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 -0.025 -5.344 -0.253 0.00 0.00 C+0 HETATM 2 C UNK 0 0.599 -4.012 0.131 0.00 0.00 C+0 HETATM 3 C UNK 0 1.986 -4.418 0.679 0.00 0.00 C+0 HETATM 4 C UNK 0 -0.102 -3.309 1.238 0.00 0.00 C+0 HETATM 5 N UNK 0 0.402 -2.028 1.628 0.00 0.00 N+0 HETATM 6 C UNK 0 1.540 -1.298 1.287 0.00 0.00 C+0 HETATM 7 O UNK 0 2.399 -1.142 2.247 0.00 0.00 O+0 HETATM 8 C UNK 0 1.965 -0.656 0.038 0.00 0.00 C+0 HETATM 9 C UNK 0 2.962 -1.367 -0.801 0.00 0.00 C+0 HETATM 10 C UNK 0 4.228 -1.241 -0.031 0.00 0.00 C+0 HETATM 11 O UNK 0 4.380 -2.261 0.888 0.00 0.00 O+0 HETATM 12 C UNK 0 5.407 -1.177 -0.944 0.00 0.00 C+0 HETATM 13 C UNK 0 5.966 -2.183 -1.679 0.00 0.00 C+0 HETATM 14 C UNK 0 7.075 -1.935 -2.483 0.00 0.00 C+0 HETATM 15 C UNK 0 7.585 -0.651 -2.513 0.00 0.00 C+0 HETATM 16 Cl UNK 0 8.989 -0.243 -3.502 0.00 0.00 Cl+0 HETATM 17 C UNK 0 7.000 0.345 -1.761 0.00 0.00 C+0 HETATM 18 C UNK 0 5.894 0.104 -0.956 0.00 0.00 C+0 HETATM 19 N UNK 0 5.092 0.894 -0.092 0.00 0.00 N+0 HETATM 20 C UNK 0 4.103 0.111 0.602 0.00 0.00 C+0 HETATM 21 N UNK 0 2.749 0.570 0.304 0.00 0.00 N+0 HETATM 22 C UNK 0 2.199 1.867 0.252 0.00 0.00 C+0 HETATM 23 O UNK 0 2.867 2.813 -0.234 0.00 0.00 O+0 HETATM 24 C UNK 0 0.833 2.130 0.768 0.00 0.00 C+0 HETATM 25 C UNK 0 0.926 2.379 2.284 0.00 0.00 C+0 HETATM 26 C UNK 0 -0.229 3.262 2.732 0.00 0.00 C+0 HETATM 27 C UNK 0 -0.090 4.637 2.130 0.00 0.00 C+0 HETATM 28 N UNK 0 0.694 4.561 0.918 0.00 0.00 N+0 HETATM 29 N UNK 0 0.378 3.380 0.209 0.00 0.00 N+0 HETATM 30 C UNK 0 -0.341 3.426 -0.981 0.00 0.00 C+0 HETATM 31 O UNK 0 -0.807 4.558 -1.349 0.00 0.00 O+0 HETATM 32 C UNK 0 -0.631 2.291 -1.883 0.00 0.00 C+0 HETATM 33 C UNK 0 0.359 2.398 -3.043 0.00 0.00 C+0 HETATM 34 N UNK 0 -1.997 2.333 -2.380 0.00 0.00 N+0 HETATM 35 C UNK 0 -3.126 2.059 -1.575 0.00 0.00 C+0 HETATM 36 O UNK 0 -4.207 1.838 -2.181 0.00 0.00 O+0 HETATM 37 C UNK 0 -3.060 2.028 -0.094 0.00 0.00 C+0 HETATM 38 C UNK 0 -3.534 3.333 0.541 0.00 0.00 C+0 HETATM 39 C UNK 0 -4.854 3.649 -0.069 0.00 0.00 C+0 HETATM 40 C UNK 0 -5.784 2.494 0.156 0.00 0.00 C+0 HETATM 41 N UNK 0 -5.249 1.318 0.695 0.00 0.00 N+0 HETATM 42 N UNK 0 -3.909 1.015 0.487 0.00 0.00 N+0 HETATM 43 C UNK 0 -3.476 -0.276 0.901 0.00 0.00 C+0 HETATM 44 O UNK 0 -3.949 -0.665 2.043 0.00 0.00 O+0 HETATM 45 C UNK 0 -2.564 -1.190 0.178 0.00 0.00 C+0 HETATM 46 C UNK 0 -3.293 -1.564 -1.139 0.00 0.00 C+0 HETATM 47 C UNK 0 -4.664 -2.047 -0.723 0.00 0.00 C+0 HETATM 48 C UNK 0 -4.654 -3.102 0.332 0.00 0.00 C+0 HETATM 49 N UNK 0 -3.810 -2.757 1.486 0.00 0.00 N+0 HETATM 50 N UNK 0 -2.544 -2.463 0.898 0.00 0.00 N+0 HETATM 51 C UNK 0 -1.542 -3.393 1.051 0.00 0.00 C+0 HETATM 52 O UNK 0 -1.969 -4.648 1.026 0.00 0.00 O+0 HETATM 53 H UNK 0 -0.881 -5.198 -0.925 0.00 0.00 H+0 HETATM 54 H UNK 0 0.762 -5.828 -0.916 0.00 0.00 H+0 HETATM 55 H UNK 0 -0.184 -6.022 0.584 0.00 0.00 H+0 HETATM 56 H UNK 0 0.650 -3.387 -0.751 0.00 0.00 H+0 HETATM 57 H UNK 0 1.837 -5.416 1.173 0.00 0.00 H+0 HETATM 58 H UNK 0 2.752 -4.445 -0.092 0.00 0.00 H+0 HETATM 59 H UNK 0 2.210 -3.736 1.517 0.00 0.00 H+0 HETATM 60 H UNK 0 0.081 -4.038 2.151 0.00 0.00 H+0 HETATM 61 H UNK 0 -0.271 -1.574 2.352 0.00 0.00 H+0 HETATM 62 H UNK 0 1.111 -0.396 -0.634 0.00 0.00 H+0 HETATM 63 H UNK 0 2.728 -2.350 -1.176 0.00 0.00 H+0 HETATM 64 H UNK 0 3.097 -0.723 -1.719 0.00 0.00 H+0 HETATM 65 H UNK 0 5.208 -2.143 1.408 0.00 0.00 H+0 HETATM 66 H UNK 0 5.575 -3.193 -1.664 0.00 0.00 H+0 HETATM 67 H UNK 0 7.534 -2.716 -3.074 0.00 0.00 H+0 HETATM 68 H UNK 0 7.393 1.335 -1.782 0.00 0.00 H+0 HETATM 69 H UNK 0 5.211 1.922 0.021 0.00 0.00 H+0 HETATM 70 H UNK 0 4.308 0.070 1.698 0.00 0.00 H+0 HETATM 71 H UNK 0 0.210 1.260 0.554 0.00 0.00 H+0 HETATM 72 H UNK 0 0.909 1.450 2.853 0.00 0.00 H+0 HETATM 73 H UNK 0 1.847 2.980 2.427 0.00 0.00 H+0 HETATM 74 H UNK 0 -1.161 2.782 2.383 0.00 0.00 H+0 HETATM 75 H UNK 0 -0.166 3.345 3.825 0.00 0.00 H+0 HETATM 76 H UNK 0 0.388 5.335 2.846 0.00 0.00 H+0 HETATM 77 H UNK 0 -1.083 5.057 1.889 0.00 0.00 H+0 HETATM 78 H UNK 0 1.706 4.654 1.086 0.00 0.00 H+0 HETATM 79 H UNK 0 -0.392 1.362 -1.369 0.00 0.00 H+0 HETATM 80 H UNK 0 0.071 3.338 -3.584 0.00 0.00 H+0 HETATM 81 H UNK 0 1.359 2.499 -2.624 0.00 0.00 H+0 HETATM 82 H UNK 0 0.248 1.544 -3.740 0.00 0.00 H+0 HETATM 83 H UNK 0 -2.135 2.579 -3.377 0.00 0.00 H+0 HETATM 84 H UNK 0 -2.001 1.917 0.221 0.00 0.00 H+0 HETATM 85 H UNK 0 -3.702 3.104 1.624 0.00 0.00 H+0 HETATM 86 H UNK 0 -2.796 4.125 0.496 0.00 0.00 H+0 HETATM 87 H UNK 0 -4.739 3.859 -1.172 0.00 0.00 H+0 HETATM 88 H UNK 0 -5.222 4.606 0.363 0.00 0.00 H+0 HETATM 89 H UNK 0 -6.534 2.882 0.928 0.00 0.00 H+0 HETATM 90 H UNK 0 -6.452 2.313 -0.727 0.00 0.00 H+0 HETATM 91 H UNK 0 -5.611 1.024 1.626 0.00 0.00 H+0 HETATM 92 H UNK 0 -1.573 -0.786 -0.015 0.00 0.00 H+0 HETATM 93 H UNK 0 -3.384 -0.746 -1.829 0.00 0.00 H+0 HETATM 94 H UNK 0 -2.778 -2.449 -1.602 0.00 0.00 H+0 HETATM 95 H UNK 0 -5.101 -2.529 -1.644 0.00 0.00 H+0 HETATM 96 H UNK 0 -5.342 -1.246 -0.417 0.00 0.00 H+0 HETATM 97 H UNK 0 -4.361 -4.115 -0.057 0.00 0.00 H+0 HETATM 98 H UNK 0 -5.687 -3.168 0.746 0.00 0.00 H+0 HETATM 99 H UNK 0 -3.804 -3.563 2.107 0.00 0.00 H+0 CONECT 1 2 53 54 55 CONECT 2 1 3 4 56 CONECT 3 2 57 58 59 CONECT 4 2 5 51 60 CONECT 5 4 6 61 CONECT 6 5 7 8 CONECT 7 6 CONECT 8 6 9 21 62 CONECT 9 8 10 63 64 CONECT 10 9 11 12 20 CONECT 11 10 65 CONECT 12 10 13 18 CONECT 13 12 14 66 CONECT 14 13 15 67 CONECT 15 14 16 17 CONECT 16 15 CONECT 17 15 18 68 CONECT 18 17 19 12 CONECT 19 18 20 69 CONECT 20 19 21 10 70 CONECT 21 20 22 8 CONECT 22 21 23 24 CONECT 23 22 CONECT 24 22 25 29 71 CONECT 25 24 26 72 73 CONECT 26 25 27 74 75 CONECT 27 26 28 76 77 CONECT 28 27 29 78 CONECT 29 28 30 24 CONECT 30 29 31 32 CONECT 31 30 CONECT 32 30 33 34 79 CONECT 33 32 80 81 82 CONECT 34 32 35 83 CONECT 35 34 36 37 CONECT 36 35 CONECT 37 35 38 42 84 CONECT 38 37 39 85 86 CONECT 39 38 40 87 88 CONECT 40 39 41 89 90 CONECT 41 40 42 91 CONECT 42 41 43 37 CONECT 43 42 44 45 CONECT 44 43 CONECT 45 43 46 50 92 CONECT 46 45 47 93 94 CONECT 47 46 48 95 96 CONECT 48 47 49 97 98 CONECT 49 48 50 99 CONECT 50 49 51 45 CONECT 51 50 52 4 CONECT 52 51 CONECT 53 1 CONECT 54 1 CONECT 55 1 CONECT 56 2 CONECT 57 3 CONECT 58 3 CONECT 59 3 CONECT 60 4 CONECT 61 5 CONECT 62 8 CONECT 63 9 CONECT 64 9 CONECT 65 11 CONECT 66 13 CONECT 67 14 CONECT 68 17 CONECT 69 19 CONECT 70 20 CONECT 71 24 CONECT 72 25 CONECT 73 25 CONECT 74 26 CONECT 75 26 CONECT 76 27 CONECT 77 27 CONECT 78 28 CONECT 79 32 CONECT 80 33 CONECT 81 33 CONECT 82 33 CONECT 83 34 CONECT 84 37 CONECT 85 38 CONECT 86 38 CONECT 87 39 CONECT 88 39 CONECT 89 40 CONECT 90 40 CONECT 91 41 CONECT 92 45 CONECT 93 46 CONECT 94 46 CONECT 95 47 CONECT 96 47 CONECT 97 48 CONECT 98 48 CONECT 99 49 MASTER 0 0 0 0 0 0 0 0 99 0 210 0 END