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 3.715 -4.974 -2.546 0.00 0.00 C+0 HETATM 2 C UNK 0 3.771 -4.279 -1.405 0.00 0.00 C+0 HETATM 3 C UNK 0 3.815 -2.820 -1.539 0.00 0.00 C+0 HETATM 4 O UNK 0 3.101 -2.365 -2.513 0.00 0.00 O+0 HETATM 5 N UNK 0 4.541 -1.929 -0.723 0.00 0.00 N+0 HETATM 6 C UNK 0 6.021 -2.057 -0.488 0.00 0.00 C+0 HETATM 7 C UNK 0 6.234 -1.674 0.908 0.00 0.00 C+0 HETATM 8 C UNK 0 7.570 -1.815 1.499 0.00 0.00 C+0 HETATM 9 S UNK 0 9.012 -1.101 0.796 0.00 0.00 S+0 HETATM 10 C UNK 0 9.689 -1.925 -0.638 0.00 0.00 C+0 HETATM 11 C UNK 0 6.575 -1.131 -1.537 0.00 0.00 C+0 HETATM 12 O UNK 0 7.182 -1.772 -2.480 0.00 0.00 O+0 HETATM 13 N UNK 0 6.522 0.246 -1.631 0.00 0.00 N+0 HETATM 14 C UNK 0 6.870 1.302 -0.691 0.00 0.00 C+0 HETATM 15 C UNK 0 8.254 1.769 -1.139 0.00 0.00 C+0 HETATM 16 C UNK 0 8.904 2.817 -0.335 0.00 0.00 C+0 HETATM 17 C UNK 0 10.287 3.050 -1.010 0.00 0.00 C+0 HETATM 18 C UNK 0 9.238 2.406 1.085 0.00 0.00 C+0 HETATM 19 C UNK 0 5.891 2.419 -0.775 0.00 0.00 C+0 HETATM 20 O UNK 0 6.396 3.607 -0.727 0.00 0.00 O+0 HETATM 21 N UNK 0 4.516 2.386 -0.901 0.00 0.00 N+0 HETATM 22 C UNK 0 3.489 1.818 -0.066 0.00 0.00 C+0 HETATM 23 C UNK 0 3.874 1.609 1.343 0.00 0.00 C+0 HETATM 24 O UNK 0 4.975 1.948 1.770 0.00 0.00 O+0 HETATM 25 O UNK 0 2.953 1.013 2.186 0.00 0.00 O+0 HETATM 26 C UNK 0 2.296 2.809 0.020 0.00 0.00 C+0 HETATM 27 C UNK 0 1.425 2.733 -1.151 0.00 0.00 C+0 HETATM 28 O UNK 0 1.900 2.300 -2.256 0.00 0.00 O+0 HETATM 29 N UNK 0 0.058 3.114 -1.154 0.00 0.00 N+0 HETATM 30 C UNK 0 -0.952 2.655 -0.249 0.00 0.00 C+0 HETATM 31 C UNK 0 -2.023 3.682 -0.027 0.00 0.00 C+0 HETATM 32 C UNK 0 -1.614 4.957 0.597 0.00 0.00 C+0 HETATM 33 C UNK 0 -0.572 5.743 -0.137 0.00 0.00 C+0 HETATM 34 N UNK 0 -0.326 6.979 0.635 0.00 0.00 N+0 HETATM 35 C UNK 0 -0.297 8.107 0.063 0.00 0.00 C+0 HETATM 36 N UNK 0 -0.067 9.332 0.736 0.00 0.00 N+0 HETATM 37 N UNK 0 -0.509 8.183 -1.342 0.00 0.00 N+0 HETATM 38 C UNK 0 -1.570 1.452 -0.865 0.00 0.00 C+0 HETATM 39 O UNK 0 -2.014 1.638 -2.055 0.00 0.00 O+0 HETATM 40 N UNK 0 -1.688 0.186 -0.249 0.00 0.00 N+0 HETATM 41 C UNK 0 -2.296 -0.058 1.047 0.00 0.00 C+0 HETATM 42 C UNK 0 -3.711 -0.514 0.872 0.00 0.00 C+0 HETATM 43 C UNK 0 -4.670 0.363 0.870 0.00 0.00 C+0 HETATM 44 C UNK 0 -6.110 -0.024 0.698 0.00 0.00 C+0 HETATM 45 C UNK 0 -6.385 -1.459 0.633 0.00 0.00 C+0 HETATM 46 C UNK 0 -7.019 0.886 0.697 0.00 0.00 C+0 HETATM 47 C UNK 0 -8.422 0.885 0.556 0.00 0.00 C+0 HETATM 48 C UNK 0 -9.101 1.641 1.752 0.00 0.00 C+0 HETATM 49 C UNK 0 -9.292 -0.246 0.162 0.00 0.00 C+0 HETATM 50 C UNK 0 -9.051 -0.763 -1.249 0.00 0.00 C+0 HETATM 51 C UNK 0 -9.970 -1.884 -1.492 0.00 0.00 C+0 HETATM 52 C UNK 0 -9.619 -3.166 -1.155 0.00 0.00 C+0 HETATM 53 C UNK 0 -10.480 -4.239 -1.392 0.00 0.00 C+0 HETATM 54 C UNK 0 -11.707 -4.006 -1.975 0.00 0.00 C+0 HETATM 55 C UNK 0 -12.074 -2.724 -2.320 0.00 0.00 C+0 HETATM 56 C UNK 0 -11.194 -1.668 -2.072 0.00 0.00 C+0 HETATM 57 O UNK 0 -10.656 0.244 0.074 0.00 0.00 O+0 HETATM 58 C UNK 0 -11.460 -0.438 0.978 0.00 0.00 C+0 HETATM 59 C UNK 0 -1.477 -1.031 1.875 0.00 0.00 C+0 HETATM 60 C UNK 0 -0.053 -0.813 1.507 0.00 0.00 C+0 HETATM 61 C UNK 0 -1.988 -2.410 1.784 0.00 0.00 C+0 HETATM 62 O UNK 0 -2.788 -2.712 2.766 0.00 0.00 O+0 HETATM 63 N UNK 0 -1.787 -3.417 0.873 0.00 0.00 N+0 HETATM 64 C UNK 0 -0.659 -4.269 0.554 0.00 0.00 C+0 HETATM 65 C UNK 0 -0.338 -4.191 -0.892 0.00 0.00 C+0 HETATM 66 O UNK 0 -0.955 -3.408 -1.637 0.00 0.00 O+0 HETATM 67 O UNK 0 0.651 -4.999 -1.404 0.00 0.00 O+0 HETATM 68 C UNK 0 0.515 -4.172 1.465 0.00 0.00 C+0 HETATM 69 C UNK 0 1.776 -3.667 0.855 0.00 0.00 C+0 HETATM 70 C UNK 0 2.938 -4.586 0.959 0.00 0.00 C+0 HETATM 71 O UNK 0 3.178 -5.033 2.121 0.00 0.00 O+0 HETATM 72 N UNK 0 3.754 -4.964 -0.145 0.00 0.00 N+0 HETATM 73 C UNK 0 4.615 -6.116 0.000 0.00 0.00 C+0 HETATM 74 H UNK 0 3.698 -4.555 -3.521 0.00 0.00 H+0 HETATM 75 H UNK 0 3.652 -6.056 -2.483 0.00 0.00 H+0 HETATM 76 H UNK 0 4.085 -1.142 -0.252 0.00 0.00 H+0 HETATM 77 H UNK 0 6.314 -3.074 -0.690 0.00 0.00 H+0 HETATM 78 H UNK 0 5.712 -0.716 1.199 0.00 0.00 H+0 HETATM 79 H UNK 0 5.575 -2.425 1.512 0.00 0.00 H+0 HETATM 80 H UNK 0 7.489 -1.460 2.602 0.00 0.00 H+0 HETATM 81 H UNK 0 7.735 -2.961 1.590 0.00 0.00 H+0 HETATM 82 H UNK 0 10.778 -2.192 -0.493 0.00 0.00 H+0 HETATM 83 H UNK 0 9.678 -1.258 -1.504 0.00 0.00 H+0 HETATM 84 H UNK 0 9.134 -2.850 -0.909 0.00 0.00 H+0 HETATM 85 H UNK 0 6.172 0.668 -2.562 0.00 0.00 H+0 HETATM 86 H UNK 0 6.995 0.979 0.331 0.00 0.00 H+0 HETATM 87 H UNK 0 8.881 0.912 -1.366 0.00 0.00 H+0 HETATM 88 H UNK 0 8.038 2.248 -2.155 0.00 0.00 H+0 HETATM 89 H UNK 0 8.446 3.797 -0.390 0.00 0.00 H+0 HETATM 90 H UNK 0 10.907 3.655 -0.317 0.00 0.00 H+0 HETATM 91 H UNK 0 10.756 2.048 -1.087 0.00 0.00 H+0 HETATM 92 H UNK 0 10.151 3.512 -1.991 0.00 0.00 H+0 HETATM 93 H UNK 0 8.479 1.766 1.555 0.00 0.00 H+0 HETATM 94 H UNK 0 9.267 3.362 1.669 0.00 0.00 H+0 HETATM 95 H UNK 0 10.216 1.925 1.154 0.00 0.00 H+0 HETATM 96 H UNK 0 4.098 2.882 -1.777 0.00 0.00 H+0 HETATM 97 H UNK 0 3.007 0.914 -0.532 0.00 0.00 H+0 HETATM 98 H UNK 0 2.160 1.497 2.608 0.00 0.00 H+0 HETATM 99 H UNK 0 2.737 3.824 0.079 0.00 0.00 H+0 HETATM 100 H UNK 0 1.728 2.642 0.934 0.00 0.00 H+0 HETATM 101 H UNK 0 -0.263 3.797 -1.904 0.00 0.00 H+0 HETATM 102 H UNK 0 -0.484 2.383 0.746 0.00 0.00 H+0 HETATM 103 H UNK 0 -2.486 3.900 -1.030 0.00 0.00 H+0 HETATM 104 H UNK 0 -2.887 3.225 0.552 0.00 0.00 H+0 HETATM 105 H UNK 0 -2.521 5.642 0.656 0.00 0.00 H+0 HETATM 106 H UNK 0 -1.262 4.844 1.652 0.00 0.00 H+0 HETATM 107 H UNK 0 -0.885 6.013 -1.160 0.00 0.00 H+0 HETATM 108 H UNK 0 0.404 5.194 -0.142 0.00 0.00 H+0 HETATM 109 H UNK 0 -0.748 10.117 0.690 0.00 0.00 H+0 HETATM 110 H UNK 0 0.819 9.406 1.278 0.00 0.00 H+0 HETATM 111 H UNK 0 -1.486 8.154 -1.748 0.00 0.00 H+0 HETATM 112 H UNK 0 0.298 8.268 -1.995 0.00 0.00 H+0 HETATM 113 H UNK 0 -1.302 -0.641 -0.799 0.00 0.00 H+0 HETATM 114 H UNK 0 -2.305 0.907 1.587 0.00 0.00 H+0 HETATM 115 H UNK 0 -3.911 -1.550 0.745 0.00 0.00 H+0 HETATM 116 H UNK 0 -4.414 1.395 0.997 0.00 0.00 H+0 HETATM 117 H UNK 0 -5.703 -2.028 1.355 0.00 0.00 H+0 HETATM 118 H UNK 0 -5.996 -1.805 -0.372 0.00 0.00 H+0 HETATM 119 H UNK 0 -7.391 -1.809 0.717 0.00 0.00 H+0 HETATM 120 H UNK 0 -6.556 1.957 0.848 0.00 0.00 H+0 HETATM 121 H UNK 0 -8.643 1.679 -0.283 0.00 0.00 H+0 HETATM 122 H UNK 0 -9.123 0.960 2.619 0.00 0.00 H+0 HETATM 123 H UNK 0 -10.146 1.846 1.459 0.00 0.00 H+0 HETATM 124 H UNK 0 -8.586 2.588 1.895 0.00 0.00 H+0 HETATM 125 H UNK 0 -9.399 -1.037 0.924 0.00 0.00 H+0 HETATM 126 H UNK 0 -9.364 0.118 -1.906 0.00 0.00 H+0 HETATM 127 H UNK 0 -8.014 -0.969 -1.428 0.00 0.00 H+0 HETATM 128 H UNK 0 -8.660 -3.398 -0.693 0.00 0.00 H+0 HETATM 129 H UNK 0 -10.235 -5.259 -1.139 0.00 0.00 H+0 HETATM 130 H UNK 0 -12.391 -4.848 -2.163 0.00 0.00 H+0 HETATM 131 H UNK 0 -13.039 -2.584 -2.772 0.00 0.00 H+0 HETATM 132 H UNK 0 -11.472 -0.651 -2.340 0.00 0.00 H+0 HETATM 133 H UNK 0 -11.452 -1.526 0.766 0.00 0.00 H+0 HETATM 134 H UNK 0 -11.071 -0.287 2.011 0.00 0.00 H+0 HETATM 135 H UNK 0 -12.517 -0.128 0.885 0.00 0.00 H+0 HETATM 136 H UNK 0 -1.561 -0.678 2.951 0.00 0.00 H+0 HETATM 137 H UNK 0 0.560 -1.234 2.339 0.00 0.00 H+0 HETATM 138 H UNK 0 0.285 -1.255 0.577 0.00 0.00 H+0 HETATM 139 H UNK 0 0.137 0.284 1.575 0.00 0.00 H+0 HETATM 140 H UNK 0 -2.644 -3.665 0.242 0.00 0.00 H+0 HETATM 141 H UNK 0 -0.992 -5.370 0.660 0.00 0.00 H+0 HETATM 142 H UNK 0 0.799 -5.196 -2.373 0.00 0.00 H+0 HETATM 143 H UNK 0 0.169 -3.568 2.357 0.00 0.00 H+0 HETATM 144 H UNK 0 0.789 -5.162 1.949 0.00 0.00 H+0 HETATM 145 H UNK 0 1.581 -3.318 -0.154 0.00 0.00 H+0 HETATM 146 H UNK 0 2.090 -2.737 1.424 0.00 0.00 H+0 HETATM 147 H UNK 0 4.045 -6.992 0.434 0.00 0.00 H+0 HETATM 148 H UNK 0 5.041 -6.468 -0.938 0.00 0.00 H+0 HETATM 149 H UNK 0 5.399 -5.922 0.787 0.00 0.00 H+0 CONECT 1 2 74 75 CONECT 2 1 3 72 CONECT 3 2 4 5 CONECT 4 3 CONECT 5 3 6 76 CONECT 6 5 7 11 77 CONECT 7 6 8 78 79 CONECT 8 7 9 80 81 CONECT 9 8 10 CONECT 10 9 82 83 84 CONECT 11 6 12 13 CONECT 12 11 CONECT 13 11 14 85 CONECT 14 13 15 19 86 CONECT 15 14 16 87 88 CONECT 16 15 17 18 89 CONECT 17 16 90 91 92 CONECT 18 16 93 94 95 CONECT 19 14 20 21 CONECT 20 19 CONECT 21 19 22 96 CONECT 22 21 23 26 97 CONECT 23 22 24 25 CONECT 24 23 CONECT 25 23 98 CONECT 26 22 27 99 100 CONECT 27 26 28 29 CONECT 28 27 CONECT 29 27 30 101 CONECT 30 29 31 38 102 CONECT 31 30 32 103 104 CONECT 32 31 33 105 106 CONECT 33 32 34 107 108 CONECT 34 33 35 CONECT 35 34 36 37 CONECT 36 35 109 110 CONECT 37 35 111 112 CONECT 38 30 39 40 CONECT 39 38 CONECT 40 38 41 113 CONECT 41 40 42 59 114 CONECT 42 41 43 115 CONECT 43 42 44 116 CONECT 44 43 45 46 CONECT 45 44 117 118 119 CONECT 46 44 47 120 CONECT 47 46 48 49 121 CONECT 48 47 122 123 124 CONECT 49 47 50 57 125 CONECT 50 49 51 126 127 CONECT 51 50 52 56 CONECT 52 51 53 128 CONECT 53 52 54 129 CONECT 54 53 55 130 CONECT 55 54 56 131 CONECT 56 55 51 132 CONECT 57 49 58 CONECT 58 57 133 134 135 CONECT 59 41 60 61 136 CONECT 60 59 137 138 139 CONECT 61 59 62 63 CONECT 62 61 CONECT 63 61 64 140 CONECT 64 63 65 68 141 CONECT 65 64 66 67 CONECT 66 65 CONECT 67 65 142 CONECT 68 64 69 143 144 CONECT 69 68 70 145 146 CONECT 70 69 71 72 CONECT 71 70 CONECT 72 70 73 2 CONECT 73 72 147 148 149 CONECT 74 1 CONECT 75 1 CONECT 76 5 CONECT 77 6 CONECT 78 7 CONECT 79 7 CONECT 80 8 CONECT 81 8 CONECT 82 10 CONECT 83 10 CONECT 84 10 CONECT 85 13 CONECT 86 14 CONECT 87 15 CONECT 88 15 CONECT 89 16 CONECT 90 17 CONECT 91 17 CONECT 92 17 CONECT 93 18 CONECT 94 18 CONECT 95 18 CONECT 96 21 CONECT 97 22 CONECT 98 25 CONECT 99 26 CONECT 100 26 CONECT 101 29 CONECT 102 30 CONECT 103 31 CONECT 104 31 CONECT 105 32 CONECT 106 32 CONECT 107 33 CONECT 108 33 CONECT 109 36 CONECT 110 36 CONECT 111 37 CONECT 112 37 CONECT 113 40 CONECT 114 41 CONECT 115 42 CONECT 116 43 CONECT 117 45 CONECT 118 45 CONECT 119 45 CONECT 120 46 CONECT 121 47 CONECT 122 48 CONECT 123 48 CONECT 124 48 CONECT 125 49 CONECT 126 50 CONECT 127 50 CONECT 128 52 CONECT 129 53 CONECT 130 54 CONECT 131 55 CONECT 132 56 CONECT 133 58 CONECT 134 58 CONECT 135 58 CONECT 136 59 CONECT 137 60 CONECT 138 60 CONECT 139 60 CONECT 140 63 CONECT 141 64 CONECT 142 67 CONECT 143 68 CONECT 144 68 CONECT 145 69 CONECT 146 69 CONECT 147 73 CONECT 148 73 CONECT 149 73 MASTER 0 0 0 0 0 0 0 0 149 0 300 0 END