Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRQAIPWRDRSFRERFERWIEANVPNATWHV-IKDTDLTYLLVGALNE--ERYYAKAVT----DISRGEAGLSAFLAERHPDFVPDVIAIDS--ARNWLLMRDIGGEALRER-P-----DVRRYEAALRQYAQLQRQEIDQIETYLSYGIPDRRPATLKDEIQTYLPEL---CAGLDRHQAEAMLALQDELLTMCDELATGMPMSLEHGDLHGGNIFWRERTNDLCILDWGDATVTHPFFSVRVFWNALYDLLPEEDEVAWYKQIQTMRTVYLEAWSGVAPKDVLWRHLLIAEELGCVYRALSWHVYVTRYRYDVAESSDKPAQWLNFLLEYRDLKRRFP 4GKI Chain:C ((18-254)) -----------------SNLDADLYGYRWARDNVGQSGATIYRLYGKPNAPELFLKHGKGSVANDVTDEMVRLNWLTAF--MPLPTIKHFIRTPDDAWLLTTAIPGKTAFQVLEEYPDSGENIVDALAVFLRRLHSIPVCNCPF------NSDRVFRLAQAQSRMNNGLVDASDFDDERNGWPVEQVWKEMHKLLP---FSPDSVVTHGDFSLDNLIFDE-GKLIGCIDVGRVGIADRYQDLAILWNCLGE---FS-----PSLQKRLFQKYGI------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4GKI.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 : 874 -16596 -18.99 -75.78 target 2D structure prediction score : 0.62 Monomeric hydrophicity matching model chain C : 0.59 3D Compatibility (PKB) : -18.99 2D Compatibility (Sec. Struct. Predict.) : 0.62 1D Compatibility (Hydrophobicity) : 0.59 QMean score : 0.234

(partial model without unconserved sides chains): PDB file : Tito_4GKI.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4gki-query.scw PDB file : Tito_Scwrl_4GKI.pdb: