exit; # BEGINOFOPTIONS # Options for the scene # caption: Comparison of two conformations of insulin, R and T (PDB ID 4trz). The alpha-carbon trace of one conformation is shown in blue (chains A and B), the other in gold (chains C and D). The largest differences are at the N-terminus of the B (or D) chain. # captionBgColor: white # captionFontColor: black # spinState: on # doModelReload: false # savePSpeed: -1 # killMove: 1 # killZoom: 1 # animationDirection: 0 # animationMode: PALINDROME # loopPause: 1 # ENDOFOPTIONS # Jmol state version 14.29.16 2018-06-03 23:13; # fullName = "jmolApplet0__323421402851473__"; # documentBase = "http://proteopedia.org/wiki/index.php?title=User:Karsten_Theis/Insulin&action=edit"; # codeBase = "http:/wiki/extensions/jsmol/j2s/"; function _setWindowState() { # width 350; # height 350; stateVersion = 1429016; background [xffffff]; axis1Color = "[xff0000]"; axis2Color = "[x008000]"; axis3Color = "[x0000ff]"; set ambientPercent 45; set diffusePercent 84; set specular true; set specularPercent 22; set specularPower 40; set specularExponent 6; set celShading false; set celShadingPower 10; set zShadePower 3; } 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}; set defaultLoadFilter ""; set defaultLoadScript ""; set defaultStructureDssp true; set defaultVDW Auto; set forceAutoBond false; # set defaultDirectory ""; # set loadFormat "https://files.rcsb.org/download/%FILE.pdb"; # set loadLigandFormat "https://files.rcsb.org/ligands/download/%FILE.cif"; # set smilesUrlFormat "https://cactus.nci.nih.gov/chemical/structure/%FILE/file?format=sdf&get3d=true"; # set nihResolverFormat "https://cactus.nci.nih.gov/chemical/structure/%FILE"; # set pubChemFormat "https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/%FILE/SDF?record_type=3d"; set bondingVersion 0; set legacyAutoBonding false; set legacyAutoBonding false; set legacyHAddition false; set legacyJavaFloat false; set minBondDistance 0.4; set minimizationCriterion 0.001; set minimizationSteps 100; set multipleBondBananas false; set pdbAddHydrogens false; set pdbGetHeader false; set pdbSequential false; set percentVdwAtom 23; set smallMoleculeMaxAtoms 40000; set smartAromatic true; reloadfile = false; if (loadedfileprev != "38e438064650097d9c9f87c964200009"); load /*file*/"/cgi-bin/getfrozenstructure?38e438064650097d9c9f87c964200009"; loadedfileprev = "38e438064650097d9c9f87c964200009"; reloadfile = true; endif; } function _setParameterState() { 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}"; set defaultloadfilter ""; set defaultloadscript ""; set defaulttorsionlabel "%VALUE %UNITS"; set defaulttranslucent 0.5; set defaultvdw "Jmol"; set allowembeddedscripts true; set allowmoveatoms false; set allowrotateselected false; set animationmode "once"; set appletproxy ""; set applysymmetrytobonds false; set atomtypes ""; set autobond true; set autofps false; set axes window; set axesmode 0; set axesoffset 0.0; set axesscale 2.0; set bondmodeor false; set bondradiusmilliangstroms 150; set bondtolerance 0.45; set cartoonbaseedges false; set cartoonblockheight 0.5; set cartoonblocks false; set cartoonfancy false; set cartoonladders false; set cartoonrockets false; set cartoonsteps 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 drawfontsize 14.0; set drawhover false; set dsspcalculatehydrogenalways true; 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 gestureswipefactor 1.0; set greyscalerendering false; set hbondsbackbone false; set hbondsrasmol true; set hbondssolid false; set helixstep 1; set helppath "https://chemapps.stolaf.edu/jmol/docs/index.htm"; set hermitelevel 0; set hiddenlinesdashed false; set hidenameinpopup false; set hidenavigationpoint false; set highresolution false; set hoverdelay 0.5; set infofontsize 20; set isosurfacekey false; set isosurfacepropertysmoothing true; set isosurfacepropertysmoothingpower 7; set jmolinjspecview true; 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 modulationscale 1.0; set monitorenergy false; set multiplebondbananas false; set multiplebondradiusfactor 0.0; set multiplebondspacing -1.0; set navigationperiodic false; set navigationspeed 5.0; set nbocharges true; set nmrpredictformat "http://www.nmrdb.org/service/predictor?POST?molfile="; set nmrurlformat "http://www.nmrdb.org/new_predictor?POST?molfile="; set partialdots false; set particleradius 20.0; set pdbaddhydrogens false; set pdbgetheader false; set pdbsequential false; set percentvdwatom 23; set pickingspinrate 10; 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 selecthetero true; set selecthydrogen true; set sheetsmoothing 1.0; set showhiddenselectionhalos false; set showhydrogens true; set showmeasurements true; set showmodulationvectors false; set showmultiplebonds true; set shownavigationpointalways false; set showunitcelldetails true; set slabbyatom false; set slabbymolecule false; set smallmoleculemaxatoms 40000; set smartaromatic true; set solventprobe false; set solventproberadius 1.2; set ssbondsbackbone true; set starwidth 0.05; set stereodegrees -5; set strandcountformeshribbon 7; set strandcountforstrands 5; set strutdefaultradius 0.3; set strutlengthmaximum 7.0; set strutsmultiple false; set strutspacing 6; set tracealpha true; set translucent true; set twistedsheets false; set usenumberlocalization true; set vectorscale 1.0; set vectorscentered false; set vectorsymmetry false; set vectortrail 0; set vibrationscale 1.0; set waitformoveto true; set wireframerotation false; set zdepth 0; set zoomheight false; set zoomlarge true; set zslab 50; # user-defined atom sets; @~anomalous_atoms ({}); @~backbone_invisible ({}); @~hydroxy_unchained_nucs ({}); @~nobackbone_aas ({}); @~nophosphorus_nucs ({}); @~protein ({0:797}); @~unbondable_aas ({}); @~unchained_aas ({}); @~unchained_nucs ({}); } function _setDataState() { DATA "coord set" 483 ; Jmol Property Data Format 1 -- Jmol 14.29.16 2018-06-03 23:13; 1 N [GLY]1:A.N_#1 -8.479476680507725 16.77566149899347 14.552739819841825 ; 2 C [GLY]1:A.CA_#2 -8.187893917879851 16.510661564954127 13.14782290859852 ; 3 C [GLY]1:A.C_#3 -8.452465966612856 15.050005382581473 12.770570807311099 ; 4 O [GLY]1:A.O_#4 -8.986584526500394 14.208281931159004 13.533790955963575 ; 5 N [ILE]2:A.N_#5 -8.057777371745193 14.78114183932335 11.539666136677305 ; 6 C [ILE]2:A.CA_#6 -8.285956903572998 13.426197047841123 10.947010491896943 ; 7 C [ILE]2:A.C_#7 -7.623658412377878 12.27961466136808 11.661524690209651 ; 8 O [ILE]2:A.O_#8 -8.237428970554907 11.22398607551223 11.66927005263063 ; 9 C [ILE]2:A.CB_#9 -7.858754085207373 13.4962717000945 9.4437003791484 ; 10 C [ILE]2:A.CG1_#10 -8.351621597451052 12.266634913326042 8.649765880590445 ; 11 C [ILE]2:A.CG2_#11 -6.307798326058145 13.71576026467434 9.23175226478896 ; 12 C [ILE]2:A.CD1_#12 -8.480921289997914 12.521912424603345 7.097081114856151 ; 13 N [VAL]3:A.N_#13 -6.450426944269902 12.483470338902645 12.23500510397993 ; 14 C [VAL]3:A.CA_#14 -5.711400841686856 11.435946981027831 12.949092097565156 ; 15 C [VAL]3:A.C_#15 -6.505749639201619 10.922741779623834 14.147359350367608 ; 16 O [VAL]3:A.O_#16 -6.641897070013672 9.730654733633923 14.364463822606961 ; 17 C [VAL]3:A.CB_#17 -4.280538458188345 11.87499006875863 13.33727762872876 ; 18 C [VAL]3:A.CG1_#18 -3.682815690143161 10.82083974039241 14.275312051213238 ; 19 C [VAL]3:A.CG2_#19 -3.481783012300518 12.1779860228479 12.085143374956395 ; 20 N [GLU]4:A.N_#20 -6.948843885550886 11.929541898841356 14.90830284945 ; 21 C [GLU]4:A.CA_#21 -7.755313391004588 11.626860966106003 16.107357973175237 ; 22 C [GLU]4:A.C_#22 -8.988395408133622 10.882570224718318 15.690331557564 ; 23 O [GLU]4:A.O_#23 -9.29298760489885 9.807986808668296 16.26658677499809 ; 24 C [GLU]4:A.CB_#24 -8.026544533875903 12.927620938808289 16.877718382692937 ; 25 C [GLU]4:A.CG_#25 -6.834402803429587 13.86091013438861 17.00156656371107 ; 26 C [GLU]4:A.CD_#26 -6.046659772818349 14.552637741013632 15.95641402175547 ; 27 O [GLU]4:A.OE1_#27 -6.476949406451551 15.252647447290684 15.036915113487641 ; 28 O [GLU]4:A.OE2_#28 -4.778715217258243 14.427388786084027 16.08121908300913 ; 29 N [GLN]5:A.N_#29 -9.706339372521947 11.327033892842456 14.674457297768026 ; 30 C [GLN]5:A.CA_#30 -10.919407166323653 10.690852372157496 14.207894761359412 ; 31 C [GLN]5:A.C_#31 -10.774270421077876 9.344927371255128 13.440048932351118 ; 32 O [GLN]5:A.O_#32 -11.664601618745037 8.556549169799581 13.812317880734238 ; 33 C [GLN]5:A.CB_#33 -11.79925566236799 11.51016224317331 13.242002966558063 ; 34 C [GLN]5:A.CG_#34 -12.224720596006518 12.877136841982937 13.795058150471224 ; 35 C [GLN]5:A.CD_#35 -13.502056067361803 13.249930469427273 13.06864985966331 ; 36 O [GLN]5:A.OE1_#36 -13.521014166941978 13.735278273547339 11.929786786464364 ; 37 N [GLN]5:A.NE2_#37 -14.56479011085096 12.887826961073973 13.792737148632956 ; 38 N [CYS]6:A.N_#38 -9.816028535617916 9.28499055087941 12.537268191244294 ; 39 C [CYS]6:A.CA_#39 -9.710255909640516 8.068090247139665 11.700945405262733 ; 40 C [CYS]6:A.C_#40 -8.581139739657214 7.085907118555996 11.963770397620461 ; 41 O [CYS]6:A.O_#41 -8.622291873820544 5.998503191163265 11.400383141335169 ; 42 C [CYS]6:A.CB_#42 -9.710988877020265 8.52847658023203 10.224332765786631 ; 43 S [CYS]6:A.SG_#43 -11.056973677853847 9.532674357619005 9.617264614904013 ; 44 N [CYS]7:A.N_#44 -7.615506408825707 7.50872524968675 12.6957199166273 ; 45 C [CYS]7:A.CA_#45 -6.463692014931432 6.719655357481684 13.083052212251424 ; 46 C [CYS]7:A.C_#46 -6.633795081203173 6.2086251211014645 14.52554382205376 ; 47 O [CYS]7:A.O_#47 -6.6222473399897 4.988868945097451 14.797471240261142 ; 48 C [CYS]7:A.CB_#48 -5.134348625471834 7.457086695808599 12.86904479613358 ; 49 S [CYS]7:A.SG_#49 -3.775928513951568 6.41004916007789 13.406981780722138 ; 50 N [THR]8:A.N_#50 -6.778107940595674 7.1516587406889425 15.413205576857756 ; 51 C [THR]8:A.CA_#51 -6.97116870943335 6.849435692906522 16.866810326755367 ; 52 C [THR]8:A.C_#52 -8.266456523998825 6.085895530605075 17.02156787258393 ; 53 O [THR]8:A.O_#53 -8.17553610475532 5.009485325946644 17.64412031910694 ; 54 C [THR]8:A.CB_#54 -6.732777746392987 8.19965385191719 17.635688517250156 ; 55 O [THR]8:A.OG1_#55 -5.3249582478565864 8.439507857111133 17.364933432841493 ; 56 C [THR]8:A.CG2_#56 -7.016066461091416 8.231752448491026 19.114111726017693 ; 57 N [SER]9:A.N_#57 -9.368511169448253 6.517442399568129 16.479890977810374 ; 58 C [SER]9:A.CA_#58 -10.720898204857107 5.983647184575509 16.445569338731808 ; 59 C [SER]9:A.C_#59 -10.984543721353312 5.4261476582654256 15.03113683069352 ; 60 O [SER]9:A.O_#60 -10.046530714690759 5.37684316649221 14.215233854584923 ; 61 C [SER]9:A.CB_#61 -11.8166196790496 7.00977359143676 16.677293416322915 ; 62 O [SER]9:A.OG_#62 -11.588072259058938 8.127565471178562 17.49955820968264 ; 63 N [ILE]10:A.N_#63 -12.218246250531148 5.07456223993066 14.739102991704655 ; 64 C [ILE]10:A.CA_#64 -12.599000046831671 4.597982146815956 13.409786264415956 ; 65 C [ILE]10:A.C_#65 -13.63010415331055 5.522825380014005 12.800984724002195 ; 66 O [ILE]10:A.O_#66 -14.600827102983775 5.942643465967716 13.474007553989317 ; 67 C [ILE]10:A.CB_#67 -13.11433289011165 3.132760239497326 13.349588067179393 ; 68 C [ILE]10:A.CG1_#68 -12.086462287117943 2.2733970161362684 14.062056925331007 ; 69 C [ILE]10:A.CG2_#69 -13.440353357226568 2.835157793270861 11.863225917828773 ; 70 C [ILE]10:A.CD1_#70 -12.236766557762074 0.7459186265548325 13.919237474317345 ; 71 N [CYS]11:A.N_#71 -13.418059094097366 5.823337259243574 11.555974481753083 ; 72 C [CYS]11:A.CA_#72 -14.1627523271262 6.65123759998822 10.658209471031473 ; 73 C [CYS]11:A.C_#73 -14.968714433531698 5.9358170032963455 9.58514868390548 ; 74 O [CYS]11:A.O_#74 -14.452417902802136 5.088791717024037 8.865815620038726 ; 75 C [CYS]11:A.CB_#75 -13.207976030863495 7.514241635548795 9.768814025405039 ; 76 S [CYS]11:A.SG_#76 -12.765163458878911 9.058490077611111 10.549941912041099 ; 77 N [SER]12:A.N_#77 -16.19947521823872 6.390302157167838 9.448265026233129 ; 78 C [SER]12:A.CA_#78 -17.089325010503302 5.856246107941999 8.420367909060413 ; 79 C [SER]12:A.C_#79 -16.682219420725456 6.582882246560468 7.133185342046214 ; 80 O [SER]12:A.O_#80 -15.922348365618754 7.571967720768815 7.196240114435627 ; 81 C [SER]12:A.CB_#81 -18.570014386948927 6.164065983015078 8.716663192504253 ; 82 O [SER]12:A.OG_#82 -18.827101217742324 7.543767093308385 8.431538294103515 ; 83 N [LEU]13:A.N_#83 -17.194965487765234 6.147572693419272 6.011656446440197 ; 84 C [LEU]13:A.CA_#84 -16.893055251970132 6.815178679720481 4.75523714677271 ; 85 C [LEU]13:A.C_#85 -17.30458491854038 8.291351126088014 4.803270906961635 ; 86 O [LEU]13:A.O_#86 -16.581092086306015 9.120247240625718 4.240357633881501 ; 87 C [LEU]13:A.CB_#87 -17.598391709156072 5.99340019242411 3.675285944180075 ; 88 C [LEU]13:A.CG_#88 -17.71598741620525 6.6005009272771655 2.303511200490542 ; 89 C [LEU]13:A.CD1_#89 -16.29455249128394 6.767612168221739 1.8006696873237198 ; 90 C [LEU]13:A.CD2_#90 -18.483028916353483 5.657797997884657 1.3753880815213262 ; 91 N [TYR]14:A.N_#91 -18.434506014269783 8.541111672064304 5.432688881839448 ; 92 C [TYR]14:A.CA_#92 -19.002442114903005 9.884380917054655 5.518282813053018 ; 93 C [TYR]14:A.C_#93 -18.147330773189736 10.844421386001667 6.298533984956863 ; 94 O [TYR]14:A.O_#94 -18.08115397433295 12.033345797699843 5.9363774241144265 ; 95 C [TYR]14:A.CB_#95 -20.52424799209281 9.712181107077834 5.821472683587174 ; 96 C [TYR]14:A.CG_#96 -21.05408154808884 8.951447608988865 4.593994395459059 ; 97 C [TYR]14:A.CD1_#97 -20.907248191432746 9.505194218076472 3.315389429765163 ; 98 C [TYR]14:A.CD2_#98 -21.67154031333201 7.708722585171464 4.679972232152161 ; 99 C [TYR]14:A.CE1_#99 -21.34027650908404 8.845922909242557 2.1730708150781277 ; 100 C [TYR]14:A.CE2_#100 -22.135036150376436 7.035577865616854 3.5470482295914287 ; 101 C [TYR]14:A.CZ_#101 -21.97282159991171 7.602543662737969 2.2956952719842048 ; 102 O [TYR]14:A.OH_#102 -22.427764595746233 6.93369479248004 1.16694195114931 ; 103 N [GLN]15:A.N_#103 -17.434814834816958 10.400825454769226 7.275732883522962 ; 104 C [GLN]15:A.CA_#104 -16.499991452499458 11.189740309265456 8.099469853816064 ; 105 C [GLN]15:A.C_#105 -15.199489091715511 11.435801177407326 7.329324634545927 ; 106 O [GLN]15:A.O_#106 -14.447307904403477 12.3868452496316 7.630275850095775 ; 107 C [GLN]15:A.CB_#107 -16.17386889476411 10.53208705966853 9.44335202150442 ; 108 C [GLN]15:A.CG_#108 -17.219306729609865 10.6894931829441 10.530769165855377 ; 109 C [GLN]15:A.CD_#109 -17.012608705247253 9.774207957697168 11.692227250837036 ; 110 O [GLN]15:A.OE1_#110 -17.003394204449375 10.15406091737949 12.869348664284104 ; 111 N [GLN]15:A.NE2_#111 -16.82173955394727 8.477844514423529 11.473200334624131 ; 112 N [LEU]16:A.N_#112 -14.888269917061526 10.574049896887635 6.366926922656313 ; 113 C [LEU]16:A.CA_#113 -13.628926567670065 10.719419086852016 5.595722587247987 ; 114 C [LEU]16:A.C_#114 -13.762483547987182 11.808761253086937 4.560314369262837 ; 115 O [LEU]16:A.O_#115 -12.918360551728103 12.633938689912096 4.2017428074495005 ; 116 C [LEU]16:A.CB_#116 -13.32523605969859 9.307591918233898 5.078919799600914 ; 117 C [LEU]16:A.CG_#117 -11.983276727896085 8.71691059002256 4.805082767242875 ; 118 C [LEU]16:A.CD1_#118 -10.88783396034749 9.061284442494316 5.821097428928052 ; 119 C [LEU]16:A.CD2_#119 -12.248850199726368 7.183218873841181 4.714190244026548 ; 120 N [GLU]17:A.N_#120 -14.970224991707912 11.894439790631711 3.9941140572498934 ; 121 C [GLU]17:A.CA_#121 -15.378691888597796 12.86008069783316 2.9612624548963336 ; 122 C [GLU]17:A.C_#122 -15.322347068578814 14.280512829857681 3.5647919235797625 ; 123 O [GLU]17:A.O_#123 -15.180198767680022 15.15420187224985 2.734949578459049 ; 124 C [GLU]17:A.CB_#124 -16.780261459378874 12.593343903269306 2.4187283816010754 ; 125 C [GLU]17:A.CG_#125 -16.741356014858372 11.299259246948894 1.5909118145629737 ; 126 C [GLU]17:A.CD_#126 -17.905447544696198 11.269834271261399 0.6200142499529786 ; 127 O [GLU]17:A.OE1_#127 -17.807410085701378 11.860221251190364 -0.4442511636371629 ; 128 O [GLU]17:A.OE2_#128 -18.81441256544583 10.599400040996333 1.1319971929720989 ; 129 N [ASN]18:A.N_#129 -15.345210026206983 14.443712758535733 4.843350513730396 ; 130 C [ASN]18:A.CA_#130 -15.208200219108024 15.820630231367463 5.368959290073973 ; 131 C [ASN]18:A.C_#131 -13.821969025775367 16.368488998834334 5.047253136043308 ; 132 O [ASN]18:A.O_#132 -13.56858045780816 17.57130030003653 5.199916842679189 ; 133 C [ASN]18:A.CB_#133 -15.343906239411305 15.664216631171271 6.884443259546141 ; 134 C [ASN]18:A.CG_#134 -16.855398250359897 15.585294299326819 7.200120573230247 ; 135 O [ASN]18:A.OD1_#135 -17.04480133913936 15.015012012580694 8.272075135412999 ; 136 N [ASN]18:A.ND2_#136 -17.640496510535733 16.1184108948591 6.276202602067788 ; 137 N [TYR]19:A.N_#137 -12.849165975592438 15.512694374553437 4.697702300531923 ; 138 C [TYR]19:A.CA_#138 -11.502801763385238 16.008411942565782 4.380783539882431 ; 139 C [TYR]19:A.C_#139 -11.25655264422227 16.153912039068743 2.922946068410013 ; 140 O [TYR]19:A.O_#140 -10.107177960490754 16.458873313555678 2.4780579280192154 ; 141 C [TYR]19:A.CB_#141 -10.422762494145475 15.171008676378811 5.168413495305302 ; 142 C [TYR]19:A.CG_#142 -10.693465993327557 15.128610829084135 6.65172466902286 ; 143 C [TYR]19:A.CD1_#143 -10.261201825953599 16.228286314511443 7.460195148604344 ; 144 C [TYR]19:A.CD2_#144 -11.417052887723731 14.088237561602302 7.247553059221982 ; 145 C [TYR]19:A.CE1_#145 -10.564902105677431 16.201816503594227 8.812542548204636 ; 146 C [TYR]19:A.CE2_#146 -11.65463396693486 14.08533073840644 8.626339765416883 ; 147 C [TYR]19:A.CZ_#147 -11.215921594789089 15.150075756148592 9.394026877279199 ; 148 O [TYR]19:A.OH_#148 -11.484258972214132 15.13633207659835 10.722847468310608 ; 149 N [CYS]20:A.N_#149 -12.30777185999315 16.00720349394141 2.0981765471613953 ; 150 C [CYS]20:A.CA_#150 -12.15243888225831 16.210484922172373 0.6449837426910392 ; 151 C [CYS]20:A.C_#151 -12.180196736781834 17.74630980300203 0.43320452525736997 ; 152 O [CYS]20:A.O_#152 -12.628052293450414 18.462794022401297 1.3398978381878788 ; 153 C [CYS]20:A.CB_#153 -13.242206591370415 15.56720912378306 -0.15919508529633308 ; 154 S [CYS]20:A.SG_#154 -13.277732186130851 13.825565104022981 0.1044752402066722 ; 155 N [ASN]21:A.N_#155 -11.780811041884856 18.137880313240956 -0.7500577458486122 ; 156 C [ASN]21:A.CA_#156 -11.780025973841465 19.564034944360568 -1.1392650836574783 ; 157 C [ASN]21:A.C_#157 -13.123562165045758 19.888239712535103 -1.8342793074091546 ; 158 O [ASN]21:A.O_#158 -14.044430102466857 19.054514658185994 -1.740626888431331 ; 159 C [ASN]21:A.CB_#159 -10.667506209604763 20.054253976992364 -2.015647462661227 ; 160 C [ASN]21:A.CG_#160 -9.217283910525698 19.979945283000525 -1.6431189385841405 ; 161 O [ASN]21:A.OD1_#161 -8.703019473619142 20.231646627324658 -0.5439444655369332 ; 162 N [ASN]21:A.ND2_#162 -8.45708580892268 19.66841626749212 -2.6908066395788257 ; 163 O [ASN]21:A.OXT_#163 -13.09901416678449 20.972787136065527 -2.4435340011907316 ; 164 N [PHE]1:B.N_#165 -17.424045772072187 -0.1276249517955339 2.941077065145441 ; 165 C [PHE]1:B.CA_#166 -16.133469848390014 0.5691955319451996 3.140438542495614 ; 166 C [PHE]1:B.C_#167 -15.54406627594791 -0.13685802518900125 4.368301239726304 ; 167 O [PHE]1:B.O_#168 -16.3118619971669 -0.5419675953277192 5.25571600558263 ; 168 C [PHE]1:B.CB_#169 -16.206041191048463 2.0824282342057554 3.2320474341708576 ; 169 C [PHE]1:B.CG_#170 -14.934737182483552 2.7616431702189725 2.797809954785048 ; 170 C [PHE]1:B.CD1_#171 -14.67196066021799 3.0371789911322313 1.4601038918774742 ; 171 C [PHE]1:B.CD2_#172 -13.954446509290062 3.0541001699634887 3.74786526862225 ; 172 C [PHE]1:B.CE1_#173 -13.493394462185135 3.6082441581762215 1.0615360910663707 ; 173 C [PHE]1:B.CE2_#174 -12.721363655561236 3.6318581113474586 3.409953391045079 ; 174 C [PHE]1:B.CZ_#175 -12.534404231099405 3.8677096878441235 2.038662682453738 ; 175 N [VAL]2:B.N_#176 -14.241820213384123 -0.25430502845876113 4.405856451882255 ; 176 C [VAL]2:B.CA_#177 -13.58773918783882 -0.9262261970273578 5.529946286037432 ; 177 C [VAL]2:B.C_#178 -13.895752904124418 -0.11999889776059725 6.786805901307556 ; 178 O [VAL]2:B.O_#179 -14.091032691313622 1.1006013902646412 6.684108571312844 ; 179 C [VAL]2:B.CB_#180 -12.090579972477592 -1.0617684931964817 5.138476530107087 ; 180 C [VAL]2:B.CG1_#181 -11.330833641075303 0.20985759851881625 5.418357924254038 ; 181 C [VAL]2:B.CG2_#182 -11.457010833743567 -2.260954916596056 5.812636799166278 ; 182 N [ASN]3:B.N_#183 -13.95064838405301 -0.7928044872078832 7.906954607994262 ; 183 C [ASN]3:B.CA_#184 -14.199902476877737 -0.28732693634672657 9.249271203580243 ; 184 C [ASN]3:B.C_#185 -12.913246995306022 -0.6162839677996264 10.016673277593046 ; 185 O [ASN]3:B.O_#186 -12.789590649393567 -1.6778910730035594 10.66761986702732 ; 186 C [ASN]3:B.CB_#187 -15.472305604437475 -0.8691007376646152 9.852260030239847 ; 187 C [ASN]3:B.CG_#188 -15.842340323933445 -0.39712613282375564 11.236761846328534 ; 188 O [ASN]3:B.OD1_#189 -16.096162235437944 0.8011300454707477 11.543275416043238 ; 189 N [ASN]3:B.ND2_#190 -15.987163219504993 -1.3266504942040669 12.206565842256989 ; 190 N [GLN]4:B.N_#191 -11.915923559324225 0.25514303425190654 9.869103144649603 ; 191 C [GLN]4:B.CA_#192 -10.66565052211672 -0.018807138310251048 10.606982969136684 ; 192 C [GLN]4:B.C_#193 -9.973275783343425 1.3202066234456549 10.849635739442142 ; 193 O [GLN]4:B.O_#194 -10.364699000252635 2.2991904149989786 10.227486560273412 ; 194 C [GLN]4:B.CB_#195 -9.777140094770354 -1.0198591464602096 9.900163262651567 ; 195 C [GLN]4:B.CG_#196 -9.326096779797876 -0.773902738906612 8.490251430797542 ; 196 C [GLN]4:B.CD_#197 -7.869587574767833 -1.0738010399708884 8.187909001288338 ; 197 O [GLN]4:B.OE1_#198 -6.969852940164281 -1.242085233834974 9.022217707577756 ; 198 N [GLN]4:B.NE2_#199 -7.47313583001948 -1.1849970172345135 6.9094351185960186 ; 199 N [HIS]5:B.N_#200 -8.986795687303015 1.240214114857313 11.711707789033039 ; 200 C [HIS]5:B.CA_#201 -8.126012703262539 2.4086489470065686 12.076501836965175 ; 201 C [HIS]5:B.C_#202 -7.31130757164499 2.6331581052949975 10.812559517727205 ; 202 O [HIS]5:B.O_#203 -6.638673631020034 1.6570365894783379 10.419180097473514 ; 203 C [HIS]5:B.CB_#204 -7.194392933337264 2.0486159890488587 13.238578372081776 ; 204 C [HIS]5:B.CG_#205 -7.959199481830316 1.7826582274637222 14.513617748899126 ; 205 N [HIS]5:B.ND1_#206 -8.256009647014622 2.8045301019709292 15.39399244068348 ; 206 C [HIS]5:B.CD2_#207 -8.479085624945338 0.6486112983621481 15.063215748160658 ; 207 C [HIS]5:B.CE1_#208 -8.92126923815673 2.3441805191168132 16.4390139418783 ; 208 N [HIS]5:B.NE2_#209 -9.063809267694621 1.0495142517232523 16.239721202290113 ; 209 N [LEU]6:B.N_#210 -7.364569017682371 3.7721748401404804 10.192874842986946 ; 210 C [LEU]6:B.CA_#211 -6.622034363470942 4.063694166258089 8.944133168422088 ; 211 C [LEU]6:B.C_#212 -5.532487062303155 5.0251462714868 9.40497427755763 ; 212 O [LEU]6:B.O_#213 -5.95358085007851 6.1035998441088735 9.866211649846232 ; 213 C [LEU]6:B.CB_#214 -7.623520116110065 4.5790690336328215 7.944434697212224 ; 214 C [LEU]6:B.CG_#215 -8.609314452640144 3.640034949231673 7.2856194618099845 ; 215 C [LEU]6:B.CD1_#216 -9.652597542682258 4.420337240635425 6.4835859662113045 ; 216 C [LEU]6:B.CD2_#217 -7.774124773476862 2.7372918151147196 6.385000211724886 ; 217 N [CYS]7:B.N_#218 -4.285841761571194 4.670931413802269 9.297148822499722 ; 218 C [CYS]7:B.CA_#219 -3.202103197307447 5.507007867373364 9.806489463045455 ; 219 C [CYS]7:B.C_#220 -2.0930576318470635 5.63069610753473 8.764492748569614 ; 220 O [CYS]7:B.O_#221 -1.995467667107918 4.754151610260642 7.917588419214325 ; 221 C [CYS]7:B.CB_#222 -2.6301632503039505 4.929361381816909 11.099748228624069 ; 222 S [CYS]7:B.SG_#223 -3.7688060745698593 4.604703811021185 12.477055739847607 ; 223 N [GLY]8:B.N_#224 -1.2403082401998233 6.607317933223367 8.94387581531186 ; 224 C [GLY]8:B.CA_#225 -0.10587920069154322 6.864751523983351 8.075795346306396 ; 225 C [GLY]8:B.C_#226 -0.5194519798395447 6.986114653374008 6.633073076715914 ; 226 O [GLY]8:B.O_#227 -1.440184547373926 7.648548199292841 6.198651235272668 ; 227 N [SER]9:B.N_#228 0.2842729733315341 6.3074556110768665 5.810494141926986 ; 228 C [SER]9:B.CA_#229 0.03665596573540064 6.34310935179968 4.379712667235057 ; 229 C [SER]9:B.C_#230 -1.2951011450742946 5.589968306542441 4.070815331933099 ; 230 O [SER]9:B.O_#231 -1.8883107024222126 5.882223726254364 2.9729473113039804 ; 231 C [SER]9:B.CB_#232 1.2220631408256803 5.723439577961394 3.6530709393968523 ; 232 O [SER]9:B.OG_#233 1.4329549311436516 4.402458096382954 4.154191262376587 ; 233 N [HIS]10:B.N_#234 -1.7737682184969392 4.751816653123586 4.966241285707191 ; 234 C [HIS]10:B.CA_#235 -3.082884562752815 4.01169021404392 4.691019100232639 ; 235 C [HIS]10:B.C_#236 -4.234505920827541 5.049956782112178 4.748419285405577 ; 236 O [HIS]10:B.O_#237 -5.076854008741526 5.061834363105451 3.829012073199036 ; 237 C [HIS]10:B.CB_#238 -3.307674577615968 2.8839441376411603 5.662376004967458 ; 238 C [HIS]10:B.CG_#239 -2.2209225043330614 1.8192640192302925 5.6055237695153055 ; 239 N [HIS]10:B.ND1_#240 -2.0771974940274873 1.1527549551139575 4.425612421632152 ; 240 C [HIS]10:B.CD2_#241 -1.2000086404513208 1.3902482028334582 6.332089191081332 ; 241 C [HIS]10:B.CE1_#242 -1.058160238916587 0.2871667524218271 4.533214169091246 ; 242 N [HIS]10:B.NE2_#243 -0.4562771028022503 0.3827508178722141 5.683763332270793 ; 243 N [LEU]11:B.N_#244 -4.18524372105561 5.968561824788345 5.670445863787973 ; 244 C [LEU]11:B.CA_#245 -5.201515018598507 7.050708834012129 5.71342842093038 ; 245 C [LEU]11:B.C_#246 -5.101593502196809 7.884224662704077 4.454096830808079 ; 246 O [LEU]11:B.O_#247 -6.137370743066275 8.242924114186575 3.8635265887513097 ; 247 C [LEU]11:B.CB_#248 -4.8187351839246455 7.85844119812705 6.97035683023951 ; 248 C [LEU]11:B.CG_#249 -5.769840516702914 9.044928803336141 7.2565644622934595 ; 249 C [LEU]11:B.CD1_#250 -7.245763784776081 8.726079504091702 6.98276411325869 ; 250 C [LEU]11:B.CD2_#251 -5.432530652561026 9.400353792345237 8.74773317600109 ; 251 N [VAL]12:B.N_#252 -3.890280863178469 8.338495243005362 3.9501881779480934 ; 252 C [VAL]12:B.CA_#253 -3.7300871970190936 9.149962175312604 2.7573254837983057 ; 253 C [VAL]12:B.C_#254 -4.238479499754051 8.492063021575076 1.4825780695897919 ; 254 O [VAL]12:B.O_#255 -5.014466810457194 9.058739104456576 0.6415983369459051 ; 255 C [VAL]12:B.CB_#256 -2.2202047433670993 9.506898675983457 2.695194085595145 ; 256 C [VAL]12:B.CG1_#257 -1.8335903578177275 10.15307202032604 1.3686688027801477 ; 257 C [VAL]12:B.CG2_#258 -2.0258248427786265 10.474466601442018 3.834330058107227 ; 258 N [GLU]13:B.N_#259 -3.9188583809234325 7.2193565916510805 1.2688687257894244 ; 259 C [GLU]13:B.CA_#260 -4.356090200392999 6.480399038834004 0.10743380674404968 ; 260 C [GLU]13:B.C_#261 -5.905638923465167 6.406783910075412 0.12284703623267834 ; 261 O [GLU]13:B.O_#262 -6.583963600785402 6.543684178675881 -0.8907761425648086 ; 262 C [GLU]13:B.CB_#263 -3.7811981321243655 5.0825850470111895 0.07934191990489836 ; 263 C [GLU]13:B.CG_#264 -3.5578716714836096 4.385761787851952 -1.2392981513322727 ; 264 C [GLU]13:B.CD_#265 -2.803488011351077 5.111417246769173 -2.351689471088358 ; 265 O [GLU]13:B.OE1_#266 -1.7450213240456662 5.748022305013215 -2.2367578754202517 ; 266 O [GLU]13:B.OE2_#267 -3.478213648005153 5.009645351752914 -3.408586720884454 ; 267 N [ALA]14:B.N_#268 -6.556841750727703 6.29103940402349 1.211842943977092 ; 268 C [ALA]14:B.CA_#269 -7.995303059056188 6.193695029684394 1.4633864535861334 ; 269 C [ALA]14:B.C_#270 -8.65900280279764 7.505204644586594 0.9923533547739352 ; 270 O [ALA]14:B.O_#271 -9.649229653083314 7.576969615411986 0.25553412732683434 ; 271 C [ALA]14:B.CB_#272 -8.355404693818414 5.870222063330261 2.913145417234792 ; 272 N [LEU]15:B.N_#273 -8.009910088878215 8.594824608209443 1.4137640613432638 ; 273 C [LEU]15:B.CA_#274 -8.455310041439494 9.926722782699445 1.0768410210972625 ; 274 C [LEU]15:B.C_#275 -8.344089955711553 10.141653016800747 -0.44366714625990067 ; 275 O [LEU]15:B.O_#276 -9.18470962865464 10.79562910784995 -1.0487711355022986 ; 276 C [LEU]15:B.CB_#277 -7.63922971054874 10.997308469266915 1.8424520066833474 ; 277 C [LEU]15:B.CG_#278 -8.053938118225359 11.300592722639445 3.2877964632951926 ; 278 C [LEU]15:B.CD1_#279 -6.932346476958967 12.162804160007274 3.8844074148485994 ; 279 C [LEU]15:B.CD2_#280 -9.496686251111804 11.74405328202798 3.297520522092136 ; 280 N [TYR]16:B.N_#281 -7.292941464445173 9.641638095671274 -1.0402884063204985 ; 281 C [TYR]16:B.CA_#282 -7.1043389286946415 9.736886392983509 -2.505099262836656 ; 282 C [TYR]16:B.C_#283 -8.239751982448752 9.042820664708337 -3.2518334606598316 ; 283 O [TYR]16:B.O_#284 -8.803301871709381 9.667288254599157 -4.171027537822145 ; 284 C [TYR]16:B.CB_#285 -5.729314645633918 9.105919312555464 -2.857757403830804 ; 285 C [TYR]16:B.CG_#286 -5.37682859059067 9.195462245897593 -4.33843145442011 ; 286 C [TYR]16:B.CD1_#287 -5.029420558505621 10.434765890298767 -4.839353740026137 ; 287 C [TYR]16:B.CD2_#288 -5.369681445059841 8.10693792683307 -5.1946444682875 ; 288 C [TYR]16:B.CE1_#289 -4.629058083269603 10.6465095637321 -6.154931371784844 ; 289 C [TYR]16:B.CE2_#290 -5.013496788802734 8.28963022198924 -6.53236567090693 ; 290 C [TYR]16:B.CZ_#291 -4.6588354040340745 9.523755829132144 -7.015495351166944 ; 291 O [TYR]16:B.OH_#292 -4.305695833538706 9.587649021205904 -8.333942204004398 ; 292 N [LEU]17:B.N_#293 -8.48791832042088 7.817851709464266 -2.8104645363054255 ; 293 C [LEU]17:B.CA_#294 -9.593787053205357 7.0027832445282945 -3.4250568754348443 ; 294 C [LEU]17:B.C_#295 -10.955505371033718 7.6569421822985015 -3.22619434244773 ; 295 O [LEU]17:B.O_#296 -11.860567381283154 7.7989481080854315 -4.050803992309202 ; 296 C [LEU]17:B.CB_#297 -9.517710664273146 5.6442155575793365 -2.6742125353581487 ; 297 C [LEU]17:B.CG_#298 -10.650393253596942 4.70306327454698 -3.0619902190710206 ; 298 C [LEU]17:B.CD1_#299 -10.528768252084287 4.628970089681424 -4.591943015389763 ; 299 C [LEU]17:B.CD2_#300 -10.601854314595572 3.3250757771220645 -2.4576571748468465 ; 300 N [VAL]18:B.N_#301 -11.266726326219192 7.994698491959699 -1.974870566465876 ; 301 C [VAL]18:B.CA_#302 -12.613289802311469 8.582201031033554 -1.696709513411954 ; 302 C [VAL]18:B.C_#303 -12.838407505312762 9.978579609301784 -2.2604629044873583 ; 303 O [VAL]18:B.O_#304 -13.991566343810879 10.22727029862258 -2.705366977562462 ; 304 C [VAL]18:B.CB_#305 -12.892668963563471 8.62053572894174 -0.2049137045981544 ; 305 C [VAL]18:B.CG1_#306 -14.089540204715362 9.55534006914885 0.05664332098800973 ; 306 C [VAL]18:B.CG2_#307 -13.047122240117915 7.291316588423096 0.5348069601398793 ; 307 N [CYS]19:B.N_#308 -11.821647626516356 10.825335180247363 -2.2690274793480443 ; 308 C [CYS]19:B.CA_#309 -12.002751526092599 12.223507312645586 -2.7186863119570415 ; 309 C [CYS]19:B.C_#310 -11.940821729558511 12.343432076352231 -4.204259854852566 ; 310 O [CYS]19:B.O_#311 -12.579425790953225 13.25625169522872 -4.746247120537252 ; 311 C [CYS]19:B.CB_#312 -11.111745729909817 13.143164857665818 -1.863991822062526 ; 312 S [CYS]19:B.SG_#313 -11.378657157850895 13.097780249747906 -0.14872871484002292 ; 313 N [GLY]20:B.N_#314 -11.257017071014857 11.457517728674633 -4.909113000928379 ; 314 C [GLY]20:B.CA_#315 -11.1726345627488 11.517628325293245 -6.353465903952042 ; 315 C [GLY]20:B.C_#316 -10.66046782396512 12.860074658961068 -6.876025061278273 ; 316 O [GLY]20:B.O_#317 -9.70584572637529 13.462138737079567 -6.366302100609907 ; 317 N [GLU]21:B.N_#318 -11.313540305082974 13.350918491923558 -7.929801444601257 ; 318 C [GLU]21:B.CA_#319 -10.903040945792117 14.599792548844691 -8.583150406467077 ; 319 C [GLU]21:B.C_#320 -11.062036692439609 15.806755653646153 -7.672044256671111 ; 320 O [GLU]21:B.O_#321 -10.449173817921995 16.84313505641067 -7.985146205824208 ; 321 C [GLU]21:B.CB_#322 -11.523777643041822 14.800377858856821 -9.963889152970147 ; 322 C [GLU]21:B.CG_#323 -11.016903867808498 13.96585533803231 -11.143127525063516 ; 323 C [GLU]21:B.CD_#324 -11.991646470283552 13.856968319819813 -12.294598530423595 ; 324 O [GLU]21:B.OE1_#325 -13.050303160928598 13.206633599079316 -12.27990967914576 ; 325 O [GLU]21:B.OE2_#326 -11.633536426888954 14.52530329056996 -13.297534003767872 ; 326 N [ARG]22:B.N_#327 -11.821622041998225 15.661010227521711 -6.610655841669455 ; 327 C [ARG]22:B.CA_#328 -12.062821175750335 16.722497817851288 -5.633849784433149 ; 328 C [ARG]22:B.C_#329 -10.728003843755973 17.085115085335218 -4.96470973367401 ; 329 O [ARG]22:B.O_#330 -10.45450602064647 18.286195839834342 -4.677429449063013 ; 330 C [ARG]22:B.CB_#331 -13.045647421704164 16.415919728164887 -4.522527848543941 ; 331 C [ARG]22:B.CG_#332 -14.525789953219956 16.52005935206815 -4.723440827545552 ; 332 C [ARG]22:B.CD_#333 -15.26414874017155 16.484499253101507 -3.4150632898704103 ; 333 N [ARG]22:B.NE_#334 -15.629999069774104 15.110919358425283 -3.1770321799899044 ; 334 C [ARG]22:B.CZ_#335 -16.063426576259516 14.56231335884662 -2.0633616479885664 ; 335 N [ARG]22:B.NH1_#336 -16.230722463340406 15.289208424715046 -0.9601310966612573 ; 336 N [ARG]22:B.NH2_#337 -16.33152213500676 13.241246333987018 -2.0491952367066704 ; 337 N [GLY]23:B.N_#338 -9.98002428458122 16.025168157187824 -4.661876299972157 ; 338 C [GLY]23:B.CA_#339 -8.683587992580655 16.306748690637736 -4.016859754474371 ; 339 C [GLY]23:B.C_#340 -8.961044164467634 16.343917581706926 -2.5342803986830846 ; 340 O [GLY]23:B.O_#341 -10.142385685299669 16.191727278592417 -2.139473708268424 ; 341 N [PHE]24:B.N_#342 -8.002733232332316 16.583213627320532 -1.6790871106460283 ; 342 C [PHE]24:B.CA_#343 -8.168540381396637 16.526091609384693 -0.2475442141926587 ; 343 C [PHE]24:B.C_#344 -7.027505554621155 17.326092813807655 0.41307337337768324 ; 344 O [PHE]24:B.O_#345 -6.192421537540365 17.812161728184723 -0.3605219309594849 ; 345 C [PHE]24:B.CB_#346 -8.146586878175427 15.005146159774405 0.05456169936429234 ; 346 C [PHE]24:B.CG_#347 -6.83423273953106 14.306153062951328 -0.17431876152453452 ; 347 C [PHE]24:B.CD1_#348 -5.9246137041130496 14.267545089756002 0.9034491331591763 ; 348 C [PHE]24:B.CD2_#349 -6.602517731150996 13.694434538578037 -1.4179933981678943 ; 349 C [PHE]24:B.CE1_#350 -4.696691925985848 13.620995313185533 0.6949125818843127 ; 350 C [PHE]24:B.CE2_#351 -5.360502767899269 12.997560312224703 -1.5791397406745107 ; 351 C [PHE]24:B.CZ_#352 -4.44223232532239 12.992318085566964 -0.4803509013840239 ; 352 N [PHE]25:B.N_#353 -7.275297815083972 17.406978348348236 1.7003583169534302 ; 353 C [PHE]25:B.CA_#354 -6.306097212668388 18.118564069573385 2.5651368745193346 ; 354 C [PHE]25:B.C_#355 -5.958987701922676 17.17896266971291 3.6720574664906467 ; 355 O [PHE]25:B.O_#356 -6.766399581640451 16.527819954250205 4.368796456780742 ; 356 C [PHE]25:B.CB_#357 -6.855637078283902 19.510982359924903 2.9273098177299435 ; 357 C [PHE]25:B.CG_#358 -8.04334560376303 19.529257665936782 3.826868860647286 ; 358 C [PHE]25:B.CD1_#359 -7.853589386045765 19.568300740750292 5.205857336359373 ; 359 C [PHE]25:B.CD2_#360 -9.324937201671768 19.50371683896523 3.3130365511071576 ; 360 C [PHE]25:B.CE1_#361 -8.956975596798875 19.55913258053008 6.061705929720417 ; 361 C [PHE]25:B.CE2_#362 -10.450988098944043 19.52565691302421 4.151432644789967 ; 362 C [PHE]25:B.CZ_#363 -10.25882439567237 19.534902420756627 5.556175906646628 ; 363 N [TYR]26:B.N_#364 -4.654246727507314 17.058393569450395 3.901924997350367 ; 364 C [TYR]26:B.CA_#365 -4.081729336054021 16.271147058830906 4.927235081179132 ; 365 C [TYR]26:B.C_#366 -3.2538863377007514 17.105214149179513 5.887644920193123 ; 366 O [TYR]26:B.O_#367 -2.1769823847936216 17.547803169993067 5.561586896417753 ; 367 C [TYR]26:B.CB_#368 -3.347074098818875 15.022044818632493 4.387650726389004 ; 368 C [TYR]26:B.CG_#369 -2.7687451538757326 14.215609686115933 5.504486886478724 ; 369 C [TYR]26:B.CD1_#370 -3.6311941774210688 13.376985272892133 6.237219290109641 ; 370 C [TYR]26:B.CD2_#371 -1.383882219148603 14.172216006085506 5.721453797671154 ; 371 C [TYR]26:B.CE1_#372 -3.119780139807581 12.657793985413937 7.32612864085805 ; 372 C [TYR]26:B.CE2_#373 -0.8871288537436044 13.385128798373465 6.7621842245420485 ; 373 C [TYR]26:B.CZ_#374 -1.751341713661338 12.615598302738357 7.516080735371217 ; 374 O [TYR]26:B.OH_#375 -1.2200331272937142 11.861493632754357 8.525345483968113 ; 375 N [THR]27:B.N_#376 -3.818716244718339 17.309748412642605 7.050824575795867 ; 376 C [THR]27:B.CA_#377 -3.266589952377597 18.16661790791765 8.127571633081452 ; 377 C [THR]27:B.C_#378 -3.3054454632648174 17.42233855857174 9.455085286273363 ; 378 O [THR]27:B.O_#379 -4.220923670552806 17.53275560980239 10.27284241817641 ; 379 C [THR]27:B.CB_#380 -4.039828817478281 19.566112815012648 7.939921260012365 ; 380 O [THR]27:B.OG1_#381 -5.461486031594367 19.301690267988466 7.977835402188196 ; 381 C [THR]27:B.CG2_#382 -3.8426839132884805 20.33451261534274 6.618295884346223 ; 382 N [PRO]28:B.N_#383 -2.3053176377689226 16.599329420896158 9.728802826762358 ; 383 C [PRO]28:B.CA_#384 -2.186314572169766 15.756092396310766 10.914605335929204 ; 384 C [PRO]28:B.C_#385 -1.9913164543515771 16.56035141465475 12.180642130599779 ; 385 O [PRO]28:B.O_#386 -2.2240881355862587 16.013868279317702 13.280574640896372 ; 386 C [PRO]28:B.CB_#387 -1.0351088406034528 14.807372663332073 10.615008553794109 ; 387 C [PRO]28:B.CG_#388 -0.1893865837378499 15.61147610519965 9.659856461706744 ; 388 C [PRO]28:B.CD_#389 -1.174531720825442 16.365231569402795 8.80886130363793 ; 389 N [LYS]29:B.N_#390 -1.5802661566510654 17.79652153789941 11.985698345990947 ; 390 C [LYS]29:B.CA_#391 -1.3715324836264173 18.690778733494067 13.137102411414034 ; 391 C [LYS]29:B.C_#392 -2.5130264808060483 18.45488777484397 14.136068331768683 ; 392 O [LYS]29:B.O_#393 -3.661078041351466 18.893689567038166 13.920774110999993 ; 393 C [LYS]29:B.CB_#394 -1.3381154453018738 20.17233783780133 12.757460577583954 ; 394 N [THR]30:B.N_#395 -2.13754894551011 17.753552600638805 15.19858778754853 ; 395 C [THR]30:B.CA_#396 -3.099412896694888 17.41133069924575 16.266711333594646 ; 396 C [THR]30:B.C_#397 -3.9828867764529 18.60930399854782 16.616030497032096 ; 397 O [THR]30:B.O_#398 -3.65897311844296 19.34443766221159 17.59155314602745 ; 398 C [THR]30:B.CB_#399 -2.405253347640282 16.727239016502892 17.49737785627995 ; 399 O [THR]30:B.OXT_#400 -4.978118356470867 18.792488893434154 15.872536451043551 ; 799 Zn [ZN]31:B.ZN_#803 1.0216457368252474 -0.5663746494104256 6.685724373161559 ; 800 Cl [CL]32:B.CL_#804 0.9050265240614088 -0.9332038130097047 8.96647103247017 ; 804 O [HOH]25:A.O_#808 -1.7822883583829245 10.29685512487227 17.729195949657214 ; 805 O [HOH]26:A.O_#809 -18.812555607592024 5.886922059450515 14.575174266311336 ; 806 O [HOH]32:A.O_#810 -11.369480884611397 16.93102261106514 12.625798039424218 ; 807 O [HOH]33:A.O_#811 -5.0908124865928865 15.111976304547786 12.584292829277508 ; 808 O [HOH]38:A.O_#812 -7.27809503813431 17.221909006941534 9.838345446115937 ; 809 O [HOH]39:A.O_#813 -9.32464385154051 19.429973334099092 9.78662618974165 ; 810 O [HOH]47:A.O_#814 -16.23961935627411 18.087609319313337 -0.725496746218659 ; 811 O [HOH]59:A.O_#815 -12.5125238273388 2.660916925233778 18.26767862538888 ; 812 O [HOH]60:A.O_#816 -10.483891297865673 3.814936431525352 20.416951767514387 ; 813 O [HOH]67:A.O_#817 -18.772093266361818 3.7276652130469436 6.023520527402028 ; 814 O [HOH]68:A.O_#818 -14.901504036772977 13.634995907933373 10.119029716495877 ; 815 O [HOH]71:A.O_#819 -23.02173920309119 11.894635049792257 -0.5004787903578922 ; 816 O [HOH]72:A.O_#820 -14.287731231496252 9.320806074973497 14.608369648901135 ; 817 O [HOH]90:A.O_#821 -21.15004137789031 8.948977269978561 -0.6949871330102662 ; 818 O [HOH]91:A.O_#822 -21.0817431245908 9.042578937601899 10.22355334071673 ; 819 O [HOH]101:A.O_#823 -14.032542791778301 17.21866581387126 15.039809569321289 ; 820 O [HOH]105:A.O_#824 -24.306808902392923 9.60556751222281 4.6606645593643705 ; 821 O [HOH]106:A.O_#825 -25.416823822129516 11.955052789851894 7.902519862761851 ; 822 O [HOH]107:A.O_#826 -13.627999535662337 12.84274850801356 16.045229623938365 ; 823 O [HOH]112:A.O_#827 -4.5242184353618695 10.888741215999254 18.365695995288522 ; 824 O [HOH]115:A.O_#828 -16.80365799252243 11.089719354613406 15.984244767604096 ; 825 O [HOH]119:A.O_#829 -15.827187336557117 17.67369358488868 1.5797988083486647 ; 826 O [HOH]122:A.O_#830 -2.3922836626785804 13.784922906867866 16.538018852437162 ; 827 O [HOH]33:B.O_#831 0.9803815348616869 0.765186221395723 8.851015788415936 ; 828 O [HOH]34:B.O_#832 1.3133702353343573 0.35125334046655254 0.9804065302045162 ; 829 O [HOH]35:B.O_#833 1.0100241013761178 2.8022571750756775 2.3124017725924 ; 830 O [HOH]36:B.O_#834 0.6241925356936715 -1.8165753829396625 14.458800860550141 ; 831 O [HOH]37:B.O_#835 -7.997716674701431 12.737723024486312 -4.552779832156677 ; 832 O [HOH]38:B.O_#836 -11.500016385357926 7.661348178795402 -7.309893932583439 ; 833 O [HOH]39:B.O_#837 -8.974466245650174 9.3512506325964 -7.4140005532159385 ; 834 O [HOH]40:B.O_#838 -19.52677813539824 6.566545047756272 -10.246169790257024 ; 835 O [HOH]41:B.O_#839 -19.77871952143743 -6.5658866355284395 -13.754526189179554 ; 836 O [HOH]42:B.O_#840 -18.405430948642632 9.880275993918584 -10.940778819280919 ; 837 O [HOH]43:B.O_#841 -16.935862206326025 -6.246936833259685 -15.434027993153073 ; 838 O [HOH]44:B.O_#842 -15.117022135230288 16.567480584884564 -10.843063751683403 ; 839 O [HOH]45:B.O_#843 -20.176980212125972 2.235650012624051 -15.701885183684919 ; 840 O [HOH]46:B.O_#844 -17.158456283977237 13.5278584983745 -11.855171546105534 ; 841 O [HOH]47:B.O_#845 -21.1962280829692 -7.39467127068524 -16.630540533113212 ; 842 O [HOH]48:B.O_#846 -19.37758507412815 -3.7717705518460107 -17.147482491003828 ; 843 O [HOH]49:B.O_#847 -18.20839923562125 -3.023254716638176 -22.985226449030602 ; 844 O [HOH]50:B.O_#848 -16.59666185582149 -5.5668458918466435 14.42327430349836 ; 845 O [HOH]51:B.O_#849 -12.892598196219605 -5.1408636506334595 13.167071081170189 ; 846 O [HOH]52:B.O_#850 -6.413429562233841 -5.58218079019748 14.058179937989642 ; 847 O [HOH]53:B.O_#851 -11.786824800369603 -2.3016546904129864 15.284634227155259 ; 848 O [HOH]54:B.O_#852 -16.890676617753595 3.422153128308329 11.072329670201793 ; 849 O [HOH]55:B.O_#853 -17.013276462691294 -4.06342545037805 11.645975571723705 ; 850 O [HOH]56:B.O_#854 0.7739567806915257 5.480567294942958 12.658535210834994 ; 851 O [HOH]57:B.O_#855 -10.980105403959303 4.860952257281735 10.229771664405327 ; 852 O [HOH]58:B.O_#856 -14.153988915857227 20.812689811203796 -14.14934559737625 ; 853 O [HOH]59:B.O_#857 -2.0659620494553375 9.200640468239722 9.935359560331516 ; 854 O [HOH]60:B.O_#858 -4.134207274022492 1.682440987765066 8.95912226190153 ; 855 O [HOH]61:B.O_#859 -6.701034817680865 16.279777229737533 7.127218334313049 ; 856 O [HOH]62:B.O_#860 -18.126786294602375 -2.590981322001241 3.07382175001436 ; 857 O [HOH]63:B.O_#861 -19.130551195880138 -2.4625250330378474 -0.5022811574518995 ; 858 O [HOH]64:B.O_#862 -17.931768672387534 1.1394488013614232 0.49431051302893003 ; 859 O [HOH]65:B.O_#863 -3.8758011034096302 -1.5849633561297534 5.562595932769592 ; 860 O [HOH]66:B.O_#864 -5.597096527862737 0.07858783947542136 6.028131625662628 ; 861 O [HOH]67:B.O_#865 -14.843858854264248 7.722700460783596 -5.674958936740072 ; 862 O [HOH]68:B.O_#866 -12.714709608292583 17.240577231971375 -11.512527288105442 ; 863 O [HOH]69:B.O_#867 4.998831111494427 5.708389307690797 14.82691733108739 ; 864 O [HOH]70:B.O_#868 -16.165272122735008 9.685373887419958 -7.1458243263270695 ; 865 O [HOH]71:B.O_#869 -3.529973772508021 -0.9321491621324025 8.370722547670901 ; 866 O [HOH]72:B.O_#870 -14.79196682805144 -3.8624369171462636 14.744048217186606 ; 867 O [HOH]73:B.O_#871 -5.746261974485775 2.5337565051625486 2.8060573725514626 ; 868 O [HOH]74:B.O_#872 -17.155856601655298 -8.940752318455328 17.33155122647535 ; 869 O [HOH]75:B.O_#873 1.5730170637254837 12.371129638268071 9.265312221282475 ; 870 O [HOH]76:B.O_#874 -17.914136640382964 0.2697840984420683 7.410720449979144 ; 871 O [HOH]77:B.O_#875 -14.041692033002457 -4.038377634484213 8.054694242706192 ; 872 O [HOH]78:B.O_#876 -9.269771473685704 -4.180454640230906 10.044503856716581 ; 873 O [HOH]79:B.O_#877 -15.263198735705036 16.687640816871703 -15.610861033460644 ; 874 O [HOH]80:B.O_#878 -19.338982173191226 14.47593561275467 -4.568138567474502 ; 875 O [HOH]81:B.O_#879 -5.849619735315786 18.054328190217383 14.29553768030911 ; 876 O [HOH]82:B.O_#880 -5.465682850335752 19.621580164910853 21.404584220891838 ; 877 O [HOH]83:B.O_#881 -2.752841211910721 2.3660497211613745 1.5072746452315373 ; 878 O [HOH]84:B.O_#882 -5.7551039367137005 20.08759261570694 11.924707964818506 ; 879 O [HOH]85:B.O_#883 -20.54978938120165 4.987337578889382 12.45028519199154 ; 880 O [HOH]86:B.O_#884 -23.29498709388109 3.9863332925618638 14.826252560676032 ; 881 O [HOH]87:B.O_#885 -12.495024877918604 2.342728996686734 8.77168229909977 ; 882 O [HOH]88:B.O_#886 -16.13054456008189 2.711101823709342 6.912885080220111 ; 883 O [HOH]89:B.O_#887 -15.436075500317695 12.264797054619017 -5.220123827710534 ; 884 O [HOH]90:B.O_#888 -20.614832783344752 12.571267384959652 -11.748663629236987 ; 885 O [HOH]91:B.O_#889 0.5298152238194493 20.122852003142853 19.38622563357471 ; end "coord set"; } function _setModelState() { calculate hbonds; select all; wireframe off; spacefill off; dots off; backbone off; trace off; ribbon off; cartoon off; strands off; rocket off; meshribbon off; isosurface off; halos off; color cpk; hbonds off; select ({802}); Spacefill 2.27; select ({798 800}); Spacefill 1.39; select ({0:398 798 799 803:884}); color atoms opaque [x0000ff]; select ({799 801}); Spacefill 1.97; select ({399:797 800:802 885:925}); color atoms opaque [xffd700]; select ({0:797 803:925}); Spacefill 0; select BONDS ({0:2 4:6}); color bonds opaque [xffff30]; select BONDS ({0:827}); wireframe 0; Backbone ({0:153 163:392 399:557 567:793}); Backbone 0.3; hover "%U"; frank on; font frank 16 SansSerif Plain; select *; set fontScaling false; } function _setPerspectiveState() { if (reloadfile) { set perspectiveModel 11; } set scaleAngstromsPerInch 0; set perspectiveDepth true; set visualRange 5; set cameraDepth 3; boundbox corners {-22.556000000000004 -1.806000000000001 -21.241} {25.424 24.493 22.701} # volume = 55447.15897084; if (reloadfile) { center {-8.784724866794999 10.050064417659302 6.017206797576853}; } # removed moveto -1.0 { -507 -698 -506 142.82} 100.0 0.0 0.0 {-9.302 11.049 4.966} 25.429002043912426 {0 0 0} 0 0 0 3.0 0.0 0.0; # removed save orientation ""; # removed moveto -1.0 {0 0 1 0} 100.0 0.0 0.0 {1.4339999999999993 11.343499999999999 0.7300000000000004} 30.55641301773316 {0 0 0} 0 0 0 3.0 0.0 0.0; # removed save orientation "default"; slab 100;depth 0; set slabRange 0.0; set spinX = 0; set spinY = 5; set spinZ = 0; spinFps = 20; spin axisangle {0.0 1.0 0.0} 10.0; } function _setSelectionState() { hide ({798:925}); select ({399:797 800:802 885:925}); set hideNotSelected false; } function _setState() { # # initialize; # update caption ppdiaCaptionCmd = "changeCaption('Comparison of two conformations of insulin, R and T (PDB ID 4trz). The alpha-carbon trace of one conformation is shown in blue (chains A and B), the other in gold (chains C and D). The largest differences are at the N-terminus of the B (or D) chain.','white','black');"; javascript @ppdiaCaptionCmd; select all; labels off; measurements off; set refreshing false; _setWindowState; _setFileState; _setParameterState; _setDataState; _setModelState; _setPerspectiveState; _setSelectionState; set refreshing false; SelectionHalos OFF; delay 1.0; moveto 1.0 { -973 57 -222 86.66} 201.14 0.0 0.0 {-8.784724866794999 10.050064417659302 6.017206797576853} 34.8770627321335 {0 0 0} 0 0 0 3.0 0.0 0.0;; set refreshing true; if (antialiasDisplayFlag) { antialiasDisplay = true } else { antialiasDisplay = false }; set antialiasTranslucent true; set antialiasImages true; spin on; } _setState;