Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKISTYENKKVLVLGLAKSGVS-AAKLLHELGALVTVNDGKPFDENPEAQELLSLGIKVITGSHPIELLD-EEFSLMVKNPGIPYSHPLVAKAQEMGIPVITEVELAYEVA--ECPIIGITGTNGKTTTTTMTGLLLNAGADQGI-ARLAG----NIGYPA-SGVA---QEAKSEDKIVMELSSFQLMGI------TDFRPHIAVITNIYEAHIDYHGTRKEYVKAKWNLQKNMTEKDYLILNWNQSELQELAQR-TKARVLPFSTKEVLEDGV-YADD-YSIYYKKEKIMEISELGVPGKHNVENALAAISVAKLYGISNEAIRETLHFFHGVPHRTQYVGEIQGRKFYNDSKATNILATKMALSGFETSKVVLLAGGLDRGNTFDELIPSLKGIKAMVVFGQTKEKLMDAGKKAGIETIVTADSVEQAVPLALENSTDGDVVLLSPANASWDQYPNFETRGNRFMEAVNRLK 3EAG Chain:B ((3-326)) -------AMKHIHIIGIGGTFMGGLAAIAKEAGFEVSGCDAKMYPPMSTQLE--ALGIDVYEG-FDAAQLDEFKADVYVIGNVAKRGMDVVEAILNLGLPYISGPQWLSENVLHHHWVLGVAGTHGKTTTASMLAWVLE-YA-GLAPGFLIGGVPENFGVSARLPQTPRQDPNSQSPFFVIEADEYDTAFFDKRSKFVHYRPRTAVLNNLEFDHADIFADLGAIQTQFHYLVRTVPSEGLIVCNGRQQSLQDTLDKGCWTPVEKFGTEHGWQAGEANADGSFDVLLD-GKTAGRVKWDLMGRHNRMNALAVIAAARHVGVDIQTACEALGAFKNVKR------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3EAG.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 1718 6518 3.79 21.58 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain B : 0.65 3D Compatibility (PKB) : 3.79 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.494

(partial model without unconserved sides chains): PDB file : Tito_3EAG.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3EAG-query.scw PDB file : Tito_Scwrl_3EAG.pdb: