Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLSTIFKRHHLSVITYEEITSGFSMTQKYLLTTHEKQYILKIYPLAT-FERIQQQRSFLSQHQKN--HVHCQLPIFYDTLEQWCYTISEYLAGKSLDR-LLPCLSQEKQYELGMQAGQELQKIHLLACPNLHFNWYQA-------RLRKYQQKKEQCAKL-GLNFHQKTAIETFIDKHFHL--LKESAVCFQHDDFHPQNLLYD-NQKIIVLDFDSFDWGDPWEEFFKLPKYT-VSVSQAFANGQLMGYFEGNIPQNFWKKYHLFVALNCYASQIGGYQSGNLASVQLRTKKIIQTHYFSNQPPQWFQQKPTS 4DCA Chain:A ((38-298)) -----------KINELRYLSSGD-DSDTFLC---NEQYVVKVPKRDSVRISQKRELELYRFLENCKLSYQIPAVVYQ----SDRFNIMKYIKGERITYEQYHKLSEKEKDALAYDEATFLKELHSIEIDCSVSLFSDALVNKKDKFLQDKKLLISILEKEQLLTDEMLEHIETIYENILSNAVLFKYTPCLVHNDFSANNMIFRNNRLFGVIDFGDFNVGDPDNDFLCLLDCSTDDFGKEFGRKVLKYYQHKA-PEVAERKAELNDVYWSIDQIIYGYERK--------------------------------

General information: TITO was launched using: RESULT: Template: 4DCA.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 : 1010 12012 11.89 49.03 target 2D structure prediction score : 0.53 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : 11.89 2D Compatibility (Sec. Struct. Predict.) : 0.53 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.266

(partial model without unconserved sides chains): PDB file : Tito_4DCA.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4dca-query.scw PDB file : Tito_Scwrl_4DCA.pdb: