Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKMLLFLIIAAVSMLTIAGCSSQSSSADGKVTLKFFHRWPKEPEKSYFEEVVKEFEKDHPDIDIQIEAVLNDSYKDKIKVMLGTTSPPDIYFSWSDEFAFKFIRGNKALDLSSYYKNDTDW-SSQLVQSQITPFTYENKQYGVPWQMDAKSFFYNKDIFQKLNLD---PPKTWDELIDVSKKLKEH--GYTPISFGTKATWTISHYIGTLNQRMVDEKTREKDYNAKTGEFTDEGYVKALEKLQELM--PYFNKHVNSVDHEYVRQQFKSGKSAMIYAETAEI-KLVE--PVNLGMFPFPEISGQKGSSEALTGAPEGFMISSRTKHPKEAMEFLQFLTSKRMGEKLVKDVGKYSAVQGTATEEN----ATAIQREAVQHIVDAKSMVPWFDMDVDVEVADAYLTGVQQMLGGDMTPQQVMKAVQKAAKQVRASAE 4RJZ Chain:A ((26-405)) -------------------------------VTLTLWSLDR---DIQPAPNLIKEFNALNNGIKIEYRQLQFDDVVSESMRAYSTGNAPDIIAIDN-PNHAMFASRGAFLDVTDMIAKSDVIKTENYFPGPLKSVTWDGKYFGVPKATNTIALYYNKDLFKAAGLDAAKPPQTWDELVDAARKLTNPAKNVYGISFSAKANEEG-TFQFLPWAQMAGATY---------KNINTDGAVKALETWKTLLDEKLASPDTLTRSQWDSTATFNAGNAAMAISGPWEIDRMLKDAKFDWGVTLLPVPTPDAPRSSAMG--DYNWAIFSKTKHPAEAFKAIEFFASKDKDM-F-KNFGQLPARSDIPVPPTGNALKDEALKTFVEQLKYAQPRG-P--SPEWPKISKAIQDAIQGALSGQMTPKAALDQAAEKIKLV-----

General information: TITO was launched using: RESULT: Template: 4RJZ.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 : 2083 55647 26.71 152.46 target 2D structure prediction score : 0.65 Monomeric hydrophicity matching model chain A : 0.71 3D Compatibility (PKB) : 26.71 2D Compatibility (Sec. Struct. Predict.) : 0.65 1D Compatibility (Hydrophobicity) : 0.71 QMean score : 0.471

(partial model without unconserved sides chains): PDB file : Tito_4RJZ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4RJZ-query.scw PDB file : Tito_Scwrl_4RJZ.pdb: