Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence --------------------------------MSHNLITTKTEFSQMPIDTQLTTLF-CLIDDFCTDITQNVEQYMLT---YGQTKRLRQSKIHASEVITLLLWFHLTGSRN---FKAFYLYWAKPF-------LCSYFTNLPSYSRFIELKAKYAMYFVALIESLKVHSAGIAF--IDSTKLAVCHNKRIHQHRVFADSASRGKTSVDWFYGFKIHLICDHIGRLVSYCITTGNVDDRKVLPDLIEHSKLKGKLFGDRGYVGKNWKSRLAEVGVQLITRVKRNMKPQVLAPFDHAVLKKRGIIEAPFKLMKSQFDLEHSRHRSKMGLLTTIFAALTLYALVLVNGYKSGIQQILKPIDLNSA 5HC3 Chain:A ((22-365)) MTNKIAEDPRIDPRIKAIFSGMDLGGGGDVESREAMLEAASSEEATAVRDGLRVFLDACDNEEIAPSAGLKIEDYEFTSEPDGNIAKIQYIRPDSTDKLPCVYYIHGGGMQSLSCYYGNYRAWGKIIASNGVAVAMVEFRNALVPSALPEV-APYPAGLNDCVSGVKWVAAHADELGIDASRIIIAGESGGGNLTLAAGLRLKQEGSQDLIQG--LYALCPYIAGSWPSEDSPSSTENNGILLDL--HNNQGAMGYGIEAYEMRDPLAWPGFATEEDVS----GLVPTFISVNECDPLRDEGI-NFYRLLLRAGVS---AKCRQVMG---TIHG-TEIFPIACPDVSRDTAASIANFCKGG--

General information: TITO was launched using: RESULT: Template: 5HC3.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 : 1631 -13869 -8.50 -46.85 target 2D structure prediction score : 0.30 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : -8.50 2D Compatibility (Sec. Struct. Predict.) : 0.30 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.104

(partial model without unconserved sides chains): PDB file : Tito_5HC3.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5HC3-query.scw PDB file : Tito_Scwrl_5HC3.pdb: