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 -6.420 -2.239 -0.852 0.00 0.00 C+0 HETATM 2 C UNK 0 -5.015 -1.736 -1.017 0.00 0.00 C+0 HETATM 3 C UNK 0 -4.727 -0.686 0.050 0.00 0.00 C+0 HETATM 4 C UNK 0 -5.664 0.488 -0.115 0.00 0.00 C+0 HETATM 5 C UNK 0 -3.280 -0.163 -0.136 0.00 0.00 C+0 HETATM 6 N UNK 0 -3.096 0.745 0.937 0.00 0.00 N+0 HETATM 7 C UNK 0 -3.038 2.144 0.741 0.00 0.00 C+0 HETATM 8 O UNK 0 -3.155 2.833 1.809 0.00 0.00 O+0 HETATM 9 C UNK 0 -2.861 2.792 -0.549 0.00 0.00 C+0 HETATM 10 N UNK 0 -3.906 3.164 -1.352 0.00 0.00 N+0 HETATM 11 C UNK 0 -4.983 3.549 -2.197 0.00 0.00 C+0 HETATM 12 C UNK 0 -6.311 3.797 -1.513 0.00 0.00 C+0 HETATM 13 O UNK 0 -4.877 3.681 -3.387 0.00 0.00 O+0 HETATM 14 C UNK 0 -1.911 4.043 -0.354 0.00 0.00 C+0 HETATM 15 C UNK 0 -2.617 5.188 0.284 0.00 0.00 C+0 HETATM 16 O UNK 0 -0.856 3.616 0.422 0.00 0.00 O+0 HETATM 17 C UNK 0 0.479 3.786 0.336 0.00 0.00 C+0 HETATM 18 O UNK 0 1.087 4.679 1.032 0.00 0.00 O+0 HETATM 19 C UNK 0 1.373 2.976 -0.563 0.00 0.00 C+0 HETATM 20 C UNK 0 1.344 3.690 -1.908 0.00 0.00 C+0 HETATM 21 C UNK 0 2.259 2.997 -2.928 0.00 0.00 C+0 HETATM 22 C UNK 0 1.742 5.157 -1.776 0.00 0.00 C+0 HETATM 23 C UNK 0 1.643 5.776 -3.151 0.00 0.00 C+0 HETATM 24 N UNK 0 0.859 1.646 -0.626 0.00 0.00 N+0 HETATM 25 C UNK 0 1.430 0.435 -1.020 0.00 0.00 C+0 HETATM 26 O UNK 0 0.988 -0.137 -2.074 0.00 0.00 O+0 HETATM 27 C UNK 0 2.546 -0.293 -0.307 0.00 0.00 C+0 HETATM 28 C UNK 0 3.917 0.132 -0.798 0.00 0.00 C+0 HETATM 29 C UNK 0 4.985 -0.517 -0.002 0.00 0.00 C+0 HETATM 30 C UNK 0 5.616 0.307 0.959 0.00 0.00 C+0 HETATM 31 C UNK 0 6.562 -0.222 1.793 0.00 0.00 C+0 HETATM 32 C UNK 0 6.936 -1.595 1.725 0.00 0.00 C+0 HETATM 33 O UNK 0 7.837 -2.079 2.531 0.00 0.00 O+0 HETATM 34 C UNK 0 8.739 -2.255 3.443 0.00 0.00 C+0 HETATM 35 C UNK 0 6.307 -2.351 0.789 0.00 0.00 C+0 HETATM 36 C UNK 0 5.350 -1.796 -0.050 0.00 0.00 C+0 HETATM 37 N UNK 0 2.372 -1.718 -0.649 0.00 0.00 N+0 HETATM 38 C UNK 0 2.406 -2.074 -2.057 0.00 0.00 C+0 HETATM 39 C UNK 0 2.178 -2.763 0.293 0.00 0.00 C+0 HETATM 40 O UNK 0 2.641 -3.895 -0.010 0.00 0.00 O+0 HETATM 41 C UNK 0 1.448 -2.464 1.559 0.00 0.00 C+0 HETATM 42 C UNK 0 2.497 -2.812 2.665 0.00 0.00 C+0 HETATM 43 C UNK 0 2.541 -4.325 2.558 0.00 0.00 C+0 HETATM 44 C UNK 0 1.238 -4.703 1.926 0.00 0.00 C+0 HETATM 45 N UNK 0 0.464 -3.440 1.951 0.00 0.00 N+0 HETATM 46 C UNK 0 -0.866 -3.297 2.361 0.00 0.00 C+0 HETATM 47 O UNK 0 -1.108 -3.896 3.550 0.00 0.00 O+0 HETATM 48 C UNK 0 -2.027 -2.648 1.792 0.00 0.00 C+0 HETATM 49 C UNK 0 -3.176 -3.718 1.896 0.00 0.00 C+0 HETATM 50 C UNK 0 -2.711 -4.651 0.770 0.00 0.00 C+0 HETATM 51 C UNK 0 -1.831 -3.841 -0.139 0.00 0.00 C+0 HETATM 52 N UNK 0 -2.115 -2.469 0.373 0.00 0.00 N+0 HETATM 53 C UNK 0 -2.414 -1.284 -0.333 0.00 0.00 C+0 HETATM 54 O UNK 0 -1.695 -1.234 -1.443 0.00 0.00 O+0 HETATM 55 H UNK 0 -6.424 -3.310 -0.509 0.00 0.00 H+0 HETATM 56 H UNK 0 -7.011 -1.689 -0.105 0.00 0.00 H+0 HETATM 57 H UNK 0 -6.976 -2.164 -1.822 0.00 0.00 H+0 HETATM 58 H UNK 0 -4.237 -2.498 -1.105 0.00 0.00 H+0 HETATM 59 H UNK 0 -5.014 -1.127 -1.981 0.00 0.00 H+0 HETATM 60 H UNK 0 -4.813 -1.079 1.052 0.00 0.00 H+0 HETATM 61 H UNK 0 -6.685 0.256 0.126 0.00 0.00 H+0 HETATM 62 H UNK 0 -5.312 1.294 0.578 0.00 0.00 H+0 HETATM 63 H UNK 0 -5.585 0.793 -1.183 0.00 0.00 H+0 HETATM 64 H UNK 0 -3.328 0.437 -1.103 0.00 0.00 H+0 HETATM 65 H UNK 0 -2.998 0.383 1.901 0.00 0.00 H+0 HETATM 66 H UNK 0 -2.124 2.110 -1.117 0.00 0.00 H+0 HETATM 67 H UNK 0 -3.089 3.257 -2.458 0.00 0.00 H+0 HETATM 68 H UNK 0 -7.145 3.523 -2.166 0.00 0.00 H+0 HETATM 69 H UNK 0 -6.394 3.153 -0.593 0.00 0.00 H+0 HETATM 70 H UNK 0 -6.438 4.855 -1.210 0.00 0.00 H+0 HETATM 71 H UNK 0 -1.652 4.371 -1.380 0.00 0.00 H+0 HETATM 72 H UNK 0 -3.255 5.797 -0.408 0.00 0.00 H+0 HETATM 73 H UNK 0 -1.816 5.886 0.642 0.00 0.00 H+0 HETATM 74 H UNK 0 -3.190 4.937 1.218 0.00 0.00 H+0 HETATM 75 H UNK 0 2.423 3.049 -0.214 0.00 0.00 H+0 HETATM 76 H UNK 0 0.339 3.650 -2.358 0.00 0.00 H+0 HETATM 77 H UNK 0 1.820 3.186 -3.921 0.00 0.00 H+0 HETATM 78 H UNK 0 3.290 3.507 -2.917 0.00 0.00 H+0 HETATM 79 H UNK 0 2.407 1.959 -2.681 0.00 0.00 H+0 HETATM 80 H UNK 0 2.807 5.231 -1.425 0.00 0.00 H+0 HETATM 81 H UNK 0 1.013 5.671 -1.123 0.00 0.00 H+0 HETATM 82 H UNK 0 0.646 6.257 -3.265 0.00 0.00 H+0 HETATM 83 H UNK 0 2.430 6.572 -3.269 0.00 0.00 H+0 HETATM 84 H UNK 0 1.854 5.050 -3.945 0.00 0.00 H+0 HETATM 85 H UNK 0 -0.170 1.553 -0.291 0.00 0.00 H+0 HETATM 86 H UNK 0 2.547 -0.196 0.769 0.00 0.00 H+0 HETATM 87 H UNK 0 4.024 1.247 -0.767 0.00 0.00 H+0 HETATM 88 H UNK 0 4.055 -0.138 -1.856 0.00 0.00 H+0 HETATM 89 H UNK 0 5.342 1.339 1.032 0.00 0.00 H+0 HETATM 90 H UNK 0 7.087 0.348 2.548 0.00 0.00 H+0 HETATM 91 H UNK 0 9.816 -2.470 3.154 0.00 0.00 H+0 HETATM 92 H UNK 0 8.537 -3.195 4.112 0.00 0.00 H+0 HETATM 93 H UNK 0 8.853 -1.469 4.257 0.00 0.00 H+0 HETATM 94 H UNK 0 6.588 -3.411 0.722 0.00 0.00 H+0 HETATM 95 H UNK 0 4.910 -2.494 -0.778 0.00 0.00 H+0 HETATM 96 H UNK 0 2.756 -1.316 -2.738 0.00 0.00 H+0 HETATM 97 H UNK 0 3.026 -2.995 -2.193 0.00 0.00 H+0 HETATM 98 H UNK 0 1.381 -2.401 -2.398 0.00 0.00 H+0 HETATM 99 H UNK 0 1.172 -1.429 1.635 0.00 0.00 H+0 HETATM 100 H UNK 0 3.482 -2.401 2.402 0.00 0.00 H+0 HETATM 101 H UNK 0 2.122 -2.488 3.639 0.00 0.00 H+0 HETATM 102 H UNK 0 2.680 -4.767 3.584 0.00 0.00 H+0 HETATM 103 H UNK 0 3.432 -4.617 1.956 0.00 0.00 H+0 HETATM 104 H UNK 0 0.792 -5.453 2.669 0.00 0.00 H+0 HETATM 105 H UNK 0 1.229 -5.228 1.003 0.00 0.00 H+0 HETATM 106 H UNK 0 -2.354 -1.755 2.389 0.00 0.00 H+0 HETATM 107 H UNK 0 -4.105 -3.209 1.678 0.00 0.00 H+0 HETATM 108 H UNK 0 -3.116 -4.236 2.866 0.00 0.00 H+0 HETATM 109 H UNK 0 -3.648 -4.878 0.201 0.00 0.00 H+0 HETATM 110 H UNK 0 -2.233 -5.540 1.169 0.00 0.00 H+0 HETATM 111 H UNK 0 -0.750 -4.085 -0.067 0.00 0.00 H+0 HETATM 112 H UNK 0 -2.118 -3.953 -1.199 0.00 0.00 H+0 CONECT 1 2 55 56 57 CONECT 2 1 3 58 59 CONECT 3 2 4 5 60 CONECT 4 3 61 62 63 CONECT 5 3 6 53 64 CONECT 6 5 7 65 CONECT 7 6 8 9 CONECT 8 7 CONECT 9 7 10 14 66 CONECT 10 9 11 67 CONECT 11 10 12 13 CONECT 12 11 68 69 70 CONECT 13 11 CONECT 14 9 15 16 71 CONECT 15 14 72 73 74 CONECT 16 14 17 CONECT 17 16 18 19 CONECT 18 17 CONECT 19 17 20 24 75 CONECT 20 19 21 22 76 CONECT 21 20 77 78 79 CONECT 22 20 23 80 81 CONECT 23 22 82 83 84 CONECT 24 19 25 85 CONECT 25 24 26 27 CONECT 26 25 CONECT 27 25 28 37 86 CONECT 28 27 29 87 88 CONECT 29 28 30 36 CONECT 30 29 31 89 CONECT 31 30 32 90 CONECT 32 31 33 35 CONECT 33 32 34 CONECT 34 33 91 92 93 CONECT 35 32 36 94 CONECT 36 35 29 95 CONECT 37 27 38 39 CONECT 38 37 96 97 98 CONECT 39 37 40 41 CONECT 40 39 CONECT 41 39 42 45 99 CONECT 42 41 43 100 101 CONECT 43 42 44 102 103 CONECT 44 43 45 104 105 CONECT 45 44 46 41 CONECT 46 45 47 48 CONECT 47 46 CONECT 48 46 49 52 106 CONECT 49 48 50 107 108 CONECT 50 49 51 109 110 CONECT 51 50 52 111 112 CONECT 52 51 53 48 CONECT 53 52 54 5 CONECT 54 53 CONECT 55 1 CONECT 56 1 CONECT 57 1 CONECT 58 2 CONECT 59 2 CONECT 60 3 CONECT 61 4 CONECT 62 4 CONECT 63 4 CONECT 64 5 CONECT 65 6 CONECT 66 9 CONECT 67 10 CONECT 68 12 CONECT 69 12 CONECT 70 12 CONECT 71 14 CONECT 72 15 CONECT 73 15 CONECT 74 15 CONECT 75 19 CONECT 76 20 CONECT 77 21 CONECT 78 21 CONECT 79 21 CONECT 80 22 CONECT 81 22 CONECT 82 23 CONECT 83 23 CONECT 84 23 CONECT 85 24 CONECT 86 27 CONECT 87 28 CONECT 88 28 CONECT 89 30 CONECT 90 31 CONECT 91 34 CONECT 92 34 CONECT 93 34 CONECT 94 35 CONECT 95 36 CONECT 96 38 CONECT 97 38 CONECT 98 38 CONECT 99 41 CONECT 100 42 CONECT 101 42 CONECT 102 43 CONECT 103 43 CONECT 104 44 CONECT 105 44 CONECT 106 48 CONECT 107 49 CONECT 108 49 CONECT 109 50 CONECT 110 50 CONECT 111 51 CONECT 112 51 MASTER 0 0 0 0 0 0 0 0 112 0 230 0 END