Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDSFILVFLYALIYRNGGCRLLDKWLKAELEKKIGAIQHMSLLDEQGGTSTVRKIVTSQ--GAFLLKSSSRQRYREWLRREALVLQKLTETHRLPVPVYYGFIQQQHSSHIVMSFEDGITLTSALRKAKGDTEKKKLIKSFGQFLNRLHETELVPDLQP---EIDWLD---LQIKRAGE---YVEKGQAEGSAGLLKELDQHRPVPVQQTMIHGDCTTDNVLVKDGEVCLFIDAAGISAGDPRYDESLAIRNF-ATNEAFLNAFYEGYCRYRVSKQEFEYFNGGLYEFF 4GKI Chain:C ((34-270)) --------------------------------------------VGQSGATIYRLYGKPNAPELFLKHGKGS-VANDVTDEMVRLNWLTA--FMPLPTIKHFIRTPDDAWLLTTAIPGKTAFQVLEE-Y-PDSGENIVDALAVFLRRLHSIPVCNCPFNSDRVFRLAQAQSRMNNGLVDASDFDDERNGWPVEQVWKEMHKLLPFSPDSVVTHGDFSLDNLIFDEGKLIGCIDVGRVGIADRYQDLAILWNCLGEFSPSLQKRLFQKYGIDNPDMNKLQFHLM-LDE--

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 : 931 15462 16.61 68.72 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain C : 0.66 3D Compatibility (PKB) : 16.61 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.377

(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: