Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTKKVGVGQAHSKIILIGEHAVVYGYPAISLPLLEVEVTCKVVPAESPWRLYEEDTL----SMAVY---------ASL----EYL---NITEACIRCEIDSAIPEKRGMGSSAAISIAAIRAVFDYYQADLPHDVLEILVNRAEMIAHMNPSGL-DAKTCLSD--Q-PIRFIKN-VGFTELEMDLSAYLVIADTGVYGHTRE--A----------IQVVQNK------------GKD-ALPFLHAL---GELTQQAEIAISQKDAEGLGQILSQAHLHL-KEIGVSSLEADSLVETALSHGALGAKMSGGGLGGCIIALVTNLTHAQELAERLEEKGAVQTWIESL 2CZ9 Chain:A ((1-325)) ----MIKVKSPGRVNLIGEHTDYTYGYVMPMAINLYT-KIEAEKHG--EVILYSEHFGEERKFSLNDLRKENSWIDYVKGIFWVLKESDYEVGGIKGRVSGNLPLGAGLSSSASFEVGILETLDKLYNLKLDSLSKVLLAKKAENEFVGVPCGILDQFAVVFGREGNVIFLDTHTLDYEYIPFPKDVSILVFYTGVR----SSEYAERKHIAEESLKILGKGSSKEVREGELSKLPPLHRKFFGYIVRENARVLEVRDALKEGNVEEVGKILTTAHWDLAKNYEVSCKELDFFVERALKLGAYGARLTGAGFGGSAIALVDKEDA-ETIGEEI-------------

General information: TITO was launched using: RESULT: Template: 2CZ9.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 : 1368 -31944 -23.35 -119.64 target 2D structure prediction score : 0.57 Monomeric hydrophicity matching model chain A : 0.70 3D Compatibility (PKB) : -23.35 2D Compatibility (Sec. Struct. Predict.) : 0.57 1D Compatibility (Hydrophobicity) : 0.70 QMean score : 0.439

(partial model without unconserved sides chains): PDB file : Tito_2CZ9.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2CZ9-query.scw PDB file : Tito_Scwrl_2CZ9.pdb: