# This file was created Wed Jan 7 16:00:56 2015 # by the following command: # g_mindist -s dynamic.tpr -f dynamic_pbc.xtc -od mindist_PW.xvg -on mindistnum_PW.xvg -or mindistres_PW.xvg -printresname -respertime -tu us # # g_mindist is part of G R O M A C S: # # GROningen Mixture of Alchemy and Childrens' Stories # @ title "Minimum Distance" @ xaxis label "Time (us)" @ yaxis label "Distance (nm)" @TYPE xy @ view 0.15, 0.15, 0.75, 0.85 @ legend on @ legend box on @ legend loctype view @ legend 0.78, 0.8 @ legend length 2 @ s0 legend "Protein-PW" # LYS0 MET1 LYS2 ALA3 VAL4 MET5 ILE6 GLY7 ALA8 CYS9 PHE10 LEU11 ILE12 LEU13 PHE14 MET15 PHE16 PHE17 GLU18 0.000000e+00 0.256831 0.488257 0.222886 0.915182 0.863926 0.785574 1.05768 1.41835 1.45741 1.37316 0.958087 0.973253 0.831257 0.819269 0.458721 0.468977 0.493221 0.454061 0.238 1.000000e+03 0.253294 0.421494 0.51982 1.00002 1.01748 1.00017 1.21411 1.40299 1.38895 1.34604 0.922194 0.830013 0.882092 0.833298 0.505372 0.472427 0.450362 0.44968 0.216587 2.000000e+03 0.235257 0.614741 0.270248 0.885342 0.987092 1.22642 1.21446 1.45929 1.34239 1.31038 1.05212 0.936866 0.792356 0.844937 0.499443 0.408878 0.464162 0.433264 0.265884 3.000000e+03 0.232717 0.549599 0.229482 0.892521 0.986725 0.512886 0.938983 1.23195 1.15121 1.04511 0.892942 0.488483 0.807693 0.825975 0.373643 0.510204 0.484138 0.44187 0.289254 4.000000e+03 0.2927 0.447014 0.254029 0.841018 0.82334 0.894826 0.881427 1.35484 1.40312 1.23594 0.868991 1.17418 0.911659 0.895346 0.829297 0.457245 0.362437 0.369574 0.248554 5.000000e+03 0.23195 0.679069 0.53993 0.980521 0.884707 0.422002 0.995037 1.16484 1.12858 1.12745 0.90199 0.586294 0.73317 0.74159 0.43663 0.424041 0.514461 0.477964 0.254728 6.000000e+03 0.223888 0.507911 0.474884 0.719913 0.557884 0.415577 0.81207 0.993292 0.969939 0.889241 1.11626 0.982357 0.930762 0.813827 0.47412 0.475119 0.425513 0.461243 0.290472 7.000000e+03 0.286086 0.466551 0.48145 0.931067 0.950651 0.882664 1.15684 1.35929 1.28249 1.25924 1.03562 0.941769 0.756806 0.803427 0.501755 0.42809 0.470393 0.526036 0.298349 8.000000e+03 0.246221 0.474342 0.266627 0.571728 0.766902 0.969485 1.00574 1.04902 1.29015 1.26444 1.03004 0.920791 0.87032 0.721804 0.469363 0.476555 0.411492 0.3553 0.243397 9.000000e+03 0.199975 0.401379 0.236044 0.83145 0.849384 0.4892 1.032 1.31902 1.21555 1.25942 1.01648 0.96668 0.677021 0.82428 0.529906 0.46452 0.434047 0.492298 0.294284 1.000000e+04 0.20509 0.502102 0.262461 0.768189 0.918417 0.916518 0.962079 1.339 1.43922 1.45991 0.909678 0.793183 1.00307 0.894274 0.514403 0.537061 0.530977 0.484461 0.242582 1.100000e+04 0.231487 0.66668 0.417053 0.896324 1.09371 1.29599 1.35189 1.37306 1.57042 1.4253 1.18502 1.05392 1.01108 0.866158 0.594581 0.51522 0.620201 0.39558 0.225336 1.200000e+04 0.204101 0.679536 0.447502 0.855243 1.09036 1.23213 1.29435 1.37621 1.43139 1.29081 0.854552 0.928705 0.965138 0.793225 0.383711 0.489495 0.547048 0.394223 0.326021 1.300000e+04 0.22394 0.415575 0.275067 0.741464 0.905827 0.865514 1.00718 1.34202 1.39565 1.35495 0.914036 0.934417 0.96393 0.793863 0.468669 0.536097 0.447435 0.3545 0.248093 1.400000e+04 0.263274 0.412924 0.50192 0.846776 0.506176 0.890309 1.16898 1.15725 1.13852 1.32784 0.751854 1.02413 1.00069 0.862431 0.465506 0.51604 0.479808 0.423514 0.305689 1.500000e+04 0.277803 0.534592 0.281103 0.840312 0.939858 0.989669 1.15663 1.33589 1.44362 1.36773 0.798808 0.979968 0.943519 0.799616 0.516757 0.539579 0.472801 0.471768 0.250352 1.600000e+04 0.217258 0.370822 0.487079 0.6521 0.495849 0.7228 1.01747 1.12674 1.21565 1.35294 0.857225 1.19329 1.17558 0.928314 0.515039 0.760764 0.666027 0.407437 0.343283 1.700000e+04 0.221145 0.448698 0.268972 0.530778 0.752981 0.948669 0.973157 1.15008 1.34233 1.3663 0.838286 0.988969 0.958506 0.815817 0.533806 0.524095 0.668501 0.447653 0.277207 1.800000e+04 0.237573 0.424686 0.264396 0.59764 0.802996 0.960628 0.932723 1.19696 1.38743 1.2303 1.0413 0.80921 0.914736 0.863672 0.452443 0.445727 0.352678 0.472549 0.213528 1.900000e+04 0.262659 0.447537 0.304969 0.581396 0.796169 0.955651 0.998186 1.20033 1.39957 1.50804 1.17299 1.11863 0.809902 1.0246 0.800962 0.511349 0.571734 0.511779 0.355339 2.000000e+04 0.213249 0.536226 0.306689 0.650086 0.898026 0.949046 0.947623 1.24768 1.42763 1.55802 1.38812 1.29674 1.2434 1.08429 0.946977 0.806564 0.581055 0.453582 0.348921 2.100000e+04 0.206224 0.429904 0.186842 0.494547 0.722765 0.926873 0.862943 1.09893 1.32362 1.41258 1.19137 1.11192 0.828501 0.616716 0.837573 0.59635 0.404746 0.590296 0.275051 2.200000e+04 0.254162 0.406869 0.218589 0.403467 0.523406 0.834629 0.728893 0.924772 1.1383 1.36588 1.10144 1.16614 1.32734 1.15314 0.80291 0.827871 0.559623 0.648535 0.246175 2.300000e+04 0.348891 0.652029 0.272543 1.10901 1.06499 0.830437 1.25723 1.37592 1.30327 1.27007 1.0495 0.802995 0.894971 0.925627 0.661415 0.432941 0.502543 0.46593 0.21568 2.400000e+04 0.215504 0.528913 0.278593 0.744076 0.9135 0.990013 1.12206 1.37896 1.43563 1.34287 0.839124 0.953143 0.887246 0.858615 0.44371 0.391869 0.551851 0.477068 0.341107 2.500000e+04 0.264248 0.525236 0.359203 0.861462 1.01074 0.948405 1.09336 1.49638 1.6079 1.4527 0.937975 1.19897 1.10653 0.985481 0.470197 0.442327 0.636745 0.413352 0.284236 2.600000e+04 0.222162 0.414951 0.341201 0.932325 0.889691 0.914166 1.05495 1.3439 1.36514 1.38531 0.962487 1.00352 0.988617 0.843755 0.519948 0.503264 0.43854 0.372329 0.305331 2.700000e+04 0.229087 0.465129 0.237447 0.570517 0.492696 0.889485 1.04922 1.03668 1.14127 1.24113 0.823604 0.886226 1.01159 0.566817 0.409303 0.515346 0.402086 0.435314 0.331305 2.800000e+04 0.212749 0.51108 0.242695 0.701491 0.913324 1.07423 0.93064 1.34783 1.52072 1.43861 1.30258 1.09056 0.960661 0.914915 0.677823 0.471744 0.499353 0.464596 0.199402 2.900000e+04 0.257537 0.501336 0.225519 0.947298 0.94304 1.05514 1.20829 1.47451 1.34112 1.33002 1.17544 0.973974 0.79958 0.853663 0.499789 0.494976 0.397671 0.48224 0.264108 3.000000e+04 0.322777 0.49439 0.204658 0.947122 0.969116 0.890182 1.09599 1.41313 1.41777 1.19103 1.13557 0.94666 0.87314 0.872674 0.579628 0.477633 0.415738 0.564642 0.226144 3.100000e+04 0.206228 0.528152 0.273009 0.913541 0.777268 1.01356 1.10076 1.4224 1.47949 1.45652 1.41254 1.13945 0.985902 0.92372 0.40447 0.626085 0.453334 0.449445 0.227662 3.200000e+04 0.276205 0.498833 0.223349 0.926072 0.986453 0.580487 0.933682 1.36375 1.44806 1.36841 1.29381 0.944234 0.89045 0.885292 0.448492 0.546543 0.496279 0.417575 0.241051 3.300000e+04 0.195348 0.377351 0.353945 0.719429 0.792301 0.599797 0.949318 1.21381 1.27595 1.29291 1.1094 0.929123 0.93292 0.80163 0.501368 0.491387 0.438571 0.402119 0.396422 3.400000e+04 0.283515 0.640965 0.269553 1.00114 1.09373 0.842452 1.10645 1.47269 1.41318 1.30893 1.07581 0.896362 0.876178 0.756388 0.376585 0.396165 0.454371 0.340717 0.241878 3.500000e+04 0.242615 0.649298 0.20928 0.939123 1.09805 1.16631 1.12122 1.53317 1.46048 1.1542 1.11651 0.865252 0.936588 0.795169 0.4557 0.500438 0.444366 0.42058 0.266542 3.600000e+04 0.225996 0.445326 0.264036 0.503835 0.741429 0.905162 0.892247 1.12335 1.359 1.28801 1.01842 0.918434 0.873684 0.826348 0.502817 0.469311 0.416496 0.379098 0.283926 3.700000e+04 0.230454 0.423268 0.20678 0.893253 0.811928 0.90928 1.22666 1.31355 1.43436 1.51447 1.34644 1.12546 1.02106 0.946367 0.74662 0.509389 0.496385 0.389515 0.273805 3.800000e+04 0.253008 0.676099 0.215717 0.912627 1.04445 1.04033 1.00482 1.35305 1.55269 1.51226 1.16503 1.1564 1.01356 0.927855 0.774874 0.556987 0.467381 0.405291 0.246646 3.900000e+04 0.236055 0.549177 0.232796 0.766021 0.990687 1.08452 0.994016 1.38459 1.5694 1.39121 1.40771 1.25228 1.01652 0.997537 0.754312 0.441186 0.396244 0.399185 0.221217 4.000000e+04 0.331572 0.425503 0.214059 0.722922 0.871718 0.670216 0.779604 1.2886 1.37087 1.28332 1.12885 0.917926 0.746499 0.916505 0.51838 0.3686 0.35657 0.405044 0.235722 4.100000e+04 0.199213 0.491921 0.327442 0.889873 0.88258 0.452197 0.987843 1.28581 1.33102 1.31826 1.16262 0.992311 0.914078 0.771221 0.506234 0.373881 0.504779 0.414191 0.301481 4.200000e+04 0.283949 0.524494 0.25172 0.941442 0.925924 0.713726 1.1654 1.37657 1.40755 1.28257 0.749742 0.919096 0.854986 0.760716 0.386872 0.506061 0.472596 0.361703 0.327623 4.300000e+04 0.233724 0.487448 0.298037 0.87081 0.931024 0.718717 1.03243 1.41267 1.36671 1.3019 1.03176 1.2082 1.0247 0.883007 0.484158 0.496029 0.494936 0.444776 0.239011 4.400000e+04 0.226119 0.588958 0.243938 0.868498 1.02442 1.06319 1.02918 1.45814 1.47675 1.39699 1.09277 0.993723 1.01518 0.850724 0.458564 0.564172 0.648687 0.476759 0.204797 4.500000e+04 0.217984 0.721267 0.209413 0.860085 1.11445 1.1437 1.25474 1.32204 1.37788 1.26392 0.523323 0.826021 0.909026 0.796647 0.455017 0.429329 0.42494 0.40518 0.345863 4.600000e+04 0.22335 0.778318 0.287936 0.972566 1.0428 0.812347 1.24458 1.42992 1.43767 1.35902 0.709334 0.975896 0.915922 0.825396 0.50909 0.481731 0.4235 0.410845 0.221551 4.700000e+04 0.282763 0.73564 0.359881 1.11935 1.20951 1.2746 1.16303 1.50616 1.4608 1.25557 0.906802 0.934463 0.896416 0.856165 0.437692 0.500793 0.38107 0.452204 0.259449 4.800000e+04 0.228843 0.416552 0.226594 0.886072 0.821896 0.56337 0.981249 1.3113 1.34203 1.29185 0.895425 0.800393 0.929482 0.780121 0.499619 0.495494 0.396795 0.364812 0.285708 4.900000e+04 0.31254 0.745284 0.339229 1.02536 1.24349 1.19709 1.00719 1.52493 1.51865 1.3927 1.17896 1.02439 0.931795 0.761413 0.483952 0.494678 0.471187 0.352439 0.200267 5.000000e+04 0.190906 0.76746 0.18636 0.934281 1.19541 0.912192 1.07647 1.55359 1.32557 1.26185 0.981504 0.96066 0.593624 0.921193 0.500325 0.500827 0.502572 0.44398 0.214367 5.100000e+04 0.253472 0.629693 0.287877 0.953768 0.947148 1.21707 1.40229 1.36409 1.46585 1.32626 0.918331 0.987161 0.64537 0.91084 0.77135 0.418651 0.471408 0.420955 0.3883 5.200000e+04 0.217699 0.642156 0.204612 0.903817 1.08999 1.06963 1.01303 1.45424 1.52366 1.41331 0.89053 1.00717 1.03859 0.880589 0.555745 0.534334 0.52586 0.457805 0.293593 5.300000e+04 0.281444 0.388646 0.423454 0.837139 0.834556 0.518861 1.00445 1.25594 1.23053 1.2271 0.963022 0.566118 0.867572 0.862948 0.474473 0.481716 0.779752 0.468258 0.262764 5.400000e+04 0.251436 0.520211 0.388986 0.931522 0.953415 0.943747 1.05955 1.24771 1.27082 1.19022 0.852557 0.793182 0.8473 0.79463 0.46686 0.467078 0.413478 0.510056 0.249016 5.500000e+04 0.208024 0.352331 0.281057 0.743476 0.785192 0.680971 1.03065 1.23393 1.30133 1.36239 1.04686 0.945001 0.882565 0.808615 0.436556 0.411444 0.485161 0.393483 0.217672 5.600000e+04 0.214532 0.50924 0.245815 0.848314 0.86444 0.501603 0.986843 1.24694 1.31682 1.2268 1.2674 1.14598 0.893681 0.900756 0.480834 0.627383 0.441555 0.42378 0.230688 5.700000e+04 0.502578 0.484497 0.232088 0.817438 0.855214 0.50891 0.906639 1.24666 1.29749 1.33888 1.28128 1.19354 0.880408 0.978086 0.513472 0.474145 0.512305 0.442976 0.325371 5.800000e+04 0.216372 0.595062 0.638155 0.916838 1.08843 1.31105 1.40974 1.52368 1.56548 1.38518 1.25032 0.937066 0.97198 0.825677 0.452789 0.477625 0.471196 0.337774 0.331293 5.900000e+04 0.218783 0.586073 0.283785 0.977083 0.882307 0.986888 0.932139 1.4323 1.49878 1.23663 1.07368 0.987794 0.802105 0.893378 0.54667 0.510351 0.409519 0.421977 0.248918 6.000000e+04 0.235951 0.442205 0.394816 0.787201 0.746995 0.536837 0.754462 1.20004 1.3038 1.12274 1.21449 1.20066 0.866617 0.862811 0.410348 0.628587 0.370494 0.408796 0.283299 6.100000e+04 0.266925 0.670661 0.468023 0.884324 1.0679 1.19412 1.35637 1.44941 1.47951 1.24307 1.14941 1.08317 0.841411 0.643961 0.499534 0.39776 0.356999 0.384258 0.333332 6.200000e+04 0.269158 0.806768 0.257202 0.859626 0.933288 1.26074 1.35521 1.34946 1.3955 0.98383 1.16922 1.09733 0.889583 0.483902 0.460113 0.349716 0.445831 0.44487 0.287618 6.300000e+04 0.204803 0.376271 0.250882 0.493573 0.746475 0.523611 0.626081 1.15923 1.28139 1.22228 1.14993 1.28911 0.955268 1.00044 0.435528 0.612695 0.398192 0.480369 0.210243 6.400000e+04 0.246278 0.469238 0.374946 0.910766 0.748506 0.99698 1.23748 1.391 1.43115 1.37271 1.08619 1.04506 0.865202 0.836768 0.570373 0.470491 0.369291 0.464285 0.379983 6.500000e+04 0.324211 0.48378 0.313925 0.781827 0.736265 0.978427 1.12284 1.34695 1.49198 1.23086 0.856305 1.22596 0.960319 0.816733 0.406916 0.676709 0.372135 0.408375 0.202815 6.600000e+04 0.254759 0.731028 0.195972 0.857621 0.951545 1.25219 1.37166 1.4469 1.47543 1.07539 0.845774 1.18871 1.00388 0.646447 0.797271 0.559712 0.466567 0.381828 0.250266 6.700000e+04 0.210062 0.400081 0.272927 0.644362 0.804046 0.844225 0.898116 1.18898 1.33244 1.24398 1.02738 1.03738 0.856293 0.792366 0.708285 0.49136 0.388218 0.445084 0.2717 6.800000e+04 0.217279 0.494002 0.291618 0.679381 0.887982 0.920709 0.806154 1.14063 1.33834 1.29359 0.997978 0.916467 0.615684 0.823304 0.386889 0.420364 0.387118 0.460031 0.235858 6.900000e+04 0.228077 0.474684 0.275002 0.917225 0.865509 0.84358 0.953795 1.32914 1.31181 1.16064 0.703603 0.804632 0.838241 0.667097 0.366909 0.44375 0.449633 0.467598 0.260425 7.000000e+04 0.22456 0.489062 0.422596 0.933536 0.912974 1.02266 1.29 1.34384 1.23031 1.18984 0.962169 0.740625 0.764477 0.753296 0.465516 0.368722 0.539914 0.419788 0.356702 7.100000e+04 0.239092 0.669257 0.241589 0.963889 0.964541 0.829907 1.22586 1.55158 1.58867 1.22228 0.991293 1.27766 1.03097 0.83345 0.520067 0.742546 0.50898 0.441927 0.296521 7.200000e+04 0.247034 0.53875 0.220595 0.519467 0.776949 0.955522 0.940937 1.15452 1.34816 1.35084 0.817746 1.13166 0.990825 0.811326 0.464884 0.564336 0.398709 0.363692 0.203661 7.300000e+04 0.239069 0.626845 0.292494 1.00325 1.03476 0.889344 1.18888 1.52623 1.49672 1.36076 0.717605 0.91953 0.958885 0.774372 0.465879 0.468663 0.484134 0.372641 0.222753 7.400000e+04 0.221856 0.692654 0.503599 0.846129 0.861763 1.18766 1.34539 1.33587 1.51657 1.42122 0.922734 1.03252 1.02085 0.864112 0.456984 0.558322 0.524898 0.442061 0.22267 7.500000e+04 0.185464 0.411768 0.283397 0.821027 0.765774 1.02726 1.24195 1.23986 1.36848 1.21567 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