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



Input alignment information:
Query sequenceMFGSNDDKKAPQGGEKKGLFGWWRKKPQAGEQPADQPVEPVSETAAAEQRAPADDVAQSLTEQPGRQQPSAAEPAEPPAPVAEAPLAGDEPASAEEHSPRPEAPVAQPEPILAAEPEPEPEPEPEPEPEPVAPLAAAPAVSEPATRPGFFARLRQGLSKTSASIGEGMASLFLGRKEI-DDDL---LDDIETRLLTADVGVEATTLIVQNLTKRVARKELADS--------GALYKALQEELASLLRPVEQPLQVDVAREPYVILVVGVNGVGKTTTIGKLAKKLQLEGKKVMLAAGDTFRAAAVEQLQVWGERNRIPVIAQHTGADSASVIFDAVQAAKARGIDVLIADTAGRLHTKDNLMEELKKVRRVIGKLDETAPHEVLLVLDAGTGQNAINQAKQFNLAVELTGLALTKLDGTAKGGVIFALAKQFGLPIRYIGVGEGIDDLRTFEADAFVQALFAERENA
1NG1 Chain:A ((2-282))------------------------------------------------------------------------------------------------------------------------------------------------------------FQQLSARLQEAIGRLR-GRGRITEEDLKATLREIRRALMDADVNLEVARDFVERVREEALGKQVLESLTPAEVILATVYEALKEALGGEAR-------LPVLKDRNLWFLVGLQGSGKTTTAAKLALYYKGKGRRPLLVAADTQRPAAREQLRLLGEKVGVPVLEVMDGESPESIRRRVEEKARLEARDLILVDTAGRLQIDEPLMGELARLKEVLG------PDEVLLVLDAMTGQEALSVARAFDEKVGVTGLVLTKLDGDARGGAALSARHVTGKPIYFAGVSEKPEGLEPFYPERLAGRILGM----


General information:
TITO was launched using:
RESULT:

Template: 1NG1.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -148789 for 2216 contacts (-67.1/contact) +
2D Compatibility (PS) -29293 + (NN) -11133 + (LL) 7420
1D Compatibility (HY) -17200 + (ID) 5200
Total energy: -204195.0 ( -92.15 by residue)
QMean score : 0.632

(partial model without unconserved sides chains):
PDB file : Tito_1NG1.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-1NG1-query.scw
PDB file : Tito_Scwrl_1NG1.pdb: