTATEENATA------IQREAVQHIVDAKSMVPWFDMDVDVEVADAYLTGVQQMLGGDMTPQQVMKAVQKAAKQVRASAE 5CI5 Chain:A ((40-414)) ------------------------------------------------WNSVIKTFEEKY-GISVEVQLFGFDTYYDKLVTALQAGKGPDLAFADLGGWVPTFAEK-----GWLEPMEEHLKNWEGTAQIWPNLWPTVTYKKIRYGLPWYTDCRLLLYNKAMFEKAGLNPDNPPKTWDELLDAALKITDTKNRIYGYGVSGTKTEHTTLGYMMFLYAAGGKLLTDDYSKAAFDSPEG-LKALKFYTDLAKKYNVSPNAIQYHEDDYRNMMAQNRVAMAIGGPWSFPLIEAAN------PDIAGKYSVALHPYDAKPASVLGGWALVIPSSSPNKEDAWKLAEYLTSFDVWMKWVEEKGGPMPTRMDVCKKSKLANDVKWQIIFETFPHAV-ARPPIPQYP-----QISEQIQTMVQRVLLGELTPEEAIKIAAENVNKILGA--

General information: TITO was launched using: RESULT: Template: 5CI5.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 : 1941 42637 21.97 120.78 target 2D structure prediction score : 0.68 Monomeric hydrophicity matching model chain A : 0.69 3D Compatibility (PKB) : 21.97 2D Compatibility (Sec. Struct. Predict.) : 0.68 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.387

(partial model without unconserved sides chains): PDB file : Tito_5CI5.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5CI5-query.scw PDB file : Tito_Scwrl_5CI5.pdb: