Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLKRIVQAFFIIFGGVVGIFLIPELFVLLNIQDIPLITNAYTSAAIGAIIFFLISIWGTEYVVNWVKWIEDSLLKAPVPDLLFGSLGLVFGLIIAYLIVNVIPLDNIPYRIFSTIIPVFLAFFLGYLGFQVGFKKKDELISLFSISARMQKKKGTADEEHEVQDKKLKILDTSVIIDGRIADICQTG--FLEGVIVIPQFVLEELQHIADSSDVLKRNRGRRGLDILNRIQKEL--DIEVEIYEGDFEDIQEVDSKLVKLAKLTS---GVVVTNDF-----NLN---KVCELQKVAVLNINDLANAVKPVVLPGEEMNVQVIKDGKEHNQGVAYLDDGTMIVVEEGRNYIGKHIDVLVTSVLQTAAGRMIFAKPKLLEKAL 2HWY Chain:A ((855-1012)) ---------------------------------------------------------------------------------------------------------------------------------------------------------------------PYLVPDTQALCHHL--PVIRQLATSGRFIVIIPRTVIDGLDLLK-EH-----PGARDGIRYLEAEFKKGNRYIRCQ------------LYKILDSCKQLTLAQ------LPLDNPSVLSGALQAAAHASVDIKNVLDFYKQW--------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 2HWY.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output 3D Compatibility (PKB) -49583 for 681 contacts (-72.8/contact) + 2D Compatibility (PS) -10752 + (NN) 18 + (LL) 22096 1D Compatibility (HY) -5200 + (ID) 850 Total energy: -44271.0 ( -65.01 by residue) QMean score : 0.555

(partial model without unconserved sides chains): PDB file : Tito_2HWY.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2HWY-query.scw PDB file : Tito_Scwrl_2HWY.pdb: