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EEM } u$‹EU҉Ɖ};}uU0t6MM } u‹EU҉Ɖ}Wà uƒ:t뵐hV' uA;}sGMM } uq‹EU҉Ɖ}릃 uƒ:t0밉Ѓ+:␐    EEM } u‹EU҉Ɖ}m t9M } u‹||҉Ɖ}.E+t-t?EM } uU‹xx҉Ɖ} t9M } u‹tt҉Ɖ}hV uFЉEM } u ‹pp҉Ɖ};hV& u! uƒ:t0*+UЍPЉU}~;}v/a}tE)EEEE t,tss;}v\O?0tEEU)Љ‰UtEPOxPGP_GEPݝh݅h]}uEEݝ`݅`EEݝX݅X18[^_ÐUVS[EE;E |:‹2։E}}UEE} tU E1e[^ÐUVS[E ;EEE U)9E|(‹2։E}} UEɐEE;E|=‹2։E}} UEE} tU E1uEE;E |:‹2։E}}UCEE} tU E뼐EEU )9E|E EE1e[^ÐUVS[EE;E|‹8tjePjj蟧jT;ЍыЍ;щEʉЃxxxxxxxxxxxxxx]]]]]]"<xERrPP=j‹P/j EPEPRE PREjEPEPRE P/EEPEPRE PcEEPE PEgEPEPRE PEFEPEPREPRE PE!EPEPRE PE}u UN }u?cƒ:t#c‹cыJ fH >e[^ÐUVS[EʉЃ w=␐00000pERgnP PQj#‹PCEPR‰EPREPR‰s‹2։‰K‹EHKщEы@ )ʍBKщ_K‹EH)ȍKщKЍы9}‹؍Kщe[^ÐU WVS[MU 0u'Nƍ4#<0EE1e[^_ÐU$S[Exc Ex|5E8te`PjeeUB‰эUE8uWEPRaPEP‹PEP{E}tEP1,E@$ExtEP1]ÐUVu EPj=~EPPu3EPjEPPlu+u1ÐU$S[EUB‰xэUExt1EUREjjEP EPEE;E}Ext Exu 1ERp}uYDЋUJʍ PEPRE}uEEx(t E@(@‹PEPRtE}tE}uEEPEPEP t ErEPD‹PEPR E}uǃEPEPEPEPt뙋E@(E@EP"UEщ}t2E8tr o|^Pjo_o1]UEU MEU ME;EwE7ME8 tMދEMEU MEM;EwÐUEE;E} E8uE U EE EאE;E|E E EÐUhEPEP}E UUÐUWVS[}~EEED}}E؉EE+EE j-@0j-fEj-MM}1u։0EU u1uM}uE +Uj-ȋMe[^_UVS[EE}Etƒ:t.t‹E9}t‹E9~tƒ:M}u E]E]EffEuEEE]9E‹EEffD@uEEEUEU )‰U}}+M } }j*2փ1tƒ:}t‹E}(~E؉EE(EE$EPfPEPr hEPEX⍀P$Xw⍀wP Xa⍀aPXK⍀KPX5⍀5PX⍀PX ⍀ PX⍀PnX⍀PTX⍀P:X⍀P X⍀PX⍀PXo⍀oPXY⍀YPXC⍀CPX-⍀-PX⍀PjX⍀PPX⍀P6X⍀PX⍀PX⍀PX⍀PX}⍀}PXg⍀gPXQ⍀QPX;⍀;PfX%⍀%PLX⍀P2__dyld_mod_term_funcs__dyld_make_delayed_module_initializer_callsThe kernel support for the dynamic linker is not present to run this program. $Date: 2002/08/06 12:23:22 $PHISTATSNormal terminationFREADONLYDATAPRINTER ENDTITLRESOSHIFHANDRANGThe number of resolution ranges must be <=50LABIUnrecognised keyword: HKLINDisagreement between symmetry operators(//,A,/,A,A)(//)(A,I6,A)(I6,3I4,F9.2,2(F6.1,F6.3),f6.3)(/,' ********************************************') * The program is now equating W2 to the phase difference. * Most of the output is therefore junk, but you CAN extract the correlation between WP and W2. Monitor every th reflections TOTAL $TABLE: Analysis in 4(SNTHR/L)**2 Intervals: $GRAPHS : 4SSLLmax CORR_obs_error_w1 CORR_obs_error_w2:N:2,7,8::4SSLLmax Number of reflections :N:2,3: $$ <4SSLLmin> 1/resol^2 Number_reflections DPHI_e Correlation_DPHI_e_(Weight1) Correlation_DPHI_e_(Weight2) Correlation_DPHI_e_cos(Weight1) Correlation_DPHI_e_cos(Weight2) $$ S1 S2 Nref DPHI_e CW1 CW2 CCW1 CCW2 $$ $$ $TABLE: Analysis on First Weight : Weight_1 v Expected and Observed error:N:2,3,5: :Weight_1 v Number of reflections :N:2,4: $$ Expected_error Observed_error $$ DPHI_e Nref_a DPHI_o $$ $TABLE: Analysis on Second Weight : Weight_2 v Expected and Observed error:N:2,3,5: :Weight_2 v Number of reflections :N:2,4: CCPDPN: illegal status : CCPDPN: illegal type: Message number 00000000Last system error message:: WARNING: $TEXT:Warning: $$ comment $$ ('CCP4 software suite: library version ', A)(A)('CCP4 software suite: patch level ', A)('Program: ', A)NOHTMLNOSUMMUse: -d filenameUse: -e filename; version Ignoring switch CINCLCINCL:environ path name too longSYS$LOGINHOMESYS$LOGIN:Opening file #!Too many logical names in environ file: =Missing = in environ file: .Bad extension in environ file: default.def path name too longMissing = in defaults file: Processing Command Line ArgumentsUse: ...End of pre-processing stageError reading environ or default file$Date: / /1920(A,3I4,F8.1,A,F8.1)CENTR: CENTRIC not called firstCENTPHASE: CENTRIC not called firstCENTPHASE: This is not a centric reflection!CENTPHASE: There are no centric zones defined! Centric phase possibilities or CURWIN ****** EPSILON ZONES - Reflection Classes and their multiplicity ****** EPSLN: have to have at least one EPSILON ZONE(A,3I5) NO EPSILON ZONE found for reflection (A,I4) Illegal number in field Real number expected at end of line(A,3F5.2) Changing Phase hand means Phi2 = 2PI(H*CX+K*CY+L*CZ)-PHI(' ERROR with label assignments ',A,' and ',A)(' Neither ',A,' nor ',A,' recognised')(' OR maybe ',A,' has been assigned twice ')ERRWIN Error this program has no PROGRAM LABELS **** Warning no argument given for LABIN ERROR Program label assigned twiceInput column assignment does not match program labels **** Error !!!! for LABIN **** **** NOT ENOUGH ARGUMENT PAIRS of type Prog_label = User_label(A,I3,A,1X,I1,1X,A)(10A)(15I5)From LRASSN : Index is out of range (allowed 1..)From LRASSN : User input label does not match any file labelFrom LRASSN : Program Label was not assigned* Input Program Labels :* Input File Labels :* Lookup Table : the number indicates the input column no.* Array element n corresponds to the nth program labelFrom LRASSN : Column type for program label does not match - file label is Error in label assignmentsFrom LRCELL : IndexFrom LRCLAB : IndexFrom LRCLOS : Index(A,A,I3,A)(A,I3)(A,I6)(A,A)(A,I4,A,A,A,A,A)(A,I4,A,I4)(A,I4,A,A,I4,A)(A,I3,A,A,I3,A)(A,I4,A,I4,A)(I3)From LROPEN : IndexFrom LROPEN : Wrong index in call, files already open for read AND write on index pretty seriousFrom LROPEN : Wrong index in call, file already open for read on index all header info will be lost write on index output header may be corruptedRO WARNING: no architecture information in file -- assuming native. ? From LROPEN : Error reading 1st record of MTZ fileMTZ From LROPEN : File is not an MTZ fileHEADER INFORMATION FROM INPUT MTZ FILE ON INDEXVERSMTZ:V1.1 MTZ version of file incompatible with this version of the softwareMTZ file, Version Stamp NCOL From LROPEN : too many batches in file, maximum isCELLSORTSYMIFrom LROPEN : Unrecognised Lattice type in header, set to PSYMMFrom LROPEN : An error occured reading symmetry from header, No symmetry information storedVALMCOLUFrom LROPEN : Column Label has unrecognised type () - set to RNDIFPROJCRYSDCELDWAVBATCFrom LROPEN : Batch information in MTZ header inconsistentFrom LROPEN : Illegal keyword in MTZ header - line ignoredFrom LROPEN : Header indicates columns, but minimum allowed columns in MTZ file is columns, but there were column labels in header datasets, but PROJECT records in header symmetry ops, but ops were present in header batches, but serial numbers presentMTZHISTMTZBATSMTZENDOFHEADERSFrom LROPEN : Unrecognised line in MTZ file header - file may be corrupt, continuing ...From LROPEN : MTZ header indicates that file is standard MTZ but there are batch headers present - ignoring them Changing "rhombhedral" to "hexagonal" Changing "hexagonal" to "rhombhedral"(2A,3I4,A,F10.6)From LRREFL : IndexFrom LRREFL : There is no file open for read on indexFrom LRREFL : Error reading file - only words transferred, wantedFrom LRREFL : S value outside range from header, reflection S =Corrupt MTZ file?From LRREFM: IndexFrom LRREFM : There is no file open for read on indexFrom LRRSOL : IndexFrom LRSYMI : IndexFrom LRSYMM : Index(A,I5,A/1X,A) *** WARNING - More than characters in (continued) line *** *** Parsing truncated line beginning with:CommentHLPWIN Can't open file DataResolution missingCCPNUN: Can't find an unused unit(' **CCPOPN ERROR** Invalid parameters in call',/)**CCPOPN ERROR** Invalid parameters in callTERMCCP4_OPENUNKNOWNNL:nl:/dev/nullUNFORMATTEDFORMATTEDSEQUENTIALDIRECTDELETEKEEPWORDSFORTRANLISTSCRATCHCCPOPN Logical name has no associated file name Open failed: File: Logical name: , Filename: ERROR in s/r GETELAPSED calling ETIME(1X, A)()UGERR4.2.24.2CBINCHTMLCCP_PROGRAM_IDCCP_SUPPRESS_HTMLCCP_SUPPRESS_SUMMARY(Z8.8)(I5.5)Non standard logical name Too many logical namesundeflibprtbesdicCLIBDCLIBD:CLIBD not defined/.scrscrCCP4_SCRCCP4_SCR:CCP4_SCR not definedinCannot find file Cannot create environment variable Cannot create logical name *** Warning*** Error*** Program Terminated *** Unrecognised errorProgram continuing ...CUNLINK: Can't unlinkCCPALC: can't allocate memory(I8,1X,A,' / ',A)(9X,A)(9X,6F10.4)(9X,F10.5)(A,I7)(A,F18.2,A)(200I4)(A,1X,A,2X,2I19,1X,I8)(A,1X,A,2X,2I19)(A,1X,A,2X,2F19.4,1X,I8)(A,1X,A,2X,2F19.4)(6F10.4)(2F12.5,6X,A,F9.3,A,F9.3,A)(5I6)(A,I4,6X,A)(A,A,A,I5,A)From LHPRT : Index* Title:* Number of Datasets =* Dataset ID, project/crystal name, dataset name, cell dimensions, wavelength:* Number of Columns =* Number of Reflections =* Missing value set to NaN in input mtz file* Missing value set to in input mtz file* Missing value set to NaN in output mtz file in output mtz file* Number of Batches =* Column Labels :* Column Types :* Associated datasets :* Column Labels, Types, Ranges [and Dataset IDs] :* Cell Dimensions :* Resolution Range :( - A )* Sort Order :* There is no sort order recorded in the MTZ header* Number of Symmetry Operations = * Number of Primitive Operations = * Space Group =* Lattice Type = * Point Group Name = * Symmetry Operations :* Space group = (number (A,I2)From LRHDRL : Error reading header record from MTZ file, want 80 bytes, got Bad attribute in QOPEN: (4I8)(A,A,I2,A)RBATHD error: Error reading batch header record from MTZ file, only words read **Symmetry Operator ERROR** **Invalid Character... ** **Blank Operator Field****Symmetry Operator ERROR****No Operator****Last General Position is INCOMPLETE****SYMMETRY OPERATOR ERROR**(A,I4,A) ***** WARNING - MORE THAN ITEMS IN THIS LINE - IGNORING THE REST****BYTESUSERLOGNAME;w+r+rMemory allocation failedCCP4_USTENV: Memory allocation failedCCP4_QOPEN: can't open CCP4_QOPEN: error unlinking CCP4_QOPEN: fseek failed onNATIVEMTZCONVERT_FROMBEIEEELEIEEEVAXCONVEXNATIVECCP4_QRARCH: seek failed on CCP4_QRARCH: can't read machine stamp in CCP4_QWARCH: seek failed on CCP4_QWARCH: can't write machine stamp to CCP4_QCLOSE: qopen not yet calledCCP4_QCLOSE: failed on CCP4_QMODE: qopen not yet calledCCP4_QMODE: bad modeCCP4_QREAD: qopen not yet calledCCP4_QREAD: seek error on file CCP4_QREAD: i/o error on CCP4_QREAD: bad file real type in conversionCCP4_QREAD: bad file integer type in conversionCCP4_QREAD: bad native real type in conversionCCP4_QREAD: Bad modeCCP4_QREADC: qopen not yet calledCCP4_QREADC: seek error on file CCP4_QREAD:C i/o error on CCP4_QWRITE: qopen not yet calledCCP4_QWRITE: seek failed on CCP4_QWRITE: i/o error (may be out of disc space): CCP4_QWRITC: qopen not yet calledCCP4_QWRITC: seek failed onCCP4_QWRITC: i/o error (may be out of disc space): CCP4_QSEEK: qopen not yet calledCCP4_QSEEK failed -- maybe corrupt file: CCP4_REWIND: qopen not yet calledCCP4_REWIND failed -- maybe corrupt file: CCP4_QBACK: qopen not yet calledCCP4_QBACK failed on CCP4_QSKIP: qopen not yet calledCCP4_QSKIP failed on CCP4_QINQ: qopen not yet calledCCP4_QINQ: seek failed on CCP4_QLOCATE: qopen not yet calledCCP4_ISNAN: bad nativeFT%oFailure in ccp4mallocFailure in ccp4reallocFailure in ccp4callocFrom LPHIST : Index* There is no History information in this MTZ file* HISTORY for current MTZ file : (A,I3,5X,A)(4F6.2)SYMTR3: character array too short(I1,A1)(1X,A1), Symmetry(1X,A,I2)(1X,A,I2,A,A) (Q)QOPEN: bad mode: diskio.dft(Q)QOPEN status changed from NEW to UNKNOWN for (Q)QOPEN NEW file already exists: (Q)QOPEN failed - no streams left(Q)QOPEN Logical name (Q)QOPEN failed - File name: (Q)QOPEN: file opened on unit Status: Logical Name: Filename: Floating ExceptionIOT TrapQuit signalInterruptKilledTrace trapbad stringformat too complicated: unknown code in do_fio: %d %s do_fiofmtstartiosfelist output starts_catwrite startendfilestartintinwriterecendread startNOYESZERONULLr+wwmalloc failureopenfort.%ldno spacesdfuSTOP statement executed getenv_nmLbuf overflownon-positive record numbercan't append to file'new' file existscan't write filecan't read filesubscript out of boundssubstring out of boundsinvalid array sectionsubscript for scalar variablevariable count incorrectno end recordvariable not in namelistbad namelist namebad variable typebad logical input fieldread unexpected characterout of free spaceincomprehensible list inputtruncation failed in endfileoff end of recordunit not connectedcan't stat filenull file namecan't backspace filesequential io not alloweddirect io not allowedunformatted io not allowedformatted io not allowedillegal unit numbererror in format%s: illegal error number %d %s: end of file %s: %s apparent state: unit %d named %s (unnamed) apparent state: internal I/O last format: %s externalinternalformattedunformattedsequentialdirectreadingwritinglately %s %s %s %s IO%s bad repetition countinvalid integerexponent fielde%ldinvalid numbercomplex formatlreadno starno real partno commano imaginary partno )logicalundelimited character stringlist iostlerliolist in%.9Gunknown type in liomalloc(%u) failure in %s left offw_ed, unexpected code: %d w_ned, unexpected code: %d 0123456789ABCDEFrd_ed, unexpected code: %d rd_ned, unexpected code: %d %#.*E%+.2d+00%#.*f>?zD@'7$tIC4DBa 6;=34CBB75L= A@A??4@ @@@@MbP?@s*> _š?$@Gy 2101 C (//, Phase analysis between two phase sets - Better to do map, Correlation!!,/) H K L FP SIGFP PHIBP WP PHIB2 W2 HHHFQPWPW (//, Resolution limits in As ,2f10.2,/,11x,as 4sinsq/,lsq ,2f10.5,/)(//, PHI2 phases adjusted to account for fractional Shift:,3f10.3,/, PhiDiff is 2PI ( h Xshift +k Yshift + l Zshift),/)(/, Data from sin(theta)/lambda of,f8.4, to,f8.4, divided into,i4, ranges)(/, Lattice multiplicity,i6)(//, PHI2 phases adjusted to account for change of hand:,3f10.3,/, Phi is -PHI+2PI ( h CX +k CY + l CZ),/)@( No. H K L FO PHI1 W1 PHI2 W2)(/, Centric Analysis ,/, Range Total no. wh,ich agree - Disagree Fraction which agree)(a,3(i10,2x),f9.4,4(2x,f6.3))(/, Correlation of Phase error, and Cos(Phase error) ,with weight 1 and weight 2,/2(13x,2f6.3),/, ,Remember - we want NEGATIVE correlation between phase error ,and weight!,/)(/, Analysis on FIRST Weight ,/, Range Total No which agree - ,Disagree Fraction which agree)(1x,f4.2,-,f4.2,i5,2(i10,2x),f9.4,2(2x,f6.3,2x,f6.3))(/, Analysis in 4(SNTHR/L)**2 Intervals ,/, Range Total No which agree - ,Disagree Fraction CW1 CW2 CCW1 CCW2)(1x,f5.3,-,f5.3,i5,2(i10,2x),f9.4,4(2x,f6.3))(/, Analysis on Second Weight ,/, Range Total No which agree - ,Disagree Fraction which agree)(//,***************************************************,/, Acentric Analysis ,/, DEL = Average Difference in degrees ,/, CW1 = Correlation with weight 1 ,/, CW2 = Correlation with weight 2,//, CWW1 = Correlation of cos(phase error) ,with weight 1 ,/, CWW2 = Correlation of cos(phase error) ,with weight 2 )( Range Limits Total No DEL CW1 , CW2 CCW1 CCW2)(a,9x,i10,5x,f10.3,2(1x,f8.3,1x,f8.3))(/,a,a,a,12(/,a))(1x,f6.4,f7.4,1x,i10,5x,f10.3,2(1x,f8.3,1x,f8.3))(/,a,a,a,12(/,a))(1x,f6.2,f7.2,1x,f7.1,i7,5x,f10.3)(/,a,a,a,12(/,a))JJJJK @ @@c@UNKNOWN SCRATCH OLD NEW READONLYPRINTER F U DFDU  environ.def default.def (a)U RRURRUSR))4C0kl h0l hk0 hhl hkh hkk h -hl hk-h hk-k -h 2h l2h -h lhkl        ????????????@??@3( Centric Zone ,i3, Reflections of Type ,a7)Wkh00 0k0 00l hh0 h0h 0kk h -h0 h0-h 0k-k -h 2h 02h -h 0hhh hkl C??C?C?C?CC???C?C?C??@?C?@C?C( EPSILON Zone ,i3)( Reflections of type ,a7)( Multiplicity ,i3)75YZdZZ@Z@ [@`[ @] `]] `]@]@] @]HJFDQPWABYIRGKLMPABCIFRH?@]@`@`@` ```R``RR`aa a@aH`aH``@]```@l@]```@]@]@] (a, line--- ,a)RRnRllUNKNOWNUNKNOWNOLD NEW OLD UNKNOWN( Open failed: Unit:,i4,, File: ,a, (logical: ,a,))( **CCPOPN ERROR** ,a,3x,a, file open failure on unit ,i3,/ Logical name: ,a,, ,File name: ,a/1x,a/)(a,3x,a, file opened on unit ,i3) p@@abcdefghijklmnopqrstuvwxyzABCDEFGHIJKLMNOPQRSTUVWXYZ()()()()`()() (/,/,/,/,1##########################################################,#####,/, ##########################################################,#####,/, ##########################################################,#####,/, ### CCP4 ,a3,: ,a17,2x,version ,a,: ,a8,##,/, ##########################################################,#####,/, User: ,a, Run date: ,a8, Run time:,a,/,/,/, Please reference: Collaborative Computational Project,, Number 4. 1994.,/, "The CCP4 Suite: Programs for Protein, Crystallography". 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