Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAQPLSTAADIAQQDAVRQLCEQLEFFQQHPPLEIRPLAAGQSNLNYYLRTA--RGEYVLRRYARQ--LGVCRQQEFRCQQAAAAKQIAATPLLLHNHQQLLISEFLPGGEPLK---LTDSRLSLLADTLGILHNLRVQTPLL---------------QPASYLRQLLAQGQQITL--------------QPAANLFAALQRCAEQLAGMATDLVLCHLDLHADNLLWNG-NKIWLLDFEYSQLCDNSFDLAAIMLHF---------ELTAAQQQRLLRQYSAQRRYPDRHTAERLAATLPQRLQLAKCLYSGFCWLWYQATPALHHRANSWQQRLQQLLQSETTEPFR 2QG7 Chain:D ((112-433)) ---------------------------------EFQIINGG-TNILIKVKDMSKQAKYLIRLYGPKTD---NREREKKISCILYNKNIAKK--IYVFFTNGRIEEFMDGYALSREDIKNPKFQKLIAKNLKLLHDIKLNENLYKELQVTQKVPGTRPSFLWNTIWKYFHLLNEERKKICSFDAKANILKLIDFDVLRDSIVEVESLCKRENSPIVLCHCDLLSSNIINTVGDSISFIDFEYSCPMERAYDIANHFNEYAGFNCDWDLTPSKEEEYHFIMHYLGTDDEE-------LINQLIREIQPFYICSHINWGLWSLLQGMHS-----------------------

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 : 889 -18336 -20.63 -78.36 target 2D structure prediction score : 0.57 Monomeric hydrophicity matching model chain D : 0.65 3D Compatibility (PKB) : -20.63 2D Compatibility (Sec. Struct. Predict.) : 0.57 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.321

(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: