P03875 y-mtPTM: Yeast Mitochondrial PTM Database

Basic Information

Name	Putative COX1/OXI3 intron 1 protein
Uniprot ID	P03875
Systematic gene name	Q0050
Standard gene name	AI1
Gene names	AI1 Q0050
Description from SGD	Q0050 AI1 SGDID:S000007261, Chr Mito from 13818-16322, Genome Release 64-3-1, Verified ORF, "Reverse transcriptase required for splicing of the COX1 pre-mRNA; encoded by a mobile group II intron within the mitochondrial COX1 gene"
Protein length	834
Download	sequence (fasta, from Uniprot), modifications (csv format)
Database links	Uniprot, SGD, TheCellVision.org, FungiDB

Sequence

MVQRWLYSTN AKDIAVLYFM LAIFSGMAGT AMSLIIRLEL AAPGSQYLHG
NSQLFNGAPT SAYISLMRTA LVLWIINRYL KHMTNSVGAN FTGTMACHKT
PMISVGGVKC YMVRLTNFLQ VFIRITISSY HLDMVKQVWL FYVEVIRLWF
IVLDSTGSVK KMKDTNNTKG NTKSEGSTER GNSGVDRGMV VPNTQMKMRF
LNQVRYYSVN NNLKMGKDTN IELSKDTSTS DLLEFEKLVM DNMNEENMNN
NLLSIMKNVD MLMLAYNRIK SKPGNMTPGT TLETLDGMNM MYLNKLSNEL
GTGKFKFKPM RMVNIPKPKG GMRPLSVGNP RDKIVQEVMR MILDTIFDKK
MSTHSHGFRK NMSCQTAIWE VRNMFGGSNW FIEVDLKKCF DTISHDLIIK
ELKRYISDKG FIDLVYKLLR AGYIDEKGTY HKPMLGLPQG SLISPILCNI
VMTLVDNWLE DYINLYNKGK VKKQHPTYKK LSRMIAKAKM FSTRLKLHKE
RAKGPTFIYN DPNFKRMKYV RYADDILIGV LGSKNDCKMI KRDLNNFLNS
LGLTMNEEKT LITCATETPA RFLGYNISIT PLKRMPTVTK TIRGKTIRSR
NTTRPIINAP IRDIINKLAT NGYCKHNKNG RMGVPTRVGR WTYEEPRTII
NNYKALGRGI LNYYKLATNY KRLRERIYYV LYYSCVLTLA SKYRLKTMSK
TIKKFGYNLN IIENDKLIAN FPRNTFDNIK KIENHGMFMY MSEAKVTDPF
EYIDSIKYML PTAKANFNKP CSICNSTIDV EMHHVKQLHR GMLKATKDYI
TGRMITMNRK QIPLCKQCHI KTHKNKFKNM GPGM

Structure

Structure visualized

Loading structure by GLmol written by biochem_fan. The structure was downloaded from the AlphaFold Protein Structure Database. id="glmol01_src" style="display: none;"> -6.705 -35.601 -5.531 1.00 37.88 N -7.758 -36.155 -4.645 1.00 37.88 C -7.430 -35.924 -3.168 1.00 37.88 C -8.215 -35.264 -2.502 1.00 37.88 O -8.028 -37.620 -5.000 1.00 37.88 C -9.404 -38.109 -4.548 1.00 37.88 C -9.835 -39.633 -5.418 1.00 37.88 S -11.428 -40.050 -4.665 1.00 37.88 C -6.238 -36.319 -2.697 1.00 46.33 N -5.754 -36.150 -1.304 1.00 46.33 C -5.813 -34.704 -0.781 1.00 46.33 C -6.289 -34.472 0.326 1.00 46.33 O -4.313 -36.699 -1.191 1.00 46.33 C -3.776 -36.634 0.240 1.00 46.33 C -4.240 -38.161 -1.656 1.00 46.33 C -5.446 -33.705 -1.598 1.00 48.87 N -5.583 -32.287 -1.217 1.00 48.87 C -7.027 -31.906 -0.842 1.00 48.87 C -7.235 -31.068 0.028 1.00 48.87 O -5.110 -31.378 -2.365 1.00 48.87 C -3.580 -31.260 -2.467 1.00 48.87 C -3.147 -30.305 -3.580 1.00 48.87 C -1.927 -29.818 -3.553 1.00 48.87 N -3.898 -29.994 -4.493 1.00 48.87 O -8.045 -32.526 -1.455 1.00 53.21 N -9.445 -32.230 -1.123 1.00 53.21 C -9.797 -32.737 0.274 1.00 53.21 C -10.485 -32.031 0.994 1.00 53.21 O -10.394 -32.793 -2.196 1.00 53.21 C -11.714 -32.005 -2.223 1.00 53.21 C -12.701 -32.541 -3.272 1.00 53.21 C -13.632 -33.531 -2.700 1.00 53.21 N -14.581 -34.194 -3.337 1.00 53.21 C -14.746 -34.104 -4.632 1.00 53.21 N1+ -15.386 -34.964 -2.661 1.00 53.21 N -9.305 -33.913 0.664 1.00 54.96 N -9.558 -34.494 1.986 1.00 54.96 C -8.798 -33.769 3.098 1.00 54.96 C -9.378 -33.493 4.144 1.00 54.96 O -9.225 -35.989 1.953 1.00 54.96 C -10.054 -36.831 1.027 1.00 54.96 C -11.297 -36.537 0.573 1.00 54.96 C -9.769 -38.182 0.547 1.00 54.96 C -10.891 -38.637 -0.210 1.00 54.96 C -8.703 -39.091 0.724 1.00 54.96 C -11.787 -37.591 -0.170 1.00 54.96 N -10.957 -39.922 -0.763 1.00 54.96 C -8.758 -40.385 0.170 1.00 54.96 C -9.879 -40.801 -0.570 1.00 54.96 C -7.547 -33.364 2.847 1.00 48.38 N -6.726 -32.650 3.833 1.00 48.38 C -7.254 -31.247 4.176 1.00 48.38 C -7.074 -30.786 5.302 1.00 48.38 O -5.277 -32.574 3.320 1.00 48.38 C -4.503 -33.900 3.437 1.00 48.38 C -3.184 -33.783 2.674 1.00 48.38 C -4.178 -34.245 4.893 1.00 48.38 C -7.923 -30.576 3.233 1.00 53.72 N -8.406 -29.200 3.410 1.00 53.72 C -9.938 -29.067 3.490 1.00 53.72 C -10.442 -27.944 3.564 1.00 53.72 O -7.787 -28.298 2.329 1.00 53.72 C -6.267 -28.226 2.363 1.00 53.72 C -5.609 -27.629 3.457 1.00 53.72 C -5.507 -28.743 1.298 1.00 53.72 C -4.201 -27.574 3.495 1.00 53.72 C -4.103 -28.714 1.341 1.00 53.72 C -3.446 -28.130 2.439 1.00 53.72 C -2.090 -28.097 2.451 1.00 53.72 O -10.699 -30.171 3.481 1.00 61.21 N -12.164 -30.114 3.592 1.00 61.21 C -12.627 -29.897 5.036 1.00 61.21 C -12.105 -30.479 5.988 1.00 61.21 O -12.848 -31.342 2.983 1.00 61.21 C -14.251 -31.151 2.970 1.00 61.21 O -13.649 -29.056 5.196 1.00 60.09 N -14.390 -28.841 6.450 1.00 60.09 C -15.686 -29.653 6.512 1.00 60.09 C -16.455 -29.519 7.462 1.00 60.09 O -14.701 -27.350 6.645 1.00 60.09 C -13.437 -26.522 6.872 1.00 60.09 C -15.343 -26.826 5.501 1.00 60.09 O -15.962 -30.480 5.500 1.00 67.14 N -17.169 -31.291 5.432 1.00 67.14 C -17.019 -32.553 6.295 1.00 67.14 C -16.087 -33.332 6.093 1.00 67.14 O -17.440 -31.605 3.953 1.00 67.14 C -18.803 -32.210 3.690 1.00 67.14 C -19.190 -32.276 2.440 1.00 67.14 N -19.529 -32.631 4.578 1.00 67.14 O -17.963 -32.791 7.211 1.00 67.67 N -17.967 -33.966 8.087 1.00 67.67 C -17.888 -35.293 7.307 1.00 67.67 C -17.230 -36.227 7.758 1.00 67.67 O -19.229 -33.909 8.958 1.00 67.67 C -18.482 -35.356 6.104 1.00 73.57 N -18.411 -36.543 5.234 1.00 73.57 C -16.994 -36.823 4.721 1.00 73.57 C -16.569 -37.969 4.740 1.00 73.57 O -19.391 -36.416 4.055 1.00 73.57 C -20.865 -36.453 4.494 1.00 73.57 C -21.800 -36.532 3.277 1.00 73.57 C -23.262 -36.635 3.732 1.00 73.57 C -24.187 -36.895 2.598 1.00 73.57 N1+ -16.254 -35.795 4.298 1.00 70.16 N -14.879 -35.975 3.800 1.00 70.16 C -13.921 -36.368 4.942 1.00 70.16 C -12.995 -37.148 4.735 1.00 70.16 O -14.372 -34.692 3.115 1.00 70.16 C -15.038 -34.318 1.779 1.00 70.16 C -15.237 -35.180 0.893 1.00 70.16 O -15.264 -33.100 1.581 1.00 70.16 O1- -14.172 -35.867 6.158 1.00 70.24 N -13.415 -36.226 7.364 1.00 70.24 C -13.668 -37.691 7.751 1.00 70.24 C -12.718 -38.417 8.030 1.00 70.24 O -13.760 -35.242 8.507 1.00 70.24 C -13.259 -33.818 8.170 1.00 70.24 C -13.163 -35.715 9.839 1.00 70.24 C -13.781 -32.730 9.119 1.00 70.24 C -14.925 -38.145 7.723 1.00 70.81 N -15.271 -39.539 8.007 1.00 70.81 C -14.600 -40.516 7.023 1.00 70.81 C -14.063 -41.537 7.444 1.00 70.81 O -16.798 -39.674 7.989 1.00 70.81 C -14.553 -40.171 5.730 1.00 75.56 N -13.850 -40.971 4.710 1.00 75.56 C -12.345 -41.042 4.989 1.00 75.56 C -11.751 -42.106 4.845 1.00 75.56 O -14.129 -40.422 3.297 1.00 75.56 C -13.292 -41.106 2.207 1.00 75.56 C -15.603 -40.623 2.919 1.00 75.56 C -11.721 -39.945 5.435 1.00 69.03 N -10.304 -39.947 5.811 1.00 69.03 C -10.026 -40.897 6.989 1.00 69.03 C -9.072 -41.670 6.930 1.00 69.03 O -9.866 -38.507 6.132 1.00 69.03 C -8.350 -38.357 6.363 1.00 69.03 C -7.571 -38.408 5.046 1.00 69.03 C -8.062 -37.015 7.036 1.00 69.03 C -10.868 -40.873 8.030 1.00 72.08 N -10.755 -41.802 9.161 1.00 72.08 C -10.933 -43.261 8.729 1.00 72.08 C -10.175 -44.122 9.169 1.00 72.08 O -11.775 -41.442 10.252 1.00 72.08 C -11.392 -40.238 11.089 1.00 72.08 C -10.249 -40.303 11.910 1.00 72.08 C -12.190 -39.079 11.092 1.00 72.08 C -9.881 -39.203 12.707 1.00 72.08 C -11.831 -37.982 11.901 1.00 72.08 C -10.670 -38.035 12.693 1.00 72.08 C -10.325 -36.963 13.453 1.00 72.08 O -11.881 -43.531 7.830 1.00 75.38 N -12.117 -44.871 7.293 1.00 75.38 C -10.909 -45.405 6.503 1.00 75.38 C -10.480 -46.535 6.716 1.00 75.38 O -13.390 -44.823 6.442 1.00 75.38 C -13.854 -46.181 5.967 1.00 75.38 C -13.638 -46.581 4.636 1.00 75.38 C -14.502 -47.050 6.866 1.00 75.38 C -14.086 -47.841 4.202 1.00 75.38 C -14.931 -48.316 6.435 1.00 75.38 C -14.724 -48.711 5.102 1.00 75.38 C -10.295 -44.574 5.652 1.00 73.61 N -9.098 -44.962 4.891 1.00 73.61 C -7.882 -45.215 5.793 1.00 73.61 C -7.127 -46.155 5.554 1.00 73.61 O -8.763 -43.885 3.848 1.00 73.61 C -9.802 -43.798 2.722 1.00 73.61 C -9.958 -45.263 1.664 1.00 73.61 S -8.452 -45.144 0.663 1.00 73.61 C -7.697 -44.409 6.845 1.00 71.46 N -6.629 -44.628 7.827 1.00 71.46 C -6.833 -45.930 8.616 1.00 71.46 C -5.861 -46.640 8.861 1.00 71.46 O -6.536 -43.416 8.771 1.00 71.46 C -5.858 -42.185 8.144 1.00 71.46 C -6.070 -40.965 9.043 1.00 71.46 C -4.350 -42.385 7.968 1.00 71.46 C -8.081 -46.274 8.955 1.00 72.96 N -8.405 -47.533 9.623 1.00 72.96 C -8.043 -48.752 8.753 1.00 72.96 C -7.369 -49.663 9.235 1.00 72.96 O -9.886 -47.523 10.019 1.00 72.96 C -8.390 -48.731 7.459 1.00 76.24 N -8.008 -49.790 6.506 1.00 76.24 C -6.485 -49.929 6.432 1.00 76.24 C -5.964 -51.038 6.529 1.00 76.24 O -8.616 -49.522 5.108 1.00 76.24 C -10.151 -49.674 5.174 1.00 76.24 C -8.035 -50.484 4.050 1.00 76.24 C -10.880 -49.204 3.910 1.00 76.24 C -5.760 -48.812 6.318 1.00 71.04 N -4.301 -48.843 6.209 1.00 71.04 C -3.639 -49.402 7.476 1.00 71.04 C -2.717 -50.210 7.380 1.00 71.04 O -3.785 -47.442 5.863 1.00 71.04 C -2.420 -47.463 5.205 1.00 71.04 C -1.248 -47.340 5.974 1.00 71.04 C -2.326 -47.644 3.812 1.00 71.04 C 0.012 -47.387 5.349 1.00 71.04 C -1.068 -47.690 3.188 1.00 71.04 C 0.102 -47.561 3.956 1.00 71.04 C -4.143 -49.042 8.664 1.00 69.65 N -3.666 -49.631 9.922 1.00 69.65 C -3.953 -51.131 10.025 1.00 69.65 C -3.096 -51.874 10.498 1.00 69.65 O -4.230 -48.890 11.139 1.00 69.65 C -5.642 -48.932 11.244 1.00 69.65 O -5.111 -51.587 9.529 1.00 73.92 N -5.452 -53.008 9.469 1.00 73.92 C -4.502 -53.785 8.557 1.00 73.92 C -3.927 -54.783 8.982 1.00 73.92 O -4.258 -53.278 7.344 1.00 76.23 N -3.342 -53.898 6.378 1.00 76.23 C -1.898 -53.959 6.893 1.00 76.23 C -1.249 -55.000 6.788 1.00 76.23 O -3.378 -53.138 5.046 1.00 76.23 C -4.699 -53.326 4.295 1.00 76.23 C -4.767 -52.468 2.696 1.00 76.23 S -3.576 -53.460 1.749 1.00 76.23 C -1.399 -52.872 7.490 1.00 67.86 N -0.058 -52.836 8.072 1.00 67.86 C 0.090 -53.842 9.228 1.00 67.86 C 1.092 -54.553 9.298 1.00 67.86 O 0.240 -51.401 8.521 1.00 67.86 C -0.931 -53.961 10.087 1.00 69.45 N -0.967 -54.968 11.149 1.00 69.45 C -0.924 -56.399 10.607 1.00 69.45 C -0.140 -57.216 11.089 1.00 69.45 O -1.702 -56.698 9.559 1.00 73.48 N -1.696 -58.029 8.927 1.00 73.48 C -0.373 -58.355 8.236 1.00 73.48 C 0.110 -59.477 8.363 1.00 73.48 O -2.849 -58.211 7.928 1.00 73.48 C -4.202 -58.254 8.636 1.00 73.48 C -2.926 -57.180 6.970 1.00 73.48 O 0.252 -57.383 7.564 1.00 72.07 N 1.542 -57.579 6.906 1.00 72.07 C 2.648 -57.881 7.926 1.00 72.07 C 3.415 -58.818 7.737 1.00 72.07 O 1.864 -56.334 6.073 1.00 72.07 C 2.681 -57.154 9.048 1.00 67.29 N 3.657 -57.417 10.106 1.00 67.29 C 3.417 -58.777 10.774 1.00 67.29 C 4.369 -59.498 11.058 1.00 67.29 O 3.632 -56.276 11.132 1.00 67.29 C 4.957 -56.198 11.898 1.00 67.29 C 6.337 -55.613 10.875 1.00 67.29 S 7.705 -55.795 12.048 1.00 67.29 C 2.152 -59.173 10.969 1.00 69.67 N 1.826 -60.510 11.481 1.00 69.67 C 2.263 -61.625 10.526 1.00 69.67 C 2.689 -62.674 11.002 1.00 69.67 O 0.328 -60.633 11.764 1.00 69.67 C 0.062 -61.894 12.353 1.00 69.67 O 2.173 -61.413 9.208 1.00 73.23 N 2.673 -62.352 8.202 1.00 73.23 C 4.199 -62.425 8.200 1.00 73.23 C 4.727 -63.526 8.163 1.00 73.23 O 2.149 -61.958 6.810 1.00 73.23 C 0.730 -62.474 6.529 1.00 73.23 C 0.124 -61.709 5.353 1.00 73.23 C 0.739 -63.965 6.177 1.00 73.23 C 4.897 -61.291 8.305 1.00 70.72 N 6.366 -61.262 8.395 1.00 70.72 C 6.838 -62.019 9.640 1.00 70.72 C 7.709 -62.869 9.532 1.00 70.72 O 6.887 -59.808 8.353 1.00 70.72 C 6.638 -59.200 6.952 1.00 70.72 C 8.389 -59.738 8.689 1.00 70.72 C 6.784 -57.674 6.906 1.00 70.72 C 6.203 -61.802 10.798 1.00 68.67 N 6.522 -62.543 12.030 1.00 68.67 C 6.279 -64.050 11.850 1.00 68.67 C 7.082 -64.859 12.300 1.00 68.67 O 5.724 -61.966 13.224 1.00 68.67 C 6.208 -60.534 13.556 1.00 68.67 C 5.852 -62.856 14.476 1.00 68.67 C 5.248 -59.750 14.462 1.00 68.67 C 5.190 -64.448 11.177 1.00 72.20 N 4.911 -65.868 10.899 1.00 72.20 C 5.882 -66.477 9.889 1.00 72.20 C 6.220 -67.641 10.045 1.00 72.20 O 3.465 -66.060 10.427 1.00 72.20 C 2.463 -65.946 11.581 1.00 72.20 C 1.047 -66.154 11.040 1.00 72.20 C 0.027 -65.940 12.083 1.00 72.20 N -1.221 -66.374 12.061 1.00 72.20 C -1.685 -67.096 11.078 1.00 72.20 N1+ -2.034 -66.092 13.039 1.00 72.20 N 6.322 -65.719 8.886 1.00 68.12 N 7.320 -66.161 7.910 1.00 68.12 C 8.694 -66.336 8.566 1.00 68.12 C 9.340 -67.350 8.329 1.00 68.12 O 7.375 -65.166 6.735 1.00 68.12 C 6.192 -65.288 5.757 1.00 68.12 C 6.147 -64.069 4.833 1.00 68.12 C 6.300 -66.540 4.882 1.00 68.12 C 9.088 -65.417 9.453 1.00 60.82 N 10.350 -65.511 10.199 1.00 60.82 C 10.354 -66.713 11.163 1.00 60.82 C 11.369 -67.383 11.323 1.00 60.82 O 10.586 -64.197 10.968 1.00 60.82 C 12.078 -63.884 11.190 1.00 60.82 C 12.808 -63.341 9.943 1.00 60.82 C 14.042 -63.140 10.038 1.00 60.82 O 12.133 -63.046 8.930 1.00 60.82 O1- 9.204 -67.035 11.774 1.00 67.92 N 9.050 -68.212 12.641 1.00 67.92 C 8.918 -69.537 11.865 1.00 67.92 C 9.172 -70.593 12.438 1.00 67.92 O 7.840 -68.007 13.573 1.00 67.92 C 8.037 -66.941 14.668 1.00 67.92 C 6.702 -66.688 15.376 1.00 67.92 C 9.056 -67.369 15.726 1.00 67.92 C 8.514 -69.506 10.589 1.00 67.42 N 8.304 -70.706 9.772 1.00 67.42 C 9.592 -71.258 9.134 1.00 67.42 C 9.614 -72.421 8.736 1.00 67.42 O 7.240 -70.401 8.710 1.00 67.42 C 10.657 -70.455 9.040 1.00 60.78 N 11.939 -70.861 8.466 1.00 60.78 C 13.106 -70.516 9.415 1.00 60.78 C 13.790 -69.507 9.221 1.00 60.78 O 12.077 -70.224 7.077 1.00 60.78 C 13.367 -71.340 10.446 1.00 51.42 N 14.524 -71.156 11.313 1.00 51.42 C 15.802 -71.442 10.508 1.00 51.42 C 16.165 -72.595 10.301 1.00 51.42 O 14.299 -72.124 12.483 1.00 51.42 C 13.464 -73.252 11.875 1.00 51.42 C 12.639 -72.553 10.796 1.00 51.42 C 16.475 -70.402 10.006 1.00 57.27 N 17.768 -70.563 9.325 1.00 57.27 C 18.149 -69.490 8.305 1.00 57.27 C 19.335 -69.335 8.029 1.00 57.27 O 17.206 -68.702 7.775 1.00 50.61 N 17.529 -67.595 6.858 1.00 50.61 C 17.457 -66.248 7.577 1.00 50.61 C 16.402 -65.621 7.642 1.00 50.61 O 16.660 -67.636 5.595 1.00 50.61 C 15.300 -67.398 5.884 1.00 50.61 O 18.582 -65.794 8.129 1.00 51.09 N 18.700 -64.469 8.742 1.00 51.09 C 18.686 -63.378 7.656 1.00 51.09 C 19.733 -62.965 7.162 1.00 51.09 O 19.985 -64.397 9.588 1.00 51.09 C 19.936 -65.270 10.853 1.00 51.09 C 21.240 -65.230 11.649 1.00 51.09 C 21.261 -65.766 12.849 1.00 51.09 N 22.265 -64.722 11.227 1.00 51.09 O 17.504 -62.880 7.281 1.00 51.56 N 17.390 -61.715 6.386 1.00 51.56 C 17.719 -60.386 7.090 1.00 51.56 C 17.936 -59.365 6.436 1.00 51.56 O 16.011 -61.699 5.711 1.00 51.56 C 15.955 -62.569 4.469 1.00 51.56 C 16.433 -62.062 3.244 1.00 51.56 C 15.459 -63.884 4.539 1.00 51.56 C 16.412 -62.865 2.086 1.00 51.56 C 15.432 -64.690 3.384 1.00 51.56 C 15.909 -64.183 2.157 1.00 51.56 C 15.887 -64.963 1.045 1.00 51.56 O 17.824 -60.392 8.422 1.00 46.25 N 18.188 -59.244 9.247 1.00 46.25 C 19.470 -59.548 10.028 1.00 46.25 C 19.496 -60.372 10.938 1.00 46.25 O 16.989 -58.886 10.141 1.00 46.25 C 15.961 -58.019 9.387 1.00 46.25 C 14.558 -58.214 9.953 1.00 46.25 C 16.324 -56.534 9.500 1.00 46.25 C 20.544 -58.858 9.650 1.00 51.32 N 21.871 -58.988 10.239 1.00 51.32 C 21.870 -58.605 11.732 1.00 51.32 C 21.807 -57.428 12.085 1.00 51.32 O 22.847 -58.095 9.452 1.00 51.32 C 23.245 -58.610 8.087 1.00 51.32 C 24.530 -58.794 7.651 1.00 51.32 C 22.415 -58.964 7.042 1.00 51.32 N 23.186 -59.354 6.013 1.00 51.32 C 24.482 -59.254 6.334 1.00 51.32 N 21.986 -59.609 12.603 1.00 45.03 N 22.790 -59.541 13.831 1.00 45.03 C 22.350 -58.633 14.985 1.00 45.03 C 23.114 -58.513 15.935 1.00 45.03 O 21.164 -58.015 14.974 1.00 46.28 N 20.746 -57.114 16.060 1.00 46.28 C 19.627 -57.716 16.931 1.00 46.28 C 18.458 -57.333 16.855 1.00 46.28 O 20.500 -55.697 15.491 1.00 46.28 C 21.337 -54.624 16.176 1.00 46.28 C 21.410 -53.445 15.607 1.00 46.28 N 21.923 -54.800 17.227 1.00 46.28 O 20.000 -58.666 17.792 1.00 48.90 N 19.106 -59.374 18.728 1.00 48.90 C 18.451 -58.472 19.792 1.00 48.90 C 17.477 -58.876 20.424 1.00 48.90 O 19.880 -60.523 19.388 1.00 48.90 C 21.098 -60.044 19.928 1.00 48.90 O 18.898 -57.221 19.953 1.00 49.30 N 18.280 -56.236 20.858 1.00 49.30 C 17.106 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1.00 72.11 C 20.999 -2.423 13.471 1.00 72.11 O 23.962 -3.694 12.752 1.00 72.11 C 23.777 -4.369 14.121 1.00 72.11 C 23.910 -5.886 13.997 1.00 72.11 C 24.839 -3.875 15.101 1.00 72.11 C 22.234 -0.961 12.317 1.00 75.72 N 21.539 0.232 12.823 1.00 75.72 C 20.077 0.317 12.361 1.00 75.72 C 19.197 0.672 13.143 1.00 75.72 O 22.265 1.510 12.380 1.00 75.72 C 23.688 1.635 12.935 1.00 75.72 C 24.333 2.999 12.623 1.00 75.72 C 25.429 3.241 13.162 1.00 75.72 O 23.740 3.824 11.883 1.00 75.72 O1- 19.789 -0.040 11.105 1.00 79.73 N 18.415 -0.068 10.601 1.00 79.73 C 17.629 -1.248 11.182 1.00 79.73 C 16.445 -1.112 11.483 1.00 79.73 O 18.409 -0.108 9.066 1.00 79.73 C 17.014 0.029 8.483 1.00 79.73 C 16.312 -1.100 8.025 1.00 79.73 C 16.378 1.283 8.487 1.00 79.73 C 14.983 -0.968 7.582 1.00 79.73 C 15.061 1.424 8.021 1.00 79.73 C 14.361 0.294 7.571 1.00 79.73 C 18.277 -2.398 11.367 1.00 78.01 N 17.675 -3.554 12.037 1.00 78.01 C 17.350 -3.237 13.496 1.00 78.01 C 16.227 -3.488 13.929 1.00 78.01 O 18.594 -4.781 11.923 1.00 78.01 C 18.634 -5.261 10.469 1.00 78.01 C 19.493 -6.506 10.225 1.00 78.01 C 19.959 -6.635 9.075 1.00 78.01 O 19.551 -7.438 11.060 1.00 78.01 O1- 18.272 -2.590 14.219 1.00 81.02 N 18.030 -2.059 15.567 1.00 81.02 C 16.841 -1.106 15.579 1.00 81.02 C 15.902 -1.354 16.318 1.00 81.02 O 19.283 -1.361 16.104 1.00 81.02 C 20.346 -2.361 16.578 1.00 81.02 C 21.644 -1.615 16.906 1.00 81.02 C 22.697 -2.594 17.426 1.00 81.02 C 23.954 -1.894 17.796 1.00 81.02 N1+ 16.788 -0.122 14.675 1.00 81.63 N 15.639 0.787 14.557 1.00 81.63 C 14.308 0.026 14.404 1.00 81.63 C 13.302 0.384 15.017 1.00 81.63 O 15.863 1.711 13.343 1.00 81.63 C 14.773 2.786 13.180 1.00 81.63 C 15.063 3.987 14.072 1.00 81.63 C 14.670 3.255 11.728 1.00 81.63 C 14.283 -1.012 13.568 1.00 79.20 N 13.094 -1.845 13.343 1.00 79.20 C 12.695 -2.617 14.612 1.00 79.20 C 11.501 -2.721 14.905 1.00 79.20 O 13.350 -2.781 12.142 1.00 79.20 C 12.286 -3.864 12.012 1.00 79.20 C 13.392 -2.047 10.796 1.00 79.20 C 13.670 -3.130 15.365 1.00 76.82 N 13.454 -3.861 16.618 1.00 76.82 C 13.047 -2.937 17.770 1.00 76.82 C 12.091 -3.234 18.482 1.00 76.82 O 14.721 -4.651 16.985 1.00 76.82 C 15.027 -5.778 15.987 1.00 76.82 C 13.763 -7.070 15.822 1.00 76.82 S 13.959 -7.899 17.422 1.00 76.82 C 13.694 -1.786 17.921 1.00 80.04 N 13.444 -0.859 19.025 1.00 80.04 C 12.046 -0.228 18.922 1.00 80.04 C 11.342 -0.072 19.919 1.00 80.04 O 14.518 0.237 19.057 1.00 80.04 C 15.963 -0.245 19.203 1.00 80.04 C 16.166 -1.352 19.747 1.00 80.04 O 16.857 0.524 18.779 1.00 80.04 O1- 11.576 0.045 17.697 1.00 78.35 N 10.200 0.492 17.435 1.00 78.35 C 9.157 -0.636 17.567 1.00 78.35 C 8.007 -0.490 17.142 1.00 78.35 O 10.120 1.215 16.079 1.00 78.35 C 10.785 2.573 16.121 1.00 78.35 C 11.878 2.742 15.429 1.00 78.35 N 10.325 3.506 16.763 1.00 78.35 O 9.512 -1.787 18.149 1.00 70.11 N 8.506 -2.674 18.732 1.00 70.11 C 7.825 -2.048 19.946 1.00 70.11 C 6.630 -2.282 20.122 1.00 70.11 O 9.085 -4.049 19.081 1.00 70.11 C 9.453 -4.881 17.845 1.00 70.11 C 9.843 -6.595 18.277 1.00 70.11 S 10.357 -7.286 16.686 1.00 70.11 C 8.543 -1.219 20.701 1.00 72.14 N 7.985 -0.449 21.801 1.00 72.14 C 7.462 0.891 21.264 1.00 72.14 C 8.198 1.645 20.626 1.00 72.14 O 9.064 -0.297 22.884 1.00 72.14 C 9.487 -1.630 23.486 1.00 72.14 C 10.666 -1.696 24.056 1.00 72.14 N 8.774 -2.622 23.458 1.00 72.14 O 6.184 1.195 21.504 1.00 67.47 N 5.526 2.392 20.954 1.00 67.47 C 6.143 3.702 21.473 1.00 67.47 C 6.188 4.703 20.754 1.00 67.47 O 4.017 2.344 21.258 1.00 67.47 C 3.316 1.208 20.490 1.00 67.47 C 1.803 1.104 20.751 1.00 67.47 C 1.202 0.158 20.189 1.00 67.47 O 1.256 1.951 21.489 1.00 67.47 O1- 6.685 3.678 22.689 1.00 69.51 N 7.223 4.847 23.392 1.00 69.51 C 8.686 5.159 23.055 1.00 69.51 C 9.237 6.133 23.565 1.00 69.51 O 7.041 4.647 24.903 1.00 69.51 C 5.555 4.533 25.285 1.00 69.51 C 5.326 4.385 26.795 1.00 69.51 C 4.137 4.394 27.184 1.00 69.51 O 6.320 4.233 27.539 1.00 69.51 O1- 9.340 4.367 22.196 1.00 77.37 N 10.763 4.563 21.957 1.00 77.37 C 11.057 5.899 21.252 1.00 77.37 C 10.459 6.239 20.220 1.00 77.37 O 11.379 3.369 21.217 1.00 77.37 C 12.893 3.480 21.240 1.00 77.37 C 13.559 3.157 20.163 1.00 77.37 N 13.491 3.906 22.212 1.00 77.37 O 12.033 6.623 21.798 1.00 77.19 N 12.579 7.839 21.210 1.00 77.19 C 13.697 7.467 20.244 1.00 77.19 C 14.707 6.878 20.622 1.00 77.19 O 13.069 8.796 22.304 1.00 77.19 C 11.893 9.444 23.044 1.00 77.19 C 10.839 10.512 22.017 1.00 77.19 S 11.914 11.947 21.774 1.00 77.19 C 13.510 7.814 18.973 1.00 81.49 N 14.445 7.441 17.925 1.00 81.49 C 15.541 8.495 17.763 1.00 81.49 C 15.270 9.662 17.451 1.00 81.49 O 13.688 7.176 16.625 1.00 81.49 C 12.799 5.961 16.754 1.00 81.49 C 11.515 6.138 16.928 1.00 81.49 N 13.250 4.835 16.685 1.00 81.49 O 16.781 8.039 17.923 1.00 80.48 N 18.001 8.828 17.798 1.00 80.48 C 18.837 8.263 16.627 1.00 80.48 C 18.581 7.155 16.160 1.00 80.48 O 18.747 8.810 19.153 1.00 80.48 C 17.922 9.238 20.368 1.00 80.48 C 18.498 9.201 21.544 1.00 80.48 N 16.765 9.624 20.304 1.00 80.48 O 19.841 9.005 16.147 1.00 82.47 N 20.802 8.555 15.119 1.00 82.47 C 20.208 8.173 13.742 1.00 82.47 C 20.801 7.396 12.992 1.00 82.47 O 21.717 7.457 15.707 1.00 82.47 C 22.503 7.913 16.920 1.00 82.47 C 23.023 6.992 17.695 1.00 82.47 N 22.659 9.093 17.185 1.00 82.47 O 19.073 8.756 13.348 1.00 86.15 N 18.454 8.501 12.040 1.00 86.15 C 19.325 8.987 10.875 1.00 86.15 C 19.333 8.373 9.807 1.00 86.15 O 17.081 9.186 11.973 1.00 86.15 C 16.073 8.738 13.040 1.00 86.15 C 14.740 9.437 12.777 1.00 86.15 C 15.851 7.229 13.013 1.00 86.15 C 20.075 10.074 11.068 1.00 85.77 N 20.996 10.595 10.062 1.00 85.77 C 22.137 9.607 9.753 1.00 85.77 C 22.542 9.509 8.595 1.00 85.77 O 21.526 11.961 10.534 1.00 85.77 C 22.322 12.724 9.456 1.00 85.77 C 21.431 13.169 8.292 1.00 85.77 C 22.960 13.972 10.060 1.00 85.77 C 22.605 8.840 10.748 1.00 85.88 N 23.616 7.783 10.559 1.00 85.88 C 23.101 6.701 9.609 1.00 85.88 C 23.708 6.417 8.574 1.00 85.88 O 24.000 7.145 11.901 1.00 85.88 C 25.058 6.240 11.691 1.00 85.88 O 21.883 6.222 9.872 1.00 86.10 N 21.185 5.248 9.029 1.00 86.10 C 21.006 5.785 7.601 1.00 86.10 C 21.188 5.053 6.627 1.00 86.10 O 19.826 4.904 9.678 1.00 86.10 C 20.031 4.225 11.052 1.00 86.10 C 18.968 4.012 8.765 1.00 86.10 C 18.738 3.996 11.845 1.00 86.10 C 20.658 7.069 7.452 1.00 87.60 N 20.499 7.700 6.136 1.00 87.60 C 21.808 7.837 5.361 1.00 87.60 C 21.792 7.770 4.131 1.00 87.60 O 19.893 9.099 6.271 1.00 87.60 C 18.404 9.060 6.598 1.00 87.60 C 17.577 10.670 6.562 1.00 87.60 S 17.830 11.174 4.843 1.00 87.60 C 22.919 8.065 6.067 1.00 87.97 N 24.252 8.200 5.478 1.00 87.97 C 24.720 6.880 4.866 1.00 87.97 C 25.493 6.917 3.911 1.00 87.97 O 25.213 8.717 6.564 1.00 87.97 C 26.638 8.962 6.049 1.00 87.97 C 27.577 9.383 7.183 1.00 87.97 C 29.010 9.494 6.646 1.00 87.97 C 29.992 9.675 7.746 1.00 87.97 N1+ 24.258 5.732 5.361 1.00 88.13 N 24.701 4.439 4.854 1.00 88.13 C 24.420 4.286 3.340 1.00 88.13 C 23.284 4.391 2.864 1.00 88.13 O 24.111 3.311 5.718 1.00 88.13 C 24.719 1.961 5.373 1.00 88.13 C 24.596 0.970 6.208 1.00 88.13 N 25.300 1.765 4.319 1.00 88.13 O 25.481 4.003 2.580 1.00 88.30 N 25.452 3.809 1.125 1.00 88.30 C 24.518 2.660 0.740 1.00 88.30 C 23.763 2.786 -0.225 1.00 88.30 O 26.879 3.564 0.597 1.00 88.30 C 26.902 3.384 -0.927 1.00 88.30 C 27.799 4.745 0.940 1.00 88.30 C 24.468 1.592 1.536 1.00 86.33 N 23.592 0.442 1.301 1.00 86.33 C 22.107 0.831 1.355 1.00 86.33 C 21.301 0.386 0.527 1.00 86.33 O 23.904 -0.652 2.337 1.00 86.33 C 25.192 -1.425 2.040 1.00 86.33 C 25.761 -1.249 0.940 1.00 86.33 O 25.512 -2.354 2.810 1.00 86.33 O1- 21.737 1.738 2.265 1.00 87.08 N 20.377 2.276 2.354 1.00 87.08 C 20.024 3.131 1.133 1.00 87.08 C 18.921 3.012 0.586 1.00 87.08 O 20.198 3.069 3.660 1.00 87.08 C 20.137 2.135 4.874 1.00 87.08 C 18.729 0.983 4.872 1.00 87.08 S 17.376 2.138 5.194 1.00 87.08 C 20.968 3.937 0.641 1.00 88.90 N 20.793 4.714 -0.590 1.00 88.90 C 20.654 3.802 -1.824 1.00 88.90 C 19.795 4.042 -2.681 1.00 88.90 O 21.964 5.704 -0.748 1.00 88.90 C 22.070 6.782 0.348 1.00 88.90 C 23.389 7.542 0.199 1.00 88.90 C 20.942 7.814 0.240 1.00 88.90 C 21.426 2.713 -1.899 1.00 86.63 N 21.321 1.703 -2.962 1.00 86.63 C 19.957 1.002 -2.952 1.00 86.63 C 19.335 0.809 -4.007 1.00 86.63 O 22.420 0.643 -2.798 1.00 86.63 C 23.819 1.173 -3.099 1.00 86.63 C 25.119 0.000 -2.669 1.00 86.63 S 25.053 -1.107 -4.085 1.00 86.63 C 19.457 0.640 -1.767 1.00 84.55 N 18.119 0.073 -1.587 1.00 84.55 C 17.027 1.031 -2.059 1.00 84.55 C 16.128 0.625 -2.806 1.00 84.55 O 17.899 -0.250 -0.103 1.00 84.55 C 18.564 -1.554 0.338 1.00 84.55 C 18.526 -1.608 1.861 1.00 84.55 C 17.843 -2.761 -0.286 1.00 84.55 C 17.118 2.301 -1.667 1.00 88.00 N 16.187 3.336 -2.090 1.00 88.00 C 16.173 3.499 -3.615 1.00 88.00 C 15.111 3.439 -4.245 1.00 88.00 O 16.562 4.634 -1.379 1.00 88.00 C 17.347 3.597 -4.240 1.00 87.60 N 17.467 3.640 -5.695 1.00 87.60 C 16.792 2.424 -6.362 1.00 87.60 C 15.995 2.582 -7.294 1.00 87.60 O 18.948 3.765 -6.063 1.00 87.60 C 19.221 3.412 -7.505 1.00 87.60 C 19.640 2.105 -7.801 1.00 87.60 C 19.003 4.347 -8.537 1.00 87.60 C 19.880 1.736 -9.129 1.00 87.60 C 19.201 3.965 -9.881 1.00 87.60 C 19.656 2.656 -10.162 1.00 87.60 C 19.841 2.191 -11.412 1.00 87.60 O 17.000 1.211 -5.840 1.00 83.05 N 16.369 0.003 -6.375 1.00 83.05 C 14.841 -0.016 -6.267 1.00 83.05 C 14.174 -0.569 -7.150 1.00 83.05 O 16.969 -1.227 -5.696 1.00 83.05 C 18.276 -1.640 -6.321 1.00 83.05 C 19.079 -2.329 -5.581 1.00 83.05 N 18.550 -1.456 -7.499 1.00 83.05 O 14.269 0.603 -5.230 1.00 81.61 N 12.812 0.755 -5.082 1.00 81.61 C 12.231 1.773 -6.067 1.00 81.61 C 11.092 1.622 -6.521 1.00 81.61 O 12.490 1.139 -3.628 1.00 81.61 C 12.720 -0.035 -2.664 1.00 81.61 C 12.381 0.362 -1.224 1.00 81.61 C 12.502 -0.793 -0.307 1.00 81.61 N 12.049 -0.855 0.934 1.00 81.61 C 11.378 0.124 1.461 1.00 81.61 N1+ 12.266 -1.899 1.687 1.00 81.61 N 13.010 2.787 -6.434 1.00 83.63 N 12.591 3.901 -7.293 1.00 83.63 C 12.746 3.560 -8.783 1.00 83.63 C 11.833 3.838 -9.567 1.00 83.63 O 13.391 5.155 -6.874 1.00 83.63 C 12.980 5.598 -5.454 1.00 83.63 C 13.213 6.363 -7.808 1.00 83.63 C 13.915 6.675 -4.895 1.00 83.63 C 13.855 2.932 -9.190 1.00 78.44 N 14.278 2.786 -10.600 1.00 78.44 C 13.240 2.196 -11.559 1.00 78.44 C 13.221 2.514 -12.742 1.00 78.44 O 15.567 1.952 -10.639 1.00 78.44 C 15.334 0.482 -10.255 1.00 78.44 C 16.669 -0.240 -10.186 1.00 78.44 C 16.489 -1.736 -9.924 1.00 78.44 C 17.819 -2.374 -9.953 1.00 78.44 N1+ 12.345 1.339 -11.065 1.00 69.88 N 11.385 0.619 -11.915 1.00 69.88 C 10.161 1.452 -12.319 1.00 69.88 C 9.422 1.052 -13.226 1.00 69.88 O 10.931 -0.667 -11.221 1.00 69.88 C 12.025 -1.535 -11.008 1.00 69.88 O 9.893 2.581 -11.644 1.00 73.34 N 8.700 3.399 -11.917 1.00 73.34 C 8.981 4.348 -13.098 1.00 73.34 C 9.917 5.140 -13.021 1.00 73.34 O 8.242 4.178 -10.673 1.00 73.34 C 7.953 3.324 -9.424 1.00 73.34 C 7.588 4.217 -8.223 1.00 73.34 C 7.328 3.384 -6.957 1.00 73.34 C 7.153 4.237 -5.747 1.00 73.34 N1+ 8.152 4.345 -14.162 1.00 64.20 N 8.433 5.092 -15.395 1.00 64.20 C 8.512 6.611 -15.183 1.00 64.20 C 9.287 7.282 -15.857 1.00 64.20 O 7.299 4.717 -16.358 1.00 64.20 C 6.152 4.308 -15.434 1.00 64.20 C 6.880 3.648 -14.267 1.00 64.20 C 7.755 7.149 -14.218 1.00 67.54 N 7.751 8.580 -13.900 1.00 67.54 C 9.083 9.103 -13.357 1.00 67.54 C 9.344 10.299 -13.451 1.00 67.54 O 9.957 8.230 -12.851 1.00 73.16 N 11.232 8.647 -12.272 1.00 73.16 C 12.310 8.987 -13.314 1.00 73.16 C 13.297 9.620 -12.961 1.00 73.16 O 11.693 7.592 -11.269 1.00 73.16 C 10.784 7.490 -10.068 1.00 73.16 C 10.683 6.350 -9.445 1.00 73.16 N 10.154 8.439 -9.641 1.00 73.16 O 12.080 8.647 -14.586 1.00 73.31 N 12.891 9.097 -15.727 1.00 73.31 C 12.496 10.497 -16.227 1.00 73.31 C 13.000 10.954 -17.251 1.00 73.31 O 12.757 8.080 -16.871 1.00 73.31 C 13.364 6.715 -16.542 1.00 73.31 C 15.146 6.725 -16.227 1.00 73.31 S 15.786 7.285 -17.834 1.00 73.31 C 11.538 11.155 -15.570 1.00 75.63 N 11.148 12.531 -15.895 1.00 75.63 C 12.099 13.483 -15.170 1.00 75.63 C 12.187 13.375 -13.941 1.00 75.63 O 9.698 12.831 -15.492 1.00 75.63 C 9.176 14.111 -16.136 1.00 75.63 C 8.857 11.771 -15.887 1.00 75.63 O 12.791 14.389 -15.886 1.00 75.90 N 13.699 15.345 -15.261 1.00 75.90 C 12.922 16.268 -14.320 1.00 75.90 C 11.745 16.569 -14.563 1.00 75.90 O 14.376 16.100 -16.409 1.00 75.90 C 13.369 15.994 -17.552 1.00 75.90 C 12.721 14.630 -17.322 1.00 75.90 C 13.560 16.669 -13.225 1.00 78.06 N 13.005 17.654 -12.305 1.00 78.06 C 13.278 19.057 -12.833 1.00 78.06 C 12.883 19.382 -13.951 1.00 78.06 O 13.943 19.872 -12.024 1.00 78.60 N 14.481 21.178 -12.432 1.00 78.60 C 15.838 21.042 -13.110 1.00 78.60 C 16.154 21.826 -13.998 1.00 78.60 O 14.591 22.112 -11.219 1.00 78.60 C 13.198 22.570 -10.801 1.00 78.60 C 15.152 21.441 -10.102 1.00 78.60 O 16.621 20.019 -12.751 1.00 79.20 N 17.837 19.662 -13.486 1.00 79.20 C 17.532 18.691 -14.624 1.00 79.20 C 16.593 17.894 -14.557 1.00 79.20 O 18.958 19.142 -12.567 1.00 79.20 C 19.401 20.235 -11.600 1.00 79.20 C 18.598 18.027 -11.781 1.00 79.20 O 18.361 18.737 -15.674 1.00 76.00 N 18.334 17.779 -16.790 1.00 76.00 C 18.762 16.361 -16.367 1.00 76.00 C 18.621 15.412 -17.137 1.00 76.00 O 19.240 18.300 -17.924 1.00 76.00 C 18.766 19.603 -18.596 1.00 76.00 C 19.825 20.084 -19.585 1.00 76.00 C 17.449 19.410 -19.354 1.00 76.00 C 19.266 16.212 -15.142 1.00 76.88 N 19.653 14.936 -14.554 1.00 76.88 C 18.431 14.012 -14.438 1.00 76.88 C 17.360 14.385 -13.946 1.00 76.88 O 20.295 15.154 -13.174 1.00 76.88 C 21.568 16.025 -13.208 1.00 76.88 C 22.029 16.472 -11.807 1.00 76.88 C 23.235 16.725 -11.621 1.00 76.88 O 21.156 16.685 -10.923 1.00 76.88 O1- 18.606 12.764 -14.860 1.00 76.61 N 17.628 11.691 -14.653 1.00 76.61 C 18.253 10.605 -13.775 1.00 76.61 C 19.380 10.748 -13.318 1.00 76.61 O 17.076 11.156 -15.982 1.00 76.61 C 16.400 12.233 -16.831 1.00 76.61 C 18.077 10.548 -16.748 1.00 76.61 O 17.527 9.523 -13.482 1.00 76.99 N 18.126 8.354 -12.812 1.00 76.99 C 19.121 7.590 -13.703 1.00 76.99 C 19.689 6.591 -13.266 1.00 76.99 O 17.010 7.407 -12.353 1.00 76.99 C 16.269 7.888 -11.105 1.00 76.99 C 15.064 6.983 -10.908 1.00 76.99 C 17.104 7.781 -9.826 1.00 76.99 C 19.277 8.014 -14.956 1.00 72.18 N 20.285 7.501 -15.867 1.00 72.18 C 21.672 8.038 -15.489 1.00 72.18 C 21.796 9.219 -15.171 1.00 72.18 O 19.890 7.906 -17.298 1.00 72.18 C 20.559 7.041 -18.356 1.00 72.18 C 21.168 6.024 -17.984 1.00 72.18 O 20.453 7.339 -19.559 1.00 72.18 O1- 22.701 7.189 -15.517 1.00 73.91 N 24.067 7.595 -15.144 1.00 73.91 C 24.423 7.387 -13.663 1.00 73.91 C 25.455 7.852 -13.193 1.00 73.91 O 23.573 6.704 -12.889 1.00 80.64 N 23.839 6.446 -11.467 1.00 80.64 C 24.992 5.445 -11.299 1.00 80.64 C 24.913 4.325 -11.811 1.00 80.64 O 22.569 5.930 -10.775 1.00 80.64 C 21.467 6.996 -10.693 1.00 80.64 C 21.722 8.383 -9.555 1.00 80.64 S 21.900 7.490 -7.994 1.00 80.64 C 26.018 5.828 -10.537 1.00 83.25 N 27.169 4.996 -10.173 1.00 83.25 C 27.412 5.000 -8.649 1.00 83.25 C 26.759 5.727 -7.896 1.00 83.25 O 28.399 5.447 -10.993 1.00 83.25 C 28.885 6.858 -10.712 1.00 83.25 C 29.715 7.417 -11.555 1.00 83.25 N 28.560 7.459 -9.705 1.00 83.25 O 28.359 4.180 -8.181 1.00 83.98 N 28.715 4.116 -6.756 1.00 83.98 C 29.366 5.408 -6.250 1.00 83.98 C 29.067 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5.591 -4.977 1.00 87.56 C 24.221 4.099 -4.884 1.00 87.56 C 23.207 6.337 -4.735 1.00 87.56 C 28.261 7.536 -2.920 1.00 89.78 N 29.266 7.911 -1.921 1.00 89.78 C 29.335 9.432 -1.731 1.00 89.78 C 29.357 9.923 -0.605 1.00 89.78 O 30.633 7.347 -2.346 1.00 89.78 C 30.718 5.839 -2.208 1.00 89.78 C 31.665 5.206 -2.857 1.00 89.78 N 29.949 5.206 -1.513 1.00 89.78 O 29.291 10.202 -2.825 1.00 91.00 N 29.218 11.666 -2.762 1.00 91.00 C 27.959 12.124 -2.026 1.00 91.00 C 28.047 12.977 -1.148 1.00 91.00 O 29.301 12.243 -4.181 1.00 91.00 C 29.286 13.777 -4.151 1.00 91.00 C 29.423 14.362 -5.557 1.00 91.00 C 29.351 15.887 -5.450 1.00 91.00 C 29.543 16.539 -6.767 1.00 91.00 N1+ 26.806 11.536 -2.344 1.00 90.28 N 25.540 11.838 -1.677 1.00 90.28 C 25.580 11.488 -0.180 1.00 90.28 C 25.123 12.278 0.642 1.00 90.28 O 24.419 11.089 -2.416 1.00 90.28 C 23.012 11.331 -1.844 1.00 90.28 C 22.629 12.810 -1.890 1.00 90.28 C 21.990 10.544 -2.667 1.00 90.28 C 26.161 10.340 0.174 1.00 91.01 N 26.405 9.927 1.561 1.00 91.01 C 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13.260 6.692 1.00 86.84 C 27.557 14.599 7.112 1.00 86.84 C 27.663 14.874 8.300 1.00 86.84 O 27.921 15.452 6.153 1.00 88.08 N 28.457 16.803 6.420 1.00 88.08 C 27.370 17.864 6.624 1.00 88.08 C 27.691 19.026 6.858 1.00 88.08 O 29.411 17.264 5.304 1.00 88.08 C 30.691 16.433 5.241 1.00 88.08 C 28.794 17.180 4.037 1.00 88.08 O 26.085 17.518 6.465 1.00 84.95 N 24.970 18.473 6.533 1.00 84.95 C 24.903 19.474 5.367 1.00 84.95 C 24.018 20.335 5.342 1.00 84.95 O 25.796 19.352 4.370 1.00 88.90 N 25.848 20.201 3.164 1.00 88.90 C 24.713 19.910 2.181 1.00 88.90 C 24.481 20.690 1.255 1.00 88.90 O 27.216 20.046 2.473 1.00 88.90 C 28.363 20.653 3.296 1.00 88.90 C 29.711 20.531 2.568 1.00 88.90 C 30.820 21.171 3.418 1.00 88.90 C 32.161 21.083 2.780 1.00 88.90 N1+ 23.999 18.799 2.358 1.00 89.38 N 22.868 18.438 1.518 1.00 89.38 C 21.751 19.499 1.570 1.00 89.38 C 21.190 19.809 2.624 1.00 89.38 O 22.355 17.048 1.903 1.00 89.38 C 21.261 16.571 0.974 1.00 89.38 C 19.917 16.851 1.268 1.00 89.38 C 21.591 15.909 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1.00 87.02 C -1.720 18.974 6.157 1.00 87.02 C 0.345 19.558 7.398 1.00 87.02 C -1.372 17.622 5.517 1.00 87.02 C 0.120 22.858 7.968 1.00 89.08 N 1.210 23.674 8.516 1.00 89.08 C 2.493 22.860 8.706 1.00 89.08 C 2.469 21.738 9.222 1.00 89.08 O 0.790 24.339 9.831 1.00 89.08 C 1.898 25.033 10.370 1.00 89.08 O 3.633 23.440 8.317 1.00 90.14 N 4.951 22.824 8.512 1.00 90.14 C 5.262 22.634 9.997 1.00 90.14 C 5.772 21.582 10.378 1.00 90.14 O 6.038 23.671 7.831 1.00 90.14 C 5.951 23.762 6.323 1.00 90.14 C 5.068 23.109 5.509 1.00 90.14 C 6.797 24.541 5.529 1.00 90.14 N 6.379 24.371 4.264 1.00 90.14 C 5.356 23.500 4.223 1.00 90.14 N 4.884 23.593 10.840 1.00 90.90 N 5.157 23.542 12.278 1.00 90.90 C 4.405 22.396 12.957 1.00 90.90 C 4.957 21.724 13.828 1.00 90.90 O 4.789 24.883 12.924 1.00 90.90 C 5.610 26.047 12.361 1.00 90.90 C 6.774 25.808 11.961 1.00 90.90 O 5.041 27.153 12.291 1.00 90.90 O1- 3.179 22.106 12.503 1.00 91.52 N 2.392 20.975 12.995 1.00 91.52 C 3.072 19.639 12.668 1.00 91.52 C 3.199 18.785 13.542 1.00 91.52 O 0.970 21.054 12.408 1.00 91.52 C 0.021 19.947 12.910 1.00 91.52 C -0.236 20.044 14.415 1.00 91.52 C -1.317 20.058 12.181 1.00 91.52 C 3.566 19.472 11.435 1.00 92.01 N 4.301 18.263 11.028 1.00 92.01 C 5.543 18.079 11.904 1.00 92.01 C 5.786 16.991 12.421 1.00 92.01 O 4.700 18.332 9.535 1.00 92.01 C 3.464 18.338 8.612 1.00 92.01 C 5.605 17.140 9.157 1.00 92.01 C 3.776 18.890 7.215 1.00 92.01 C 6.330 19.142 12.083 1.00 92.94 N 7.568 19.089 12.868 1.00 92.94 C 7.272 18.806 14.343 1.00 92.94 C 7.983 18.012 14.957 1.00 92.94 O 8.373 20.391 12.673 1.00 92.94 C 8.827 20.587 11.206 1.00 92.94 C 9.588 20.450 13.617 1.00 92.94 C 9.825 19.565 10.648 1.00 92.94 C 6.217 19.406 14.906 1.00 92.62 N 5.770 19.146 16.279 1.00 92.62 C 5.450 17.667 16.487 1.00 92.62 C 5.925 17.088 17.458 1.00 92.62 O 4.565 20.046 16.593 1.00 92.62 C 4.071 19.883 18.038 1.00 92.62 C 2.880 20.810 18.310 1.00 92.62 C 2.387 20.619 19.750 1.00 92.62 C 1.244 21.515 20.063 1.00 92.62 N1+ 4.708 17.051 15.569 1.00 91.45 N 4.362 15.627 15.660 1.00 91.45 C 5.564 14.701 15.451 1.00 91.45 C 5.695 13.696 16.147 1.00 91.45 O 3.234 15.291 14.670 1.00 91.45 C 1.891 15.935 15.056 1.00 91.45 C 1.531 15.659 16.522 1.00 91.45 C 1.281 16.626 17.287 1.00 91.45 O 1.598 14.487 16.941 1.00 91.45 O1- 6.494 15.052 14.559 1.00 92.47 N 7.733 14.288 14.387 1.00 92.47 C 8.610 14.326 15.648 1.00 92.47 C 9.125 13.287 16.063 1.00 92.47 O 8.501 14.813 13.165 1.00 92.47 C 7.857 14.484 11.806 1.00 92.47 C 8.612 15.226 10.705 1.00 92.47 C 7.916 12.994 11.477 1.00 92.47 C 8.736 15.495 16.292 1.00 92.36 N 9.546 15.686 17.509 1.00 92.36 C 9.073 14.862 18.710 1.00 92.36 C 9.874 14.612 19.602 1.00 92.36 O 9.581 17.174 17.888 1.00 92.36 C 10.580 17.977 17.043 1.00 92.36 C 10.548 19.448 17.477 1.00 92.36 C 11.602 20.263 16.721 1.00 92.36 C 11.611 21.679 17.171 1.00 92.36 N1+ 7.811 14.410 18.734 1.00 89.41 N 7.297 13.531 19.803 1.00 89.41 C 7.966 12.156 19.831 1.00 89.41 C 7.927 11.504 20.862 1.00 89.41 O 5.784 13.319 19.665 1.00 89.41 C 4.950 14.595 19.812 1.00 89.41 C 3.473 14.194 19.844 1.00 89.41 C 2.570 15.352 19.741 1.00 89.41 N 1.373 15.455 20.280 1.00 89.41 C 0.900 14.589 21.129 1.00 89.41 N1+ 0.602 16.436 19.926 1.00 89.41 N 8.528 11.709 18.707 1.00 88.75 N 9.067 10.351 18.555 1.00 88.75 C 10.495 10.310 18.003 1.00 88.75 C 11.120 9.247 17.973 1.00 88.75 O 8.136 9.571 17.624 1.00 88.75 C 6.684 9.537 18.060 1.00 88.75 C 6.308 8.838 19.223 1.00 88.75 C 5.710 10.225 17.312 1.00 88.75 C 4.948 8.724 19.566 1.00 88.75 C 4.353 10.153 17.678 1.00 88.75 C 3.968 9.379 18.794 1.00 88.75 C 2.658 9.275 19.132 1.00 88.75 O 10.992 11.444 17.508 1.00 90.66 N 12.303 11.587 16.881 1.00 90.66 C 13.029 12.733 17.576 1.00 90.66 C 12.607 13.886 17.475 1.00 90.66 O 12.162 11.844 15.362 1.00 90.66 C 11.419 10.678 14.665 1.00 90.66 C 13.558 12.073 14.750 1.00 90.66 C 11.108 10.920 13.183 1.00 90.66 C 14.139 12.423 18.245 1.00 88.81 N 14.990 13.440 18.878 1.00 88.81 C 16.098 13.954 17.943 1.00 88.81 C 16.694 15.001 18.202 1.00 88.81 O 15.590 12.888 20.170 1.00 88.81 C 16.705 12.104 19.840 1.00 88.81 O 16.366 13.239 16.842 1.00 90.12 N 17.451 13.545 15.909 1.00 90.12 C 17.228 14.883 15.181 1.00 90.12 C 16.465 14.993 14.214 1.00 90.12 O 17.654 12.378 14.930 1.00 90.12 C 18.859 12.574 13.999 1.00 90.12 C 19.449 13.679 13.971 1.00 90.12 O 19.164 11.610 13.266 1.00 90.12 O1- 17.955 15.908 15.638 1.00 89.39 N 17.919 17.265 15.081 1.00 89.39 C 18.321 17.298 13.605 1.00 89.39 C 17.734 18.073 12.853 1.00 89.39 O 18.839 18.195 15.893 1.00 89.39 C 18.384 18.388 17.350 1.00 89.39 C 19.327 19.347 18.094 1.00 89.39 C 18.902 19.503 19.561 1.00 89.39 C 19.849 20.354 20.332 1.00 89.39 N1+ 19.277 16.467 13.183 1.00 88.99 N 19.762 16.439 11.802 1.00 88.99 C 18.695 15.932 10.833 1.00 88.99 C 18.471 16.522 9.776 1.00 88.99 O 17.966 14.884 11.225 1.00 91.75 N 16.836 14.378 10.445 1.00 91.75 C 15.691 15.398 10.355 1.00 91.75 C 15.150 15.639 9.273 1.00 91.75 O 16.345 13.064 11.059 1.00 91.75 C 15.218 12.436 10.263 1.00 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1.00 91.78 N 12.552 17.406 6.765 1.00 91.78 C 12.154 18.870 6.579 1.00 91.78 C 11.460 19.204 5.620 1.00 91.78 O 11.708 16.754 7.880 1.00 91.78 C 10.204 16.955 7.638 1.00 91.78 C 11.940 15.240 7.958 1.00 91.78 C 12.635 19.763 7.440 1.00 90.84 N 12.347 21.191 7.356 1.00 90.84 C 12.887 21.827 6.063 1.00 90.84 C 12.168 22.558 5.375 1.00 90.84 O 12.936 21.850 8.599 1.00 90.84 C 12.483 23.272 8.810 1.00 90.84 C 13.383 24.332 8.601 1.00 90.84 C 11.192 23.516 9.315 1.00 90.84 C 13.029 25.630 9.006 1.00 90.84 C 10.824 24.816 9.699 1.00 90.84 C 11.770 25.854 9.602 1.00 90.84 C 11.502 27.056 10.164 1.00 90.84 O 14.121 21.481 5.669 1.00 90.28 N 14.729 21.868 4.384 1.00 90.28 C 13.909 21.372 3.196 1.00 90.28 C 13.749 22.113 2.231 1.00 90.28 O 16.165 21.320 4.297 1.00 90.28 C 17.171 22.120 5.137 1.00 90.28 C 18.513 21.377 5.225 1.00 90.28 C 19.562 22.229 5.948 1.00 90.28 C 20.731 21.420 6.369 1.00 90.28 N1+ 13.372 20.150 3.257 1.00 90.37 N 12.521 19.605 2.199 1.00 90.37 C 11.217 20.395 2.051 1.00 90.37 C 10.838 20.740 0.933 1.00 90.37 O 12.220 18.126 2.486 1.00 90.37 C 11.276 17.499 1.451 1.00 90.37 C 11.881 17.408 0.050 1.00 90.37 C 10.920 16.092 1.885 1.00 90.37 C 10.537 20.679 3.165 1.00 89.53 N 9.272 21.419 3.167 1.00 89.53 C 9.439 22.845 2.616 1.00 89.53 C 8.540 23.360 1.956 1.00 89.53 O 8.705 21.434 4.600 1.00 89.53 C 8.249 20.068 5.142 1.00 89.53 C 7.776 20.206 6.590 1.00 89.53 C 7.107 19.478 4.322 1.00 89.53 C 10.616 23.452 2.821 1.00 89.14 N 10.958 24.813 2.373 1.00 89.14 C 11.710 24.890 1.040 1.00 89.14 C 12.052 25.996 0.626 1.00 89.14 O 11.730 25.523 3.496 1.00 89.14 C 10.826 25.789 4.705 1.00 89.14 C 11.589 26.550 5.790 1.00 89.14 C 10.653 27.034 6.817 1.00 89.14 N 10.770 28.106 7.579 1.00 89.14 C 11.848 28.846 7.581 1.00 89.14 N1+ 9.794 28.449 8.371 1.00 89.14 N 11.957 23.764 0.366 1.00 87.07 N 12.784 23.698 -0.847 1.00 87.07 C 12.225 24.495 -2.043 1.00 87.07 C 12.967 24.812 -2.971 1.00 87.07 O 12.963 22.223 -1.225 1.00 87.07 C 10.930 24.821 -2.028 1.00 86.48 N 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C 15.269 -9.980 3.138 1.00 65.57 O 13.743 -11.604 5.658 1.00 65.57 C 14.257 -12.507 6.782 1.00 65.57 C 15.366 -12.239 7.299 1.00 65.57 O 13.565 -13.520 7.025 1.00 65.57 O1- 13.260 -9.196 3.715 1.00 67.29 N 12.997 -8.629 2.389 1.00 67.29 C 14.093 -7.651 1.950 1.00 67.29 C 14.445 -7.601 0.769 1.00 67.29 O 11.615 -7.965 2.345 1.00 67.29 C 11.602 -6.643 2.861 1.00 67.29 O 14.651 -6.888 2.893 1.00 69.12 N 15.754 -5.960 2.659 1.00 69.12 C 17.070 -6.726 2.469 1.00 69.12 C 17.762 -6.473 1.477 1.00 69.12 O 15.804 -4.920 3.800 1.00 69.12 C 14.603 -3.959 3.672 1.00 69.12 C 17.127 -4.152 3.735 1.00 69.12 C 14.393 -3.089 4.912 1.00 69.12 C 17.364 -7.699 3.342 1.00 67.79 N 18.532 -8.587 3.262 1.00 67.79 C 18.597 -9.320 1.928 1.00 67.79 C 19.658 -9.367 1.330 1.00 67.79 O 18.527 -9.601 4.425 1.00 67.79 C 18.903 -8.956 5.764 1.00 67.79 C 18.929 -9.955 6.937 1.00 67.79 C 19.397 -9.138 8.143 1.00 67.79 C 19.354 -9.793 9.471 1.00 67.79 N1+ 17.477 -9.794 1.383 1.00 67.81 N 17.443 -10.429 0.058 1.00 67.81 C 17.650 -9.436 -1.101 1.00 67.81 C 18.210 -9.784 -2.146 1.00 67.81 O 16.112 -11.179 -0.117 1.00 67.81 C 16.006 -12.463 0.685 1.00 67.81 C 16.850 -13.549 0.381 1.00 67.81 C 15.060 -12.590 1.721 1.00 67.81 C 16.774 -14.736 1.136 1.00 67.81 C 15.012 -13.755 2.507 1.00 67.81 C 15.873 -14.831 2.217 1.00 67.81 C 15.823 -15.959 2.969 1.00 67.81 O 17.195 -8.186 -0.955 1.00 67.80 N 17.321 -7.168 -2.005 1.00 67.80 C 18.741 -6.599 -2.122 1.00 67.80 C 19.147 -6.226 -3.226 1.00 67.80 O 16.295 -6.041 -1.783 1.00 67.80 C 14.901 -6.442 -2.282 1.00 67.80 C 13.641 -5.123 -2.240 1.00 67.80 S 12.774 -5.552 -0.706 1.00 67.80 C 19.491 -6.532 -1.021 1.00 70.48 N 20.814 -5.907 -0.962 1.00 70.48 C 21.907 -6.610 -1.781 1.00 70.48 C 22.536 -5.932 -2.592 1.00 70.48 O 21.263 -5.785 0.499 1.00 70.48 C 20.919 -4.465 1.176 1.00 70.48 C 21.472 -4.546 2.581 1.00 70.48 C 21.562 -3.254 0.498 1.00 70.48 C 22.129 -7.932 -1.673 1.00 69.49 N 23.117 -8.630 -2.491 1.00 69.49 C 22.826 -8.448 -3.977 1.00 69.49 C 23.712 -8.148 -4.770 1.00 69.49 O 23.032 -10.104 -2.077 1.00 69.49 C 22.515 -10.040 -0.645 1.00 69.49 C 21.588 -8.834 -0.679 1.00 69.49 C 21.544 -8.497 -4.350 1.00 71.40 N 21.103 -8.223 -5.722 1.00 71.40 C 21.382 -6.769 -6.131 1.00 71.40 C 21.674 -6.496 -7.296 1.00 71.40 O 19.606 -8.535 -5.879 1.00 71.40 C 19.160 -8.458 -7.342 1.00 71.40 C 19.298 -9.845 -5.469 1.00 71.40 O 21.287 -5.812 -5.203 1.00 70.75 N 21.648 -4.413 -5.416 1.00 70.75 C 23.143 -4.252 -5.687 1.00 70.75 C 23.510 -3.747 -6.747 1.00 70.75 O 21.254 -3.578 -4.184 1.00 70.75 C 23.974 -4.724 -4.751 1.00 76.03 N 25.439 -4.670 -4.802 1.00 76.03 C 25.959 -5.351 -6.063 1.00 76.03 C 26.657 -4.730 -6.858 1.00 76.03 O 26.029 -5.286 -3.511 1.00 76.03 C 25.775 -4.429 -2.251 1.00 76.03 C 26.446 -4.985 -0.974 1.00 76.03 C 26.206 -4.002 0.187 1.00 76.03 C 26.858 -4.331 1.488 1.00 76.03 N1+ 25.470 -6.557 -6.348 1.00 76.19 N 25.808 -7.289 -7.563 1.00 76.19 C 25.383 -6.571 -8.853 1.00 76.19 C 25.935 -6.848 -9.908 1.00 76.19 O 25.155 -8.674 -7.492 1.00 76.19 C 24.384 -5.682 -8.831 1.00 76.33 N 24.010 -4.919 -10.024 1.00 76.33 C 24.916 -3.710 -10.269 1.00 76.33 C 25.167 -3.410 -11.432 1.00 76.33 O 22.536 -4.501 -9.948 1.00 76.33 C 21.572 -5.606 -10.325 1.00 76.33 C 20.439 -5.666 -9.672 1.00 76.33 N 21.766 -6.387 -11.248 1.00 76.33 O 25.372 -3.036 -9.212 1.00 76.14 N 26.298 -1.906 -9.319 1.00 76.14 C 27.736 -2.353 -9.611 1.00 76.14 C 28.436 -1.660 -10.337 1.00 76.14 O 26.218 -1.063 -8.040 1.00 76.14 C 25.047 -0.099 -8.018 1.00 76.14 C 25.138 1.111 -8.730 1.00 76.14 C 23.889 -0.379 -7.268 1.00 76.14 C 24.096 2.050 -8.667 1.00 76.14 C 22.850 0.565 -7.188 1.00 76.14 C 22.964 1.786 -7.879 1.00 76.14 C 28.139 -3.538 -9.139 1.00 81.98 N 29.483 -4.093 -9.352 1.00 81.98 C 29.627 -4.886 -10.666 1.00 81.98 C 30.620 -5.582 -10.866 1.00 81.98 O 29.876 -4.936 -8.124 1.00 81.98 C 30.027 -4.126 -6.848 1.00 81.98 C 30.285 -4.778 -5.740 1.00 81.98 N 29.909 -2.914 -6.816 1.00 81.98 O 28.633 -4.842 -11.562 1.00 83.58 N 28.733 -5.519 -12.862 1.00 83.58 C 29.666 -4.752 -13.797 1.00 83.58 C 29.551 -3.532 -13.863 1.00 83.58 O 27.357 -5.683 -13.510 1.00 83.58 C 26.734 -7.001 -13.065 1.00 83.58 C 25.227 -7.034 -13.310 1.00 83.58 C 24.695 -8.266 -12.582 1.00 83.58 C 23.221 -8.330 -12.610 1.00 83.58 N1+ 30.503 -5.442 -14.590 1.00 87.26 N 31.274 -4.789 -15.638 1.00 87.26 C 30.356 -4.231 -16.736 1.00 87.26 C 29.191 -4.624 -16.884 1.00 87.26 O 32.231 -5.864 -16.158 1.00 87.26 C 31.470 -7.166 -15.918 1.00 87.26 C 30.710 -6.885 -14.624 1.00 87.26 C 30.895 -3.309 -17.532 1.00 85.98 N 30.225 -2.764 -18.706 1.00 85.98 C 29.774 -3.889 -19.647 1.00 85.98 C 30.586 -4.687 -20.096 1.00 85.98 O 31.206 -1.832 -19.424 1.00 85.98 C 30.455 -1.159 -20.940 1.00 85.98 S 28.498 -3.912 -20.036 1.00 84.64 N 27.961 -4.989 -20.887 1.00 84.64 C 28.475 -4.985 -22.337 1.00 84.64 C 28.151 -5.903 -23.091 1.00 84.64 O 26.435 -4.924 -20.896 1.00 84.64 C 25.930 -5.103 -19.586 1.00 84.64 O 29.209 -3.944 -22.746 1.00 82.46 N 29.732 -3.776 -24.111 1.00 82.46 C 31.232 -4.052 -24.157 1.00 82.46 C 31.664 -4.877 -24.946 1.00 82.46 O 29.397 -2.376 -24.669 1.00 82.46 C 27.870 -2.167 -24.672 1.00 82.46 C 29.976 -2.181 -26.085 1.00 82.46 C 27.458 -0.777 -25.145 1.00 82.46 C 32.020 -3.364 -23.326 1.00 86.23 N 33.482 -3.462 -23.344 1.00 86.23 C 34.078 -4.206 -22.142 1.00 86.23 C 35.291 -4.214 -21.992 1.00 86.23 O 34.082 -2.056 -23.488 1.00 86.23 C 33.743 -1.044 -22.017 1.00 86.23 S 33.252 -4.750 -21.242 1.00 85.93 N 33.669 -5.413 -19.999 1.00 85.93 C 34.530 -4.569 -19.034 1.00 85.93 C 34.982 -5.085 -18.018 1.00 85.93 O 34.253 -6.800 -20.322 1.00 85.93 C 33.228 -7.760 -20.902 1.00 85.93 C 33.677 -8.759 -21.622 1.00 85.93 N 32.025 -7.639 -20.711 1.00 85.93 O 34.693 -3.261 -19.275 1.00 86.42 N 35.354 -2.341 -18.339 1.00 86.42 C 34.648 -2.321 -16.983 1.00 86.42 C 33.427 -2.151 -16.922 1.00 86.42 O 35.386 -0.921 -18.913 1.00 86.42 C 35.941 0.005 -17.997 1.00 86.42 O 35.422 -2.426 -15.908 1.00 85.46 N 34.986 -2.238 -14.513 1.00 85.46 C 35.103 -0.783 -14.050 1.00 85.46 C 34.561 -0.420 -13.009 1.00 85.46 O 35.822 -3.132 -13.587 1.00 85.46 C 35.534 -4.614 -13.830 1.00 85.46 C 37.188 -2.911 -13.855 1.00 85.46 O 35.770 0.062 -14.839 1.00 83.50 N 36.020 1.474 -14.534 1.00 83.50 C 34.785 2.314 -14.890 1.00 83.50 C 34.240 2.175 -15.993 1.00 83.50 O 37.293 1.965 -15.265 1.00 83.50 C 38.507 1.043 -14.977 1.00 83.50 C 37.606 3.416 -14.854 1.00 83.50 C 39.739 1.346 -15.837 1.00 83.50 C 34.369 3.185 -13.963 1.00 81.87 N 33.275 4.160 -14.101 1.00 81.87 C 32.001 3.580 -14.727 1.00 81.87 C 31.460 4.092 -15.715 1.00 81.87 O 33.764 5.436 -14.802 1.00 81.87 C 34.685 6.297 -13.939 1.00 81.87 C 34.727 6.067 -12.709 1.00 81.87 O 35.272 7.226 -14.534 1.00 81.87 O1- 31.532 2.466 -14.164 1.00 84.07 N 30.294 1.827 -14.606 1.00 84.07 C 29.083 2.577 -14.059 1.00 84.07 C 28.892 2.739 -12.854 1.00 84.07 O 30.248 0.328 -14.284 1.00 84.07 C 28.978 -0.282 -14.891 1.00 84.07 C 31.450 -0.405 -14.894 1.00 84.07 C 28.234 3.001 -14.983 1.00 86.06 N 26.986 3.704 -14.755 1.00 86.06 C 25.802 2.846 -15.209 1.00 86.06 C 25.850 2.109 -16.201 1.00 86.06 O 27.008 5.036 -15.513 1.00 86.06 C 27.959 6.071 -14.886 1.00 86.06 C 28.070 7.374 -15.694 1.00 86.06 C 28.998 8.165 -15.398 1.00 86.06 O 27.242 7.575 -16.612 1.00 86.06 O1- 24.690 2.951 -14.486 1.00 85.74 N 23.468 2.242 -14.849 1.00 85.74 C 22.697 3.001 -15.927 1.00 85.74 C 22.115 4.057 -15.664 1.00 85.74 O 22.624 1.976 -13.599 1.00 85.74 C 23.289 0.906 -12.729 1.00 85.74 C 23.333 -0.739 -13.506 1.00 85.74 S 22.126 -1.570 -12.463 1.00 85.74 C 22.633 2.412 -17.123 1.00 83.36 N 21.824 2.915 -18.223 1.00 83.36 C 20.360 2.485 -18.094 1.00 83.36 C 20.097 1.305 -17.857 1.00 83.36 O 22.418 2.530 -19.573 1.00 83.36 C 21.642 3.135 -20.715 1.00 83.36 C 20.931 2.459 -21.670 1.00 83.36 C 21.440 4.480 -20.937 1.00 83.36 N 20.648 4.608 -22.012 1.00 83.36 C 20.295 3.399 -22.486 1.00 83.36 N 19.403 3.402 -18.277 1.00 78.25 N 17.966 3.124 -18.126 1.00 78.25 C 17.136 3.473 -19.361 1.00 78.25 C 17.298 4.526 -19.967 1.00 78.25 O 17.381 3.895 -16.941 1.00 78.25 C 17.965 3.515 -15.619 1.00 78.25 C 17.351 2.824 -14.612 1.00 78.25 C 19.197 3.904 -15.167 1.00 78.25 N 19.319 3.493 -13.909 1.00 78.25 C 18.216 2.819 -13.516 1.00 78.25 N 16.119 2.650 -19.641 1.00 72.99 N 15.145 2.890 -20.718 1.00 72.99 C 13.721 2.998 -20.159 1.00 72.99 C 13.266 2.155 -19.379 1.00 72.99 O 15.276 1.819 -21.819 1.00 72.99 C 14.272 2.063 -22.951 1.00 72.99 C 16.670 1.835 -22.455 1.00 72.99 C 12.972 4.028 -20.591 1.00 65.69 N 11.600 4.326 -20.118 1.00 65.69 C 10.634 3.149 -20.330 1.00 65.69 C 9.899 2.757 -19.413 1.00 65.69 O 11.060 5.602 -20.806 1.00 65.69 C 11.745 6.893 -20.319 1.00 65.69 C 11.179 8.161 -20.987 1.00 65.69 C 11.902 9.414 -20.457 1.00 65.69 C 11.492 10.664 -21.152 1.00 65.69 N1+ 10.618 2.580 -21.535 1.00 65.19 N 9.732 1.480 -21.919 1.00 65.19 C 10.448 0.516 -22.867 1.00 65.19 C 11.156 0.947 -23.766 1.00 65.19 O 8.449 2.016 -22.579 1.00 65.19 C 7.592 2.877 -21.632 1.00 65.19 C 6.242 3.268 -22.224 1.00 65.19 C 5.498 4.137 -21.577 1.00 65.19 N 5.808 2.789 -23.251 1.00 65.19 O 10.231 -0.785 -22.668 1.00 61.87 N 10.675 -1.838 -23.578 1.00 61.87 C 9.446 -2.639 -23.993 1.00 61.87 C 8.702 -3.121 -23.135 1.00 61.87 O 11.713 -2.747 -22.898 1.00 61.87 C 13.037 -2.055 -22.545 1.00 61.87 C 13.883 -3.039 -21.759 1.00 61.87 C 13.854 -1.636 -23.762 1.00 61.87 C 9.229 -2.777 -25.296 1.00 59.40 N 8.183 -3.622 -25.856 1.00 59.40 C 8.826 -4.615 -26.822 1.00 59.40 C 9.636 -4.218 -27.650 1.00 59.40 O 7.116 -2.750 -26.535 1.00 59.40 C 5.941 -3.558 -27.021 1.00 59.40 C 4.957 -4.105 -26.245 1.00 59.40 C 5.670 -3.907 -28.323 1.00 59.40 N 4.555 -4.659 -28.329 1.00 59.40 C 4.107 -4.839 -27.077 1.00 59.40 N 8.462 -5.904 -26.769 1.00 52.59 N 9.046 -6.912 -27.680 1.00 52.59 C 8.802 -6.597 -29.160 1.00 52.59 C 9.617 -6.965 -29.989 1.00 52.59 O 8.566 -8.329 -27.339 1.00 52.59 C 9.265 -8.902 -26.097 1.00 52.59 C 8.862 -10.370 -25.914 1.00 52.59 C 9.518 -10.979 -24.743 1.00 52.59 N 9.369 -12.225 -24.324 1.00 52.59 C 8.567 -13.068 -24.916 1.00 52.59 N1+ 10.045 -12.659 -23.298 1.00 52.59 N 7.730 -5.874 -29.486 1.00 50.89 N 7.485 -5.393 -30.851 1.00 50.89 C 8.522 -4.377 -31.355 1.00 50.89 C 8.669 -4.229 -32.560 1.00 50.89 O 9.285 -3.726 -30.464 1.00 55.32 N 10.372 -2.823 -30.861 1.00 55.32 C 11.591 -3.550 -31.431 1.00 55.32 C 12.350 -2.907 -32.138 1.00 55.32 O 10.810 -1.913 -29.702 1.00 55.32 C 9.867 -0.727 -29.507 1.00 55.32 C 10.487 0.468 -28.296 1.00 55.32 S 9.520 1.924 -28.777 1.00 55.32 C 11.754 -4.866 -31.221 1.00 53.44 N 12.873 -5.635 -31.797 1.00 53.44 C 12.970 -5.494 -33.323 1.00 53.44 C 14.065 -5.533 -33.864 1.00 53.44 O 12.714 -7.126 -31.436 1.00 53.44 C 13.303 -7.483 -30.062 1.00 53.44 C 12.585 -8.694 -29.460 1.00 53.44 C 14.791 -7.813 -30.158 1.00 53.44 C 11.833 -5.306 -34.009 1.00 48.49 N 11.787 -5.101 -35.465 1.00 48.49 C 12.073 -3.654 -35.895 1.00 48.49 C 12.315 -3.420 -37.070 1.00 48.49 O 10.427 -5.570 -36.012 1.00 48.49 C 10.243 -7.094 -35.926 1.00 48.49 C 8.920 -7.516 -36.582 1.00 48.49 C 8.775 -9.043 -36.575 1.00 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