Q99258 y-mtPTM: Yeast Mitochondrial PTM Database

Basic Information

Name	3,4-dihydroxy-2-butanone 4-phosphate synthase (DHBP synthase) (EC 4.1.99.12)
Uniprot ID	Q99258
Systematic gene name	YDR487C
Standard gene name	RIB3
Gene names	RIB3 YDR487C D8035.30
Description from SGD	YDR487C RIB3 SGDID:S000002895, Chr IV from 1428980-1428354, Genome Release 64-3-1, reverse complement, Verified ORF, "3,4-dihydroxy-2-butanone-4-phosphate synthase (DHBP synthase); required for riboflavin biosynthesis from ribulose-5-phosphate, also has an unrelated function in mitochondrial respiration"
Protein length	208
Download	sequence (fasta, from Uniprot), modifications (csv format)
Database links	Uniprot, SGD, TheCellVision.org, FungiDB

Sequence

MFTPIDQAIE HFKQNKFVIV MDDAGRENEG DLICAAENVS TEQMAFLVRH
SSGYVCAPMT NAIADKLDLP LLRTGMKFES NDDDRHGTAY TITVDVAQGT
TTGISAHDRS MTCRALADSS S TPKSFLKPG HICPLRAADG GVLQRRGHTE
AGVDLCKLSG LSPVAVIGEL VNDDEQGTMM RLNDCQAFGK KHGIPLISIE
ELAQYLKK

Legend

X Phoshorylation
X K-acetylation

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;"> -21.558 0.489 10.274 1.00 82.65 N -22.168 0.955 9.006 1.00 82.65 C -21.040 1.447 8.126 1.00 82.65 C -20.162 2.116 8.659 1.00 82.65 O -23.207 2.065 9.248 1.00 82.65 C -23.921 2.528 7.970 1.00 82.65 C -25.136 3.850 8.232 1.00 82.65 S -26.532 2.933 8.934 1.00 82.65 C -21.041 1.077 6.849 1.00 95.05 N -20.036 1.538 5.898 1.00 95.05 C -20.312 2.980 5.459 1.00 95.05 C -21.459 3.433 5.424 1.00 95.05 O -19.975 0.577 4.710 1.00 95.05 C -19.438 -0.798 5.064 1.00 95.05 C -18.068 -0.956 5.324 1.00 95.05 C -20.282 -1.923 5.108 1.00 95.05 C -17.532 -2.217 5.628 1.00 95.05 C -19.752 -3.189 5.426 1.00 95.05 C -18.377 -3.337 5.681 1.00 95.05 C -19.244 3.714 5.187 1.00 97.90 N -19.277 5.070 4.652 1.00 97.90 C -19.600 5.010 3.155 1.00 97.90 C -19.032 4.175 2.454 1.00 97.90 O -17.925 5.765 4.887 1.00 97.90 C -17.956 7.233 4.469 1.00 97.90 C -17.589 5.745 6.262 1.00 97.90 O -20.470 5.888 2.625 1.00 97.88 N -20.674 5.995 1.183 1.00 97.88 C -19.353 6.206 0.422 1.00 97.88 C -18.493 6.972 0.862 1.00 97.88 O -21.641 7.168 1.009 1.00 97.88 C -22.437 7.163 2.311 1.00 97.88 C -21.372 6.783 3.336 1.00 97.88 C -19.185 5.522 -0.715 1.00 98.21 N -17.916 5.500 -1.467 1.00 98.21 C -17.480 6.901 -1.919 1.00 98.21 C -16.303 7.232 -1.832 1.00 98.21 O -18.022 4.530 -2.670 1.00 98.21 C -18.246 3.062 -2.241 1.00 98.21 C -16.796 4.622 -3.594 1.00 98.21 C -17.106 2.443 -1.424 1.00 98.21 C -18.416 7.753 -2.331 1.00 97.87 N -18.161 9.152 -2.691 1.00 97.87 C -17.558 9.953 -1.526 1.00 97.87 C -16.588 10.685 -1.712 1.00 97.87 O -19.469 9.790 -3.202 1.00 97.87 C -20.632 9.777 -2.192 1.00 97.87 C -20.791 8.756 -1.482 1.00 97.87 O -21.382 10.773 -2.144 1.00 97.87 O1- -18.057 9.755 -0.303 1.00 98.10 N -17.492 10.394 0.890 1.00 98.10 C -16.101 9.850 1.231 1.00 98.10 C -15.223 10.615 1.634 1.00 98.10 O -18.425 10.208 2.091 1.00 98.10 C -19.783 10.887 1.898 1.00 98.10 C -20.696 10.717 3.107 1.00 98.10 C -21.987 10.866 2.918 1.00 98.10 N -20.293 10.460 4.231 1.00 98.10 O -15.881 8.544 1.058 1.00 98.32 N -14.568 7.939 1.262 1.00 98.32 C -13.539 8.453 0.241 1.00 98.32 C -12.413 8.755 0.630 1.00 98.32 O -14.711 6.417 1.227 1.00 98.32 C -13.928 8.635 -1.026 1.00 98.47 N -13.082 9.233 -2.072 1.00 98.47 C -12.711 10.674 -1.710 1.00 98.47 C -11.536 11.028 -1.760 1.00 98.47 O -13.787 9.156 -3.447 1.00 98.47 C -13.854 7.696 -3.946 1.00 98.47 C -13.073 10.025 -4.501 1.00 98.47 C -14.916 7.497 -5.035 1.00 98.47 C -13.668 11.507 -1.292 1.00 98.05 N -13.364 12.884 -0.872 1.00 98.05 C -12.433 12.931 0.349 1.00 98.05 C -11.566 13.801 0.443 1.00 98.05 O -14.663 13.659 -0.596 1.00 98.05 C -15.465 13.968 -1.874 1.00 98.05 C -14.632 14.719 -2.925 1.00 98.05 C -14.504 14.226 -4.076 1.00 98.05 O -14.055 15.771 -2.571 1.00 98.05 O1- -12.550 11.963 1.260 1.00 97.27 N -11.615 11.811 2.372 1.00 97.27 C -10.211 11.414 1.889 1.00 97.27 C -9.219 12.017 2.301 1.00 97.27 O -12.182 10.783 3.359 1.00 97.27 C -11.588 10.906 4.733 1.00 97.27 C -11.978 11.808 5.681 1.00 97.27 C -10.628 10.101 5.303 1.00 97.27 N -10.452 10.513 6.570 1.00 97.27 C -11.233 11.574 6.838 1.00 97.27 N -10.128 10.440 0.983 1.00 98.30 N -8.880 9.918 0.425 1.00 98.30 C -8.117 10.978 -0.383 1.00 98.30 C -6.912 11.149 -0.192 1.00 98.30 O -9.222 8.696 -0.432 1.00 98.30 C -8.036 7.813 -0.736 1.00 98.30 C -7.270 8.011 -1.897 1.00 98.30 C -7.717 6.764 0.141 1.00 98.30 C -6.212 7.138 -2.197 1.00 98.30 C -6.670 5.887 -0.166 1.00 98.30 C -5.917 6.065 -1.339 1.00 98.30 C -8.829 11.776 -1.195 1.00 97.04 N -8.303 12.945 -1.931 1.00 97.04 C -7.569 13.944 -1.044 1.00 97.04 C -6.620 14.582 -1.483 1.00 97.04 O -9.462 13.689 -2.608 1.00 97.04 C -9.902 13.012 -3.902 1.00 97.04 C -11.062 13.784 -4.522 1.00 97.04 C -11.576 13.089 -5.781 1.00 97.04 C -12.845 13.713 -6.213 1.00 97.04 N1+ -7.989 14.076 0.211 1.00 96.73 N -7.368 14.966 1.195 1.00 96.73 C -6.128 14.347 1.858 1.00 96.73 C -5.716 14.809 2.923 1.00 96.73 O -8.415 15.399 2.229 1.00 96.73 C -9.541 16.228 1.602 1.00 96.73 C -10.673 16.519 2.580 1.00 96.73 C -11.660 17.269 2.148 1.00 96.73 N -10.688 16.125 3.746 1.00 96.73 O -5.547 13.304 1.256 1.00 95.26 N -4.422 12.548 1.792 1.00 95.26 C -4.717 11.969 3.185 1.00 95.26 C -3.905 12.052 4.105 1.00 95.26 O -3.154 13.409 1.712 1.00 95.26 C -1.934 12.621 2.125 1.00 95.26 C -1.139 13.163 3.010 1.00 95.26 N -1.696 11.525 1.648 1.00 95.26 O -5.913 11.410 3.372 1.00 98.11 N -6.301 10.750 4.622 1.00 98.11 C -6.497 9.261 4.396 1.00 98.11 C -6.742 8.814 3.279 1.00 98.11 O -7.557 11.390 5.207 1.00 98.11 C -7.403 12.885 5.510 1.00 98.11 C -8.742 13.417 6.010 1.00 98.11 C -8.695 14.913 6.289 1.00 98.11 C -10.075 15.437 6.396 1.00 98.11 N1+ -6.413 8.506 5.484 1.00 98.69 N -6.681 7.079 5.446 1.00 98.69 C -8.152 6.777 5.146 1.00 98.69 C -9.051 7.561 5.475 1.00 98.69 O -6.235 6.424 6.757 1.00 98.69 C -4.733 6.406 6.959 1.00 98.69 C -3.930 5.676 6.065 1.00 98.69 C -4.134 7.079 8.041 1.00 98.69 C -2.541 5.622 6.238 1.00 98.69 C -2.738 7.026 8.216 1.00 98.69 C -1.946 6.297 7.312 1.00 98.69 C -8.372 5.596 4.581 1.00 98.79 N -9.647 4.883 4.511 1.00 98.79 C -9.378 3.445 4.945 1.00 98.79 C -8.350 2.876 4.584 1.00 98.79 O -10.234 4.949 3.087 1.00 98.79 C -11.487 4.081 2.931 1.00 98.79 C -10.631 6.390 2.728 1.00 98.79 C -10.279 2.864 5.733 1.00 98.77 N -10.245 1.437 6.051 1.00 98.77 C -11.067 0.709 4.996 1.00 98.77 C -12.220 1.078 4.750 1.00 98.77 O -10.764 1.130 7.467 1.00 98.77 C -10.019 1.938 8.546 1.00 98.77 C -10.615 -0.376 7.761 1.00 98.77 C -10.800 2.010 9.860 1.00 98.77 C -10.496 -0.328 4.394 1.00 98.71 N -11.175 -1.135 3.378 1.00 98.71 C -11.284 -2.568 3.867 1.00 98.71 C -10.273 -3.235 4.059 1.00 98.71 O -10.458 -1.045 2.021 1.00 98.71 C -11.240 -1.813 0.950 1.00 98.71 C -10.325 0.415 1.567 1.00 98.71 C -12.518 -3.034 4.054 1.00 98.11 N -12.810 -4.438 4.340 1.00 98.11 C -12.877 -5.238 3.046 1.00 98.11 C -13.546 -4.815 2.096 1.00 98.11 O -14.148 -4.583 5.072 1.00 98.11 C -14.147 -3.934 6.454 1.00 98.11 C -12.977 -4.574 7.685 1.00 98.11 S -13.286 -6.363 7.623 1.00 98.11 C -12.266 -6.415 3.029 1.00 93.56 N -12.555 -7.408 2.000 1.00 93.56 C -13.749 -8.306 2.371 1.00 93.56 C -14.444 -8.102 3.372 1.00 93.56 O -11.284 -8.178 1.631 1.00 93.56 C -10.882 -9.273 2.615 1.00 93.56 C -11.227 -9.200 3.812 1.00 93.56 O -10.268 -10.241 2.114 1.00 93.56 O1- -14.046 -9.265 1.494 1.00 86.64 N -15.171 -10.177 1.665 1.00 86.64 C -14.916 -11.161 2.823 1.00 86.64 C -13.829 -11.719 2.962 1.00 86.64 O -15.459 -10.916 0.341 1.00 86.64 C -16.076 -10.019 -0.751 1.00 86.64 C -16.931 -9.181 -0.395 1.00 86.64 O -15.749 -10.199 -1.953 1.00 86.64 O1- -15.959 -11.480 3.600 1.00 79.10 N -15.857 -12.399 4.742 1.00 79.10 C -15.391 -13.826 4.373 1.00 79.10 C -14.968 -14.585 5.242 1.00 79.10 O -17.217 -12.446 5.450 1.00 79.10 C -15.508 -14.204 3.096 1.00 79.54 N -15.026 -15.479 2.558 1.00 79.54 C -13.622 -15.428 1.948 1.00 79.54 C -13.173 -16.455 1.444 1.00 79.54 O -12.961 -14.263 1.940 1.00 81.52 N -11.600 -14.074 1.428 1.00 81.52 C -10.611 -14.074 2.597 1.00 81.52 C -10.184 -15.153 2.997 1.00 81.52 O -11.560 -12.851 0.491 1.00 81.52 C -10.185 -12.702 -0.168 1.00 81.52 C -10.070 -11.456 -1.052 1.00 81.52 C -8.658 -11.238 -1.417 1.00 81.52 N -7.781 -10.622 -0.640 1.00 81.52 C -8.119 -9.923 0.396 1.00 81.52 N1+ -6.502 -10.741 -0.833 1.00 81.52 N -10.299 -12.918 3.177 1.00 83.23 N -9.470 -12.817 4.388 1.00 83.23 C -10.294 -12.324 5.597 1.00 83.23 C -9.996 -12.697 6.733 1.00 83.23 O -8.195 -11.988 4.100 1.00 83.23 C -7.336 -12.581 2.976 1.00 83.23 C -6.071 -11.785 2.597 1.00 83.23 C -4.981 -12.403 2.615 1.00 83.23 O -6.193 -10.686 2.005 1.00 83.23 O1- -11.406 -11.609 5.361 1.00 90.60 N -12.257 -10.989 6.385 1.00 90.60 C -11.479 -9.981 7.251 1.00 90.60 C -11.587 -9.981 8.484 1.00 90.60 O -12.993 -12.077 7.195 1.00 90.60 C -14.102 -11.544 8.088 1.00 90.60 C -14.375 -12.230 9.174 1.00 90.60 N -14.781 -10.562 7.834 1.00 90.60 O -10.664 -9.143 6.615 1.00 93.61 N -9.754 -8.197 7.276 1.00 93.61 C -9.918 -6.788 6.712 1.00 93.61 C -10.419 -6.572 5.602 1.00 93.61 O -8.265 -8.621 7.251 1.00 93.61 C -8.053 -10.124 7.097 1.00 93.61 C -6.742 -10.687 7.650 1.00 93.61 C -6.850 -11.590 8.527 1.00 93.61 O -5.668 -10.211 7.249 1.00 93.61 O1- -9.518 -5.815 7.525 1.00 97.46 N -9.472 -4.418 7.133 1.00 97.46 C -8.043 -3.953 6.914 1.00 97.46 C -7.228 -4.039 7.832 1.00 97.46 O -7.781 -3.349 5.760 1.00 98.59 N -6.523 -2.645 5.520 1.00 98.59 C -6.702 -1.158 5.742 1.00 98.59 C -7.717 -0.564 5.360 1.00 98.59 O -5.977 -2.864 4.110 1.00 98.59 C -5.327 -4.227 3.923 1.00 98.59 C -5.641 -5.132 4.722 1.00 98.59 O -4.507 -4.290 2.981 1.00 98.59 O1- -5.669 -0.536 6.299 1.00 98.61 N -5.547 0.908 6.321 1.00 98.61 C -4.874 1.384 5.031 1.00 98.61 C -3.707 1.082 4.795 1.00 98.61 O -4.767 1.311 7.578 1.00 98.61 C -4.915 2.803 7.884 1.00 98.61 C -6.327 3.140 8.368 1.00 98.61 C -3.924 3.222 8.967 1.00 98.61 C -5.599 2.151 4.216 1.00 98.76 N -5.162 2.558 2.875 1.00 98.76 C -5.046 4.082 2.781 1.00 98.76 C -5.961 4.803 3.183 1.00 98.76 O -6.106 1.980 1.793 1.00 98.76 C -6.340 0.462 2.016 1.00 98.76 C -5.586 2.285 0.372 1.00 98.76 C -6.902 -0.317 0.820 1.00 98.76 C -3.954 4.590 2.207 1.00 98.72 N -3.832 5.981 1.744 1.00 98.72 C -3.080 6.073 0.407 1.00 98.72 C -2.520 5.089 -0.077 1.00 98.72 O -3.186 6.867 2.820 1.00 98.72 C -1.448 6.421 3.095 1.00 98.72 S -3.063 7.261 -0.202 1.00 98.75 N -2.270 7.522 -1.399 1.00 98.75 C -0.781 7.664 -1.054 1.00 98.75 C -0.407 8.373 -0.118 1.00 98.75 O -2.801 8.776 -2.091 1.00 98.75 C 0.087 7.035 -1.846 1.00 98.87 N 1.523 7.058 -1.596 1.00 98.87 C 2.173 8.415 -1.893 1.00 98.87 C 3.150 8.758 -1.238 1.00 98.87 O 2.164 5.933 -2.406 1.00 98.87 C 1.638 9.206 -2.828 1.00 98.11 N 2.268 10.465 -3.263 1.00 98.11 C 2.404 11.516 -2.155 1.00 98.11 C 3.356 12.293 -2.159 1.00 98.11 O 1.519 11.040 -4.473 1.00 98.11 C 0.113 11.547 -4.143 1.00 98.11 C -0.543 12.154 -5.379 1.00 98.11 C -1.575 11.604 -5.796 1.00 98.11 O -0.008 13.132 -5.934 1.00 98.11 O1- 1.497 11.501 -1.174 1.00 95.24 N 1.435 12.500 -0.110 1.00 95.24 C 1.571 11.891 1.295 1.00 95.24 C 1.469 12.620 2.282 1.00 95.24 O 0.152 13.330 -0.297 1.00 95.24 C 0.198 14.248 -1.503 1.00 95.24 C -0.876 14.340 -2.254 1.00 95.24 N 1.178 14.919 -1.764 1.00 95.24 O 1.835 10.583 1.420 1.00 98.61 N 1.943 9.933 2.735 1.00 98.61 C 3.020 10.610 3.585 1.00 98.61 C 4.170 10.734 3.162 1.00 98.61 O 2.167 8.412 2.611 1.00 98.61 C 3.538 8.007 2.054 1.00 98.61 C 1.987 7.724 3.970 1.00 98.61 C 2.663 11.068 4.785 1.00 98.58 N 3.598 11.709 5.714 1.00 98.58 C 4.350 10.686 6.575 1.00 98.58 C 3.968 9.516 6.676 1.00 98.58 O 2.892 12.787 6.552 1.00 98.58 C 2.459 12.312 7.813 1.00 98.58 O 5.418 11.131 7.240 1.00 98.67 N 6.142 10.312 8.227 1.00 98.67 C 5.227 9.894 9.380 1.00 98.67 C 5.255 8.742 9.807 1.00 98.67 O 7.335 11.097 8.788 1.00 98.67 C 8.119 10.318 9.844 1.00 98.67 C 8.233 11.413 7.749 1.00 98.67 O 4.388 10.807 9.871 1.00 98.71 N 3.430 10.566 10.954 1.00 98.71 C 2.352 9.571 10.526 1.00 98.71 C 1.991 8.691 11.303 1.00 98.71 O 2.741 11.868 11.406 1.00 98.71 C 3.683 12.974 11.911 1.00 98.71 C 4.515 13.641 10.803 1.00 98.71 C 5.581 14.192 11.143 1.00 98.71 O 4.124 13.534 9.610 1.00 98.71 O1- 1.874 9.664 9.283 1.00 98.77 N 0.934 8.694 8.724 1.00 98.77 C 1.567 7.311 8.611 1.00 98.77 C 0.959 6.333 9.035 1.00 98.77 O 0.452 9.164 7.351 1.00 98.77 C -0.491 10.359 7.477 1.00 98.77 C -0.952 10.813 6.105 1.00 98.77 C -2.229 10.715 5.828 1.00 98.77 N -0.166 11.236 5.275 1.00 98.77 O 2.801 7.217 8.113 1.00 98.87 N 3.517 5.942 8.057 1.00 98.87 C 3.737 5.360 9.459 1.00 98.87 C 3.524 4.170 9.674 1.00 98.87 O 4.840 6.141 7.306 1.00 98.87 C 5.611 4.829 7.122 1.00 98.87 C 4.743 3.522 6.215 1.00 98.87 S 4.694 4.244 4.552 1.00 98.87 C 4.100 6.187 10.443 1.00 98.79 N 4.240 5.748 11.830 1.00 98.79 C 2.904 5.266 12.417 1.00 98.79 C 2.873 4.246 13.104 1.00 98.79 O 4.832 6.897 12.654 1.00 98.79 C 1.805 5.967 12.126 1.00 98.80 N 0.457 5.573 12.531 1.00 98.80 C 0.049 4.236 11.906 1.00 98.80 C -0.400 3.346 12.624 1.00 98.80 O -0.534 6.685 12.158 1.00 98.80 C -1.961 6.377 12.560 1.00 98.80 C -2.817 5.689 11.678 1.00 98.80 C -2.419 6.739 13.839 1.00 98.80 C -4.126 5.365 12.077 1.00 98.80 C -3.727 6.413 14.236 1.00 98.80 C -4.581 5.727 13.356 1.00 98.80 C 0.255 4.073 10.597 1.00 98.82 N -0.034 2.833 9.881 1.00 98.82 C 0.753 1.674 10.489 1.00 98.82 C 0.159 0.678 10.880 1.00 98.82 O 0.235 3.050 8.380 1.00 98.82 C -0.068 1.822 7.494 1.00 98.82 C -0.495 2.282 6.101 1.00 98.82 C 1.159 0.930 7.313 1.00 98.82 C 2.066 1.821 10.665 1.00 98.57 N 2.927 0.774 11.243 1.00 98.57 C 2.536 0.440 12.680 1.00 98.57 C 2.614 -0.715 13.076 1.00 98.57 O 4.395 1.222 11.177 1.00 98.57 C 5.366 0.296 11.927 1.00 98.57 C 4.841 1.285 9.712 1.00 98.57 C 2.105 1.429 13.469 1.00 98.14 N 1.672 1.217 14.856 1.00 98.14 C 0.382 0.398 14.968 1.00 98.14 C 0.178 -0.228 16.002 1.00 98.14 O 1.539 2.587 15.542 1.00 98.14 C 1.017 2.457 16.977 1.00 98.14 C 1.131 3.766 17.759 1.00 98.14 C 0.630 3.585 19.136 1.00 98.14 N 1.233 2.924 20.112 1.00 98.14 C 2.455 2.484 20.004 1.00 98.14 N1+ 0.602 2.660 21.221 1.00 98.14 N -0.495 0.464 13.970 1.00 98.49 N -1.842 -0.115 14.025 1.00 98.49 C -2.070 -1.265 13.035 1.00 98.49 C -3.170 -1.807 12.975 1.00 98.49 O -2.863 1.022 13.855 1.00 98.49 C -2.867 1.971 15.028 1.00 98.49 C -2.567 3.307 15.034 1.00 98.49 C -3.158 1.616 16.321 1.00 98.49 N -3.044 2.709 17.088 1.00 98.49 C -2.678 3.774 16.356 1.00 98.49 N -1.047 -1.637 12.269 1.00 98.42 N -1.084 -2.736 11.303 1.00 98.42 C -0.049 -3.804 11.640 1.00 98.42 C 0.753 -3.642 12.560 1.00 98.42 O -0.878 -2.213 9.871 1.00 98.42 C 0.415 -1.655 9.731 1.00 98.42 O -0.019 -4.863 10.836 1.00 96.54 N 1.028 -5.889 10.804 1.00 96.54 C 2.449 -5.307 10.683 1.00 96.54 C 3.438 -5.985 10.961 1.00 96.54 O 0.739 -6.796 9.594 1.00 96.54 C 0.945 -6.066 8.390 1.00 96.54 O 2.574 -4.050 10.237 1.00 97.08 N 3.843 -3.398 9.933 1.00 97.08 C 4.454 -3.848 8.603 1.00 97.08 C 5.494 -3.298 8.212 1.00 97.08 O 3.808 -4.785 7.898 1.00 97.43 N 4.207 -5.306 6.593 1.00 97.43 C 3.698 -4.400 5.466 1.00 97.43 C 2.715 -4.661 4.784 1.00 97.43 O 3.755 -6.765 6.455 1.00 97.43 C 4.419 -7.468 5.290 1.00 97.43 C 3.651 -7.923 4.204 1.00 97.43 C 5.816 -7.655 5.294 1.00 97.43 C 4.280 -8.577 3.128 1.00 97.43 C 6.450 -8.281 4.205 1.00 97.43 C 5.678 -8.746 3.118 1.00 97.43 C 6.287 -9.355 2.066 1.00 97.43 O 4.368 -3.259 5.318 1.00 98.78 N 3.882 -2.169 4.468 1.00 98.78 C 4.044 -2.501 2.992 1.00 98.78 C 5.163 -2.653 2.483 1.00 98.78 O 4.557 -0.836 4.815 1.00 98.78 C 4.019 0.312 3.956 1.00 98.78 C 4.275 -0.479 6.276 1.00 98.78 C 2.914 -2.511 2.295 1.00 98.81 N 2.856 -2.736 0.863 1.00 98.81 C 2.531 -1.444 0.103 1.00 98.81 C 1.853 -0.551 0.616 1.00 98.81 O 1.878 -3.876 0.570 1.00 98.81 C 2.484 -5.434 1.278 1.00 98.81 S 2.998 -1.355 -1.144 1.00 98.89 N 2.733 -0.237 -2.047 1.00 98.89 C 2.064 -0.720 -3.348 1.00 98.89 C 2.758 -0.987 -4.335 1.00 98.89 O 4.031 0.549 -2.281 1.00 98.89 C 0.727 -0.887 -3.366 1.00 98.88 N -0.004 -1.248 -4.574 1.00 98.88 C 0.163 -0.219 -5.681 1.00 98.88 C 0.054 0.978 -5.431 1.00 98.88 O -1.469 -1.360 -4.165 1.00 98.88 C -1.394 -1.671 -2.678 1.00 98.88 C -0.183 -0.859 -2.230 1.00 98.88 C 0.387 -0.676 -6.907 1.00 98.88 N 0.566 0.177 -8.078 1.00 98.88 C 0.111 -0.507 -9.362 1.00 98.88 C -0.083 -1.719 -9.421 1.00 98.88 O 2.032 0.613 -8.186 1.00 98.88 C 3.004 -0.554 -8.408 1.00 98.88 C 4.750 -0.079 -8.397 1.00 98.88 S 4.854 0.582 -6.715 1.00 98.88 C -0.030 0.277 -10.426 1.00 98.70 N -0.293 -0.262 -11.769 1.00 98.70 C 0.909 -1.022 -12.336 1.00 98.70 C 2.061 -0.696 -12.032 1.00 98.70 O -0.693 0.839 -12.759 1.00 98.70 C -1.923 1.614 -12.293 1.00 98.70 C 0.351 1.767 -12.946 1.00 98.70 O 0.650 -1.969 -13.245 1.00 98.45 N 1.705 -2.650 -14.002 1.00 98.45 C 2.613 -1.666 -14.746 1.00 98.45 C 3.828 -1.804 -14.689 1.00 98.45 O 1.071 -3.655 -14.977 1.00 98.45 C 0.531 -4.843 -14.220 1.00 98.45 C -0.767 -5.018 -14.195 1.00 98.45 N 1.294 -5.563 -13.588 1.00 98.45 O 2.042 -0.617 -15.346 1.00 98.53 N 2.802 0.399 -16.071 1.00 98.53 C 3.848 1.118 -15.196 1.00 98.53 C 4.964 1.369 -15.653 1.00 98.53 O 1.804 1.396 -16.671 1.00 98.53 C 3.518 1.439 -13.937 1.00 98.73 N 4.482 2.039 -12.997 1.00 98.73 C 5.545 1.016 -12.605 1.00 98.73 C 6.735 1.327 -12.644 1.00 98.73 O 3.772 2.634 -11.759 1.00 98.73 C 2.975 3.881 -12.202 1.00 98.73 C 4.777 3.007 -10.649 1.00 98.73 C 2.154 4.535 -11.088 1.00 98.73 C 5.132 -0.206 -12.273 1.00 98.67 N 6.063 -1.257 -11.890 1.00 98.67 C 7.044 -1.609 -13.027 1.00 98.67 C 8.231 -1.796 -12.770 1.00 98.67 O 5.240 -2.453 -11.415 1.00 98.67 C 6.590 -1.630 -14.282 1.00 98.33 N 7.438 -1.836 -15.463 1.00 98.33 C 8.403 -0.669 -15.670 1.00 98.33 C 9.601 -0.872 -15.862 1.00 98.33 O 6.566 -2.019 -16.718 1.00 98.33 C 5.769 -3.324 -16.716 1.00 98.33 C 6.179 -4.267 -15.998 1.00 98.33 O 4.736 -3.385 -17.410 1.00 98.33 O1- 7.909 0.570 -15.562 1.00 98.61 N 8.740 1.776 -15.673 1.00 98.61 C 9.868 1.803 -14.637 1.00 98.61 C 10.959 2.289 -14.937 1.00 98.61 O 7.826 2.998 -15.530 1.00 98.61 C 8.604 4.318 -15.588 1.00 98.61 C 7.694 5.477 -15.205 1.00 98.61 C 8.556 6.725 -15.046 1.00 98.61 C 7.807 7.753 -14.309 1.00 98.61 N1+ 9.599 1.338 -13.419 1.00 98.68 N 10.547 1.345 -12.301 1.00 98.68 C 11.393 0.065 -12.199 1.00 98.68 C 12.210 -0.036 -11.280 1.00 98.68 O 9.786 1.663 -11.001 1.00 98.68 C 9.123 3.053 -10.964 1.00 98.68 C 8.480 3.258 -9.595 1.00 98.68 C 10.122 4.185 -11.226 1.00 98.68 C 11.245 -0.861 -13.153 1.00 97.73 N 11.929 -2.159 -13.187 1.00 97.73 C 11.712 -2.960 -11.892 1.00 97.73 C 12.642 -3.312 -11.162 1.00 97.73 O 13.400 -1.968 -13.580 1.00 97.73 C 14.124 -3.278 -13.892 1.00 97.73 C 13.458 -4.228 -14.361 1.00 97.73 O 15.363 -3.284 -13.700 1.00 97.73 O1- 10.434 -3.179 -11.569 1.00 97.75 N 9.971 -3.933 -10.404 1.00 97.75 C 9.375 -5.276 -10.863 1.00 97.75 C 8.150 -5.391 -11.015 1.00 97.75 O 8.987 -3.074 -9.584 1.00 97.75 C 9.536 -1.707 -9.139 1.00 97.75 C 8.485 -0.966 -8.314 1.00 97.75 C 10.808 -1.821 -8.302 1.00 97.75 C 10.211 -6.294 -11.146 1.00 94.69 N 9.739 -7.620 -11.532 1.00 94.69 C 9.059 -8.335 -10.360 1.00 94.69 C 9.385 -8.098 -9.194 1.00 94.69 O 10.985 -8.376 -12.005 1.00 94.69 C 12.104 -7.744 -11.178 1.00 94.69 C 11.671 -6.282 -11.116 1.00 94.69 C 8.136 -9.248 -10.675 1.00 93.44 N 7.504 -10.123 -9.684 1.00 93.44 C 8.549 -11.018 -8.998 1.00 93.44 C 9.392 -11.609 -9.674 1.00 93.44 O 6.415 -10.984 -10.349 1.00 93.44 C 5.184 -10.220 -10.852 1.00 93.44 C 4.288 -11.169 -11.649 1.00 93.44 C 4.369 -9.651 -9.697 1.00 93.44 C 8.454 -11.188 -7.676 1.00 90.86 N 9.366 -12.056 -6.911 1.00 90.86 C 9.287 -13.516 -7.345 1.00 90.86 C 10.297 -14.208 -7.373 1.00 90.86 O 9.037 -11.995 -5.409 1.00 90.86 C 9.557 -10.742 -4.708 1.00 90.86 C 9.091 -10.726 -3.255 1.00 90.86 C 11.086 -10.648 -4.726 1.00 90.86 C 8.088 -13.976 -7.715 1.00 83.26 N 7.839 -15.363 -8.126 1.00 83.26 C 8.466 -15.715 -9.487 1.00 83.26 C 8.365 -16.850 -9.948 1.00 83.26 O 6.324 -15.622 -8.053 1.00 83.26 C 5.953 -17.112 -7.994 1.00 83.26 C 4.431 -17.278 -8.021 1.00 83.26 C 4.069 -18.683 -8.256 1.00 83.26 N 3.772 -19.576 -7.337 1.00 83.26 C 3.632 -19.286 -6.083 1.00 83.26 N1+ 3.621 -20.816 -7.653 1.00 83.26 N 9.124 -14.770 -10.159 1.00 78.60 N 9.812 -15.056 -11.425 1.00 78.60 C 11.011 -15.984 -11.207 1.00 78.60 C 11.776 -15.840 -10.260 1.00 78.60 O 10.219 -13.789 -12.191 1.00 78.60 C 8.993 -13.041 -12.702 1.00 78.60 C 10.991 -12.900 -11.423 1.00 78.60 O 11.165 -16.985 -12.079 1.00 76.85 N 12.268 -17.953 -12.008 1.00 76.85 C 12.120 -19.056 -10.948 1.00 76.85 C 13.036 -19.865 -10.788 1.00 76.85 O 10.988 -19.126 -10.240 1.00 77.91 N 10.694 -20.231 -9.322 1.00 77.91 C 10.261 -21.495 -10.083 1.00 77.91 C 9.720 -21.418 -11.182 1.00 77.91 O 9.653 -19.807 -8.278 1.00 77.91 C 10.134 -18.604 -7.456 1.00 77.91 C 9.092 -18.242 -6.022 1.00 77.91 S 9.820 -19.376 -4.818 1.00 77.91 C 10.510 -22.675 -9.498 1.00 75.13 N 10.231 -23.987 -10.122 1.00 75.13 C 8.803 -24.508 -9.911 1.00 75.13 C 8.501 -25.600 -10.375 1.00 75.13 O 11.241 -25.039 -9.630 1.00 75.13 C 12.676 -24.776 -10.097 1.00 75.13 C 13.569 -25.942 -9.656 1.00 75.13 C 15.006 -25.717 -10.127 1.00 75.13 C 15.880 -26.842 -9.716 1.00 75.13 N1+ 7.960 -23.799 -9.165 1.00 68.17 N 6.593 -24.246 -8.898 1.00 68.17 C 5.733 -24.133 -10.163 1.00 68.17 C 5.795 -23.128 -10.867 1.00 68.17 O 6.003 -23.450 -7.728 1.00 68.17 C 6.830 -23.513 -6.456 1.00 68.17 C 7.062 -24.748 -5.821 1.00 68.17 C 7.336 -22.332 -5.882 1.00 68.17 C 7.809 -24.806 -4.631 1.00 68.17 C 8.061 -22.392 -4.680 1.00 68.17 C 8.313 -23.626 -4.061 1.00 68.17 C 4.941 -25.168 -10.446 1.00 66.14 N 4.147 -25.280 -11.681 1.00 66.14 C 2.702 -24.772 -11.528 1.00 66.14 C 2.021 -24.538 -12.524 1.00 66.14 O 4.153 -26.740 -12.164 1.00 66.14 C 5.563 -27.250 -12.517 1.00 66.14 C 5.580 -28.681 -13.086 1.00 66.14 C 6.683 -29.121 -13.487 1.00 66.14 O 4.515 -29.338 -13.111 1.00 66.14 O1- 2.232 -24.572 -10.295 1.00 66.41 N 0.889 -24.077 -9.974 1.00 66.41 C 0.953 -22.992 -8.902 1.00 66.41 C 1.962 -22.866 -8.216 1.00 66.41 O -0.015 -25.231 -9.517 1.00 66.41 C 0.396 -25.729 -8.260 1.00 66.41 O -0.125 -22.219 -8.747 1.00 66.92 N -0.284 -21.237 -7.667 1.00 66.92 C -0.797 -21.877 -6.363 1.00 66.92 C -1.286 -21.166 -5.495 1.00 66.92 O -1.211 -20.097 -8.135 1.00 66.92 C -0.636 -19.243 -9.247 1.00 66.92 C -1.488 -18.653 -10.053 1.00 66.92 N 0.561 -19.083 -9.420 1.00 66.92 O -0.730 -23.204 -6.210 1.00 67.96 N -1.285 -23.882 -5.025 1.00 67.96 C -0.552 -23.499 -3.723 1.00 67.96 C -1.071 -23.685 -2.623 1.00 67.96 O -1.258 -25.405 -5.224 1.00 67.96 C -2.120 -25.891 -6.393 1.00 67.96 C -3.179 -25.286 -6.663 1.00 67.96 O -1.679 -26.859 -7.057 1.00 67.96 O1- 0.650 -22.934 -3.841 1.00 69.18 N 1.448 -22.354 -2.761 1.00 69.18 C 1.170 -20.853 -2.518 1.00 69.18 C 1.677 -20.296 -1.545 1.00 69.18 O 2.935 -22.626 -3.054 1.00 69.18 C 3.444 -21.905 -4.305 1.00 69.18 C 2.673 -21.732 -5.276 1.00 69.18 O 4.611 -21.470 -4.337 1.00 69.18 O1- 0.347 -20.202 -3.348 1.00 73.49 N -0.090 -18.809 -3.203 1.00 73.49 C -1.621 -18.721 -3.137 1.00 73.49 C -2.325 -18.655 -4.146 1.00 73.49 O 0.486 -17.938 -4.328 1.00 73.49 C 0.109 -16.455 -4.188 1.00 73.49 C -0.665 -16.079 -3.270 1.00 73.49 O 0.579 -15.672 -5.040 1.00 73.49 O1- -2.141 -18.662 -1.906 1.00 73.31 N -3.585 -18.658 -1.620 1.00 73.31 C -4.354 -17.533 -2.318 1.00 73.31 C -5.540 -17.709 -2.587 1.00 73.31 O -3.818 -18.561 -0.105 1.00 73.31 C -3.348 -19.818 0.636 1.00 73.31 C -3.662 -19.688 2.128 1.00 73.31 C -3.224 -20.892 2.863 1.00 73.31 N -2.546 -20.931 3.995 1.00 73.31 C -2.182 -19.851 4.630 1.00 73.31 N1+ -2.215 -22.079 4.516 1.00 73.31 N -3.717 -16.391 -2.589 1.00 78.28 N -4.399 -15.186 -3.081 1.00 78.28 C -3.834 -14.637 -4.395 1.00 78.28 C -4.331 -13.613 -4.888 1.00 78.28 O -4.424 -14.122 -1.969 1.00 78.28 C -5.151 -14.576 -0.727 1.00 78.28 C -6.325 -15.282 -0.684 1.00 78.28 C -4.739 -14.412 0.577 1.00 78.28 N -5.628 -15.024 1.371 1.00 78.28 C -6.613 -15.572 0.647 1.00 78.28 N -2.815 -15.285 -4.966 1.00 79.72 N -2.157 -14.826 -6.186 1.00 79.72 C -1.584 -13.417 -6.033 1.00 79.72 C -1.707 -12.615 -6.961 1.00 79.72 O -1.104 -13.044 -4.840 1.00 86.62 N -0.709 -11.655 -4.566 1.00 86.62 C 0.571 -11.329 -5.328 1.00 86.62 C 1.617 -11.947 -5.143 1.00 86.62 O -0.581 -11.343 -3.070 1.00 86.62 C -0.233 -9.873 -2.822 1.00 86.62 C -1.826 -11.545 -2.433 1.00 86.62 O 0.493 -10.323 -6.196 1.00 92.50 N 1.526 -10.001 -7.171 1.00 92.50 C 2.683 -9.175 -6.568 1.00 92.50 C 2.924 -8.031 -6.966 1.00 92.50 O 0.819 -9.336 -8.351 1.00 92.50 C 3.394 -9.763 -5.600 1.00 94.47 N 4.578 -9.176 -4.971 1.00 94.47 C 5.714 -8.971 -5.972 1.00 94.47 C 6.097 -9.897 -6.695 1.00 94.47 O 5.071 -10.051 -3.810 1.00 94.47 C 4.200 -10.017 -2.572 1.00 94.47 C 4.368 -8.975 -1.641 1.00 94.47 C 3.245 -11.026 -2.336 1.00 94.47 C 3.545 -8.909 -0.502 1.00 94.47 C 2.435 -10.973 -1.184 1.00 94.47 C 2.567 -9.899 -0.278 1.00 94.47 C 1.762 -9.801 0.809 1.00 94.47 O 6.301 -7.775 -5.967 1.00 96.26 N 7.540 -7.473 -6.695 1.00 96.26 C 8.747 -7.490 -5.773 1.00 96.26 C 8.615 -7.569 -4.551 1.00 96.26 O 7.481 -6.135 -7.446 1.00 96.26 C 6.185 -5.945 -8.235 1.00 96.26 C 7.633 -5.044 -6.576 1.00 96.26 O 9.944 -7.384 -6.356 1.00 96.58 N 11.150 -7.079 -5.581 1.00 96.58 C 10.891 -5.881 -4.657 1.00 96.58 C 10.307 -4.879 -5.082 1.00 96.58 O 12.368 -6.883 -6.509 1.00 96.58 C 13.710 -6.815 -5.752 1.00 96.58 C 12.233 -5.635 -7.397 1.00 96.58 C 14.059 -8.089 -4.972 1.00 96.58 C 11.272 -6.017 -3.387 1.00 98.47 N 11.094 -4.960 -2.389 1.00 98.47 C 12.068 -3.817 -2.643 1.00 98.47 C 13.087 -3.995 -3.317 1.00 98.47 O 11.227 -5.480 -0.953 1.00 98.47 C 10.242 -6.603 -0.641 1.00 98.47 C 12.523 -5.976 -0.706 1.00 98.47 O 11.764 -2.629 -2.127 1.00 98.77 N 12.513 -1.413 -2.464 1.00 98.77 C 12.672 -0.463 -1.291 1.00 98.77 C 11.812 -0.394 -0.419 1.00 98.77 O 11.867 -0.656 -3.640 1.00 98.77 C 11.806 -1.496 -4.914 1.00 98.77 C 10.445 -0.182 -3.331 1.00 98.77 C 13.758 0.303 -1.335 1.00 98.77 N 13.949 1.554 -0.599 1.00 98.77 C 14.346 2.636 -1.605 1.00 98.77 C 15.060 2.353 -2.572 1.00 98.77 O 15.038 1.420 0.476 1.00 98.77 C 14.609 0.575 1.673 1.00 98.77 C 13.420 0.598 2.050 1.00 98.77 O 15.470 -0.119 2.251 1.00 98.77 O1- 13.925 3.886 -1.407 1.00 98.63 N 14.472 4.992 -2.207 1.00 98.63 C 15.947 5.194 -1.854 1.00 98.63 C 16.333 5.165 -0.688 1.00 98.63 O 13.627 6.273 -2.115 1.00 98.63 C 13.656 6.943 -0.746 1.00 98.63 C 14.054 7.312 -3.156 1.00 98.63 C 16.787 5.374 -2.871 1.00 97.13 N 18.242 5.358 -2.738 1.00 97.13 C 18.831 6.649 -2.153 1.00 97.13 C 19.940 6.634 -1.628 1.00 97.13 O 18.832 5.065 -4.126 1.00 97.13 C 18.123 7.774 -2.279 1.00 96.30 N 18.575 9.076 -1.790 1.00 96.30 C 17.693 9.554 -0.640 1.00 96.30 C 16.474 9.419 -0.684 1.00 96.30 O 18.606 10.113 -2.922 1.00 96.30 C 19.641 9.774 -4.006 1.00 96.30 C 19.779 10.869 -5.061 1.00 96.30 C 20.555 10.640 -6.097 1.00 96.30 N 19.220 11.947 -4.988 1.00 96.30 O 18.321 10.145 0.377 1.00 94.10 N 17.639 10.726 1.535 1.00 94.10 C 17.302 9.736 2.652 1.00 94.10 C 17.017 10.182 3.758 1.00 94.10 O 17.375 8.425 2.405 1.00 94.29 N 17.169 7.377 3.418 1.00 94.29 C 18.460 7.033 4.163 1.00 94.29 C 19.565 7.402 3.761 1.00 94.29 O 16.575 6.100 2.801 1.00 94.29 C 15.193 6.320 2.209 1.00 94.29 C 17.406 5.648 1.764 1.00 94.29 O 18.304 6.323 5.280 1.00 94.22 N 19.396 5.767 6.084 1.00 94.22 C 19.434 4.246 5.944 1.00 94.22 C 20.032 3.724 5.011 1.00 94.22 O 19.316 6.235 7.548 1.00 94.22 C 19.513 7.742 7.689 1.00 94.22 C 18.075 5.911 8.149 1.00 94.22 O 18.788 3.520 6.856 1.00 95.52 N 18.642 2.063 6.798 1.00 95.52 C 17.413 1.624 6.008 1.00 95.52 C 17.307 0.440 5.716 1.00 95.52 O 18.567 1.461 8.206 1.00 95.52 C 19.818 1.741 9.037 1.00 95.52 C 17.484 2.015 8.917 1.00 95.52 O 16.477 2.530 5.695 1.00 97.28 N 15.259 2.226 4.934 1.00 97.28 C 14.031 1.889 5.791 1.00 97.28 C 12.912 2.236 5.427 1.00 97.28 O 14.210 1.290 6.975 1.00 98.12 N 13.093 0.720 7.764 1.00 98.12 C 12.243 1.747 8.534 1.00 98.12 C 11.096 1.469 8.910 1.00 98.12 O 13.632 -0.382 8.709 1.00 98.12 C 12.538 -1.202 9.431 1.00 98.12 C 14.556 0.199 9.795 1.00 98.12 C 11.498 -1.873 8.527 1.00 98.12 C 12.790 2.930 8.821 1.00 98.23 N 12.103 3.927 9.650 1.00 98.23 C 10.797 4.399 8.995 1.00 98.23 C 10.628 4.312 7.780 1.00 98.23 O 13.039 5.098 9.980 1.00 98.23 C 13.132 5.998 8.896 1.00 98.23 O 9.854 4.928 9.782 1.00 98.68 N 8.631 5.511 9.218 1.00 98.68 C 8.944 6.651 8.230 1.00 98.68 C 8.291 6.785 7.198 1.00 98.68 O 7.747 6.006 10.366 1.00 98.68 C 9.986 7.432 8.521 1.00 98.53 N 10.481 8.481 7.640 1.00 98.53 C 10.943 7.902 6.295 1.00 98.53 C 10.437 8.304 5.246 1.00 98.53 O 11.607 9.217 8.373 1.00 98.53 C 12.301 10.234 7.519 1.00 98.53 C 11.908 11.527 7.315 1.00 98.53 C 13.460 10.034 6.803 1.00 98.53 N 13.762 11.196 6.196 1.00 98.53 C 12.837 12.132 6.470 1.00 98.53 N 11.821 6.901 6.329 1.00 98.74 N 12.431 6.301 5.139 1.00 98.74 C 11.410 5.534 4.287 1.00 98.74 C 11.365 5.695 3.063 1.00 98.74 O 13.599 5.399 5.565 1.00 98.74 C 14.811 6.142 6.144 1.00 98.74 C 14.721 7.364 6.402 1.00 98.74 O 15.851 5.479 6.376 1.00 98.74 O1- 10.512 4.784 4.932 1.00 98.80 N 9.398 4.102 4.263 1.00 98.80 C 8.417 5.083 3.628 1.00 98.80 C 8.006 4.869 2.492 1.00 98.80 O 8.716 3.142 5.250 1.00 98.80 C 9.553 1.861 5.401 1.00 98.80 C 8.762 0.730 6.055 1.00 98.80 C 8.601 0.940 7.502 1.00 98.80 N 7.827 0.222 8.288 1.00 98.80 C 7.042 -0.708 7.822 1.00 98.80 N1+ 7.881 0.402 9.573 1.00 98.80 N 8.097 6.198 4.294 1.00 98.77 N 7.240 7.236 3.701 1.00 98.77 C 7.898 7.904 2.485 1.00 98.77 C 7.237 8.092 1.466 1.00 98.77 O 6.806 8.272 4.747 1.00 98.77 C 7.826 9.217 5.028 1.00 98.77 O 9.204 8.206 2.543 1.00 98.73 N 9.953 8.731 1.393 1.00 98.73 C 9.955 7.749 0.227 1.00 98.73 C 9.764 8.160 -0.914 1.00 98.73 O 11.409 9.034 1.770 1.00 98.73 C 11.559 10.353 2.522 1.00 98.73 C 13.263 10.904 2.765 1.00 98.73 S 13.874 9.447 3.635 1.00 98.73 C 10.126 6.459 0.515 1.00 98.90 N 10.093 5.408 -0.504 1.00 98.90 C 8.733 5.342 -1.192 1.00 98.90 C 8.682 5.365 -2.419 1.00 98.90 O 10.489 4.057 0.096 1.00 98.90 C 10.503 2.953 -0.958 1.00 98.90 C 11.792 4.161 0.627 1.00 98.90 O 7.630 5.349 -0.438 1.00 98.88 N 6.282 5.379 -1.012 1.00 98.88 C 6.046 6.623 -1.884 1.00 98.88 C 5.577 6.488 -3.016 1.00 98.88 O 5.252 5.281 0.118 1.00 98.88 C 5.333 3.635 0.880 1.00 98.88 S 6.439 7.818 -1.418 1.00 98.84 N 6.331 9.051 -2.221 1.00 98.84 C 7.146 8.964 -3.509 1.00 98.84 C 6.645 9.318 -4.569 1.00 98.84 O 6.733 10.288 -1.403 1.00 98.84 C 5.719 10.608 -0.293 1.00 98.84 C 5.950 11.980 0.350 1.00 98.84 C 7.281 12.110 0.982 1.00 98.84 N 7.633 11.677 2.181 1.00 98.84 C 6.841 11.031 2.975 1.00 98.84 N1+ 8.823 11.899 2.649 1.00 98.84 N 8.363 8.427 -3.440 1.00 98.81 N 9.200 8.226 -4.617 1.00 98.81 C 8.584 7.226 -5.609 1.00 98.81 C 8.691 7.440 -6.815 1.00 98.81 O 10.597 7.792 -4.162 1.00 98.81 C 7.927 6.154 -5.143 1.00 98.89 N 7.231 5.197 -6.022 1.00 98.89 C 6.073 5.851 -6.781 1.00 98.89 C 5.813 5.494 -7.928 1.00 98.89 O 6.713 3.992 -5.209 1.00 98.89 C 7.806 3.036 -4.703 1.00 98.89 C 7.216 2.058 -3.686 1.00 98.89 C 8.445 2.240 -5.842 1.00 98.89 C 5.405 6.818 -6.155 1.00 98.74 N 4.328 7.589 -6.763 1.00 98.74 C 4.817 8.747 -7.656 1.00 98.74 C 4.025 9.290 -8.432 1.00 98.74 O 3.449 8.093 -5.624 1.00 98.74 C 6.094 9.130 -7.563 1.00 98.62 N 6.678 10.246 -8.305 1.00 98.62 C 6.923 9.878 -9.779 1.00 98.62 C 7.688 8.974 -10.132 1.00 98.62 O 7.953 10.741 -7.601 1.00 98.62 C 8.541 12.027 -8.199 1.00 98.62 C 8.232 12.369 -9.367 1.00 98.62 O 9.365 12.666 -7.520 1.00 98.62 O1- 6.295 10.634 -10.679 1.00 97.75 N 6.432 10.459 -12.127 1.00 97.75 C 7.845 10.733 -12.668 1.00 97.75 C 8.158 10.299 -13.779 1.00 97.75 O 5.412 11.337 -12.850 1.00 97.75 C 5.765 12.702 -12.750 1.00 97.75 O 8.718 11.395 -11.915 1.00 98.24 N 10.121 11.618 -12.276 1.00 98.24 C 11.045 10.465 -11.868 1.00 98.24 C 12.161 10.363 -12.383 1.00 98.24 O 10.600 12.942 -11.682 1.00 98.24 C 10.813 12.846 -10.291 1.00 98.24 O 10.580 9.557 -11.000 1.00 98.56 N 11.369 8.411 -10.553 1.00 98.56 C 11.728 7.469 -11.699 1.00 98.56 C 10.959 7.233 -12.638 1.00 98.56 O 10.661 7.637 -9.443 1.00 98.56 C 10.751 8.369 -8.245 1.00 98.56 O 12.924 6.896 -11.586 1.00 98.60 N 13.501 5.936 -12.532 1.00 98.60 C 13.892 4.658 -11.789 1.00 98.60 C 13.979 4.675 -10.559 1.00 98.60 O 14.730 6.529 -13.247 1.00 98.60 C 14.478 7.900 -13.870 1.00 98.60 C 15.825 6.635 -12.362 1.00 98.60 O 14.227 3.558 -12.485 1.00 98.57 N 14.725 2.349 -11.830 1.00 98.57 C 15.899 2.589 -10.870 1.00 98.57 C 15.986 1.937 -9.832 1.00 98.57 O 15.141 1.432 -12.980 1.00 98.57 C 14.164 1.808 -14.089 1.00 98.57 C 14.034 3.319 -13.911 1.00 98.57 C 16.784 3.549 -11.178 1.00 98.19 N 17.951 3.896 -10.347 1.00 98.19 C 17.604 4.712 -9.100 1.00 98.19 C 18.461 4.863 -8.236 1.00 98.19 O 18.995 4.648 -11.184 1.00 98.19 C 19.644 3.752 -12.245 1.00 98.19 C 20.756 4.520 -12.966 1.00 98.19 C 21.440 3.606 -13.986 1.00 98.19 C 22.522 4.318 -14.709 1.00 98.19 N1+ 16.375 5.218 -8.993 1.00 98.53 N 15.897 5.896 -7.786 1.00 98.53 C 15.761 4.937 -6.599 1.00 98.53 C 15.687 5.407 -5.468 1.00 98.53 O 14.548 6.584 -8.042 1.00 98.53 C 14.633 7.519 -9.111 1.00 98.53 O 15.753 3.617 -6.831 1.00 98.76 N 15.475 2.611 -5.806 1.00 98.76 C 16.601 1.595 -5.641 1.00 98.76 C 17.065 0.999 -6.621 1.00 98.76 O 14.167 1.882 -6.126 1.00 98.76 C 12.988 2.816 -6.235 1.00 98.76 C 12.327 3.251 -5.071 1.00 98.76 C 12.601 3.302 -7.497 1.00 98.76 C 11.280 4.182 -5.171 1.00 98.76 C 11.559 4.233 -7.591 1.00 98.76 C 10.906 4.671 -6.433 1.00 98.76 C 16.950 1.339 -4.383 1.00 98.29 N 17.680 0.154 -3.949 1.00 98.29 C 16.743 -1.057 -3.996 1.00 98.29 C 15.546 -0.933 -3.735 1.00 98.29 O 18.224 0.364 -2.525 1.00 98.29 C 19.107 1.612 -2.350 1.00 98.29 C 19.527 1.759 -0.890 1.00 98.29 C 20.366 1.570 -3.221 1.00 98.29 C 17.293 -2.215 -4.369 1.00 96.51 N 16.573 -3.486 -4.515 1.00 96.51 C 17.470 -4.605 -3.959 1.00 96.51 C 18.555 -4.791 -4.517 1.00 96.51 O 16.230 -3.741 -6.000 1.00 96.51 C 15.421 -2.605 -6.644 1.00 96.51 C 15.023 -2.904 -8.095 1.00 96.51 C 14.361 -1.687 -8.753 1.00 96.51 C 15.335 -0.589 -8.953 1.00 96.51 N1+ 17.078 -5.346 -2.904 1.00 96.39 N 15.834 -5.224 -2.136 1.00 96.39 C 15.799 -3.986 -1.211 1.00 96.39 C 16.797 -3.279 -1.077 1.00 96.39 O 15.746 -6.531 -1.341 1.00 96.39 C 17.209 -6.862 -1.064 1.00 96.39 C 17.908 -6.404 -2.342 1.00 96.39 C 14.658 -3.764 -0.553 1.00 97.72 N 14.463 -2.784 0.527 1.00 97.72 C 13.261 -3.128 1.418 1.00 97.72 C 12.883 -4.301 1.497 1.00 97.72 O 12.663 -2.142 2.093 1.00 98.43 N 11.681 -2.354 3.170 1.00 98.43 C 10.221 -2.065 2.795 1.00 98.43 C 9.326 -2.369 3.586 1.00 98.43 O 12.085 -1.522 4.391 1.00 98.43 C 13.429 -1.899 4.951 1.00 98.43 C 13.687 -2.855 5.892 1.00 98.43 C 14.642 -1.393 4.555 1.00 98.43 N 15.600 -2.006 5.263 1.00 98.43 C 15.065 -2.893 6.119 1.00 98.43 N 9.954 -1.490 1.621 1.00 98.80 N 8.601 -1.406 1.054 1.00 98.80 C 8.376 -2.581 0.109 1.00 98.80 C 9.267 -2.914 -0.673 1.00 98.80 O 8.386 -0.044 0.359 1.00 98.80 C 8.416 1.125 1.368 1.00 98.80 C 7.078 -0.002 -0.454 1.00 98.80 C 7.365 1.040 2.481 1.00 98.80 C 7.184 -3.181 0.156 1.00 98.66 N 6.781 -4.282 -0.721 1.00 98.66 C 5.841 -3.777 -1.829 1.00 98.66 C 4.638 -3.648 -1.590 1.00 98.66 O 6.123 -5.381 0.129 1.00 98.66 C 7.255 -5.958 1.426 1.00 98.66 S 6.323 -3.457 -3.042 1.00 98.78 N 5.425 -3.063 -4.113 1.00 98.78 C 4.574 -4.250 -4.576 1.00 98.78 C 5.035 -5.394 -4.637 1.00 98.78 O 6.284 -2.460 -5.223 1.00 98.78 C 7.683 -2.348 -4.619 1.00 98.78 C 7.692 -3.394 -3.514 1.00 98.78 C 3.319 -3.956 -4.909 1.00 98.52 N 2.348 -4.932 -5.395 1.00 98.52 C 1.783 -4.463 -6.732 1.00 98.52 C 1.366 -3.313 -6.860 1.00 98.52 O 1.212 -5.114 -4.376 1.00 98.52 C 1.604 -5.658 -2.998 1.00 98.52 C 0.351 -5.789 -2.134 1.00 98.52 C 2.247 -7.027 -3.122 1.00 98.52 C 1.723 -5.351 -7.723 1.00 98.22 N 1.084 -5.049 -9.011 1.00 98.22 C -0.414 -5.326 -8.931 1.00 98.22 C -0.822 -6.473 -8.792 1.00 98.22 O 1.752 -5.859 -10.125 1.00 98.22 C 3.137 -5.301 -10.477 1.00 98.22 C 3.867 -6.277 -11.402 1.00 98.22 C 5.154 -5.742 -11.877 1.00 98.22 N 5.415 -5.292 -13.089 1.00 98.22 C 4.523 -5.208 -14.033 1.00 98.22 N1+ 6.614 -4.902 -13.383 1.00 98.22 N -1.229 -4.286 -9.037 1.00 98.38 N -2.671 -4.446 -9.157 1.00 98.38 C -3.042 -5.027 -10.526 1.00 98.38 C -2.415 -4.711 -11.544 1.00 98.38 O -3.357 -3.100 -8.909 1.00 98.38 C -4.100 -5.833 -10.560 1.00 97.36 N -4.746 -6.214 -11.808 1.00 97.36 C -5.223 -4.964 -12.577 1.00 97.36 C -5.768 -4.032 -11.982 1.00 97.36 O -5.901 -7.164 -11.482 1.00 97.36 C -5.055 -4.939 -13.903 1.00 97.56 N -5.369 -3.744 -14.703 1.00 97.56 C -6.859 -3.365 -14.641 1.00 97.56 C -7.194 -2.178 -14.637 1.00 97.56 O -4.927 -3.942 -16.161 1.00 97.56 C -3.405 -3.995 -16.341 1.00 97.56 C -2.669 -3.363 -15.543 1.00 97.56 O -2.973 -4.687 -17.284 1.00 97.56 O1- -7.746 -4.361 -14.521 1.00 97.23 N -9.183 -4.178 -14.306 1.00 97.23 C -9.591 -3.837 -12.867 1.00 97.23 C -10.789 -3.810 -12.582 1.00 97.23 O -8.636 -3.609 -11.959 1.00 97.50 N -8.902 -3.210 -10.577 1.00 97.50 C -9.758 -4.223 -9.813 1.00 97.50 C -9.710 -5.430 -10.080 1.00 97.50 O -10.585 -3.738 -8.883 1.00 97.11 N -11.417 -4.599 -8.018 1.00 97.11 C -12.479 -5.383 -8.785 1.00 97.11 C -12.998 -6.384 -8.290 1.00 97.11 O -12.063 -3.842 -6.848 1.00 97.11 C -11.004 -3.268 -5.907 1.00 97.11 C -13.002 -2.725 -7.302 1.00 97.11 C -12.790 -4.963 -10.016 1.00 96.92 N -13.685 -5.691 -10.914 1.00 96.92 C -13.034 -6.959 -11.482 1.00 96.92 C -13.753 -7.885 -11.855 1.00 96.92 O -14.153 -4.764 -12.049 1.00 96.92 C -14.890 -3.491 -11.596 1.00 96.92 C -15.357 -2.709 -12.824 1.00 96.92 C -16.119 -3.819 -10.750 1.00 96.92 C -11.700 -7.011 -11.529 1.00 94.86 N -10.932 -8.177 -11.961 1.00 94.86 C -10.430 -9.009 -10.774 1.00 94.86 C -10.561 -10.233 -10.798 1.00 94.86 O -9.785 -7.701 -12.862 1.00 94.86 C -8.967 -8.872 -13.430 1.00 94.86 C -7.846 -8.420 -14.360 1.00 94.86 C -6.907 -9.286 -14.666 1.00 94.86 N -7.767 -7.289 -14.810 1.00 94.86 O -9.874 -8.372 -9.736 1.00 93.33 N -9.392 -9.041 -8.517 1.00 93.33 C -9.841 -8.273 -7.279 1.00 93.33 C -9.461 -7.132 -7.073 1.00 93.33 O -7.862 -9.200 -8.578 1.00 93.33 C -7.300 -9.882 -7.319 1.00 93.33 C -5.778 -10.043 -7.398 1.00 93.33 C -5.236 -10.662 -6.173 1.00 93.33 N -4.835 -10.036 -5.081 1.00 93.33 C -4.952 -8.753 -4.889 1.00 93.33 N1+ -4.276 -10.740 -4.140 1.00 93.33 N -10.625 -8.925 -6.421 1.00 93.66 N -11.224 -8.337 -5.209 1.00 93.66 C -10.249 -8.293 -4.024 1.00 93.66 C -10.545 -8.848 -2.972 1.00 93.66 O -12.510 -9.104 -4.867 1.00 93.66 C -13.615 -8.881 -5.900 1.00 93.66 C -14.741 -9.875 -5.620 1.00 93.66 C -15.978 -9.466 -6.297 1.00 93.66 N -16.974 -8.849 -5.694 1.00 93.66 C -16.974 -8.603 -4.418 1.00 93.66 N1+ -18.030 -8.480 -6.356 1.00 93.66 N -9.070 -7.705 -4.210 1.00 94.24 N -8.064 -7.554 -3.155 1.00 94.24 C -7.816 -6.097 -2.773 1.00 94.24 C -8.112 -5.175 -3.538 1.00 94.24 O -7.220 -5.881 -1.598 1.00 97.52 N -6.828 -4.545 -1.129 1.00 97.52 C -5.791 -3.880 -2.034 1.00 97.52 C -5.794 -2.659 -2.183 1.00 97.52 O -6.290 -4.650 0.296 1.00 97.52 C -7.274 -5.272 1.246 1.00 97.52 C -8.147 -4.605 2.053 1.00 97.52 C -7.374 -6.638 1.488 1.00 97.52 N -8.192 -6.750 2.548 1.00 97.52 C -8.708 -5.554 2.877 1.00 97.52 N -4.962 -4.681 -2.710 1.00 97.90 N -4.047 -4.216 -3.760 1.00 97.90 C -4.789 -3.420 -4.833 1.00 97.90 C -4.443 -2.273 -5.117 1.00 97.90 O -3.340 -5.404 -4.432 1.00 97.90 C -2.215 -4.960 -5.360 1.00 97.90 C -2.801 -6.281 -3.465 1.00 97.90 O -5.834 -4.005 -5.414 1.00 98.32 N -6.635 -3.348 -6.441 1.00 98.32 C -7.438 -2.184 -5.867 1.00 98.32 C -7.468 -1.112 -6.470 1.00 98.32 O -7.583 -4.356 -7.088 1.00 98.32 C -6.883 -5.337 -8.034 1.00 98.32 C -5.973 -6.340 -7.323 1.00 98.32 C -4.896 -6.635 -7.882 1.00 98.32 O -6.325 -6.851 -6.233 1.00 98.32 O1- -8.027 -2.362 -4.681 1.00 98.54 N -8.808 -1.316 -4.031 1.00 98.54 C -7.975 -0.050 -3.784 1.00 98.54 C -8.451 1.053 -4.048 1.00 98.54 O -9.390 -1.870 -2.728 1.00 98.54 C -6.721 -0.192 -3.343 1.00 98.67 N -5.813 0.937 -3.154 1.00 98.67 C -5.547 1.701 -4.451 1.00 98.67 C -5.653 2.927 -4.479 1.00 98.67 O -5.268 0.990 -5.547 1.00 98.83 N -5.030 1.617 -6.858 1.00 98.83 C -6.294 2.287 -7.402 1.00 98.83 C -6.213 3.398 -7.932 1.00 98.83 O -4.453 0.591 -7.852 1.00 98.83 C -4.348 1.143 -9.279 1.00 98.83 C -3.041 0.188 -7.411 1.00 98.83 C -7.459 1.658 -7.259 1.00 98.79 N -8.729 2.224 -7.718 1.00 98.79 C -9.133 3.458 -6.907 1.00 98.79 C -9.566 4.450 -7.494 1.00 98.79 O -9.829 1.155 -7.697 1.00 98.79 C -9.691 0.125 -8.827 1.00 98.79 C -8.992 0.409 -9.836 1.00 98.79 O -10.329 -0.944 -8.700 1.00 98.79 O1- -8.916 3.462 -5.588 1.00 98.78 N -9.122 4.647 -4.752 1.00 98.78 C -8.222 5.808 -5.185 1.00 98.78 C -8.713 6.933 -5.298 1.00 98.78 O -8.882 4.303 -3.273 1.00 98.78 C -10.024 3.510 -2.615 1.00 98.78 C -9.562 3.029 -1.239 1.00 98.78 C -11.288 4.356 -2.429 1.00 98.78 C -6.946 5.554 -5.500 1.00 98.75 N -6.066 6.582 -6.061 1.00 98.75 C -6.610 7.128 -7.392 1.00 98.75 C -6.736 8.344 -7.548 1.00 98.75 O -4.643 6.040 -6.240 1.00 98.75 C -3.823 5.779 -4.642 1.00 98.75 S -7.006 6.252 -8.327 1.00 98.40 N -7.550 6.655 -9.639 1.00 98.40 C -8.836 7.476 -9.509 1.00 98.40 C -8.932 8.549 -10.099 1.00 98.40 O -7.822 5.417 -10.503 1.00 98.40 C -6.562 4.712 -11.030 1.00 98.40 C -6.999 3.394 -11.685 1.00 98.40 C -5.838 2.558 -12.230 1.00 98.40 C -6.327 1.195 -12.581 1.00 98.40 N1+ -9.800 7.009 -8.713 1.00 98.33 N -11.061 7.715 -8.438 1.00 98.33 C -10.833 9.065 -7.746 1.00 98.33 C -11.629 9.995 -7.889 1.00 98.33 O -11.944 6.820 -7.550 1.00 98.33 C -12.544 5.597 -8.267 1.00 98.33 C -13.225 4.690 -7.243 1.00 98.33 C -13.575 6.020 -9.316 1.00 98.33 C -9.722 9.183 -7.022 1.00 98.00 N -9.306 10.411 -6.352 1.00 98.00 C -8.531 11.376 -7.257 1.00 98.00 C -8.274 12.503 -6.845 1.00 98.00 O -8.525 10.066 -5.086 1.00 98.00 C -9.365 9.325 -4.224 1.00 98.00 O -8.183 10.989 -8.490 1.00 97.55 N -7.334 11.800 -9.372 1.00 97.55 C -5.886 11.918 -8.880 1.00 97.55 C -5.216 12.901 -9.184 1.00 97.55 O -5.437 10.935 -8.100 1.00 98.20 N -4.118 10.851 -7.479 1.00 98.20 C -3.206 9.898 -8.267 1.00 98.20 C -3.677 9.086 -9.074 1.00 98.20 O -4.325 10.414 -6.013 1.00 98.20 C -5.024 11.465 -5.122 1.00 98.20 C -5.133 10.915 -3.701 1.00 98.20 C -4.353 12.838 -5.014 1.00 98.20 C -1.894 9.973 -8.030 1.00 98.43 N -0.936 9.009 -8.584 1.00 98.43 C -1.369 7.588 -8.196 1.00 98.43 C -1.653 7.350 -7.018 1.00 98.43 O 0.481 9.287 -8.082 1.00 98.43 C 1.401 8.421 -8.728 1.00 98.43 O -1.459 6.626 -9.140 1.00 98.60 N -2.058 5.315 -8.897 1.00 98.60 C -1.073 4.363 -8.201 1.00 98.60 C -0.796 3.259 -8.680 1.00 98.60 O -2.566 4.864 -10.265 1.00 98.60 C -1.507 5.426 -11.206 1.00 98.60 C -1.160 6.770 -10.558 1.00 98.60 C -0.541 4.838 -7.074 1.00 98.90 N 0.275 4.130 -6.096 1.00 98.90 C -0.326 4.399 -4.718 1.00 98.90 C -0.475 5.553 -4.308 1.00 98.90 O 1.752 4.559 -6.138 1.00 98.90 C 2.607 3.673 -5.222 1.00 98.90 C 2.318 4.470 -7.557 1.00 98.90 C -0.685 3.340 -4.009 1.00 98.89 N -1.232 3.403 -2.661 1.00 98.89 C -0.205 2.924 -1.629 1.00 98.89 C 0.855 2.406 -1.976 1.00 98.89 O -2.535 2.595 -2.628 1.00 98.89 C -0.542 3.084 -0.355 1.00 98.93 N 0.109 2.429 0.781 1.00 98.93 C -0.963 1.655 1.524 1.00 98.93 C -2.012 2.228 1.820 1.00 98.93 O 0.772 3.440 1.729 1.00 98.93 C 1.560 2.738 2.838 1.00 98.93 C 1.738 4.351 0.971 1.00 98.93 C -0.698 0.383 1.813 1.00 98.70 N -1.605 -0.484 2.573 1.00 98.70 C -0.866 -1.186 3.712 1.00 98.70 C 0.350 -1.400 3.645 1.00 98.70 O -2.375 -1.480 1.670 1.00 98.70 C -1.471 -2.583 1.090 1.00 98.70 C -3.105 -0.711 0.561 1.00 98.70 C -2.209 -3.639 0.258 1.00 98.70 C -1.620 -1.531 4.750 1.00 98.31 N -1.194 -2.424 5.820 1.00 98.31 C -2.407 -2.994 6.546 1.00 98.31 C -3.335 -2.250 6.886 1.00 98.31 O -2.381 -4.298 6.786 1.00 97.87 N -3.470 -5.061 7.392 1.00 97.87 C -3.572 -4.711 8.879 1.00 97.87 C -2.587 -4.796 9.619 1.00 97.87 O -3.257 -6.577 7.225 1.00 97.87 C -2.998 -7.101 5.799 1.00 97.87 C -1.591 -6.806 5.251 1.00 97.87 C -1.367 -7.010 4.037 1.00 97.87 O -0.708 -6.387 6.053 1.00 97.87 O1- -4.748 -4.283 9.335 1.00 98.69 N -4.946 -3.831 10.711 1.00 98.69 C -4.879 -4.993 11.711 1.00 98.69 C -5.491 -6.044 11.517 1.00 98.69 O -6.280 -3.084 10.830 1.00 98.69 C -6.305 -1.699 10.163 1.00 98.69 C -7.747 -1.188 10.124 1.00 98.69 C -5.470 -0.678 10.945 1.00 98.69 C -4.204 -4.759 12.838 1.00 98.40 N -4.042 -5.741 13.924 1.00 98.40 C -4.551 -5.183 15.247 1.00 98.40 C -4.395 -3.998 15.547 1.00 98.40 O -2.590 -6.241 14.064 1.00 98.40 C -2.112 -6.895 12.768 1.00 98.40 C -1.608 -5.134 14.465 1.00 98.40 C -5.164 -6.042 16.051 1.00 97.96 N -5.535 -5.747 17.423 1.00 97.96 C -4.283 -5.666 18.307 1.00 97.96 C -3.341 -6.445 18.167 1.00 97.96 O -6.531 -6.808 17.925 1.00 97.96 C -7.915 -6.647 17.319 1.00 97.96 C -8.515 -7.706 16.827 1.00 97.96 N -8.471 -5.557 17.308 1.00 97.96 O -4.304 -4.729 19.255 1.00 95.22 N -3.285 -4.583 20.303 1.00 95.22 C -3.606 -5.538 21.466 1.00 95.22 C -3.906 -5.123 22.588 1.00 95.22 O -3.188 -3.097 20.701 1.00 95.22 C -1.955 -2.714 21.537 1.00 95.22 C -0.993 -3.507 21.619 1.00 95.22 O -1.941 -1.547 22.011 1.00 95.22 O1- -3.665 -6.831 21.145 1.00 95.38 N -3.831 -7.930 22.092 1.00 95.38 C -2.567 -8.804 22.135 1.00 95.38 C -1.672 -8.695 21.299 1.00 95.38 O -5.134 -8.711 21.818 1.00 95.38 C -5.164 -9.516 20.512 1.00 95.38 C -4.170 -10.200 20.201 1.00 95.38 O -6.212 -9.523 19.834 1.00 95.38 O1- -2.475 -9.684 23.132 1.00 95.54 N -1.304 -10.548 23.330 1.00 95.54 C -1.049 -11.529 22.168 1.00 95.54 C 0.032 -12.115 22.084 1.00 95.54 O -1.499 -11.351 24.623 1.00 95.54 C -1.385 -10.545 25.920 1.00 95.54 C -1.569 -11.430 27.168 1.00 95.54 C -1.516 -10.865 28.285 1.00 95.54 O -1.759 -12.662 27.018 1.00 95.54 O1- -2.034 -11.753 21.295 1.00 95.46 N -1.946 -12.656 20.149 1.00 95.46 C -1.744 -11.905 18.822 1.00 95.46 C -1.509 -12.558 17.805 1.00 95.46 O -3.197 -13.551 20.110 1.00 95.46 C -3.232 -14.633 21.201 1.00 95.46 C -3.545 -14.110 22.601 1.00 95.46 C -2.577 -14.086 23.491 1.00 95.46 N -4.672 -13.779 22.930 1.00 95.46 O -1.821 -10.569 18.819 1.00 93.15 N -1.782 -9.738 17.618 1.00 93.15 C -2.872 -10.111 16.615 1.00 93.15 C -2.584 -10.209 15.422 1.00 93.15 O -4.092 -10.417 17.079 1.00 96.45 N -5.147 -10.903 16.175 1.00 96.45 C -5.488 -9.878 15.093 1.00 96.45 C -5.454 -8.674 15.321 1.00 96.45 O -6.429 -11.351 16.891 1.00 96.45 C -6.185 -12.455 17.913 1.00 96.45 C -7.120 -10.293 17.514 1.00 96.45 O -5.838 -10.342 13.895 1.00 96.81 N -6.235 -9.448 12.806 1.00 96.81 C -7.573 -8.775 13.123 1.00 96.81 C -8.512 -9.440 13.577 1.00 96.81 O -6.316 -10.228 11.491 1.00 96.81 C -4.996 -10.902 11.098 1.00 96.81 C -3.537 -9.839 11.075 1.00 96.81 S -4.025 -8.639 9.809 1.00 96.81 C -7.679 -7.472 12.853 1.00 97.28 N -8.930 -6.747 13.060 1.00 97.28 C -10.018 -7.279 12.125 1.00 97.28 C -9.852 -7.347 10.904 1.00 97.28 O -8.754 -5.237 12.859 1.00 97.28 C -8.016 -4.563 14.014 1.00 97.28 C -8.241 -2.759 14.067 1.00 97.28 S -7.335 -2.407 15.592 1.00 97.28 C -11.168 -7.629 12.707 1.00 95.78 N -12.385 -7.992 11.967 1.00 95.78 C -13.319 -6.790 11.869 1.00 95.78 C -13.069 -5.733 12.441 1.00 95.78 O -13.028 -9.235 12.619 1.00 95.78 C -12.090 -10.457 12.728 1.00 95.78 C -11.559 -10.881 11.357 1.00 95.78 C -10.582 -11.990 11.413 1.00 95.78 N -9.458 -12.010 10.710 1.00 95.78 C -9.107 -11.027 9.957 1.00 95.78 N1+ -8.623 -13.006 10.706 1.00 95.78 N -14.446 -6.955 11.174 1.00 95.88 N -15.389 -5.864 10.891 1.00 95.88 C -15.743 -5.000 12.117 1.00 95.88 C -15.757 -3.775 12.015 1.00 95.88 O -16.662 -6.468 10.269 1.00 95.88 C -17.750 -5.431 9.926 1.00 95.88 C -17.267 -4.408 8.899 1.00 95.88 C -18.981 -6.134 9.357 1.00 95.88 C -16.034 -5.613 13.269 1.00 95.86 N -16.397 -4.869 14.481 1.00 95.86 C -15.218 -4.052 15.035 1.00 95.86 C -15.416 -2.908 15.452 1.00 95.86 O -16.936 -5.844 15.540 1.00 95.86 C -18.300 -6.420 15.204 1.00 95.86 C -18.669 -7.502 15.846 1.00 95.86 N -19.054 -5.924 14.384 1.00 95.86 O -14.006 -4.606 14.985 1.00 97.15 N -12.780 -3.932 15.419 1.00 97.15 C -12.486 -2.747 14.496 1.00 97.15 C -12.311 -1.623 14.965 1.00 97.15 O -11.591 -4.908 15.433 1.00 97.15 C -11.880 -6.213 16.176 1.00 97.15 C -12.567 -6.154 17.221 1.00 97.15 O -11.504 -7.271 15.617 1.00 97.15 O1- -12.568 -2.952 13.176 1.00 98.09 N -12.398 -1.899 12.174 1.00 98.09 C -13.456 -0.792 12.300 1.00 98.09 C -13.137 0.386 12.141 1.00 98.09 O -12.444 -2.526 10.777 1.00 98.09 C -11.007 -3.600 10.527 1.00 98.09 S -14.707 -1.127 12.634 1.00 97.53 N -15.748 -0.132 12.922 1.00 97.53 C -15.415 0.702 14.164 1.00 97.53 C -15.561 1.929 14.143 1.00 97.53 O -17.108 -0.822 13.115 1.00 97.53 C -17.748 -1.219 11.781 1.00 97.53 C -19.080 -1.940 11.937 1.00 97.53 C -19.757 -2.234 10.847 1.00 97.53 N -19.601 -2.183 13.007 1.00 97.53 O -14.964 0.060 15.244 1.00 97.96 N -14.563 0.749 16.466 1.00 97.96 C -13.322 1.625 16.238 1.00 97.96 C -13.296 2.784 16.662 1.00 97.96 O -14.336 -0.298 17.563 1.00 97.96 C -12.331 1.104 15.515 1.00 98.35 N -11.108 1.804 15.143 1.00 98.35 C -11.400 3.014 14.248 1.00 98.35 C -10.993 4.132 14.574 1.00 98.35 O -10.159 0.806 14.468 1.00 98.35 C -8.814 1.408 14.127 1.00 98.35 C -8.568 1.899 12.835 1.00 98.35 C -7.810 1.488 15.106 1.00 98.35 C -7.330 2.479 12.517 1.00 98.35 C -6.568 2.065 14.790 1.00 98.35 C -6.327 2.559 13.497 1.00 98.35 C -12.194 2.832 13.188 1.00 98.41 N -12.623 3.909 12.295 1.00 98.41 C -13.359 5.018 13.042 1.00 98.41 C -13.025 6.193 12.899 1.00 98.41 O -14.280 4.665 13.949 1.00 98.09 N -14.967 5.647 14.803 1.00 98.09 C -14.005 6.386 15.739 1.00 98.09 C -14.123 7.599 15.886 1.00 98.09 O -16.081 4.941 15.586 1.00 98.09 C -16.910 5.935 16.413 1.00 98.09 C -18.007 5.206 17.191 1.00 98.09 C -18.791 6.217 18.032 1.00 98.09 C -19.824 5.541 18.856 1.00 98.09 N1+ -13.073 5.672 16.377 1.00 98.30 N -12.093 6.242 17.317 1.00 98.30 C -11.164 7.248 16.638 1.00 98.30 C -10.837 8.265 17.241 1.00 98.30 O -11.301 5.087 17.951 1.00 98.30 C -10.187 5.551 18.903 1.00 98.30 C -9.420 4.336 19.429 1.00 98.30 C -8.187 4.777 20.221 1.00 98.30 C -7.321 3.610 20.522 1.00 98.30 N1+ -10.742 6.958 15.410 1.00 98.07 N -9.747 7.751 14.687 1.00 98.07 C -10.345 8.671 13.612 1.00 98.07 C -9.604 9.406 12.966 1.00 98.07 O -8.664 6.799 14.159 1.00 98.07 C -7.866 6.185 15.284 1.00 98.07 C -7.997 4.931 15.819 1.00 98.07 C -6.882 6.825 15.997 1.00 98.07 N -6.422 5.977 16.929 1.00 98.07 C -7.101 4.820 16.897 1.00 98.07 N -11.670 8.663 13.428 1.00 97.35 N -12.344 9.456 12.397 1.00 97.35 C -12.004 9.001 10.976 1.00 97.35 C -11.885 9.833 10.083 1.00 97.35 O -11.806 7.696 10.777 1.00 98.61 N -11.403 7.106 9.499 1.00 98.61 C -12.621 6.417 8.865 1.00 98.61 C -13.215 5.545 9.509 1.00 98.61 O -10.199 6.151 9.666 1.00 98.61 C -9.038 6.868 10.395 1.00 98.61 C -9.740 5.669 8.284 1.00 98.61 C -7.803 6.000 10.647 1.00 98.61 C -13.012 6.788 7.630 1.00 98.52 N -14.067 6.111 6.887 1.00 98.52 C -13.794 4.618 6.741 1.00 98.52 C -12.656 4.212 6.512 1.00 98.52 O -14.107 6.778 5.512 1.00 98.52 C -13.585 8.179 5.794 1.00 98.52 C -12.527 7.923 6.863 1.00 98.52 C -14.854 3.820 6.824 1.00 98.62 N -14.810 2.377 6.618 1.00 98.62 C -15.662 2.043 5.400 1.00 98.62 C -16.857 2.331 5.413 1.00 98.62 O -15.328 1.680 7.886 1.00 98.62 C -15.369 0.145 7.771 1.00 98.62 C -13.975 -0.457 7.750 1.00 98.62 C -16.120 -0.437 8.961 1.00 98.62 C -15.080 1.407 4.393 1.00 98.52 N -15.784 0.920 3.198 1.00 98.52 C -15.525 -0.575 3.003 1.00 98.52 C -14.710 -1.169 3.712 1.00 98.52 O -15.406 1.747 1.949 1.00 98.52 C -13.940 1.536 1.521 1.00 98.52 C -15.706 3.234 2.194 1.00 98.52 C -13.587 2.200 0.185 1.00 98.52 C -16.197 -1.181 2.027 1.00 97.96 N -15.921 -2.549 1.585 1.00 97.96 C -15.501 -2.613 0.114 1.00 97.96 C -15.899 -1.771 -0.697 1.00 97.96 O -17.133 -3.439 1.857 1.00 97.96 C -18.250 -2.996 1.112 1.00 97.96 O -14.723 -3.638 -0.249 1.00 97.81 N -14.370 -3.927 -1.650 1.00 97.81 C -15.631 -4.173 -2.488 1.00 97.81 C -15.697 -3.722 -3.630 1.00 97.81 O -13.385 -5.121 -1.737 1.00 97.81 C -12.036 -4.725 -1.094 1.00 97.81 C -13.174 -5.579 -3.194 1.00 97.81 C -10.947 -5.801 -1.151 1.00 97.81 C -16.652 -4.833 -1.930 1.00 96.00 N -17.930 -5.050 -2.618 1.00 96.00 C -18.621 -3.724 -2.970 1.00 96.00 C -19.018 -3.530 -4.119 1.00 96.00 O -18.832 -5.959 -1.764 1.00 96.00 C -20.248 -6.190 -2.334 1.00 96.00 C -20.294 -6.816 -3.741 1.00 96.00 C -21.302 -6.638 -4.462 1.00 96.00 O -19.329 -7.483 -4.160 1.00 96.00 O1- -18.724 -2.777 -2.033 1.00 96.73 N -19.320 -1.461 -2.308 1.00 96.73 C -18.493 -0.652 -3.315 1.00 96.73 C -19.065 0.004 -4.190 1.00 96.73 O -19.465 -0.663 -1.009 1.00 96.73 C -20.600 -1.191 -0.115 1.00 96.73 C -20.529 -0.616 1.306 1.00 96.73 C -21.605 -0.414 1.916 1.00 96.73 O -19.387 -0.437 1.796 1.00 96.73 O1- -17.159 -0.731 -3.248 1.00 98.26 N -16.271 -0.095 -4.225 1.00 98.26 C -16.468 -0.689 -5.630 1.00 98.26 C -16.599 0.050 -6.608 1.00 98.26 O -14.817 -0.225 -3.735 1.00 98.26 C -13.773 0.435 -4.657 1.00 98.26 C -14.007 1.938 -4.820 1.00 98.26 C -12.374 0.228 -4.080 1.00 98.26 C -16.569 -2.015 -5.740 1.00 97.48 N -16.841 -2.699 -7.001 1.00 97.48 C -18.229 -2.347 -7.561 1.00 97.48 C -18.386 -2.168 -8.769 1.00 97.48 O -16.691 -4.209 -6.775 1.00 97.48 C -19.249 -2.218 -6.709 1.00 97.02 N -20.576 -1.756 -7.128 1.00 97.02 C -20.559 -0.302 -7.603 1.00 97.02 C -21.253 0.028 -8.563 1.00 97.02 O -21.569 -1.889 -5.973 1.00 97.02 C -21.948 -3.343 -5.668 1.00 97.02 C -22.866 -3.440 -4.455 1.00 97.02 C -23.102 -4.623 -3.946 1.00 97.02 N -23.423 -2.465 -3.972 1.00 97.02 O -19.779 0.563 -6.951 1.00 97.88 N -19.612 1.957 -7.355 1.00 97.88 C -18.968 2.074 -8.743 1.00 97.88 C -19.465 2.831 -9.568 1.00 97.88 O -18.806 2.690 -6.276 1.00 97.88 C -18.604 4.164 -6.552 1.00 97.88 C -17.461 4.597 -7.251 1.00 97.88 C -19.553 5.103 -6.100 1.00 97.88 C -17.271 5.967 -7.506 1.00 97.88 C -19.361 6.476 -6.347 1.00 97.88 C -18.218 6.908 -7.055 1.00 97.88 C -18.020 8.231 -7.292 1.00 97.88 O -17.939 1.270 -9.031 1.00 97.06 N -17.222 1.257 -10.317 1.00 97.06 C -18.011 0.660 -11.494 1.00 97.06 C -17.628 0.852 -12.644 1.00 97.06 O -15.914 0.472 -10.123 1.00 97.06 C -14.826 1.257 -9.376 1.00 97.06 C -13.746 0.291 -8.909 1.00 97.06 C -14.179 2.305 -10.283 1.00 97.06 C -19.086 -0.093 -11.231 1.00 94.30 N -19.969 -0.643 -12.277 1.00 94.30 C -21.014 0.354 -12.787 1.00 94.30 C -21.690 0.036 -13.764 1.00 94.30 O -20.675 -1.900 -11.750 1.00 94.30 C -19.750 -3.118 -11.719 1.00 94.30 C -20.472 -4.285 -11.043 1.00 94.30 C -19.538 -5.491 -10.951 1.00 94.30 C -20.181 -6.605 -10.214 1.00 94.30 N1+ -21.211 1.471 -12.084 1.00 82.71 N -22.176 2.518 -12.445 1.00 82.71 C -21.593 3.440 -13.504 1.00 82.71 C -22.384 3.840 -14.384 1.00 82.71 O -22.567 3.330 -11.206 1.00 82.71 C -23.337 2.497 -10.177 1.00 82.71 C -23.617 3.347 -8.937 1.00 82.71 C -24.330 2.494 -7.888 1.00 82.71 C -24.550 3.259 -6.638 1.00 82.71 N1+ -20.398 3.761 -13.358 1.00 82.71 O1- id="glmol01_rep" style="display: none;"> 245,253,261,269,275,435,441,446,453,1007,1013,1020,1028,1234,1239,1246,1254,1258,1468,1476,1484 ,92,103,112,315,322,331,340,348,353,364,372,379,390,468,476,481,489,494,502,511,805,810,820,828,839,845,853,860,866,877,882,890,928,935,944,1115,1125,1132,1141,1146,1150,1157,1165,1173,1179,1188,1196,1362,1370,1378,1386,1392,1401,1406,1417,1421,1430,1439,1490,1498,1507,1516,1524,1529,1538,1550,1558 19,27-907,927-942,949-1419,1429-1575 -26,908-926,943-948 .198,-34.108,34.108,0.450,20.000,-1.000,-0.000,0.000,0.000,-1.000,0.000,0.000,0.000,1.000 id="glmol01_viewbox" style="left: 30%; z-index:1;"> style="overflow: auto;"> type="radio" value="true" checked>Use imported representation
style="border: 2px solid white; position: absolute; color: white; left: 10%; top: 10%; padding: 5px; z-index:101;"> from server... It may take a while.

If you believe something went wrong, please make sure PDB ID is correct.
Please also make sure that WebGL is enabled in your browser.

Internet Explorer: sorry. IE doesn't support WebGL.
Firefox (version 4 or later): try force enable WebGL.
Chrome: try force enable WebGL.
Safari: enable WebGL.

References

[3, Phos]	Lanz MC, Yugandhar K, Gupta S, Sanford EJ, Faça VM, Vega S, Joiner AMN, Fromme JC, Yu H, Smolka MB (2021). In-depth and 3-dimensional exploration of the budding yeast phosphoproteome. EMBO Reports, e51121. (Publication) (All modifications)
[3, Phos]	Vlastaridis P, Kyriakidou P, Chaliotis A, et al (2017) Estimating the total number of phosphoproteins and phosphorylation sites in eukaryotic proteomes. GigaScience 6:1–11. (Publication) (All modifications)
[3, Phos]	Bai Y, Chen B, Li M, et al (2017) FPD: A comprehensive phosphorylation database in fungi. Fungal Biology 121:869–875. (Publication) (All modifications)
[3, Phos]	Holt, L.J., Tuch, B.B., Villén, J., Johnson, A.D., Gygi, S.P., Morgan, D.O. (2009). Global analysis of Cdk1 substrate phosphorylation sites provides insights into evolution. Science 325(5948): 1682-1686. (Publication) (All modifications)
[3, Phos]	Frankovsky, J., Vozáriková, V., Nosek, J., Tomáška, Ľ. (2021a). Mitochondrial protein phosphorylation in yeast revisited.Mitochondrion 57:148-162. (Publication) (All modifications)
[120, Phos]	Lanz MC, Yugandhar K, Gupta S, Sanford EJ, Faça VM, Vega S, Joiner AMN, Fromme JC, Yu H, Smolka MB (2021). In-depth and 3-dimensional exploration of the budding yeast phosphoproteome. EMBO Reports, e51121. (Publication) (All modifications)
[120, Phos]	Zhou, X., Li, W., Liu, Y., Amon, A. (2021. Cross-compartment signal propagation in the mitotic exit network. Elife 10:e63645. (Publication) (All modifications)
[121, Phos]	Lanz MC, Yugandhar K, Gupta S, Sanford EJ, Faça VM, Vega S, Joiner AMN, Fromme JC, Yu H, Smolka MB (2021). In-depth and 3-dimensional exploration of the budding yeast phosphoproteome. EMBO Reports, e51121. (Publication) (All modifications)
[122, Phos]	Bai Y, Chen B, Li M, et al (2017) FPD: A comprehensive phosphorylation database in fungi. Fungal Biology 121:869–875. (Publication) (All modifications)
[122, Phos]	Zhou, X., Li, W., Liu, Y., Amon, A. (2021. Cross-compartment signal propagation in the mitotic exit network. Elife 10:e63645. (Publication) (All modifications)
[122, Phos]	MacGilvray, M.E., Shishkova, E., Place, M., Wagner, E.R., Coon, J.J., Gasch, A.P. (2020). Phosphoproteome response to dithiothreitol reveals unique versus shared features of Saccharomyces cerevisiae stress responses. Journal of Proteome Research 19(8): 3405-3417. (Publication) (All modifications)
[122, Phos]	Frankovsky, J., Vozáriková, V., Nosek, J., Tomáška, Ľ. (2021a). Mitochondrial protein phosphorylation in yeast revisited.Mitochondrion 57:148-162. (Publication) (All modifications)
[125, Phos]	Lanz MC, Yugandhar K, Gupta S, Sanford EJ, Faça VM, Vega S, Joiner AMN, Fromme JC, Yu H, Smolka MB (2021). In-depth and 3-dimensional exploration of the budding yeast phosphoproteome. EMBO Reports, e51121. (Publication) (All modifications)
[190, K-acetyl]	Henriksen, P., Wagner, S. A., Weinert, B. T., et al. (2012). Proteome-wide analysis of lysine acetylation suggests its broad regulatory scope in Saccharomyces cerevisiae. Molecular & Cellular Proteomics, 11(11), 1510-1522. (Publication) (All modifications)