Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MEQTLPPDSSASWGAWGASASTSLEAYRALRADRARWLPVALDIARGHGLDISSPHVFSTGTNLVVGLG-----ERLILKIFPPQLRAQFVSESGSLTQLAGRLSLPIPEIVAEGARDGWPYLVITRLTGTLGSEVWPSLPEDQKERVLRQIGETIASVQRAPLGPLASIE---PRWDAFMRQQMQGCRARHERLGLAPKFLVGLDDLLREAAAGLIPMDAPPVILTGEYIPENFLLACDDGEWSLKGLFDFGDVRAGFRDYDLLGASAFMAAGRPGRVRNLLEGFGYAKPDFTLKRRLMALMLLHQASDLNSHICIAGWQEKANDLVELQELIWAS 4GKI Chain:C ((38-271)) -------------------------------------------------------------GATIYRLYGKPNAPELFLKHGKGSVANDVTDEMVRLNWLTA--FMPLPTIKHFIRTPDDAWLLTTAIPGKTAFQVLEEYP-DSGENIVDALAVFLRRLHSIPVCNCPFNSDRVFRLAQAQSRMNNGLVDASD--FDDERNGWPVEQVWKEM-HKLLPFSPDSVVTHGDFSLDNLIFDEG----KLIGCIDVGRVGIADRYQDLAILWNCLGEFSPSLQKRLFQKYGID---NPDMNKLQFHLMLDEF-----------------------------

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 : 960 -1525 -1.59 -6.75 target 2D structure prediction score : 0.65 Monomeric hydrophicity matching model chain C : 0.65 3D Compatibility (PKB) : -1.59 2D Compatibility (Sec. Struct. Predict.) : 0.65 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.297

(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: