HEADER PROTEIN 01-JUL-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 01-JUL-21 0 HETATM 1 C UNK 0 -7.136 4.121 -3.695 0.00 0.00 C+0 HETATM 2 C UNK 0 -7.146 5.079 -2.545 0.00 0.00 C+0 HETATM 3 C UNK 0 -8.109 4.639 -1.429 0.00 0.00 C+0 HETATM 4 C UNK 0 -8.015 5.682 -0.377 0.00 0.00 C+0 HETATM 5 C UNK 0 -7.702 3.229 -0.941 0.00 0.00 C+0 HETATM 6 N UNK 0 -8.634 2.847 0.091 0.00 0.00 N+0 HETATM 7 C UNK 0 -9.318 1.650 0.256 0.00 0.00 C+0 HETATM 8 O UNK 0 -9.227 1.115 1.435 0.00 0.00 O+0 HETATM 9 C UNK 0 -10.139 0.876 -0.691 0.00 0.00 C+0 HETATM 10 C UNK 0 -9.294 -0.011 -1.581 0.00 0.00 C+0 HETATM 11 C UNK 0 -10.012 0.062 -2.906 0.00 0.00 C+0 HETATM 12 C UNK 0 -10.536 1.450 -2.905 0.00 0.00 C+0 HETATM 13 N UNK 0 -11.050 1.595 -1.517 0.00 0.00 N+0 HETATM 14 C UNK 0 -12.176 2.275 -1.024 0.00 0.00 C+0 HETATM 15 O UNK 0 -12.235 3.534 -1.314 0.00 0.00 O+0 HETATM 16 C UNK 0 -13.310 1.700 -0.206 0.00 0.00 C+0 HETATM 17 C UNK 0 -13.007 1.642 1.223 0.00 0.00 C+0 HETATM 18 C UNK 0 -14.149 1.116 2.070 0.00 0.00 C+0 HETATM 19 C UNK 0 -15.379 1.969 1.955 0.00 0.00 C+0 HETATM 20 C UNK 0 -16.454 1.427 2.851 0.00 0.00 C+0 HETATM 21 N UNK 0 -16.897 0.105 2.587 0.00 0.00 N+0 HETATM 22 N UNK 0 -13.880 0.566 -0.869 0.00 0.00 N+0 HETATM 23 C UNK 0 -14.146 -0.746 -0.482 0.00 0.00 C+0 HETATM 24 O UNK 0 -15.381 -1.133 -0.437 0.00 0.00 O+0 HETATM 25 C UNK 0 -13.217 -1.825 -0.100 0.00 0.00 C+0 HETATM 26 C UNK 0 -13.504 -2.961 -1.111 0.00 0.00 C+0 HETATM 27 O UNK 0 -14.812 -3.381 -1.045 0.00 0.00 O+0 HETATM 28 N UNK 0 -13.509 -2.416 1.202 0.00 0.00 N+0 HETATM 29 C UNK 0 -12.481 -2.898 2.054 0.00 0.00 C+0 HETATM 30 O UNK 0 -12.807 -3.071 3.282 0.00 0.00 O+0 HETATM 31 C UNK 0 -11.110 -3.192 1.587 0.00 0.00 C+0 HETATM 32 N UNK 0 -10.628 -4.501 1.995 0.00 0.00 N+0 HETATM 33 C UNK 0 -9.352 -4.982 1.660 0.00 0.00 C+0 HETATM 34 O UNK 0 -8.953 -6.115 2.079 0.00 0.00 O+0 HETATM 35 C UNK 0 -8.367 -4.232 0.804 0.00 0.00 C+0 HETATM 36 C UNK 0 -8.083 -5.071 -0.403 0.00 0.00 C+0 HETATM 37 C UNK 0 -9.284 -5.336 -1.223 0.00 0.00 C+0 HETATM 38 C UNK 0 -10.077 -6.429 -1.016 0.00 0.00 C+0 HETATM 39 C UNK 0 -11.211 -6.669 -1.797 0.00 0.00 C+0 HETATM 40 C UNK 0 -11.565 -5.805 -2.808 0.00 0.00 C+0 HETATM 41 C UNK 0 -10.771 -4.702 -3.023 0.00 0.00 C+0 HETATM 42 C UNK 0 -9.659 -4.482 -2.243 0.00 0.00 C+0 HETATM 43 N UNK 0 -7.211 -3.859 1.572 0.00 0.00 N+0 HETATM 44 C UNK 0 -5.882 -3.769 1.192 0.00 0.00 C+0 HETATM 45 O UNK 0 -5.012 -4.298 1.983 0.00 0.00 O+0 HETATM 46 C UNK 0 -5.277 -3.150 -0.002 0.00 0.00 C+0 HETATM 47 N UNK 0 -6.055 -2.097 -0.607 0.00 0.00 N+0 HETATM 48 C UNK 0 -5.562 -1.030 -1.390 0.00 0.00 C+0 HETATM 49 O UNK 0 -6.020 -0.875 -2.585 0.00 0.00 O+0 HETATM 50 C UNK 0 -4.547 -0.031 -0.992 0.00 0.00 C+0 HETATM 51 C UNK 0 -5.032 1.024 -0.055 0.00 0.00 C+0 HETATM 52 C UNK 0 -3.914 1.193 0.957 0.00 0.00 C+0 HETATM 53 O UNK 0 -3.523 2.389 1.200 0.00 0.00 O+0 HETATM 54 N UNK 0 -3.273 0.154 1.631 0.00 0.00 N+0 HETATM 55 C UNK 0 -2.189 0.439 2.587 0.00 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1.432 0.00 0.00 N+0 HETATM 76 C UNK 0 8.565 1.817 0.372 0.00 0.00 C+0 HETATM 77 C UNK 0 9.503 2.819 0.963 0.00 0.00 C+0 HETATM 78 C UNK 0 10.632 3.236 0.075 0.00 0.00 C+0 HETATM 79 C UNK 0 10.151 3.875 -1.209 0.00 0.00 C+0 HETATM 80 C UNK 0 11.498 4.295 0.757 0.00 0.00 C+0 HETATM 81 C UNK 0 9.155 0.495 0.078 0.00 0.00 C+0 HETATM 82 O UNK 0 8.952 -0.507 0.803 0.00 0.00 O+0 HETATM 83 N UNK 0 9.987 0.274 -1.060 0.00 0.00 N+0 HETATM 84 C UNK 0 10.577 -0.992 -1.391 0.00 0.00 C+0 HETATM 85 C UNK 0 10.043 -1.535 -2.707 0.00 0.00 C+0 HETATM 86 O UNK 0 10.286 -0.699 -3.774 0.00 0.00 O+0 HETATM 87 C UNK 0 12.070 -0.826 -1.453 0.00 0.00 C+0 HETATM 88 O UNK 0 12.562 0.277 -1.181 0.00 0.00 O+0 HETATM 89 N UNK 0 12.852 -1.923 -1.819 0.00 0.00 N+0 HETATM 90 C UNK 0 14.325 -1.797 -1.905 0.00 0.00 C+0 HETATM 91 C UNK 0 14.725 -0.686 -2.756 0.00 0.00 C+0 HETATM 92 C UNK 0 16.165 -0.419 -2.893 0.00 0.00 C+0 HETATM 93 C UNK 0 17.070 -0.992 -3.773 0.00 0.00 C+0 HETATM 94 N UNK 0 18.298 -0.497 -3.547 0.00 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0.00 0.00 C+0 HETATM 114 O UNK 0 -5.983 4.354 0.119 0.00 0.00 O+0 HETATM 115 H UNK 0 -6.425 3.277 -3.573 0.00 0.00 H+0 HETATM 116 H UNK 0 -8.158 3.724 -3.919 0.00 0.00 H+0 HETATM 117 H UNK 0 -6.773 4.691 -4.602 0.00 0.00 H+0 HETATM 118 H UNK 0 -7.447 6.100 -2.836 0.00 0.00 H+0 HETATM 119 H UNK 0 -6.138 5.074 -2.081 0.00 0.00 H+0 HETATM 120 H UNK 0 -9.106 4.634 -1.890 0.00 0.00 H+0 HETATM 121 H UNK 0 -7.197 6.432 -0.569 0.00 0.00 H+0 HETATM 122 H UNK 0 -8.951 6.320 -0.427 0.00 0.00 H+0 HETATM 123 H UNK 0 -7.994 5.332 0.671 0.00 0.00 H+0 HETATM 124 H UNK 0 -7.811 2.614 -1.843 0.00 0.00 H+0 HETATM 125 H UNK 0 -8.824 3.591 0.837 0.00 0.00 H+0 HETATM 126 H UNK 0 -10.780 0.132 -0.119 0.00 0.00 H+0 HETATM 127 H UNK 0 -8.261 0.314 -1.644 0.00 0.00 H+0 HETATM 128 H UNK 0 -9.295 -1.077 -1.268 0.00 0.00 H+0 HETATM 129 H UNK 0 -10.849 -0.659 -2.870 0.00 0.00 H+0 HETATM 130 H UNK 0 -9.344 -0.145 -3.762 0.00 0.00 H+0 HETATM 131 H UNK 0 -9.750 2.209 -3.017 0.00 0.00 H+0 HETATM 132 H UNK 0 -11.316 1.630 -3.670 0.00 0.00 H+0 HETATM 133 H UNK 0 -14.152 2.492 -0.285 0.00 0.00 H+0 HETATM 134 H UNK 0 -12.116 1.059 1.540 0.00 0.00 H+0 HETATM 135 H UNK 0 -12.831 2.696 1.576 0.00 0.00 H+0 HETATM 136 H UNK 0 -13.854 1.076 3.151 0.00 0.00 H+0 HETATM 137 H UNK 0 -14.413 0.082 1.798 0.00 0.00 H+0 HETATM 138 H UNK 0 -15.136 3.002 2.303 0.00 0.00 H+0 HETATM 139 H UNK 0 -15.730 2.019 0.892 0.00 0.00 H+0 HETATM 140 H UNK 0 -16.135 1.450 3.931 0.00 0.00 H+0 HETATM 141 H UNK 0 -17.328 2.125 2.819 0.00 0.00 H+0 HETATM 142 H UNK 0 -16.297 -0.502 2.017 0.00 0.00 H+0 HETATM 143 H UNK 0 -17.878 0.047 2.239 0.00 0.00 H+0 HETATM 144 H UNK 0 -14.164 0.829 -1.897 0.00 0.00 H+0 HETATM 145 H UNK 0 -12.165 -1.615 -0.239 0.00 0.00 H+0 HETATM 146 H UNK 0 -12.868 -3.814 -0.721 0.00 0.00 H+0 HETATM 147 H UNK 0 -13.146 -2.706 -2.109 0.00 0.00 H+0 HETATM 148 H UNK 0 -14.951 -3.975 -0.241 0.00 0.00 H+0 HETATM 149 H UNK 0 -14.492 -2.498 1.538 0.00 0.00 H+0 HETATM 150 H UNK 0 -10.433 -2.462 2.124 0.00 0.00 H+0 HETATM 151 H UNK 0 -10.960 -2.996 0.529 0.00 0.00 H+0 HETATM 152 H UNK 0 -11.267 -5.093 2.558 0.00 0.00 H+0 HETATM 153 H UNK 0 -8.923 -3.293 0.533 0.00 0.00 H+0 HETATM 154 H UNK 0 -7.577 -6.040 -0.110 0.00 0.00 H+0 HETATM 155 H UNK 0 -7.302 -4.535 -1.012 0.00 0.00 H+0 HETATM 156 H UNK 0 -9.888 -7.168 -0.253 0.00 0.00 H+0 HETATM 157 H UNK 0 -11.841 -7.529 -1.643 0.00 0.00 H+0 HETATM 158 H UNK 0 -12.460 -5.994 -3.423 0.00 0.00 H+0 HETATM 159 H UNK 0 -11.066 -4.022 -3.832 0.00 0.00 H+0 HETATM 160 H UNK 0 -9.033 -3.613 -2.413 0.00 0.00 H+0 HETATM 161 H UNK 0 -7.441 -3.618 2.589 0.00 0.00 H+0 HETATM 162 H UNK 0 -4.268 -2.696 0.236 0.00 0.00 H+0 HETATM 163 H UNK 0 -5.005 -3.930 -0.774 0.00 0.00 H+0 HETATM 164 H UNK 0 -7.092 -2.132 -0.456 0.00 0.00 H+0 HETATM 165 H UNK 0 -3.682 -0.620 -0.594 0.00 0.00 H+0 HETATM 166 H UNK 0 -4.122 0.503 -1.878 0.00 0.00 H+0 HETATM 167 H UNK 0 -5.883 0.635 0.506 0.00 0.00 H+0 HETATM 168 H UNK 0 -3.529 -0.828 1.487 0.00 0.00 H+0 HETATM 169 H UNK 0 -2.354 1.468 2.946 0.00 0.00 H+0 HETATM 170 H UNK 0 -2.893 -0.627 4.358 0.00 0.00 H+0 HETATM 171 H UNK 0 -1.150 -0.318 4.256 0.00 0.00 H+0 HETATM 172 H UNK 0 -2.581 -2.193 2.653 0.00 0.00 H+0 HETATM 173 H UNK 0 0.051 1.988 2.983 0.00 0.00 H+0 HETATM 174 H UNK 0 1.374 0.477 0.708 0.00 0.00 H+0 HETATM 175 H UNK 0 2.262 2.498 -0.214 0.00 0.00 H+0 HETATM 176 H UNK 0 0.517 2.361 -0.382 0.00 0.00 H+0 HETATM 177 H UNK 0 -0.952 3.795 0.905 0.00 0.00 H+0 HETATM 178 H UNK 0 -1.317 6.046 1.820 0.00 0.00 H+0 HETATM 179 H UNK 0 0.621 7.460 2.416 0.00 0.00 H+0 HETATM 180 H UNK 0 2.868 6.615 2.082 0.00 0.00 H+0 HETATM 181 H UNK 0 3.248 4.345 1.149 0.00 0.00 H+0 HETATM 182 H UNK 0 3.852 1.543 0.334 0.00 0.00 H+0 HETATM 183 H UNK 0 5.220 2.223 2.819 0.00 0.00 H+0 HETATM 184 H UNK 0 5.218 0.401 2.491 0.00 0.00 H+0 HETATM 185 H UNK 0 7.876 1.411 2.398 0.00 0.00 H+0 HETATM 186 H UNK 0 8.053 2.209 -0.519 0.00 0.00 H+0 HETATM 187 H UNK 0 8.952 3.775 1.230 0.00 0.00 H+0 HETATM 188 H UNK 0 9.895 2.471 1.953 0.00 0.00 H+0 HETATM 189 H UNK 0 11.272 2.378 -0.114 0.00 0.00 H+0 HETATM 190 H UNK 0 9.294 3.378 -1.669 0.00 0.00 H+0 HETATM 191 H UNK 0 9.885 4.954 -1.045 0.00 0.00 H+0 HETATM 192 H UNK 0 11.015 3.884 -1.919 0.00 0.00 H+0 HETATM 193 H UNK 0 12.377 4.415 0.059 0.00 0.00 H+0 HETATM 194 H UNK 0 10.995 5.277 0.778 0.00 0.00 H+0 HETATM 195 H UNK 0 11.814 4.017 1.764 0.00 0.00 H+0 HETATM 196 H UNK 0 10.178 1.059 -1.707 0.00 0.00 H+0 HETATM 197 H UNK 0 10.329 -1.733 -0.623 0.00 0.00 H+0 HETATM 198 H UNK 0 10.579 -2.491 -2.898 0.00 0.00 H+0 HETATM 199 H UNK 0 8.984 -1.798 -2.550 0.00 0.00 H+0 HETATM 200 H UNK 0 9.553 -0.802 -4.442 0.00 0.00 H+0 HETATM 201 H UNK 0 12.402 -2.849 -2.034 0.00 0.00 H+0 HETATM 202 H UNK 0 14.613 -2.736 -2.612 0.00 0.00 H+0 HETATM 203 H UNK 0 14.332 -0.879 -3.818 0.00 0.00 H+0 HETATM 204 H UNK 0 14.191 0.286 -2.502 0.00 0.00 H+0 HETATM 205 H UNK 0 16.767 -1.725 -4.516 0.00 0.00 H+0 HETATM 206 H UNK 0 19.163 -0.752 -4.055 0.00 0.00 H+0 HETATM 207 H UNK 0 20.261 1.125 -2.279 0.00 0.00 H+0 HETATM 208 H UNK 0 19.647 2.664 -0.440 0.00 0.00 H+0 HETATM 209 H UNK 0 17.295 2.762 0.286 0.00 0.00 H+0 HETATM 210 H UNK 0 15.566 1.349 -0.796 0.00 0.00 H+0 HETATM 211 H UNK 0 16.977 -2.080 -0.999 0.00 0.00 H+0 HETATM 212 H UNK 0 15.746 -3.171 1.496 0.00 0.00 H+0 HETATM 213 H UNK 0 18.494 -3.382 0.163 0.00 0.00 H+0 HETATM 214 H UNK 0 17.261 -4.660 0.202 0.00 0.00 H+0 HETATM 215 H UNK 0 18.783 -3.719 2.715 0.00 0.00 H+0 HETATM 216 H UNK 0 18.936 -5.878 0.618 0.00 0.00 H+0 HETATM 217 H UNK 0 20.201 -4.863 1.384 0.00 0.00 H+0 HETATM 218 H UNK 0 19.422 -6.208 2.378 0.00 0.00 H+0 HETATM 219 H UNK 0 16.424 -5.518 1.993 0.00 0.00 H+0 HETATM 220 H UNK 0 16.681 -4.497 3.470 0.00 0.00 H+0 HETATM 221 H UNK 0 17.565 -6.090 3.298 0.00 0.00 H+0 HETATM 222 H UNK 0 18.288 -1.371 3.528 0.00 0.00 H+0 HETATM 223 H UNK 0 -4.473 2.604 -1.349 0.00 0.00 H+0 CONECT 1 2 115 116 117 CONECT 2 1 3 118 119 CONECT 3 2 4 5 120 CONECT 4 3 121 122 123 CONECT 5 3 6 113 124 CONECT 6 5 7 125 CONECT 7 6 8 9 CONECT 8 7 CONECT 9 7 10 13 126 CONECT 10 9 11 127 128 CONECT 11 10 12 129 130 CONECT 12 11 13 131 132 CONECT 13 12 14 9 CONECT 14 13 15 16 CONECT 15 14 CONECT 16 14 17 22 133 CONECT 17 16 18 134 135 CONECT 18 17 19 136 137 CONECT 19 18 20 138 139 CONECT 20 19 21 140 141 CONECT 21 20 142 143 CONECT 22 16 23 144 CONECT 23 22 24 25 CONECT 24 23 CONECT 25 23 26 28 145 CONECT 26 25 27 146 147 CONECT 27 26 148 CONECT 28 25 29 149 CONECT 29 28 30 31 CONECT 30 29 CONECT 31 29 32 150 151 CONECT 32 31 33 152 CONECT 33 32 34 35 CONECT 34 33 CONECT 35 33 36 43 153 CONECT 36 35 37 154 155 CONECT 37 36 38 42 CONECT 38 37 39 156 CONECT 39 38 40 157 CONECT 40 39 41 158 CONECT 41 40 42 159 CONECT 42 41 37 160 CONECT 43 35 44 161 CONECT 44 43 45 46 CONECT 45 44 CONECT 46 44 47 162 163 CONECT 47 46 48 164 CONECT 48 47 49 50 CONECT 49 48 CONECT 50 48 51 165 166 CONECT 51 50 52 112 167 CONECT 52 51 53 54 CONECT 53 52 CONECT 54 52 55 168 CONECT 55 54 56 58 169 CONECT 56 55 57 170 171 CONECT 57 56 172 CONECT 58 55 59 60 CONECT 59 58 CONECT 60 58 61 173 CONECT 61 60 62 69 174 CONECT 62 61 63 175 176 CONECT 63 62 64 68 CONECT 64 63 65 177 CONECT 65 64 66 178 CONECT 66 65 67 179 CONECT 67 66 68 180 CONECT 68 67 63 181 CONECT 69 61 70 71 CONECT 70 69 CONECT 71 69 72 182 CONECT 72 71 73 183 184 CONECT 73 72 74 75 CONECT 74 73 CONECT 75 73 76 185 CONECT 76 75 77 81 186 CONECT 77 76 78 187 188 CONECT 78 77 79 80 189 CONECT 79 78 190 191 192 CONECT 80 78 193 194 195 CONECT 81 76 82 83 CONECT 82 81 CONECT 83 81 84 196 CONECT 84 83 85 87 197 CONECT 85 84 86 198 199 CONECT 86 85 200 CONECT 87 84 88 89 CONECT 88 87 CONECT 89 87 90 201 CONECT 90 89 91 101 202 CONECT 91 90 92 203 204 CONECT 92 91 93 100 CONECT 93 92 94 205 CONECT 94 93 95 206 CONECT 95 94 96 100 CONECT 96 95 97 207 CONECT 97 96 98 208 CONECT 98 97 99 209 CONECT 99 98 100 210 CONECT 100 99 92 95 CONECT 101 90 102 103 CONECT 102 101 CONECT 103 101 104 211 CONECT 104 103 105 109 212 CONECT 105 104 106 213 214 CONECT 106 105 107 108 215 CONECT 107 106 216 217 218 CONECT 108 106 219 220 221 CONECT 109 104 110 111 CONECT 110 109 CONECT 111 109 222 CONECT 112 51 113 223 CONECT 113 112 114 5 CONECT 114 113 CONECT 115 1 CONECT 116 1 CONECT 117 1 CONECT 118 2 CONECT 119 2 CONECT 120 3 CONECT 121 4 CONECT 122 4 CONECT 123 4 CONECT 124 5 CONECT 125 6 CONECT 126 9 CONECT 127 10 CONECT 128 10 CONECT 129 11 CONECT 130 11 CONECT 131 12 CONECT 132 12 CONECT 133 16 CONECT 134 17 CONECT 135 17 CONECT 136 18 CONECT 137 18 CONECT 138 19 CONECT 139 19 CONECT 140 20 CONECT 141 20 CONECT 142 21 CONECT 143 21 CONECT 144 22 CONECT 145 25 CONECT 146 26 CONECT 147 26 CONECT 148 27 CONECT 149 28 CONECT 150 31 CONECT 151 31 CONECT 152 32 CONECT 153 35 CONECT 154 36 CONECT 155 36 CONECT 156 38 CONECT 157 39 CONECT 158 40 CONECT 159 41 CONECT 160 42 CONECT 161 43 CONECT 162 46 CONECT 163 46 CONECT 164 47 CONECT 165 50 CONECT 166 50 CONECT 167 51 CONECT 168 54 CONECT 169 55 CONECT 170 56 CONECT 171 56 CONECT 172 57 CONECT 173 60 CONECT 174 61 CONECT 175 62 CONECT 176 62 CONECT 177 64 CONECT 178 65 CONECT 179 66 CONECT 180 67 CONECT 181 68 CONECT 182 71 CONECT 183 72 CONECT 184 72 CONECT 185 75 CONECT 186 76 CONECT 187 77 CONECT 188 77 CONECT 189 78 CONECT 190 79 CONECT 191 79 CONECT 192 79 CONECT 193 80 CONECT 194 80 CONECT 195 80 CONECT 196 83 CONECT 197 84 CONECT 198 85 CONECT 199 85 CONECT 200 86 CONECT 201 89 CONECT 202 90 CONECT 203 91 CONECT 204 91 CONECT 205 93 CONECT 206 94 CONECT 207 96 CONECT 208 97 CONECT 209 98 CONECT 210 99 CONECT 211 103 CONECT 212 104 CONECT 213 105 CONECT 214 105 CONECT 215 106 CONECT 216 107 CONECT 217 107 CONECT 218 107 CONECT 219 108 CONECT 220 108 CONECT 221 108 CONECT 222 111 CONECT 223 112 MASTER 0 0 0 0 0 0 0 0 223 0 456 0 END