Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLAGVLSILPWLADTLLSPADAYPESSSSSSSRSRSTSPSRSRTSSPPPNTDADLADERLSLRTDQLLPVEGANSPCALPQPRCVRREGKVLHGASGDFVWKVEYE--GSSMIVKGGPG---ITKAEAEMTIFVRTRTSIPVPKVYGVVHEDDSTYIYFEFVAGVSLTSAVQRLSEPALSSVYKQLRQMLDELHAVLAPPGTVIGS-----LD---GSNTF---AFTIRQGNDSPRAFGDLTSSAALADYFKEEYLALPDTSQEAWAAIEAHL-GRSSPLVLVHGDLWPSNILVSVDNLDNPFVAAIIDWENGGFYPEWVEFPPVARRALGG--------RCDATDRVLQVVAGSDNVEGFNKEDYRWATHVYGAF 2QG7 Chain:D ((112-400)) ---------------------------------------------------------------------------------------EFQIINGG-TNILIKVKDMSKQAKYLIRLYGPKTDNREREKKISCILYNK-NIA-KKIYVFFTN----GRIEEFMDGYALSRED--I---KNPKFQKLIAKNLKLLHDIKLNENLYKELQVTQKVPGTRPSFLWNTIWKYFHLLNEERKKICSFDAK---ANILK---LIDFDVLRDSIVEVESLCKRENSPIVLCHCDLLSSNIINTVG-----DSISFIDFEYSCPMERAYDIANHFNEYAGFNCDWDLTPSKEEEYHFIMHYLGTDD-------------------

General information: TITO was launched using: RESULT: Template: 2QG7.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain D - contact count / total energy / energy per contact / energy per residue : 846 -9127 -10.79 -41.11 target 2D structure prediction score : 0.54 Monomeric hydrophicity matching model chain D : 0.66 3D Compatibility (PKB) : -10.79 2D Compatibility (Sec. Struct. Predict.) : 0.54 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.160

(partial model without unconserved sides chains): PDB file : Tito_2QG7.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2qg7-query.scw PDB file : Tito_Scwrl_2QG7.pdb: