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 -1.165 -5.717 4.789 0.00 0.00 C+0 HETATM 2 C UNK 0 -2.030 -4.767 3.979 0.00 0.00 C+0 HETATM 3 C UNK 0 -2.299 -5.430 2.648 0.00 0.00 C+0 HETATM 4 C UNK 0 -1.031 -5.700 1.911 0.00 0.00 C+0 HETATM 5 C UNK 0 -3.407 -4.814 1.876 0.00 0.00 C+0 HETATM 6 C UNK 0 -3.299 -3.387 1.506 0.00 0.00 C+0 HETATM 7 C UNK 0 -2.123 -3.034 0.635 0.00 0.00 C+0 HETATM 8 C UNK 0 -2.121 -1.564 0.262 0.00 0.00 C+0 HETATM 9 C UNK 0 -2.054 -0.646 1.402 0.00 0.00 C+0 HETATM 10 O UNK 0 -3.042 -0.386 2.107 0.00 0.00 O+0 HETATM 11 O UNK 0 -0.841 -0.032 1.716 0.00 0.00 O+0 HETATM 12 C UNK 0 -0.785 0.885 2.844 0.00 0.00 C+0 HETATM 13 C UNK 0 0.156 0.214 3.810 0.00 0.00 C+0 HETATM 14 C UNK 0 0.295 0.996 5.068 0.00 0.00 C+0 HETATM 15 C UNK 0 -0.315 -1.194 4.140 0.00 0.00 C+0 HETATM 16 C UNK 0 -0.278 2.189 2.290 0.00 0.00 C+0 HETATM 17 N UNK 0 -0.179 3.244 3.292 0.00 0.00 N+0 HETATM 18 C UNK 0 1.038 3.787 3.775 0.00 0.00 C+0 HETATM 19 O UNK 0 2.115 3.335 3.353 0.00 0.00 O+0 HETATM 20 C UNK 0 1.051 4.886 4.776 0.00 0.00 C+0 HETATM 21 N UNK 0 2.085 4.702 5.801 0.00 0.00 N+0 HETATM 22 C UNK 0 1.747 4.608 7.162 0.00 0.00 C+0 HETATM 23 O UNK 0 0.534 4.656 7.493 0.00 0.00 O+0 HETATM 24 N UNK 0 2.727 4.462 8.163 0.00 0.00 N+0 HETATM 25 C UNK 0 2.372 4.349 9.573 0.00 0.00 C+0 HETATM 26 C UNK 0 2.664 5.663 10.242 0.00 0.00 C+0 HETATM 27 O UNK 0 3.148 6.599 9.527 0.00 0.00 O+0 HETATM 28 O UNK 0 2.439 5.906 11.570 0.00 0.00 O+0 HETATM 29 C UNK 0 3.180 3.294 10.245 0.00 0.00 C+0 HETATM 30 C UNK 0 2.732 3.212 11.710 0.00 0.00 C+0 HETATM 31 C UNK 0 3.067 1.927 9.658 0.00 0.00 C+0 HETATM 32 C UNK 0 1.444 6.198 4.090 0.00 0.00 C+0 HETATM 33 C UNK 0 1.452 7.318 5.075 0.00 0.00 C+0 HETATM 34 C UNK 0 0.631 8.513 4.697 0.00 0.00 C+0 HETATM 35 N UNK 0 0.632 8.784 3.301 0.00 0.00 N+0 HETATM 36 C UNK 0 0.665 7.829 2.421 0.00 0.00 C+0 HETATM 37 N UNK 0 0.665 8.158 1.045 0.00 0.00 N+0 HETATM 38 N UNK 0 0.711 6.477 2.906 0.00 0.00 N+0 HETATM 39 C UNK 0 -1.132 2.669 1.174 0.00 0.00 C+0 HETATM 40 O UNK 0 -1.774 3.762 1.373 0.00 0.00 O+0 HETATM 41 N UNK 0 -1.310 2.053 -0.079 0.00 0.00 N+0 HETATM 42 C UNK 0 -2.195 2.626 -1.085 0.00 0.00 C+0 HETATM 43 C UNK 0 -2.196 1.823 -2.363 0.00 0.00 C+0 HETATM 44 C UNK 0 -0.808 1.853 -2.909 0.00 0.00 C+0 HETATM 45 N UNK 0 -0.583 1.207 -4.140 0.00 0.00 N+0 HETATM 46 C UNK 0 -0.627 -0.189 -4.256 0.00 0.00 C+0 HETATM 47 C UNK 0 0.386 -0.972 -3.543 0.00 0.00 C+0 HETATM 48 O UNK 0 1.275 -0.472 -2.832 0.00 0.00 O+0 HETATM 49 O UNK 0 0.338 -2.351 -3.683 0.00 0.00 O+0 HETATM 50 C UNK 0 -0.579 -0.529 -5.756 0.00 0.00 C+0 HETATM 51 O UNK 0 -0.551 -1.905 -5.865 0.00 0.00 O+0 HETATM 52 C UNK 0 -1.709 -2.487 -6.321 0.00 0.00 C+0 HETATM 53 O UNK 0 -2.212 -3.227 -5.216 0.00 0.00 O+0 HETATM 54 C UNK 0 -3.010 -4.222 -5.732 0.00 0.00 C+0 HETATM 55 C UNK 0 -2.957 -5.402 -4.770 0.00 0.00 C+0 HETATM 56 N UNK 0 -3.799 -6.442 -5.323 0.00 0.00 N+0 HETATM 57 C UNK 0 -2.399 -4.656 -7.025 0.00 0.00 C+0 HETATM 58 O UNK 0 -3.375 -4.829 -7.999 0.00 0.00 O+0 HETATM 59 C UNK 0 -1.479 -3.478 -7.394 0.00 0.00 C+0 HETATM 60 O UNK 0 -1.840 -3.022 -8.664 0.00 0.00 O+0 HETATM 61 C UNK 0 -0.868 -3.295 -9.617 0.00 0.00 C+0 HETATM 62 C UNK 0 0.487 0.168 -6.473 0.00 0.00 C+0 HETATM 63 O UNK 0 1.748 -0.236 -6.022 0.00 0.00 O+0 HETATM 64 C UNK 0 2.628 0.279 -6.985 0.00 0.00 C+0 HETATM 65 N UNK 0 3.929 -0.303 -6.794 0.00 0.00 N+0 HETATM 66 C UNK 0 4.180 -1.609 -6.631 0.00 0.00 C+0 HETATM 67 C UNK 0 5.465 -2.113 -6.458 0.00 0.00 C+0 HETATM 68 C UNK 0 6.513 -1.205 -6.457 0.00 0.00 C+0 HETATM 69 O UNK 0 7.665 -1.651 -6.301 0.00 0.00 O+0 HETATM 70 N UNK 0 6.203 0.084 -6.623 0.00 0.00 N+0 HETATM 71 C UNK 0 4.981 0.561 -6.788 0.00 0.00 C+0 HETATM 72 O UNK 0 4.774 1.797 -6.939 0.00 0.00 O+0 HETATM 73 C UNK 0 1.975 -0.133 -8.293 0.00 0.00 C+0 HETATM 74 O UNK 0 2.323 0.851 -9.227 0.00 0.00 O+0 HETATM 75 C UNK 0 0.514 -0.067 -7.974 0.00 0.00 C+0 HETATM 76 O UNK 0 -0.044 1.048 -8.646 0.00 0.00 O+0 HETATM 77 H UNK 0 -1.816 -6.434 5.356 0.00 0.00 H+0 HETATM 78 H UNK 0 -0.517 -5.118 5.446 0.00 0.00 H+0 HETATM 79 H UNK 0 -0.514 -6.270 4.059 0.00 0.00 H+0 HETATM 80 H UNK 0 -2.968 -4.510 4.493 0.00 0.00 H+0 HETATM 81 H UNK 0 -1.416 -3.869 3.783 0.00 0.00 H+0 HETATM 82 H UNK 0 -2.693 -6.469 2.954 0.00 0.00 H+0 HETATM 83 H UNK 0 -0.730 -6.788 2.045 0.00 0.00 H+0 HETATM 84 H UNK 0 -0.159 -5.093 2.255 0.00 0.00 H+0 HETATM 85 H UNK 0 -1.210 -5.599 0.820 0.00 0.00 H+0 HETATM 86 H UNK 0 -3.502 -5.420 0.927 0.00 0.00 H+0 HETATM 87 H UNK 0 -4.373 -4.996 2.426 0.00 0.00 H+0 HETATM 88 H UNK 0 -4.223 -3.096 0.923 0.00 0.00 H+0 HETATM 89 H UNK 0 -3.341 -2.709 2.395 0.00 0.00 H+0 HETATM 90 H UNK 0 -2.067 -3.642 -0.277 0.00 0.00 H+0 HETATM 91 H UNK 0 -1.201 -3.264 1.243 0.00 0.00 H+0 HETATM 92 H UNK 0 -3.054 -1.309 -0.311 0.00 0.00 H+0 HETATM 93 H UNK 0 -1.268 -1.418 -0.443 0.00 0.00 H+0 HETATM 94 H UNK 0 -1.769 1.004 3.266 0.00 0.00 H+0 HETATM 95 H UNK 0 1.135 0.109 3.270 0.00 0.00 H+0 HETATM 96 H UNK 0 1.334 1.339 5.203 0.00 0.00 H+0 HETATM 97 H UNK 0 0.023 0.302 5.927 0.00 0.00 H+0 HETATM 98 H UNK 0 -0.441 1.821 5.154 0.00 0.00 H+0 HETATM 99 H UNK 0 -0.274 -1.841 3.237 0.00 0.00 H+0 HETATM 100 H UNK 0 -1.375 -1.191 4.452 0.00 0.00 H+0 HETATM 101 H UNK 0 0.299 -1.653 4.916 0.00 0.00 H+0 HETATM 102 H UNK 0 0.734 2.007 1.899 0.00 0.00 H+0 HETATM 103 H UNK 0 -1.072 3.638 3.689 0.00 0.00 H+0 HETATM 104 H UNK 0 0.053 5.026 5.199 0.00 0.00 H+0 HETATM 105 H UNK 0 3.077 4.642 5.515 0.00 0.00 H+0 HETATM 106 H UNK 0 3.722 4.431 7.893 0.00 0.00 H+0 HETATM 107 H UNK 0 1.276 4.172 9.610 0.00 0.00 H+0 HETATM 108 H UNK 0 1.666 6.498 11.854 0.00 0.00 H+0 HETATM 109 H UNK 0 4.265 3.562 10.259 0.00 0.00 H+0 HETATM 110 H UNK 0 1.667 3.567 11.748 0.00 0.00 H+0 HETATM 111 H UNK 0 2.732 2.167 12.022 0.00 0.00 H+0 HETATM 112 H UNK 0 3.342 3.891 12.340 0.00 0.00 H+0 HETATM 113 H UNK 0 2.050 1.657 9.288 0.00 0.00 H+0 HETATM 114 H UNK 0 3.300 1.196 10.481 0.00 0.00 H+0 HETATM 115 H UNK 0 3.850 1.734 8.882 0.00 0.00 H+0 HETATM 116 H UNK 0 2.519 6.050 3.774 0.00 0.00 H+0 HETATM 117 H UNK 0 1.050 6.935 6.064 0.00 0.00 H+0 HETATM 118 H UNK 0 2.495 7.649 5.324 0.00 0.00 H+0 HETATM 119 H UNK 0 -0.410 8.445 5.097 0.00 0.00 H+0 HETATM 120 H UNK 0 1.080 9.385 5.227 0.00 0.00 H+0 HETATM 121 H UNK 0 1.574 8.226 0.539 0.00 0.00 H+0 HETATM 122 H UNK 0 -0.215 8.339 0.519 0.00 0.00 H+0 HETATM 123 H UNK 0 0.214 5.757 2.373 0.00 0.00 H+0 HETATM 124 H UNK 0 -0.815 1.180 -0.343 0.00 0.00 H+0 HETATM 125 H UNK 0 -1.903 3.681 -1.298 0.00 0.00 H+0 HETATM 126 H UNK 0 -3.232 2.670 -0.682 0.00 0.00 H+0 HETATM 127 H UNK 0 -2.857 2.305 -3.112 0.00 0.00 H+0 HETATM 128 H UNK 0 -2.553 0.810 -2.101 0.00 0.00 H+0 HETATM 129 H UNK 0 -0.548 2.943 -3.050 0.00 0.00 H+0 HETATM 130 H UNK 0 -0.044 1.499 -2.186 0.00 0.00 H+0 HETATM 131 H UNK 0 0.415 1.500 -4.430 0.00 0.00 H+0 HETATM 132 H UNK 0 -1.619 -0.632 -3.944 0.00 0.00 H+0 HETATM 133 H UNK 0 1.101 -2.988 -3.494 0.00 0.00 H+0 HETATM 134 H UNK 0 -1.617 -0.234 -6.144 0.00 0.00 H+0 HETATM 135 H UNK 0 -2.497 -1.746 -6.594 0.00 0.00 H+0 HETATM 136 H UNK 0 -4.071 -3.880 -5.874 0.00 0.00 H+0 HETATM 137 H UNK 0 -3.229 -5.101 -3.744 0.00 0.00 H+0 HETATM 138 H UNK 0 -1.897 -5.750 -4.780 0.00 0.00 H+0 HETATM 139 H UNK 0 -4.806 -6.175 -5.267 0.00 0.00 H+0 HETATM 140 H UNK 0 -3.561 -7.365 -4.938 0.00 0.00 H+0 HETATM 141 H UNK 0 -1.808 -5.578 -6.955 0.00 0.00 H+0 HETATM 142 H UNK 0 -3.911 -3.993 -8.007 0.00 0.00 H+0 HETATM 143 H UNK 0 -0.460 -3.872 -7.455 0.00 0.00 H+0 HETATM 144 H UNK 0 -1.163 -2.929 -10.611 0.00 0.00 H+0 HETATM 145 H UNK 0 -0.795 -4.422 -9.724 0.00 0.00 H+0 HETATM 146 H UNK 0 0.140 -2.970 -9.376 0.00 0.00 H+0 HETATM 147 H UNK 0 0.480 1.278 -6.367 0.00 0.00 H+0 HETATM 148 H UNK 0 2.640 1.371 -6.841 0.00 0.00 H+0 HETATM 149 H UNK 0 3.348 -2.293 -6.636 0.00 0.00 H+0 HETATM 150 H UNK 0 5.590 -3.166 -6.336 0.00 0.00 H+0 HETATM 151 H UNK 0 6.985 0.793 -6.627 0.00 0.00 H+0 HETATM 152 H UNK 0 2.305 -1.122 -8.622 0.00 0.00 H+0 HETATM 153 H UNK 0 1.760 1.656 -9.076 0.00 0.00 H+0 HETATM 154 H UNK 0 -0.072 -0.943 -8.216 0.00 0.00 H+0 HETATM 155 H UNK 0 -0.277 1.751 -7.981 0.00 0.00 H+0 CONECT 1 2 77 78 79 CONECT 2 1 3 80 81 CONECT 3 2 4 5 82 CONECT 4 3 83 84 85 CONECT 5 3 6 86 87 CONECT 6 5 7 88 89 CONECT 7 6 8 90 91 CONECT 8 7 9 92 93 CONECT 9 8 10 11 CONECT 10 9 CONECT 11 9 12 CONECT 12 11 13 16 94 CONECT 13 12 14 15 95 CONECT 14 13 96 97 98 CONECT 15 13 99 100 101 CONECT 16 12 17 39 102 CONECT 17 16 18 103 CONECT 18 17 19 20 CONECT 19 18 CONECT 20 18 21 32 104 CONECT 21 20 22 105 CONECT 22 21 23 24 CONECT 23 22 CONECT 24 22 25 106 CONECT 25 24 26 29 107 CONECT 26 25 27 28 CONECT 27 26 CONECT 28 26 108 CONECT 29 25 30 31 109 CONECT 30 29 110 111 112 CONECT 31 29 113 114 115 CONECT 32 20 33 38 116 CONECT 33 32 34 117 118 CONECT 34 33 35 119 120 CONECT 35 34 36 CONECT 36 35 37 38 CONECT 37 36 121 122 CONECT 38 36 32 123 CONECT 39 16 40 41 CONECT 40 39 CONECT 41 39 42 124 CONECT 42 41 43 125 126 CONECT 43 42 44 127 128 CONECT 44 43 45 129 130 CONECT 45 44 46 131 CONECT 46 45 47 50 132 CONECT 47 46 48 49 CONECT 48 47 CONECT 49 47 133 CONECT 50 46 51 62 134 CONECT 51 50 52 CONECT 52 51 53 59 135 CONECT 53 52 54 CONECT 54 53 55 57 136 CONECT 55 54 56 137 138 CONECT 56 55 139 140 CONECT 57 54 58 59 141 CONECT 58 57 142 CONECT 59 57 60 52 143 CONECT 60 59 61 CONECT 61 60 144 145 146 CONECT 62 50 63 75 147 CONECT 63 62 64 CONECT 64 63 65 73 148 CONECT 65 64 66 71 CONECT 66 65 67 149 CONECT 67 66 68 150 CONECT 68 67 69 70 CONECT 69 68 CONECT 70 68 71 151 CONECT 71 70 72 65 CONECT 72 71 CONECT 73 64 74 75 152 CONECT 74 73 153 CONECT 75 73 76 62 154 CONECT 76 75 155 CONECT 77 1 CONECT 78 1 CONECT 79 1 CONECT 80 2 CONECT 81 2 CONECT 82 3 CONECT 83 4 CONECT 84 4 CONECT 85 4 CONECT 86 5 CONECT 87 5 CONECT 88 6 CONECT 89 6 CONECT 90 7 CONECT 91 7 CONECT 92 8 CONECT 93 8 CONECT 94 12 CONECT 95 13 CONECT 96 14 CONECT 97 14 CONECT 98 14 CONECT 99 15 CONECT 100 15 CONECT 101 15 CONECT 102 16 CONECT 103 17 CONECT 104 20 CONECT 105 21 CONECT 106 24 CONECT 107 25 CONECT 108 28 CONECT 109 29 CONECT 110 30 CONECT 111 30 CONECT 112 30 CONECT 113 31 CONECT 114 31 CONECT 115 31 CONECT 116 32 CONECT 117 33 CONECT 118 33 CONECT 119 34 CONECT 120 34 CONECT 121 37 CONECT 122 37 CONECT 123 38 CONECT 124 41 CONECT 125 42 CONECT 126 42 CONECT 127 43 CONECT 128 43 CONECT 129 44 CONECT 130 44 CONECT 131 45 CONECT 132 46 CONECT 133 49 CONECT 134 50 CONECT 135 52 CONECT 136 54 CONECT 137 55 CONECT 138 55 CONECT 139 56 CONECT 140 56 CONECT 141 57 CONECT 142 58 CONECT 143 59 CONECT 144 61 CONECT 145 61 CONECT 146 61 CONECT 147 62 CONECT 148 64 CONECT 149 66 CONECT 150 67 CONECT 151 70 CONECT 152 73 CONECT 153 74 CONECT 154 75 CONECT 155 76 MASTER 0 0 0 0 0 0 0 0 155 0 316 0 END