Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKMLLFLIIAAVSMLTIAGCSSQSSSADGKVTLKFFHRWPKEPEKSYFEEVVKEFEKDHPDIDIQIEAVL-NDSYKDKIKVMLGTTSPPDIYFSWSDEFAFKFIRGNKALDLSSYYKNDTDWSSQLVQSQITPFTYENKQYGVPWQMDAKSFFYNKDIFQKLNLD-PPKTWDELIDVSKKLKEHGYTPISFGTKATWT--ISHYIGTLNQRMVD--EKTREKDYNAKTGEFTDEGYVKALEKLQELM--PYFNKHVNSVDHEYVRQQFKSGKSAMIYAETAEI-KLVE-PVNLGMFPFPEISGQKGSSEALTGAPEGFMISSR--TKHPKEAMEFLQFLTSKRMGEKLVKDVGKYSAVQGTATEENATAIQREAV-QHIVDAKSMVPWFDMDVDVEVADAYLTGVQQMLGGDMTPQQVMKAVQKAAKQVRASAE 3QUF Chain:A ((27-411)) ----------------------------GGKTKISFYSYFKD----NQIGEVVKGFEKKNPDITLDVQYGQDPAQYISTLQTRLAGGKPPTIFNLTM-DNRTDVMKSGAALDISGED-----FLDGIDDTNFALFQQDGKTYGMPVSAWVGAFFYNKDILKKAGYDKFPKTWDEFIEMGKKINSNGSTAFLEDFNTQIAGSFTGLLASYY-GEQGKSGDLDADIWSGK-STFTK-DWTPVFKRWEAAAKAGVIPQKSVGLSADQVKQEFVSGNLGVMRSGPWDLPDLQKSDIDFGVAPFPAYSKEDGQW-INGGPDQGFAIASRASDKEKAAAKKFLAYLNSEEGLEAFTSAAGTLSLSSKYNAEP--PAELKDVVDNYFKQNKFYWVNWP-KSPTVMSTEGIAQQQKIVQGQISAKDAAKALDAKWATL-----

General information: TITO was launched using: RESULT: Template: 3QUF.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 : 2054 69950 34.06 188.04 target 2D structure prediction score : 0.65 Monomeric hydrophicity matching model chain A : 0.73 3D Compatibility (PKB) : 34.06 2D Compatibility (Sec. Struct. Predict.) : 0.65 1D Compatibility (Hydrophobicity) : 0.73 QMean score : 0.425

(partial model without unconserved sides chains): PDB file : Tito_3QUF.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3QUF-query.scw PDB file : Tito_Scwrl_3QUF.pdb: