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 2.613 0.668 -3.453 0.00 0.00 C+0 HETATM 2 O UNK 0 1.643 -0.308 -3.256 0.00 0.00 O+0 HETATM 3 C UNK 0 0.466 0.239 -2.772 0.00 0.00 C+0 HETATM 4 C UNK 0 -0.589 0.216 -3.852 0.00 0.00 C+0 HETATM 5 O UNK 0 -0.351 0.749 -4.975 0.00 0.00 O+0 HETATM 6 N UNK 0 -1.703 -0.440 -3.308 0.00 0.00 N+0 HETATM 7 C UNK 0 -1.533 -0.569 -1.880 0.00 0.00 C+0 HETATM 8 O UNK 0 -1.937 -1.849 -1.453 0.00 0.00 O+0 HETATM 9 C UNK 0 -2.368 0.432 -1.202 0.00 0.00 C+0 HETATM 10 C UNK 0 -3.751 -0.052 -1.088 0.00 0.00 C+0 HETATM 11 O UNK 0 -3.905 -1.336 -1.142 0.00 0.00 O+0 HETATM 12 N UNK 0 -4.952 0.659 -0.923 0.00 0.00 N+0 HETATM 13 C UNK 0 -6.101 0.382 -1.820 0.00 0.00 C+0 HETATM 14 C UNK 0 -5.203 1.653 0.099 0.00 0.00 C+0 HETATM 15 C UNK 0 -6.430 1.390 0.883 0.00 0.00 C+0 HETATM 16 O UNK 0 -7.424 2.136 0.625 0.00 0.00 O+0 HETATM 17 N UNK 0 -6.623 0.406 1.891 0.00 0.00 N+0 HETATM 18 C UNK 0 -6.253 -0.976 1.872 0.00 0.00 C+0 HETATM 19 C UNK 0 -7.543 -1.821 1.817 0.00 0.00 C+0 HETATM 20 C UNK 0 -8.331 -1.455 0.644 0.00 0.00 C+0 HETATM 21 C UNK 0 -8.259 -1.974 -0.641 0.00 0.00 C+0 HETATM 22 N UNK 0 -9.129 -1.350 -1.442 0.00 0.00 N+0 HETATM 23 C UNK 0 -9.785 -0.420 -0.714 0.00 0.00 C+0 HETATM 24 C UNK 0 -10.780 0.458 -1.046 0.00 0.00 C+0 HETATM 25 C UNK 0 -11.351 1.334 -0.106 0.00 0.00 C+0 HETATM 26 Cl UNK 0 -12.604 2.415 -0.572 0.00 0.00 Cl+0 HETATM 27 C UNK 0 -10.838 1.247 1.175 0.00 0.00 C+0 HETATM 28 C UNK 0 -9.839 0.361 1.504 0.00 0.00 C+0 HETATM 29 C UNK 0 -9.307 -0.471 0.576 0.00 0.00 C+0 HETATM 30 C UNK 0 -5.590 -1.385 3.148 0.00 0.00 C+0 HETATM 31 O UNK 0 -5.885 -2.334 3.892 0.00 0.00 O+0 HETATM 32 N UNK 0 -4.473 -0.559 3.591 0.00 0.00 N+0 HETATM 33 C UNK 0 -3.538 -0.086 2.601 0.00 0.00 C+0 HETATM 34 C UNK 0 -2.210 -0.702 2.665 0.00 0.00 C+0 HETATM 35 O UNK 0 -2.041 -1.902 2.773 0.00 0.00 O+0 HETATM 36 N UNK 0 -1.022 0.163 2.602 0.00 0.00 N+0 HETATM 37 C UNK 0 -1.056 1.545 2.358 0.00 0.00 C+0 HETATM 38 C UNK 0 0.036 2.157 1.540 0.00 0.00 C+0 HETATM 39 O UNK 0 -0.007 3.561 1.777 0.00 0.00 O+0 HETATM 40 C UNK 0 1.416 1.627 1.818 0.00 0.00 C+0 HETATM 41 C UNK 0 2.144 1.478 0.560 0.00 0.00 C+0 HETATM 42 O UNK 0 1.934 2.453 -0.277 0.00 0.00 O+0 HETATM 43 N UNK 0 3.006 0.487 0.119 0.00 0.00 N+0 HETATM 44 C UNK 0 2.903 -0.888 0.553 0.00 0.00 C+0 HETATM 45 C UNK 0 4.150 -1.054 1.494 0.00 0.00 C+0 HETATM 46 O UNK 0 3.924 -0.027 2.478 0.00 0.00 O+0 HETATM 47 C UNK 0 5.414 -0.796 0.812 0.00 0.00 C+0 HETATM 48 O UNK 0 6.314 -0.395 1.942 0.00 0.00 O+0 HETATM 49 C UNK 0 6.192 -2.026 0.296 0.00 0.00 C+0 HETATM 50 C UNK 0 7.357 -1.526 -0.384 0.00 0.00 C+0 HETATM 51 C UNK 0 8.350 -1.103 -0.969 0.00 0.00 C+0 HETATM 52 C UNK 0 9.450 -0.298 -0.475 0.00 0.00 C+0 HETATM 53 C UNK 0 10.397 0.055 -1.270 0.00 0.00 C+0 HETATM 54 C UNK 0 11.536 0.849 -0.894 0.00 0.00 C+0 HETATM 55 C UNK 0 12.479 1.212 -1.843 0.00 0.00 C+0 HETATM 56 C UNK 0 13.560 1.902 -1.361 0.00 0.00 C+0 HETATM 57 C UNK 0 13.716 2.218 -0.039 0.00 0.00 C+0 HETATM 58 C UNK 0 12.793 1.867 0.911 0.00 0.00 C+0 HETATM 59 C UNK 0 11.684 1.160 0.416 0.00 0.00 C+0 HETATM 60 C UNK 0 2.994 -1.881 -0.490 0.00 0.00 C+0 HETATM 61 O UNK 0 3.967 -1.438 -1.458 0.00 0.00 O+0 HETATM 62 C UNK 0 1.819 -2.255 -1.308 0.00 0.00 C+0 HETATM 63 O UNK 0 2.120 -3.218 -2.142 0.00 0.00 O+0 HETATM 64 N UNK 0 0.520 -1.815 -1.375 0.00 0.00 N+0 HETATM 65 C UNK 0 -0.042 -0.503 -1.606 0.00 0.00 C+0 HETATM 66 H UNK 0 2.184 1.349 -4.241 0.00 0.00 H+0 HETATM 67 H UNK 0 3.550 0.239 -3.858 0.00 0.00 H+0 HETATM 68 H UNK 0 2.842 1.280 -2.586 0.00 0.00 H+0 HETATM 69 H UNK 0 0.676 1.304 -2.553 0.00 0.00 H+0 HETATM 70 H UNK 0 -2.515 -0.744 -3.844 0.00 0.00 H+0 HETATM 71 H UNK 0 -2.032 -2.454 -2.197 0.00 0.00 H+0 HETATM 72 H UNK 0 -2.021 0.571 -0.134 0.00 0.00 H+0 HETATM 73 H UNK 0 -2.355 1.449 -1.708 0.00 0.00 H+0 HETATM 74 H UNK 0 -6.124 1.097 -2.658 0.00 0.00 H+0 HETATM 75 H UNK 0 -6.037 -0.676 -2.160 0.00 0.00 H+0 HETATM 76 H UNK 0 -7.004 0.525 -1.213 0.00 0.00 H+0 HETATM 77 H UNK 0 -5.380 2.596 -0.498 0.00 0.00 H+0 HETATM 78 H UNK 0 -4.309 1.857 0.677 0.00 0.00 H+0 HETATM 79 H UNK 0 -7.091 0.679 2.821 0.00 0.00 H+0 HETATM 80 H UNK 0 -5.696 -1.286 0.985 0.00 0.00 H+0 HETATM 81 H UNK 0 -8.150 -1.635 2.733 0.00 0.00 H+0 HETATM 82 H UNK 0 -7.208 -2.892 1.781 0.00 0.00 H+0 HETATM 83 H UNK 0 -7.613 -2.778 -1.017 0.00 0.00 H+0 HETATM 84 H UNK 0 -9.304 -1.525 -2.468 0.00 0.00 H+0 HETATM 85 H UNK 0 -11.162 0.515 -2.048 0.00 0.00 H+0 HETATM 86 H UNK 0 -11.263 1.901 1.901 0.00 0.00 H+0 HETATM 87 H UNK 0 -9.426 0.283 2.518 0.00 0.00 H+0 HETATM 88 H UNK 0 -4.363 -0.341 4.583 0.00 0.00 H+0 HETATM 89 H UNK 0 -3.494 1.011 2.624 0.00 0.00 H+0 HETATM 90 H UNK 0 -4.014 -0.349 1.603 0.00 0.00 H+0 HETATM 91 H UNK 0 -0.122 -0.356 2.740 0.00 0.00 H+0 HETATM 92 H UNK 0 -2.036 1.815 1.870 0.00 0.00 H+0 HETATM 93 H UNK 0 -1.132 2.068 3.365 0.00 0.00 H+0 HETATM 94 H UNK 0 -0.258 2.083 0.466 0.00 0.00 H+0 HETATM 95 H UNK 0 -0.558 3.708 2.575 0.00 0.00 H+0 HETATM 96 H UNK 0 1.952 2.441 2.426 0.00 0.00 H+0 HETATM 97 H UNK 0 1.413 0.765 2.490 0.00 0.00 H+0 HETATM 98 H UNK 0 3.819 0.647 -0.575 0.00 0.00 H+0 HETATM 99 H UNK 0 2.037 -1.080 1.224 0.00 0.00 H+0 HETATM 100 H UNK 0 4.113 -1.996 2.033 0.00 0.00 H+0 HETATM 101 H UNK 0 4.220 0.823 2.050 0.00 0.00 H+0 HETATM 102 H UNK 0 5.531 -0.007 0.100 0.00 0.00 H+0 HETATM 103 H UNK 0 6.359 0.579 1.845 0.00 0.00 H+0 HETATM 104 H UNK 0 5.644 -2.811 -0.148 0.00 0.00 H+0 HETATM 105 H UNK 0 6.564 -2.518 1.297 0.00 0.00 H+0 HETATM 106 H UNK 0 6.792 -1.731 -1.623 0.00 0.00 H+0 HETATM 107 H UNK 0 8.456 -1.403 -2.027 0.00 0.00 H+0 HETATM 108 H UNK 0 9.469 0.015 0.562 0.00 0.00 H+0 HETATM 109 H UNK 0 10.317 -0.286 -2.305 0.00 0.00 H+0 HETATM 110 H UNK 0 12.323 0.955 -2.847 0.00 0.00 H+0 HETATM 111 H UNK 0 14.376 2.241 -2.027 0.00 0.00 H+0 HETATM 112 H UNK 0 14.581 2.765 0.330 0.00 0.00 H+0 HETATM 113 H UNK 0 12.858 2.078 1.969 0.00 0.00 H+0 HETATM 114 H UNK 0 10.964 0.897 1.212 0.00 0.00 H+0 HETATM 115 H UNK 0 3.429 -2.820 -0.052 0.00 0.00 H+0 HETATM 116 H UNK 0 4.285 -2.182 -2.014 0.00 0.00 H+0 HETATM 117 H UNK 0 -0.247 -2.574 -1.232 0.00 0.00 H+0 HETATM 118 H UNK 0 0.013 0.083 -0.649 0.00 0.00 H+0 CONECT 1 2 66 67 68 CONECT 2 1 3 CONECT 3 2 4 65 69 CONECT 4 3 5 6 CONECT 5 4 CONECT 6 4 7 70 CONECT 7 6 8 9 65 CONECT 8 7 71 CONECT 9 7 10 72 73 CONECT 10 9 11 12 CONECT 11 10 CONECT 12 10 13 14 CONECT 13 12 74 75 76 CONECT 14 12 15 77 78 CONECT 15 14 16 17 CONECT 16 15 CONECT 17 15 18 79 CONECT 18 17 19 30 80 CONECT 19 18 20 81 82 CONECT 20 19 21 29 CONECT 21 20 22 83 CONECT 22 21 23 84 CONECT 23 22 24 29 CONECT 24 23 25 85 CONECT 25 24 26 27 CONECT 26 25 CONECT 27 25 28 86 CONECT 28 27 29 87 CONECT 29 28 20 23 CONECT 30 18 31 32 CONECT 31 30 CONECT 32 30 33 88 CONECT 33 32 34 89 90 CONECT 34 33 35 36 CONECT 35 34 CONECT 36 34 37 91 CONECT 37 36 38 92 93 CONECT 38 37 39 40 94 CONECT 39 38 95 CONECT 40 38 41 96 97 CONECT 41 40 42 43 CONECT 42 41 CONECT 43 41 44 98 CONECT 44 43 45 60 99 CONECT 45 44 46 47 100 CONECT 46 45 101 CONECT 47 45 48 49 102 CONECT 48 47 103 CONECT 49 47 50 104 105 CONECT 50 49 51 106 CONECT 51 50 52 107 CONECT 52 51 53 108 CONECT 53 52 54 109 CONECT 54 53 55 59 CONECT 55 54 56 110 CONECT 56 55 57 111 CONECT 57 56 58 112 CONECT 58 57 59 113 CONECT 59 58 54 114 CONECT 60 44 61 62 115 CONECT 61 60 116 CONECT 62 60 63 64 CONECT 63 62 CONECT 64 62 65 117 CONECT 65 64 3 7 118 CONECT 66 1 CONECT 67 1 CONECT 68 1 CONECT 69 3 CONECT 70 6 CONECT 71 8 CONECT 72 9 CONECT 73 9 CONECT 74 13 CONECT 75 13 CONECT 76 13 CONECT 77 14 CONECT 78 14 CONECT 79 17 CONECT 80 18 CONECT 81 19 CONECT 82 19 CONECT 83 21 CONECT 84 22 CONECT 85 24 CONECT 86 27 CONECT 87 28 CONECT 88 32 CONECT 89 33 CONECT 90 33 CONECT 91 36 CONECT 92 37 CONECT 93 37 CONECT 94 38 CONECT 95 39 CONECT 96 40 CONECT 97 40 CONECT 98 43 CONECT 99 44 CONECT 100 45 CONECT 101 46 CONECT 102 47 CONECT 103 48 CONECT 104 49 CONECT 105 49 CONECT 106 50 CONECT 107 51 CONECT 108 52 CONECT 109 53 CONECT 110 55 CONECT 111 56 CONECT 112 57 CONECT 113 58 CONECT 114 59 CONECT 115 60 CONECT 116 61 CONECT 117 64 CONECT 118 65 MASTER 0 0 0 0 0 0 0 0 118 0 244 0 END