Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ------MHVITTQVLFIFCFLLLIHSIETLAYATRLSGARVGFIASALSLFNVMVIVSRMSNMVQQPFTGHLIDDAGKNALAIVGEQFRFL--IFGSTVGTILGIILLPSFVALFSRAIIHLAGGGGSVFQVFRKGFSKQGFKNALSYLRLPSISYVKGFHMRLIPKRLFVINMLIT-SIYTIGVLSALYAGLLAPERSTTAVMASGLINGIATMLLAIFVDP----------KVSVLADDVAKGKRSYIYLKWTSVTMVTSRVAGTLLAQLMFIPGAYYIAWLTKWF----------------------------------------------------------------------------------------------- 4IC4 Chain:A ((625-996)) KSVTRRNDIPEAAASPPSLLSFLRKNVGKDLSSIAMPVTSNEPISILQLISETFEYAPLLTKATQRPDPITFVSAFAISFLSIYRDKTRTLRKPFNPLLAETFELIREDMGFRLISEKVSH----RPPVFAFFAEHLD-----WECSYTVTPSQKF-WGKSIELNNEGILRLKFKTTGELFEWTQPTTILKNLIAGERYMEPVNEFEVHSSKGDKSHILFDKAGMFSGRSEGFKVSIIPPPSSNRKKETLAGKWTQ-SLANETTHETIWEVGDLVSNPKKKYGFTKFTANLNEITEIEKGNLPPTDSRLRPDIRAYEEGNVDKAEEWKLKLEQLQRERRNKGQDVEPKYFEKVSKNEWKYITGPKSYWERRKKHDWSDISQLW

General information: TITO was launched using: RESULT: Template: 4IC4.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 : 1313 -141351 -107.65 -547.87 target 2D structure prediction score : 0.22 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : -107.65 2D Compatibility (Sec. Struct. Predict.) : 0.22 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.196

(partial model without unconserved sides chains): PDB file : Tito_4IC4.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4IC4-query.scw PDB file : Tito_Scwrl_4IC4.pdb: