Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSSALSIRQLTKTYGNGFQALKGIDLDVAEGDFFALLGPNGAGKSTTIGILSTLVNKTSGSVSVFGHDLDKDPAGLKRCLGVVPQEFNFNQFEKVFDIVVTQAGYYGIPAKIAKERAERYLTQLGLWDKRNEASRMLSGGMKRRLMIARALVHQPRLLILDEPTAGVDIELRRSMWSFLTELNQE-GISIILTTHYLEEAEQLCRNIAIIDHGEIVQNTSMRDLLMTLHSETFLLDLKNVQALPPTLDG---YPTRLVDDHTLEVQVEKSQGINDLFAQLGAQGIEVLSLRNKTNRLEELFVSLVEKNLTRIAR 4YER Chain:A ((6-307)) ----IVVENLVKKFGD-FEAVKGVSFSVKKGEIFAFLGPNGAGKTTTIHMLTTLLKPTSGKAWVAGHDVLKEPREVRRKIGIVFQDQSLDRELTAYENMYIHGKIYGYGGEKLKKRILELLEFVELLEFKDKPVKTFSGGMARRLEIARSLIHEPEVLFLDEPTIGLDPHTRAHMWEYISKMKKEHNMTIFLTTHYMDEAEQLADRVAIIDHGKIIALGTPTELKRMVGKEIIYVR-------------DFIESCRKLPDGRLELNVED-----------------IEEITYHKPTLNDVFLHLTGREL-----

General information: TITO was launched using: RESULT: Template: 4YER.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output 3D Compatibility (PKB) -424 for 1996 contacts (-0.2/contact) + 2D Compatibility (PS) -26355 + (NN) 7381 + (LL) 2196 1D Compatibility (HY) 4400 + (ID) 1650 Total energy: -14452.0 ( -7.24 by residue) QMean score : 0.112

(partial model without unconserved sides chains): PDB file : Tito_4YER.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4YER-query.scw PDB file : Tito_Scwrl_4YER.pdb: