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



Input alignment information:
Query sequenceMKKLYGVIGNPIGHSMSPDIHNASLKDLGLDGHYHAFKVEENDLEDAVKGIRALGVQGINVTVPHKVSIMDYLDHIDESAKVLGAVNTVRREGD-KLVGYNTDGEGFVKSLM--KVLDKPISELSFLMIGAGGAARAIFTTIVRNTPKKFDICNRTLEKAKRLTEATPSFHNKEVLSIKEAEERLEQ-YDVIIHTTSV---GMYPNVDDVPLSLQRAASSAVVCDIVYNPIQTALLKEASQKGL-KTLDGVGMFVEQAALSFQLWTGQEPNIEKMRSIVIGKLGGTEC
3SEF Chain:B ((32-290))----YAVFG---NHSKSPFIHTLFARQTQQSMIYTAQCVPVDGFTEAAKHFFAQGGRGCNVTVPFKEEAYRFADRLTERARLAGAVNTLKKLDDGEILGDNTDGEGLVQDLLAQQVLLKGA---TILLIGAGGAARGVLKPLLDQQPASITVTNRTFAKAEQLAELVAAYGEVKA----QAFEQLKQSYDVIINSTSASLDGELPAIDPVIFS-----SRSVCYDMMYGKGYTVFNQWARQHGCAQAIDGLGMLVGQAAESFMLWRGLRPGTKQI-------------


General information:
TITO was launched using:
RESULT:

Template: 3SEF.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 1405 -44776 -31.87 -180.55
target 2D structure prediction score : 0.59
Monomeric hydrophicity matching model chain B : 0.76

3D Compatibility (PKB) : -31.87
2D Compatibility (Sec. Struct. Predict.) : 0.59
1D Compatibility (Hydrophobicity) : 0.76
QMean score : 0.519

(partial model without unconserved sides chains):
PDB file : Tito_3SEF.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3SEF-query.scw
PDB file : Tito_Scwrl_3SEF.pdb: