Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MCPLMAENHEVIEEGNSSELPLSAEDAKKLTELAENVL-QGWD----V---QAEKIDVIQGNQMALVWKVHTDS---------GAVCLKRIHRPEKKALFSIFAQDYLAKKGMNVPGILPNKKGSLYSKHGSFLFVVYDWIEGRPFELT---VKQDLEFIMKGLADFHTASVGYQPPNGVPIFTKLGRWPNHYTKRCKQMETWKLMAEAEKEDPFSQLYLQEIDGFIEDGLRIKDRLLQSTYVPWTEQLKKSPNLCHQDYGTGNTLLGEN------EQIWVIDLDTVSFDLPIRDLRKMIIPLLDTTG-------------VWDDETFNVMLNAYESRAPLT-------------EEQKQVMFIDMLFPYELYDVIREKYVRKSALPKEELESAFEYERIKANALRQLI 4DA5 Chain:A ((81-429)) -------------------EQ----PEPRTRRRAYLWCKEFLPGAWRGLREDEFHISVIRGGLSNMLFQCSLPDTTATLGDEPRKVLLRLY---AEAMVLESVMFAILAERSL-GPKLYGIFP----------QGRLEQFIPSRRLDTEELSLPDISAEIAEKMATFHGMKMPFNKEPKWL-FGTMEKYLKEVLRIK-----FT-EESR--IKKLHK-------LLSYNLPLELENLRS-----LLESTPSPVVFCHNDCQEGNILLLEGRENSEKQKLMLIDFEYSSYNYRGFDIGNHFCEWMYDYSYEKYPFFRANIRKYPTKKQQLHFISSYLPAFQNDFENLSTEEKSIIKEEMLLEVNRFALASHFLWGLWSIVQAK---------------------------

General information: TITO was launched using: RESULT: Template: 4DA5.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain A - contact count / total energy / energy per contact / energy per residue : 1007 21311 21.16 78.35 target 2D structure prediction score : 0.71 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : 21.16 2D Compatibility (Sec. Struct. Predict.) : 0.71 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.394

(partial model without unconserved sides chains): PDB file : Tito_4DA5.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4DA5-query.scw PDB file : Tito_Scwrl_4DA5.pdb: