Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRKKVRKAVIPAAGLGTRFLPATKAQPKEMLPIVDKPAIQYIVEEAAESGIEDILIITGRNKRSIEDHFDRSAELEFNLREKGKTETLKEMQQIADLANIHYIRQKEPLGLGHAVLCAEHFIGDEPFAVLLGDDIMVSETPALRQLMD--VYDVYGTEVVGVQSVLPEDVSKYGIINTSGSQGHVYEVNDLVEKPSPEEAPSEIAVMGRYVLNSSIFSVLKTIGRGAGNEIQLTDALREVCRKEPIHARLLEGNRYDIGDKLGCFKASTEIGLMRPEMRSQLLAYLEDVIKRETKEMLR 1H5R Chain:D ((2-205)) ---KMRKGIILAGGSGTRLYPVTMAVSKQLLPIYDKPMIYYPLSTLMLAGIRDILII------STPQDTPRFQQLLGDGSQWG--------------LNLQYKVQPSPDGLAQAFIIGEEFIGGDDCALVLGDNIFYGHD--LPKLMEAAVNKESGATVFAYHVNDPE---RYGVVEFDKNGTAI----SLEEKPL--EPKSNYAVTGLYFYDNDVVQMAKNLKPSARGELEITDINR-------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 1H5R.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain D - contact count / total energy / energy per contact / energy per residue : 998 -60602 -60.72 -300.01 target 2D structure prediction score : 0.48 Monomeric hydrophicity matching model chain D : 0.73 3D Compatibility (PKB) : -60.72 2D Compatibility (Sec. Struct. Predict.) : 0.48 1D Compatibility (Hydrophobicity) : 0.73 QMean score : 0.412

(partial model without unconserved sides chains): PDB file : Tito_1H5R.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1H5R-query.scw PDB file : Tito_Scwrl_1H5R.pdb: