Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNGFMDKLSEKIMPLANLLGQNRYLTVLRDAFMLSFPLTMFGSIVVVINNLPFFSDA---TKGTLSNLFGNGQNATMSIMSVFVTFGIGYYLSKSYDVEGIFGGAVSFASFLILTPFAMKTAGGE-----DV--------T----GVLSL-DRLG----AKGMFIGMIAAFLAGEIYCRITKRGWQIKMPDGVPPAVTKPFAALIPAVVTLTIFLVINAVMTGIFNANLHDVVYEVIQKPLTGL--GSSLPATLIALFFVQFLWFFGLHGQIIVNSVMDPIWNTLMLDNLEAY--------QHGKELPHIITK---------------------------PFME---TFTVGIGGSGMTLAVVLLMAFVL---KKKQYRDVGRLALAPGI-FNVNEPAIFGLPIVLNATILIPWVVAPLIVTTFNYLVMAAGLVPAPTGVSVPWTVPIIA-S--GVLA---TNSW-LGGMLQVIDFVIVAFIWYPFLKVLDKQPDLDIA 5IWS Chain:A ((6-443)) -----------------------FWQKFGKALLVVVAVMPAAGLMISIGKLIGMSAGDINAVHTIARVMEDIGWAIITNLHILFAVAIGGSWAKD-RAG---GAFAALLAFVLTNRITGAIFGVNAEMLADSKAKVSSVLAGDLIVKDYFTSVLGAPALNMGVFVGIITGFLGATLYNKYYNY---NKLPQALAFFNGKRFVPFVVIVWSTVTAIVLSLLW-----PFIQSGLNEFG-RWIAASKDSAPIVAPFVYGTLERLLLPFGLHHMLTI-PM----NYTELGGTYTMLTGSKVGQVVAGQDP--LWLAWITDLNNLLANGDTKAYNDLLNNVVPARFKAGQVIGS-TAALMGIAF----AMFRNVDKEKRAKYKPMFLSAALAVFLTGVTEPIEFMFMFI-APVL---YVVYAITTGLAFALADLINLRV-HA-----FGFIELITRTPMMVNAGLTRDLINFVIVSLVFFGLNFTLFNFLIKKFNLPTPG---

General information: TITO was launched using: RESULT: Template: 5IWS.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 : 1508 -213305 -141.45 -589.24 target 2D structure prediction score : 0.59 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : -141.45 2D Compatibility (Sec. Struct. Predict.) : 0.59 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.259

(partial model without unconserved sides chains): PDB file : Tito_5IWS.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5IWS-query.scw PDB file : Tito_Scwrl_5IWS.pdb: