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



Input alignment information:
Query sequence-------MGQKFHKLNSKYGIIDYPILLKDLESIIQEFPKSERKFYEYAIK-----------ALKKEVGK---------KEKILHMTSADPKLTKFGFMVITE--KKLLFVTMKGG-----FFGG------ADTEVVEFKSIKEVDFDIAPNPLGMATMQLG----ILHLKIKGKLGMSSKRTIRNIDEHSLDKIVAILREQTK--------------------------
2A6T Chain:A ((1-245))MSFTNATFSQVLDDLSARFILNLPAEEQSSVERLCFQIEQAHWFYEDFIRAQNDQLPSLGLRVFSAKLFAHCPLLWKWHEEAFDDFLRYKTRIPVRGAIMLDMSMQQCVLVKGWKASSGWGFPKGKIDKDESDVDCAIREVYEETGFDCSSRINPNEFIDMTIRGQNVRLYIIPGISLDTRFEISKIEWHNLMDLPTFKMKNKFYMVIPFLAPLKKWIKKRNIANNTTKE


General information:
TITO was launched using:
RESULT:

Template: 2A6T.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 : 492 3132 6.37 19.58
target 2D structure prediction score : 0.59
Monomeric hydrophicity matching model chain A : 0.63

3D Compatibility (PKB) : 6.37
2D Compatibility (Sec. Struct. Predict.) : 0.59
1D Compatibility (Hydrophobicity) : 0.63
QMean score : 0.275

(partial model without unconserved sides chains):
PDB file : Tito_2A6T.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-2A6T-query.scw
PDB file : Tito_Scwrl_2A6T.pdb: