JFIFe /****** Jmol Embedded Script **** # Jmol state version 13.3.5 2013-09-06 12:28; function _setWindowState() { # preferredWidthHeight 365 283; # width 365; # height 283; stateVersion = 1303005; background [xffffff]; axis1Color = "[xff0000]"; axis2Color = "[x008000]"; axis3Color = "[x0000ff]"; set ambientPercent 45; set diffusePercent 84; set specular true; set specularPercent 22; set specularPower 40; set celShading false; set specularExponent 6; set zShadePower 3; statusReporting = true; } function _setFileState() { set allowEmbeddedScripts false; set appendNew true; set appletProxy ""; set applySymmetryToBonds false; set autoBond true; set bondRadiusMilliAngstroms 150; set bondTolerance 0.45; set defaultLattice {0.0 0.0 0.0}; set defaultLoadFilter ""; set defaultLoadScript ""; set defaultStructureDssp true; set defaultVDW Auto; set forceAutoBond false; #set defaultDirectory "C:/Program Files (x86)/JMOL/jmol-13.3.5"; #set loadFormat "http://www.rcsb.org/pdb/files/%FILE.pdb.gz"; #set loadLigandFormat "http://www.rcsb.org/pdb/files/ligand/%FILE.cif"; #set smilesUrlFormat "http://cactus.nci.nih.gov/chemical/structure/%FILE/file?format=sdf&get3d=True"; #set nihResolverFormat "http://cactus.nci.nih.gov/chemical/structure/%FILE"; #set pubChemFormat "http://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/%FILE/SDF?record_type=3d"; #set edsUrlFormat "http://eds.bmc.uu.se/eds/dfs/%LC13/%LCFILE/%LCFILE.omap"; #set edsUrlCutoff "load('http://eds.bmc.uu.se/eds/dfs/%LC13/%LCFILE/%LCFILE.sfdat').lines.find('MAP_SIGMA').split(' ')[2]"; set legacyAutoBonding false; set legacyHAddition true; set minBondDistance 0.4; set minimizationCriterion 0.001; set minimizationSteps 100; set pdbAddHydrogens false; set pdbGetHeader false; set pdbSequential false; set percentVdwAtom 23; set smallMoleculeMaxAtoms 40000; set smartAromatic true; zap;load /*data*/ data "model list" 9 empty Xx -6.0 5.65853145547 -7.19885281075e-06 Xx 6.0 5.65853145547 -7.19885281075e-06 Xx 6.0 -5.72375336235 -7.19885281075e-06 Xx -6.0 -5.72375336235 -7.19885281075e-06 Xx -6.0 3.3820744919 4.54088149318 Xx -6.0 3.3820744919 -4.54089589089 Xx 6.0 3.3820744919 4.54088149318 Xx 6.0 3.3820744919 -4.54089589089 Xx 5.5 5.5 5.5 end "model list" ; } function _setVariableState() { set defaultanglelabel "%VALUE %UNITS"; set defaultcolorscheme "jmol"; set defaultdistancelabel "%VALUE %UNITS"; set defaultdrawarrowscale 0.5; set defaultlabelpdb "%m%r"; set defaultlabelxyz "%a"; set defaultlattice "{0.0 0.0 0.0}"; set defaultloadfilter ""; set defaultloadscript ""; set defaulttorsionlabel "%VALUE %UNITS"; set defaulttranslucent 0.5; set defaultvdw "Auto"; set allowembeddedscripts true; set allowmoveatoms false; set allowrotateselected false; set appletproxy ""; set applysymmetrytobonds false; set atompicking true; set atomtypes ""; set autobond true; set autofps false; set axes window; set axesmode 0; set axesscale 2.0; set bondmodeor false; set bondradiusmilliangstroms 150; set bondtolerance 0.45; set cartoonbaseedges false; set cartoonfancy false; set cartoonladders false; set cartoonrockets false; set chaincasesensitive false; set dataseparator "~~~"; set defaultstructuredssp true; set delaymaximumms 0; set dipolescale 1.0; set disablepopupmenu false; set displaycellparameters true; set dotdensity 3; set dotscale 1; set dotsselectedonly false; set dotsurface true; set dragselected false; set drawhover false; set drawpicking false; set dsspcalculatehydrogenalways true; set dynamicmeasurements false; set ellipsoidarcs false; set ellipsoidarrows false; set ellipsoidaxes false; set ellipsoidaxisdiameter 0.02; set ellipsoidball true; set ellipsoiddotcount 200; set ellipsoiddots false; set ellipsoidfill false; set energyunits "kJ"; set forceautobond false; set fractionalrelative false; set gestureswipefactor 1.0; set greyscalerendering false; set hbondsangleminimum 90.0; set hbondsbackbone false; set hbondsdistancemaximum 3.25; set hbondsrasmol true; set hbondssolid false; set helixstep 1; set helppath "http://chemapps.stolaf.edu/jmol/docs/index.htm"; set hermitelevel 0; set hidenameinpopup false; set hidenavigationpoint false; set highresolution false; set historylevel 0; set hoverdelay 0.5; set imagestate true; set iskiosk false; set isosurfacekey false; set isosurfacepropertysmoothing true; set isosurfacepropertysmoothingpower 7; set justifymeasurements false; set loadatomdatatolerance 0.01; set measureallmodels false; set measurementlabels true; set meshscale 1; set messagestylechime false; set minbonddistance 0.4; set minimizationcriterion 0.001; set minimizationrefresh true; set minimizationsilent false; set minimizationsteps 100; set minpixelselradius 6; set monitorenergy false; set multiplebondradiusfactor 0.0; set multiplebondspacing -1.0; set navigationperiodic false; set navigationspeed 5.0; set nmrpredictformat "http://www.nmrdb.org/service/predictor?POST?molfile="; set nmrurlformat "http://www.nmrdb.org/predictor?smiles="; set partialdots false; set pdbaddhydrogens false; set pdbgetheader false; set pdbsequential false; set percentvdwatom 23; set pickingspinrate 10; set picklabel ""; set pointgroupdistancetolerance 0.2; set pointgrouplineartolerance 8.0; set propertyatomnumbercolumncount 0; set propertyatomnumberfield 0; set propertycolorscheme "roygb"; set propertydatacolumncount 0; set propertydatafield 0; set quaternionframe "p"; set rangeselected false; set ribbonaspectratio 16; set ribbonborder false; set rocketbarrels false; set saveproteinstructurestate true; set selectallmodels true; set selecthetero true; set selecthydrogen true; set sheetsmoothing 1.0; set showhiddenselectionhalos false; set showhydrogens true; set showkeystrokes true; set showmeasurements true; set showmultiplebonds true; set shownavigationpointalways false; set slabbyatom false; set slabbymolecule false; set smallmoleculemaxatoms 40000; set smartaromatic true; set solventprobe false; set solventproberadius 1.2; set ssbondsbackbone false; set starscale 0.05; set stereodegrees -5.0; set strandcountformeshribbon 7; set strandcountforstrands 5; set strutdefaultradius 0.3; set strutlengthmaximum 7.0; set strutsmultiple false; set strutspacing 6; set testflag1 false; set testflag2 false; set testflag3 false; set testflag4 false; set tracealpha true; set translucent true; set twistedsheets false; set usearcball false; set useminimizationthread true; set usenumberlocalization true; set vectorscale 1.0; set vectorsymmetry false; set vibrationscale 1.0; set waitformoveto true; set wireframerotation false; set zdepth 0; set zoomheight false; set zoomlarge true; set zslab 50; # label defaults; select none; color label none; background label none; set labelOffset 4 4; set labelAlignment left; set labelPointer off; font label 13.0 SansSerif Plain; } function _setModelState() { select ({0:7}); color atoms opaque [x000000]; select ({0:8}); Spacefill 0.0; select ({0 1}); label "0"; select ({5 7}); label "-1"; select ({2 3}); label "infinity"; select ({4 6}); label "1"; select ({0:7}); set labelOffset 0 0; measures delete; select *; set measures nanometers; font measures 15.0 SansSerif Plain; draw delete; draw ID "line_151368" diameter 1 CURVE {-6.0 5.6585317 -7.198853E-6} {-6.0 5.638029 0.48136064} {-6.0 5.5766697 0.95926017} {-6.0 5.474895 1.4302483} {-6.0 5.333439 1.8909312} {-6.0 5.1533203 2.33799} {-6.0 4.935837 2.7682033} {-6.0 4.6825557 3.1784718} {-6.0 4.3953013 3.565839} {-6.0 4.076144 3.9275146} {-6.0 3.727383 4.260892} {-6.0 3.351531 4.5635695} {-6.0 2.9512966 4.8333664} {-6.0 2.5295627 5.068339} {-6.0 2.0893683 5.2667937} {-6.0 1.6338851 5.4273014} {-6.0 1.1663948 5.5487046} {-6.0 0.69026554 5.63013} {-6.0 0.20892797 5.6709895} {-6.0 -0.2741499 5.6709895} {-6.0 -0.75548744 5.63013} {-6.0 -1.2316167 5.5487046} {-6.0 -1.699107 5.4273014} {-6.0 -2.1545904 5.2667937} {-6.0 -2.5947845 5.068339} {-6.0 -3.0165184 4.8333664} {-6.0 -3.416753 4.5635695} {-6.0 -3.792605 4.260892} {-6.0 -4.141366 3.9275146} {-6.0 -4.460523 3.565839} {-6.0 -4.7477775 3.1784718} {-6.0 -5.0010586 2.7682033} {-6.0 -5.218542 2.33799} {-6.0 -5.3986607 1.8909312} {-6.0 -5.540117 1.4302483} {-6.0 -5.6418915 0.95926017} {-6.0 -5.703251 0.48136064} {-6.0 -5.7237535 -7.198853E-6} {-6.0 -5.703251 -0.48137504} {-6.0 -5.6418915 -0.9592746} {-6.0 -5.540117 -1.4302626} {-6.0 -5.3986607 -1.8909456} {-6.0 -5.218542 -2.3380044} {-6.0 -5.0010586 -2.7682178} {-6.0 -4.7477775 -3.178486} {-6.0 -4.460523 -3.5658536} {-6.0 -4.141366 -3.9275289} {-6.0 -3.792605 -4.260906} {-6.0 -3.416753 -4.563584} {-6.0 -3.0165184 -4.833381} {-6.0 -2.5947845 -5.068353} {-6.0 -2.1545904 -5.266808} {-6.0 -1.699107 -5.4273157} {-6.0 -1.2316167 -5.548719} {-6.0 -0.75548744 -5.630144} {-6.0 -0.2741499 -5.671004} {-6.0 0.20892797 -5.671004} {-6.0 0.69026554 -5.630144} {-6.0 1.1663948 -5.548719} {-6.0 1.6338851 -5.4273157} {-6.0 2.0893683 -5.266808} {-6.0 2.5295627 -5.068353} {-6.0 2.9512966 -4.833381} {-6.0 3.351531 -4.563584} {-6.0 3.727383 -4.260906} {-6.0 4.076144 -3.9275289} {-6.0 4.3953013 -3.5658536} {-6.0 4.6825557 -3.178486} {-6.0 4.935837 -2.7682178} {-6.0 5.1533203 -2.3380044} {-6.0 5.333439 -1.8909456} {-6.0 5.474895 -1.4302626} {-6.0 5.5766697 -0.9592746} {-6.0 5.638029 -0.48137504} {-6.0 5.6585317 -7.198853E-6}; 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draw ID "line_449488" fill noMesh noDots notFrontOnly fullylit; color draw opaque [x6666ff]; pmesh ID "obj_257482" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_257482.pmesh"; pmesh ID "obj_257482" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [xff0000]; pmesh ID "obj_133282" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_133282.pmesh"; pmesh ID "obj_133282" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_806900" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_806900.pmesh"; pmesh ID "obj_806900" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_982257" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_982257.pmesh"; pmesh ID "obj_982257" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_891030" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_891030.pmesh"; pmesh ID "obj_891030" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_419508" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_419508.pmesh"; pmesh ID "obj_419508" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_520519" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_520519.pmesh"; pmesh ID "obj_520519" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_188005" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_188005.pmesh"; pmesh ID "obj_188005" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_19283" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_19283.pmesh"; pmesh ID "obj_19283" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_633156" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_633156.pmesh"; pmesh ID "obj_633156" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_631351" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_631351.pmesh"; pmesh ID "obj_631351" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_385443" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_385443.pmesh"; pmesh ID "obj_385443" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_912936" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_912936.pmesh"; pmesh ID "obj_912936" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_832543" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_832543.pmesh"; pmesh ID "obj_832543" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_886256" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_886256.pmesh"; pmesh ID "obj_886256" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_817106" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_817106.pmesh"; pmesh ID "obj_817106" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_606156" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_606156.pmesh"; pmesh ID "obj_606156" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_200785" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_200785.pmesh"; pmesh ID "obj_200785" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_21120" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_21120.pmesh"; pmesh ID "obj_21120" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_32089" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_32089.pmesh"; pmesh ID "obj_32089" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_980687" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_980687.pmesh"; pmesh ID "obj_980687" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_185757" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_185757.pmesh"; pmesh ID "obj_185757" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_380977" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_380977.pmesh"; pmesh ID "obj_380977" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_360277" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_360277.pmesh"; pmesh ID "obj_360277" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_436780" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_436780.pmesh"; pmesh ID "obj_436780" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_517102" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_517102.pmesh"; pmesh ID "obj_517102" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_144823" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_144823.pmesh"; pmesh ID "obj_144823" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_164552" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_164552.pmesh"; pmesh ID "obj_164552" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_830466" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_830466.pmesh"; pmesh ID "obj_830466" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_822901" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_822901.pmesh"; pmesh ID "obj_822901" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_608306" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_608306.pmesh"; pmesh ID "obj_608306" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_30698" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_30698.pmesh"; pmesh ID "obj_30698" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_142976" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_142976.pmesh"; pmesh ID "obj_142976" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; pmesh ID "obj_343013" select ({0:8}) /*file*/"./rp1toRP1MD.x.jmol|obj_343013.pmesh"; pmesh ID "obj_343013" fill noMesh noDots notFrontOnly fullylit; color pmesh opaque [x6666ff]; boundBox off; font boundBox 14.0 SansSerif Plain; boundBox off; frank off; font frank 16.0 SansSerif Bold; select *; set fontScaling false; } function _setPerspectiveState() { set perspectiveModel 11; set scaleAngstromsPerInch 0.0; set perspectiveDepth true; set visualRange 5.0; set cameraDepth 3.0; boundbox corners {-6.0 -5.723753 -4.5408955} {6.0 5.658531 5.5} # volume = 1371.4598; center {0.0 0.0 0.0}; moveto -1.0 {0 0 1 0} 100.0 0.0 0.0 {0.0 -0.032610655 0.47955203} 10.277105 {0 0 0} 0 0 0 3.0 0.0 0.0; save orientation "default"; moveto 0.0 { -982 134 132 89.76} 100.0 0.0 0.0 {0.0 0.0 0.0} 10.526279 {0 0 0} 0 0 0 3.0 0.0 0.0;; slab 100;depth 0; set slabRange 0.0; set spinX 0; set spinY 30; set spinZ 0; set spinFps 30; set navX 0; set navY 0; set navZ 0; set navFps 10; } function _setSelectionState() { select ({7}); set hideNotSelected false; } function _setState() { initialize; set refreshing false; _setWindowState; _setFileState; _setVariableState; _setModelState; _setPerspectiveState; _setSelectionState; set refreshing true; set antialiasDisplay true; set antialiasTranslucent true; set antialiasImages true; } _setState; **/CJPEG Encoder Copyright 1998, James R. Weeks and BioElectroMech.     $.' 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