Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)



Input alignment information:
Query sequenceMPKQIDTILINIGQLLTM-ESSGPRAGKSMQDLHVIEDAVVGIHEQ-KIVFAGQKGAEAG------YEADEIIDCS-GRLVTPGLVDPHTHLVFGGSREKEMNLKLQGISYLDILAQGGGILSTVKDT-RAASEEELLQKAHFHLQRMLSYGTTTAEVKSGYGLEKETELKQLRVAKKLHESQPVDLVSTF--MGAHAIPPEYQNDPDDFLDQMLSLLPEIKEQELASFADIFTETG---VFTVSQSRRYLQKAAEAGFGLKIHADEIDPL-G-----------GAELAGKLK----AVSADHLVGTSDEGIKKLAEAGTIAVLLPGTTFYLGKSTYARARAMIDEGVCVSLATDFNPGSSPTENIQLIMSIAA-----------LHLKMTAEEIWHAVTVNAAYAIGKGEEAGQLKAGRSADLVIWQAPNYMY--------------------IPYHYGVNHVHQVMKNGTIVVNREGAILG
4AQL Chain:A ((31-472))----LAHIFRGT-FVHSTWTC--------P--MEVLRDHLLGVSDSGKIVFLEEASQQEKLAKEWCFKPCEIRELSHHEFFMPGLVDTHIHASQYSFAGSSIDLP-LLEWLTKY---------TFPAEHRFQNIDFAEEVYTRVVRRTLKNGTTTACYFATIHTD--SSLLLADIT----DKFGQRAFVGKVCMDLNDTFPEYKETTEESIKETERFVSEMLQ-KNYSRVKPIVTPRFSLSCSETLMGELGNIAKTRDLHIQSHISENRDEVEAVKNLYPSYKNYTSVYDKNNLLTNKTVMAHGCYLSAEELNVFHERGASIAHCPNSNLSLSS-GFLNVLEVLKHEVKIGLGTDVAGG--YSYSMLDAIRRAVMVSNILLINKVNEKSLTLKEVFRLATLGGSQALGLDGEIGNFEVGKEFDAILINPKASDSPIDLFYGDFFGDISEAVIQKFLYLGDDRNIEEVYVGGKQVVPF------


General information:
TITO was launched using:
RESULT:

Template: 4AQL.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 : 2264 41509 18.33 109.23
target 2D structure prediction score : 0.60
Monomeric hydrophicity matching model chain A : 0.65

3D Compatibility (PKB) : 18.33
2D Compatibility (Sec. Struct. Predict.) : 0.60
1D Compatibility (Hydrophobicity) : 0.65
QMean score : 0.413

(partial model without unconserved sides chains):
PDB file : Tito_4AQL.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-4AQL-query.scw
PDB file : Tito_Scwrl_4AQL.pdb: