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UUUUUU?A?@@@@@@A@333333?-pdb--ivalue--superpose-o::CmdLineError:: Unsupported option: -X::CmdLineError:: Option '--ivalue' takes an alignment fasta file as an argument ::CmdLineError:: MMLigner takes two structures (in PDB format) as arguments ::CmdLineError:: Option '-o' takes one output_prefix_string as an argument ::CmdLineError:: The following arguments cannot be processed: ::CmdLineError:: File '' does not exist Usage: mmligner (:) (:) ( -o ) ( --superpose) _vs_r...building MFP Library OKwParsing Brookhaven PDB ...: ::PDBParseError:: chain '' not found nResi = ::FastaFileError:: The alignement file not in FASTA format Aborted!> structure1> structure2> %lf isempty? record Type serial number atomname altLoc resiName chain ID resiSeqNum icode coords Occupancy tempFactor CA atom_name indx: RES TYPE: ()sec. str. type => nAtoms = ATOM ALAARGASNASPASXCYSSECGLUGLNGLXPCAGLYHISILELEUXLELYSMETMSEPHEPROSERTHRTRPTYRVALPYLXAAUNKINIHYP DA DT DG DC DI A T U G C I Ncyanfirebrickwhitemarinetv_bluegreencyanwarmpinksmudgebr6rubytealhotpinksalmonpalecyandashbr0lightpinkdensitypalegreenlightbluelimenitrogengraytv_yellowskybluedeeppurpleredvioletlimegreenolivewheatraspberrysandpaleyellowdeepolivetv_greendeepsalmonorangedirtyvioletlimondeepbluebr1brownmagentavioletpurplepinkhydrogentv_orangedeeptealyelloworangeoxygenbr8sulfurdarksalmonchartreusegreyyellowbluebr4br2bluewhitetv_redbr7aquamarinepurplelightteallightmagentablackbrightorangeslatechocolatepurplebluebr3carbonforestsplitpeabr9lightorangebr5 N CA C N O ATOM HETATMSTRANGE!!! residue indx: nResidues = RESIDUE nSSEs = Residues -- alter /-/, ss='H''S'seleselect , color _, ss=''HETATM 2195 P PO4 126 HETATM 2196 O PO4 126 0.50 59.85 P%5u P P04 %4u %8.3f O OXYlist of SSEs - to is a omega matrix: **tableau matrix: ** Chain labels: nChains = CHAIN TER+++++ CHAIN +++++::PDB_PARSE_ERROR:: The file: is either NOT a PDB format file, or does NOT conform to its basic requirements. ::PDB_PARSE_ERROR:: Unable to find the file: ::PDB_PARSE_ERROR:: The parser stumbled into an unrecognized record type: at Line in File: TITLE MODEL nModels = ENDMDL/\.pml_model-%uload hidealter all, ss='L'show cartoonset cartoon_fancy_helices,1set cartoon_discrete_colors,1set cartoon_highlight_color, grey60set cartoon_dumbbell_length,1.0set cartoon_rect_length,1.10000set cartoon_loop_radius,0.3set cartoon_smooth_loops=0deselectrebuild_m%lu_c%lu_Seg.pmlset cartoon_rect_length,1.40000_sparse.pdb.tableau_info----- MODEL -----RMSD_VARYING...filtering MFP library ...clustering filtered MFP library ...generating seed alignments seeds********************SUFFICIENT STATS*********************** sum_xmxm = sum_ymym = sum_zmzm = sum_xpxp = sum_ypyp = sum_zpzp = sum_xmyp = sum_xmzp = sum_ymxp = sum_ymzp = sum_zmxp = sum_zmyp = ****************************END*********************** Print Centers of Mass of moving set: Print Centers of Mass of fixed set: --------------------- Print Eigen values ----- Print Eigen vectors Quaternion norms: (should be ~1)Print Rotation matrix Print Quaternion matrix Structure Sizes = Coverage = RMSD = AI(A) = bitsNULL(S & T) = I(A & ) = Compression = bits (+ve better; -ve worse)[  ]   ==================== ------ +idMMLigner (v1.0): Minimum Message Length (MML) alignment of protein structures Authors: Collier, Allison, Lesk, Stuckey, Garcia de la Banda, Konagurthu.  Computing Ivalue of ....stats Alignment Stats written to: ...Alignment stats --=o0o=--DONEComputing MMLigner alignment......expectation maximization on seed alignments using I-value... ...perturbing seed alignment of [none of the resultant alignments are significant] [only 1 resultant alignment is significant] [only resultant alignments are significant] Writing aligment output to __.afastaWriting alignment stats to Writing superposed pdb to _superposed.pdbSummary: Alignment stats -------  DHXQX QaaQ!Q! 0 `E[ aa a!eP" f#hf#f$g@20g2xg3h 5h`6i0>Ti @i@i Bi@Vl0XlPZl` l@ana\nbncDododo0h8p0m`pmpnqpqtqrqsqvq`yr~Xr`r (s`hssss 8tpXtxtt0px w@wp\y yy z4z\zz@zzp${{{{@<||}d}}}p(~h~| @ 4@t@ P,Ll@  ̄ Ȇp%)h0-@7T7?0pD IO8f @` `,tпܬX` p<p Գ@"T`6p6;ضP=LAHܹ`Ua i@`nnoPpPqq0rstz@{,}p~p\`PH@h(@(p@,L :nЗPpp@< <\ h `0\4T0/^D@d , (T @l @$`PPpD &p'  z@ P @ @!!$%&p'(*+0p2033p4HHPJ`JJLRRS0TUUV WWYYZ\_0``abcdeghkpmpprr`ypyzz@{}0ppp0p@P`P P```pPp  p `)@*P-@.0 202 6@66 ;p;A`A AA Y P P`pP 0@P@@ P     @p P$$$P%%%& 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