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



Input alignment information:
Query sequenceMTKKVGLLVMAYGTPYKDEDIERYYTDIRHGHKP-------------SEEMIADLRGRYHAIGGLSPLAKITEAQAYGLEKALND-SQDEVEFKAYIGLKHIEPFIEDAVEAMHKDGIEEAISIVLAPHYSSFSVEAYNKRAKEAADKL---GGPRINAINDWYKQPKFIQMWADRINETAKQIPADELLDTVLIVSAHSLPEKIKQHNDPYPNQLQETADFIFEKVVV-PHYALGWQSE-GKTGEPWLGPDVQDLTRELYGREKYKHFIYTPVGFVAEHLEVLYDNDYECKV-VTDEVGA-AYHRPPMPNSDPEFLEVLRTVVWEKYSN
3HCN Chain:A ((1-326))RKPKTGILMLNMGGPETLGDVHDFLLRLFLDRDLMTLPIQNKLAPFIAKRRTPKIQEQYRRIGGGSPIKIWTSKQGEGMVKLLDELSPNTAPHKYYIGFRYVHPLTEEAIEEMERDGLERAIAFTQYPQYSCSTTGSSLNAIYRYYNQVGRKPTMKWSTIDRWPTHHLLIQCFADHILKELDHFPLEKRSEVVILFSAHSLPMSVVNRGDPYPQEVSATVQKVMERLEYCNPYRLVWQSKVGP--MPWLGPQTDESIKGL-CERGRKNILLVPIAFTSDHIETLYELDIEYSQVLAKECGVENIRRAESLNGNPLFSKALADLVHSHIQ-


General information:
TITO was launched using:
RESULT:

Template: 3HCN.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -116008 for 2516 contacts (-46.1/contact) +
2D Compatibility (PS) -33228 + (NN) -18589 + (LL) -108
1D Compatibility (HY) -17200 + (ID) 4250
Total energy: -189383.0 ( -75.27 by residue)
QMean score : 0.514

(partial model without unconserved sides chains):
PDB file : Tito_3HCN.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3HCN-query.scw
PDB file : Tito_Scwrl_3HCN.pdb: