Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSVEQNEFLSQVQLQILAEQAIKQYPSDYQGQVKLLCQSENATYQVSTGSARYAL-RIHRPNYHSKLDIQSELEWL-DALNASGIQVPVAIADQSGERVITLKLSNDIYRYAVLFNWVEGDMPTVEV-DPTAFEQLGQITAKLHAHSKTWQAPENFQRIVWNHETMVGADGHWGNWKNAPHLRPQDHGVIEEAIAQISKDLNFFGKTQERYGLIHADLR--------------LTNLLLQQ---ERIGVIDFDDCGMSWFMHDLAAAISF-------NEHYANAPHWVDYWLKGY------ERVGHIQSEEYEMIPT----FIMQRRIQMMAWN-----------------GSHAQTEMAQSLGDQWSNETVRLCKKYLNGQMPVGI 4OCV Chain:A ((24-378)) ----TNEALFDVASHFALEGTVDSIEPYGDGHI-------NTTYLVTTDGPRYILQRMNTGIFPDTVNLMRNVELVTSTLKAQGKETLDIVRTTSGDT--WAEIDGGAWR---VYKFIEHTMSYNLVPNPDVFREAGRAFGDFQNFLSGFDANQLTETIAHFHD----TPHRFEDFKKALAADELGR------AAGCGPEIEFYLSHADQYAVVMDGLRDGSIPLRVTHNDTKLNNILMDATTGKARAIIDLDTIMPGSMLFDFGDSIRFGASTALEDERDLDKVHFSTELFRAYTEGFVGELRDSITAREAELLPFSGNLLTMECGMRFLADYLEGDVYFATKYPEHNLVRSRTQIKLVREMEQR-ADETRAIVADVMETT-----

General information: TITO was launched using: RESULT: Template: 4OCV.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain A - contact count / total energy / energy per contact / energy per residue : 1411 -13963 -9.90 -46.39 target 2D structure prediction score : 0.57 Monomeric hydrophicity matching model chain A : 0.69 3D Compatibility (PKB) : -9.90 2D Compatibility (Sec. Struct. Predict.) : 0.57 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.299

(partial model without unconserved sides chains): PDB file : Tito_4OCV.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4ocv-query.scw PDB file : Tito_Scwrl_4OCV.pdb: