Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSAAEMGMAETADLRTRLAPLFPGREISLRSAAAPVASPLHRAVASACVLAQ-PDGADPLFLKLAHPDMQDDLLDTDGAAARLAARAGVAPALVLA-RPGLLGFAYLALPWRYARTGDLQPPATLAAVLAAKKRLHEGDNLGRR---------------FCPFTRIAQLQAQAEAAQVPL-----------PAETAPLLRQAALIQQALIASGMDLRFCHNHAAASNIMLNG-SQMMLVDFDIGGDNDPWYDVGALLNEVC---------DFDAPRRAAIEAYAGRCD----EALFARCRLYGAVDDLMWGLWGFTRAVTAPRDGIEFWKYGTWRLFQARTTMTMRDFELWLRTV 2QG7 Chain:D ((116-453)) ---------------------------------------INGG-TNILIKVKDMSKQAKYLIRLYGPKTD--NREREKKISCILYNKNIAKKIYVFFTNG-RIEEFM-DG-YALSREDIKNPKFQKLIAKNLKLLHDIKLNENLYKELQVTQKVPGTRPSFLWNTIWKYFHLLNEERKKICSFDAKANILKLIDFDVLRDSIVEVESLCKRENSPIVLCHCDLLSSNIINTVGDSISFIDFEYSCPMERAYDIANHFNEYAGFNCDWDLTPSKEEEYHFIMHYLGTDDEELINQLIREIQPFYICSHINWGLWSLLQGMHS-S-DFDFINYGMTRLTASCLPI------------

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 : 1010 -15243 -15.09 -60.01 target 2D structure prediction score : 0.68 Monomeric hydrophicity matching model chain D : 0.63 3D Compatibility (PKB) : -15.09 2D Compatibility (Sec. Struct. Predict.) : 0.68 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.280

(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: