Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MFARDALSTAVETACDPDPAVDTISTIEAGNN-HTYRVTLADGTDLFLKVGTR--FPDAFPAEPATMRRVRAE--TDLPVPRVHGTGTDPLEYPYAVYEYVPDCEAEWA-G-DLSHEAAERLCREAGRHLCELHQITFPQFGRIGLDTDASADDTLVADAPDADALTVVDPTPFDDLLRQSLDRQVTELADSPFDTRRDSLEAFGTDLIDRSDFADVTPALVHGDYRLGNLCVDPSAEQITAAVLDWELPTALDPLWDAVMAQSLLTAGHRLDPDSRQTLRRAFWEAYGTSTAD---TPRRRCYELLARIRLARHLDTECRGLSEAARRARITDHHEAFDALLVDR 5IQI Chain:C ((10-280)) --TNVKAMKYLIEHYFDNFKVDSIEIIGSGYDSVAYLVN----NEYIFKTKFSTNKKKGFAKEKAIYNFLNTNLETNVKIPNIEYSYISD-ELSILGYKEIKGTFLTPEIYSTMSEEEQNLLKRDIASFLRQMHGLDYTDISECTIDN---------------------KQNVLEEYI-LLRETIYNDLT-DIEKDYIESFMERLNATT----VFEGKKCLCHNDFSCNHLLLDG--NNRLTGIIDFGDSGIIDEYCDFIYLLEDSEEEI------GTNFGEDILRMY-GNIDIEKAKEYQDIVEEYYPIETIV--------------------------------

General information: TITO was launched using: RESULT: Template: 5IQI.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain C - contact count / total energy / energy per contact / energy per residue : 1140 12927 11.34 49.53 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain C : 0.67 3D Compatibility (PKB) : 11.34 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.304

(partial model without unconserved sides chains): PDB file : Tito_5IQI.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5iqi-query.scw PDB file : Tito_Scwrl_5IQI.pdb: