Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLTWVIRVCFLILGGTTGVFSLPALWVKLGIGHILLINNPYTDALIGALIFYLITFWAVKYVEAALNWLEEKLAKIAIATLVYGGLGLFVGLVIAFFASNALSQTNIPLLNSVVPVILTLVLGYLGFRIGISRRNEFGNFVNNRNAKKRTPEEEKTEEKSKKTYKILDTSVIIDGR--IADILTTGFLDGTVVIPLFVLAELQHIADSSDTLKRTRGRRGLDILNRIQKEDA--IQVEMYEGDFEDTPEVDSKLVKLAKVMG---GIVVTNDY-----NLN---KVCEFQNVPVLNINDLANAVKPVVLPGEKMTVLMVKDGKEHNQGVAYLDDGTMIVVEDGRKFINETIQVEVTSVLQTSAGRMIFAKPS 2HWY Chain:A ((855-1012)) ------------------------------------------------------------------------------------------------------------------------------------------------------------------PYLVPDTQALCHHLPVIRQLATS--GRFIVIIPRTVIDGLDLLK-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) -71121 for 684 contacts (-104.0/contact) + 2D Compatibility (PS) -11036 + (NN) -2139 + (LL) 19256 1D Compatibility (HY) -5200 + (ID) 1050 Total energy: -71290.0 ( -104.23 by residue) QMean score : 0.533

(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: