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 5.463 -3.709 -0.814 0.00 0.00 C+0 HETATM 2 C UNK 0 4.162 -3.272 -1.486 0.00 0.00 C+0 HETATM 3 C UNK 0 3.765 -4.401 -2.400 0.00 0.00 C+0 HETATM 4 C UNK 0 3.162 -2.961 -0.410 0.00 0.00 C+0 HETATM 5 C UNK 0 1.819 -2.498 -0.894 0.00 0.00 C+0 HETATM 6 N UNK 0 1.914 -1.304 -1.706 0.00 0.00 N+0 HETATM 7 C UNK 0 2.525 -0.096 -1.444 0.00 0.00 C+0 HETATM 8 O UNK 0 3.396 0.374 -2.261 0.00 0.00 O+0 HETATM 9 C UNK 0 2.294 0.804 -0.254 0.00 0.00 C+0 HETATM 10 N UNK 0 3.601 1.139 0.274 0.00 0.00 N+0 HETATM 11 C UNK 0 3.974 0.742 1.583 0.00 0.00 C+0 HETATM 12 O UNK 0 3.168 0.109 2.274 0.00 0.00 O+0 HETATM 13 C UNK 0 5.296 1.076 2.114 0.00 0.00 C+0 HETATM 14 N UNK 0 6.168 1.766 1.335 0.00 0.00 N+0 HETATM 15 C UNK 0 7.383 2.109 1.716 0.00 0.00 C+0 HETATM 16 C UNK 0 7.810 1.756 2.975 0.00 0.00 C+0 HETATM 17 C UNK 0 6.985 1.061 3.814 0.00 0.00 C+0 HETATM 18 C UNK 0 5.701 0.718 3.365 0.00 0.00 C+0 HETATM 19 O UNK 0 4.924 0.028 4.240 0.00 0.00 O+0 HETATM 20 C UNK 0 1.583 2.080 -0.738 0.00 0.00 C+0 HETATM 21 C UNK 0 0.675 1.753 -1.906 0.00 0.00 C+0 HETATM 22 O UNK 0 0.965 2.657 0.347 0.00 0.00 O+0 HETATM 23 C UNK 0 0.385 3.869 0.518 0.00 0.00 C+0 HETATM 24 O UNK 0 0.634 4.560 1.538 0.00 0.00 O+0 HETATM 25 C UNK 0 -0.558 4.436 -0.470 0.00 0.00 C+0 HETATM 26 C UNK 0 0.116 5.362 -1.434 0.00 0.00 C+0 HETATM 27 C UNK 0 -0.665 6.074 -2.325 0.00 0.00 C+0 HETATM 28 C UNK 0 -0.158 6.951 -3.241 0.00 0.00 C+0 HETATM 29 C UNK 0 1.228 7.122 -3.262 0.00 0.00 C+0 HETATM 30 C UNK 0 2.013 6.417 -2.380 0.00 0.00 C+0 HETATM 31 C UNK 0 1.483 5.537 -1.462 0.00 0.00 C+0 HETATM 32 N UNK 0 -1.631 5.215 0.122 0.00 0.00 N+0 HETATM 33 C UNK 0 -1.238 6.328 1.013 0.00 0.00 C+0 HETATM 34 C UNK 0 -3.006 4.974 -0.108 0.00 0.00 C+0 HETATM 35 O UNK 0 -3.755 5.986 -0.272 0.00 0.00 O+0 HETATM 36 C UNK 0 -3.607 3.605 -0.165 0.00 0.00 C+0 HETATM 37 C UNK 0 -5.117 3.787 -0.373 0.00 0.00 C+0 HETATM 38 O UNK 0 -5.659 4.498 0.671 0.00 0.00 O+0 HETATM 39 N UNK 0 -3.341 2.891 1.063 0.00 0.00 N+0 HETATM 40 C UNK 0 -2.664 1.722 1.307 0.00 0.00 C+0 HETATM 41 O UNK 0 -1.607 1.774 2.038 0.00 0.00 O+0 HETATM 42 C UNK 0 -2.984 0.320 0.827 0.00 0.00 C+0 HETATM 43 C UNK 0 -4.337 0.207 0.260 0.00 0.00 C+0 HETATM 44 C UNK 0 -5.490 0.538 1.159 0.00 0.00 C+0 HETATM 45 C UNK 0 -4.566 -1.206 -0.229 0.00 0.00 C+0 HETATM 46 C UNK 0 -6.012 -1.251 -0.794 0.00 0.00 C+0 HETATM 47 C UNK 0 -3.696 -1.607 -1.379 0.00 0.00 C+0 HETATM 48 N UNK 0 -2.668 -0.569 1.927 0.00 0.00 N+0 HETATM 49 C UNK 0 -3.403 -0.336 3.180 0.00 0.00 C+0 HETATM 50 C UNK 0 -1.705 -1.597 1.944 0.00 0.00 C+0 HETATM 51 O UNK 0 -0.788 -1.532 2.873 0.00 0.00 O+0 HETATM 52 C UNK 0 -1.601 -2.760 1.024 0.00 0.00 C+0 HETATM 53 N UNK 0 -0.905 -3.806 1.760 0.00 0.00 N+0 HETATM 54 C UNK 0 -1.437 -4.040 3.121 0.00 0.00 C+0 HETATM 55 C UNK 0 0.192 -4.566 1.309 0.00 0.00 C+0 HETATM 56 O UNK 0 1.227 -4.500 2.089 0.00 0.00 O+0 HETATM 57 C UNK 0 0.367 -5.401 0.148 0.00 0.00 C+0 HETATM 58 C UNK 0 -0.886 -6.161 -0.264 0.00 0.00 C+0 HETATM 59 C UNK 0 -0.457 -6.741 -1.592 0.00 0.00 C+0 HETATM 60 O UNK 0 -1.337 -6.423 -2.616 0.00 0.00 O+0 HETATM 61 C UNK 0 0.897 -6.095 -1.912 0.00 0.00 C+0 HETATM 62 N UNK 0 0.773 -4.858 -1.103 0.00 0.00 N+0 HETATM 63 C UNK 0 0.991 -3.546 -1.521 0.00 0.00 C+0 HETATM 64 O UNK 0 0.399 -3.143 -2.615 0.00 0.00 O+0 HETATM 65 H UNK 0 5.362 -4.793 -0.580 0.00 0.00 H+0 HETATM 66 H UNK 0 5.616 -3.190 0.142 0.00 0.00 H+0 HETATM 67 H UNK 0 6.259 -3.513 -1.564 0.00 0.00 H+0 HETATM 68 H UNK 0 4.317 -2.374 -2.111 0.00 0.00 H+0 HETATM 69 H UNK 0 4.651 -4.603 -3.045 0.00 0.00 H+0 HETATM 70 H UNK 0 3.668 -5.311 -1.767 0.00 0.00 H+0 HETATM 71 H UNK 0 2.853 -4.228 -2.969 0.00 0.00 H+0 HETATM 72 H UNK 0 3.053 -3.896 0.179 0.00 0.00 H+0 HETATM 73 H UNK 0 3.571 -2.212 0.326 0.00 0.00 H+0 HETATM 74 H UNK 0 1.264 -2.170 0.049 0.00 0.00 H+0 HETATM 75 H UNK 0 1.431 -1.387 -2.662 0.00 0.00 H+0 HETATM 76 H UNK 0 1.733 0.277 0.524 0.00 0.00 H+0 HETATM 77 H UNK 0 4.300 1.677 -0.287 0.00 0.00 H+0 HETATM 78 H UNK 0 8.087 2.661 1.097 0.00 0.00 H+0 HETATM 79 H UNK 0 8.816 2.024 3.327 0.00 0.00 H+0 HETATM 80 H UNK 0 7.283 0.769 4.800 0.00 0.00 H+0 HETATM 81 H UNK 0 4.033 -0.342 4.243 0.00 0.00 H+0 HETATM 82 H UNK 0 2.431 2.674 -1.191 0.00 0.00 H+0 HETATM 83 H UNK 0 1.171 0.997 -2.579 0.00 0.00 H+0 HETATM 84 H UNK 0 -0.299 1.400 -1.558 0.00 0.00 H+0 HETATM 85 H UNK 0 0.509 2.630 -2.564 0.00 0.00 H+0 HETATM 86 H UNK 0 -1.064 3.607 -1.047 0.00 0.00 H+0 HETATM 87 H UNK 0 -1.751 5.920 -2.286 0.00 0.00 H+0 HETATM 88 H UNK 0 -0.773 7.508 -3.937 0.00 0.00 H+0 HETATM 89 H UNK 0 1.668 7.809 -3.975 0.00 0.00 H+0 HETATM 90 H UNK 0 3.087 6.542 -2.387 0.00 0.00 H+0 HETATM 91 H UNK 0 2.071 4.980 -0.762 0.00 0.00 H+0 HETATM 92 H UNK 0 -1.976 7.142 0.861 0.00 0.00 H+0 HETATM 93 H UNK 0 -1.329 6.015 2.076 0.00 0.00 H+0 HETATM 94 H UNK 0 -0.251 6.718 0.758 0.00 0.00 H+0 HETATM 95 H UNK 0 -3.236 3.116 -1.062 0.00 0.00 H+0 HETATM 96 H UNK 0 -5.612 2.836 -0.600 0.00 0.00 H+0 HETATM 97 H UNK 0 -5.270 4.416 -1.299 0.00 0.00 H+0 HETATM 98 H UNK 0 -6.492 4.060 1.002 0.00 0.00 H+0 HETATM 99 H UNK 0 -3.751 3.397 1.918 0.00 0.00 H+0 HETATM 100 H UNK 0 -2.259 0.193 -0.031 0.00 0.00 H+0 HETATM 101 H UNK 0 -4.354 0.822 -0.680 0.00 0.00 H+0 HETATM 102 H UNK 0 -6.339 0.823 0.461 0.00 0.00 H+0 HETATM 103 H UNK 0 -5.364 1.396 1.808 0.00 0.00 H+0 HETATM 104 H UNK 0 -5.866 -0.389 1.637 0.00 0.00 H+0 HETATM 105 H UNK 0 -4.560 -1.938 0.582 0.00 0.00 H+0 HETATM 106 H UNK 0 -6.181 -0.394 -1.469 0.00 0.00 H+0 HETATM 107 H UNK 0 -6.729 -1.336 0.023 0.00 0.00 H+0 HETATM 108 H UNK 0 -6.046 -2.160 -1.427 0.00 0.00 H+0 HETATM 109 H UNK 0 -2.652 -1.286 -1.299 0.00 0.00 H+0 HETATM 110 H UNK 0 -4.139 -1.329 -2.365 0.00 0.00 H+0 HETATM 111 H UNK 0 -3.651 -2.736 -1.392 0.00 0.00 H+0 HETATM 112 H UNK 0 -2.754 -0.580 4.074 0.00 0.00 H+0 HETATM 113 H UNK 0 -4.267 -1.018 3.276 0.00 0.00 H+0 HETATM 114 H UNK 0 -3.645 0.729 3.320 0.00 0.00 H+0 HETATM 115 H UNK 0 -1.108 -2.474 0.080 0.00 0.00 H+0 HETATM 116 H UNK 0 -2.572 -3.206 0.743 0.00 0.00 H+0 HETATM 117 H UNK 0 -0.640 -4.124 3.864 0.00 0.00 H+0 HETATM 118 H UNK 0 -2.058 -4.986 3.108 0.00 0.00 H+0 HETATM 119 H UNK 0 -2.140 -3.267 3.450 0.00 0.00 H+0 HETATM 120 H UNK 0 1.111 -6.251 0.347 0.00 0.00 H+0 HETATM 121 H UNK 0 -1.683 -5.419 -0.430 0.00 0.00 H+0 HETATM 122 H UNK 0 -1.155 -6.934 0.477 0.00 0.00 H+0 HETATM 123 H UNK 0 -0.306 -7.850 -1.476 0.00 0.00 H+0 HETATM 124 H UNK 0 -0.967 -6.820 -3.444 0.00 0.00 H+0 HETATM 125 H UNK 0 1.713 -6.667 -1.433 0.00 0.00 H+0 HETATM 126 H UNK 0 1.019 -5.919 -2.972 0.00 0.00 H+0 CONECT 1 2 65 66 67 CONECT 2 1 3 4 68 CONECT 3 2 69 70 71 CONECT 4 2 5 72 73 CONECT 5 4 6 63 74 CONECT 6 5 7 75 CONECT 7 6 8 9 CONECT 8 7 CONECT 9 7 10 20 76 CONECT 10 9 11 77 CONECT 11 10 12 13 CONECT 12 11 CONECT 13 11 14 18 CONECT 14 13 15 CONECT 15 14 16 78 CONECT 16 15 17 79 CONECT 17 16 18 80 CONECT 18 17 19 13 CONECT 19 18 81 CONECT 20 9 21 22 82 CONECT 21 20 83 84 85 CONECT 22 20 23 CONECT 23 22 24 25 CONECT 24 23 CONECT 25 23 26 32 86 CONECT 26 25 27 31 CONECT 27 26 28 87 CONECT 28 27 29 88 CONECT 29 28 30 89 CONECT 30 29 31 90 CONECT 31 30 26 91 CONECT 32 25 33 34 CONECT 33 32 92 93 94 CONECT 34 32 35 36 CONECT 35 34 CONECT 36 34 37 39 95 CONECT 37 36 38 96 97 CONECT 38 37 98 CONECT 39 36 40 99 CONECT 40 39 41 42 CONECT 41 40 CONECT 42 40 43 48 100 CONECT 43 42 44 45 101 CONECT 44 43 102 103 104 CONECT 45 43 46 47 105 CONECT 46 45 106 107 108 CONECT 47 45 109 110 111 CONECT 48 42 49 50 CONECT 49 48 112 113 114 CONECT 50 48 51 52 CONECT 51 50 CONECT 52 50 53 115 116 CONECT 53 52 54 55 CONECT 54 53 117 118 119 CONECT 55 53 56 57 CONECT 56 55 CONECT 57 55 58 62 120 CONECT 58 57 59 121 122 CONECT 59 58 60 61 123 CONECT 60 59 124 CONECT 61 59 62 125 126 CONECT 62 61 63 57 CONECT 63 62 64 5 CONECT 64 63 CONECT 65 1 CONECT 66 1 CONECT 67 1 CONECT 68 2 CONECT 69 3 CONECT 70 3 CONECT 71 3 CONECT 72 4 CONECT 73 4 CONECT 74 5 CONECT 75 6 CONECT 76 9 CONECT 77 10 CONECT 78 15 CONECT 79 16 CONECT 80 17 CONECT 81 19 CONECT 82 20 CONECT 83 21 CONECT 84 21 CONECT 85 21 CONECT 86 25 CONECT 87 27 CONECT 88 28 CONECT 89 29 CONECT 90 30 CONECT 91 31 CONECT 92 33 CONECT 93 33 CONECT 94 33 CONECT 95 36 CONECT 96 37 CONECT 97 37 CONECT 98 38 CONECT 99 39 CONECT 100 42 CONECT 101 43 CONECT 102 44 CONECT 103 44 CONECT 104 44 CONECT 105 45 CONECT 106 46 CONECT 107 46 CONECT 108 46 CONECT 109 47 CONECT 110 47 CONECT 111 47 CONECT 112 49 CONECT 113 49 CONECT 114 49 CONECT 115 52 CONECT 116 52 CONECT 117 54 CONECT 118 54 CONECT 119 54 CONECT 120 57 CONECT 121 58 CONECT 122 58 CONECT 123 59 CONECT 124 60 CONECT 125 61 CONECT 126 61 MASTER 0 0 0 0 0 0 0 0 126 0 258 0 END