Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------MRLMINKSMKNIYIMGLLLACSGFAMAETVTQQPTGQPVRTASNPNAIRIVTRPE-----IMGLWGMEIPNNKKCVEYYNFRSSNDVVIKSGEEWSYGIYEYQPSDDPKEQLSALVMQIKFDNNKVDCSGQKQDQTGDISQYFVQWKNDHTINFCSTAKGEQCFATLRRMLP----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------- 5M11 Chain:A ((11-758)) GIWNTLLAIHKTEKAVETPKKVFAVANGVLYSVGKEAPHEAKIFDRISGLSDTSVSSIAYSEQLKSLVIYYASGNIDILDEAGRVTNVPALKDNIDLIDKTLNRLLIVGNRAYLAGGFGLSVLDVAEARIPATYAKGTKVTDVAKLDNDRLLMLKEGQLFIGKETDNLQDPAAWTALSLNLPMGSVTGLGIVGEDICFLLADGRVYVAANQSFEPELLLSSSADSRLYVTDRGLFICAENRIYFIEKGRKTTQFPIADVLGVGAMNESNTAYIALGEEGLASLLLAEGSTAEAMPVAFDGPGDNDFYEMRFSHGRLYAASGLWGTNLMGHAGMVKLYDGNRWTNFD-------------KKTVQEQLGGGF----SFNDAIDIAVSNGDPDHFFVGTWGNG---------LFEFKDGKAIARYSGNE--TAIAECNPGD-------ARVKAIAFDNKG-NLWGTLGAVGKNIFMYDPQSSTWHSFSY-PDVANLASFGNMII-LPNGDKWVNILHRSGGSTRKGVLIFNDRGTPETTSDDSHLYVEQFVNRLGAAIGHKTIYAMAVDHNGSVWMGSDIGIFGVYNAAGVLSSTSTPIAVRPVGGEEPNLYYVLDKVTVTDIVVDKLNHKWVATQGTGLYLLSEDCSKILAQFTVENSPLLSNNILSLALNDDNGLLYIGTADGLMTFQTGTGSGSASELDGVYVYPNPLRPEYPDGVTIAGLQAGCSVKITDTTGRLLYQTESVTTEVKWNARGADGNRVASGVYAVAVYDPVSKKSKLIRFAVIR

General information: TITO was launched using: RESULT: Template: 5M11.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 : 604 14671 24.29 113.73 target 2D structure prediction score : 0.47 Monomeric hydrophicity matching model chain A : 0.51 3D Compatibility (PKB) : 24.29 2D Compatibility (Sec. Struct. Predict.) : 0.47 1D Compatibility (Hydrophobicity) : 0.51 QMean score : 0.128

(partial model without unconserved sides chains): PDB file : Tito_5M11.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5M11-query.scw PDB file : Tito_Scwrl_5M11.pdb: