HEADER PROTEIN 04-JUL-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 04-JUL-21 0 HETATM 1 C UNK 0 -7.489 3.685 -2.720 0.00 0.00 C+0 HETATM 2 O UNK 0 -7.090 3.840 -1.411 0.00 0.00 O+0 HETATM 3 C UNK 0 -6.871 2.615 -0.792 0.00 0.00 C+0 HETATM 4 C UNK 0 -5.422 2.504 -0.393 0.00 0.00 C+0 HETATM 5 C UNK 0 -4.579 1.793 -1.385 0.00 0.00 C+0 HETATM 6 C UNK 0 -3.583 2.373 -2.026 0.00 0.00 C+0 HETATM 7 C UNK 0 -3.226 1.882 -3.377 0.00 0.00 C+0 HETATM 8 C UNK 0 -2.842 3.477 -1.452 0.00 0.00 C+0 HETATM 9 C UNK 0 -2.464 3.466 -0.192 0.00 0.00 C+0 HETATM 10 C UNK 0 -2.033 2.266 0.552 0.00 0.00 C+0 HETATM 11 O UNK 0 -2.542 2.326 1.753 0.00 0.00 O+0 HETATM 12 O UNK 0 -1.266 1.314 0.061 0.00 0.00 O+0 HETATM 13 C UNK 0 0.063 0.903 0.001 0.00 0.00 C+0 HETATM 14 C UNK 0 0.882 1.484 -1.065 0.00 0.00 C+0 HETATM 15 C UNK 0 0.887 3.026 -1.025 0.00 0.00 C+0 HETATM 16 C UNK 0 2.358 1.155 -1.056 0.00 0.00 C+0 HETATM 17 O UNK 0 2.816 1.822 -2.298 0.00 0.00 O+0 HETATM 18 C UNK 0 3.191 1.799 0.001 0.00 0.00 C+0 HETATM 19 C UNK 0 2.932 1.561 1.420 0.00 0.00 C+0 HETATM 20 C UNK 0 4.642 1.733 -0.371 0.00 0.00 C+0 HETATM 21 C UNK 0 5.298 0.454 -0.606 0.00 0.00 C+0 HETATM 22 C UNK 0 5.462 -0.515 0.477 0.00 0.00 C+0 HETATM 23 O UNK 0 5.077 -0.311 1.596 0.00 0.00 O+0 HETATM 24 C UNK 0 6.133 -1.852 0.271 0.00 0.00 C+0 HETATM 25 C UNK 0 5.993 -2.694 1.526 0.00 0.00 C+0 HETATM 26 C UNK 0 7.525 -1.766 -0.222 0.00 0.00 C+0 HETATM 27 O UNK 0 7.984 -3.131 -0.359 0.00 0.00 O+0 HETATM 28 C UNK 0 8.330 -3.690 -1.557 0.00 0.00 C+0 HETATM 29 C UNK 0 8.794 -5.097 -1.596 0.00 0.00 C+0 HETATM 30 O UNK 0 8.233 -2.959 -2.582 0.00 0.00 O+0 HETATM 31 C UNK 0 8.546 -1.086 0.604 0.00 0.00 C+0 HETATM 32 C UNK 0 8.764 -1.692 1.979 0.00 0.00 C+0 HETATM 33 C UNK 0 8.495 0.373 0.681 0.00 0.00 C+0 HETATM 34 C UNK 0 9.335 1.183 0.057 0.00 0.00 C+0 HETATM 35 N UNK 0 9.282 2.608 0.133 0.00 0.00 N+0 HETATM 36 C UNK 0 10.451 3.287 0.669 0.00 0.00 C+0 HETATM 37 C UNK 0 8.183 3.363 -0.281 0.00 0.00 C+0 HETATM 38 O UNK 0 8.191 4.607 -0.186 0.00 0.00 O+0 HETATM 39 C UNK 0 -0.158 -0.613 -0.326 0.00 0.00 C+0 HETATM 40 C UNK 0 1.037 -1.457 -0.207 0.00 0.00 C+0 HETATM 41 C UNK 0 -1.209 -1.075 0.700 0.00 0.00 C+0 HETATM 42 O UNK 0 -0.524 -1.847 1.631 0.00 0.00 O+0 HETATM 43 C UNK 0 -0.505 -1.348 2.906 0.00 0.00 C+0 HETATM 44 C UNK 0 -2.273 -1.886 -0.015 0.00 0.00 C+0 HETATM 45 C UNK 0 -3.240 -2.525 0.907 0.00 0.00 C+0 HETATM 46 O UNK 0 -3.595 -3.791 0.599 0.00 0.00 O+0 HETATM 47 C UNK 0 -3.324 -4.777 1.506 0.00 0.00 C+0 HETATM 48 C UNK 0 -4.516 -1.674 1.075 0.00 0.00 C+0 HETATM 49 C UNK 0 -4.582 -0.902 2.268 0.00 0.00 C+0 HETATM 50 O UNK 0 -4.027 -0.272 1.165 0.00 0.00 O+0 HETATM 51 C UNK 0 -5.468 -1.909 -0.018 0.00 0.00 C+0 HETATM 52 O UNK 0 -5.709 -3.259 -0.285 0.00 0.00 O+0 HETATM 53 C UNK 0 -5.355 -3.579 -1.594 0.00 0.00 C+0 HETATM 54 C UNK 0 -6.750 -1.189 -0.083 0.00 0.00 C+0 HETATM 55 C UNK 0 -7.541 -0.952 1.140 0.00 0.00 C+0 HETATM 56 C UNK 0 -9.004 -1.373 0.987 0.00 0.00 C+0 HETATM 57 C UNK 0 -9.905 -0.281 1.509 0.00 0.00 C+0 HETATM 58 C UNK 0 -9.678 0.929 1.006 0.00 0.00 C+0 HETATM 59 C UNK 0 -8.275 1.073 0.469 0.00 0.00 C+0 HETATM 60 C UNK 0 -7.821 2.508 0.383 0.00 0.00 C+0 HETATM 61 O UNK 0 -7.484 0.427 1.404 0.00 0.00 O+0 HETATM 62 H UNK 0 -7.659 4.670 -3.192 0.00 0.00 H+0 HETATM 63 H UNK 0 -8.393 3.040 -2.834 0.00 0.00 H+0 HETATM 64 H UNK 0 -6.671 3.171 -3.293 0.00 0.00 H+0 HETATM 65 H UNK 0 -7.084 1.845 -1.553 0.00 0.00 H+0 HETATM 66 H UNK 0 -5.057 3.549 -0.222 0.00 0.00 H+0 HETATM 67 H UNK 0 -5.387 2.003 0.590 0.00 0.00 H+0 HETATM 68 H UNK 0 -4.749 0.758 -1.623 0.00 0.00 H+0 HETATM 69 H UNK 0 -4.078 1.353 -3.850 0.00 0.00 H+0 HETATM 70 H UNK 0 -2.979 2.720 -4.072 0.00 0.00 H+0 HETATM 71 H UNK 0 -2.401 1.139 -3.348 0.00 0.00 H+0 HETATM 72 H UNK 0 -2.571 4.358 -2.067 0.00 0.00 H+0 HETATM 73 H UNK 0 -2.479 4.441 0.324 0.00 0.00 H+0 HETATM 74 H UNK 0 0.552 0.876 0.948 0.00 0.00 H+0 HETATM 75 H UNK 0 0.495 1.227 -2.057 0.00 0.00 H+0 HETATM 76 H UNK 0 1.007 3.438 -0.035 0.00 0.00 H+0 HETATM 77 H UNK 0 1.755 3.335 -1.644 0.00 0.00 H+0 HETATM 78 H UNK 0 0.009 3.363 -1.610 0.00 0.00 H+0 HETATM 79 H UNK 0 2.653 0.145 -1.227 0.00 0.00 H+0 HETATM 80 H UNK 0 2.315 1.279 -2.968 0.00 0.00 H+0 HETATM 81 H UNK 0 2.984 2.968 -0.090 0.00 0.00 H+0 HETATM 82 H UNK 0 2.121 2.268 1.842 0.00 0.00 H+0 HETATM 83 H UNK 0 2.646 0.584 1.776 0.00 0.00 H+0 HETATM 84 H UNK 0 3.819 1.943 2.048 0.00 0.00 H+0 HETATM 85 H UNK 0 5.268 2.307 0.376 0.00 0.00 H+0 HETATM 86 H UNK 0 4.764 2.346 -1.324 0.00 0.00 H+0 HETATM 87 H UNK 0 4.758 -0.110 -1.471 0.00 0.00 H+0 HETATM 88 H UNK 0 6.320 0.582 -1.098 0.00 0.00 H+0 HETATM 89 H UNK 0 5.524 -2.361 -0.505 0.00 0.00 H+0 HETATM 90 H UNK 0 6.437 -3.662 1.328 0.00 0.00 H+0 HETATM 91 H UNK 0 6.240 -2.185 2.451 0.00 0.00 H+0 HETATM 92 H UNK 0 4.879 -2.897 1.602 0.00 0.00 H+0 HETATM 93 H UNK 0 7.504 -1.275 -1.218 0.00 0.00 H+0 HETATM 94 H UNK 0 9.914 -5.159 -1.477 0.00 0.00 H+0 HETATM 95 H UNK 0 8.385 -5.610 -0.697 0.00 0.00 H+0 HETATM 96 H UNK 0 8.467 -5.628 -2.514 0.00 0.00 H+0 HETATM 97 H UNK 0 9.536 -1.317 0.072 0.00 0.00 H+0 HETATM 98 H UNK 0 9.867 -1.640 2.242 0.00 0.00 H+0 HETATM 99 H UNK 0 8.515 -2.748 2.053 0.00 0.00 H+0 HETATM 100 H UNK 0 8.305 -1.045 2.780 0.00 0.00 H+0 HETATM 101 H UNK 0 7.732 0.840 1.281 0.00 0.00 H+0 HETATM 102 H UNK 0 10.103 0.690 -0.549 0.00 0.00 H+0 HETATM 103 H UNK 0 11.341 2.893 0.149 0.00 0.00 H+0 HETATM 104 H UNK 0 10.357 4.386 0.526 0.00 0.00 H+0 HETATM 105 H UNK 0 10.595 3.060 1.744 0.00 0.00 H+0 HETATM 106 H UNK 0 7.316 2.878 -0.688 0.00 0.00 H+0 HETATM 107 H UNK 0 -0.565 -0.712 -1.357 0.00 0.00 H+0 HETATM 108 H UNK 0 1.423 -1.809 -1.204 0.00 0.00 H+0 HETATM 109 H UNK 0 0.655 -2.455 0.226 0.00 0.00 H+0 HETATM 110 H UNK 0 1.810 -1.172 0.505 0.00 0.00 H+0 HETATM 111 H UNK 0 -1.617 -0.211 1.262 0.00 0.00 H+0 HETATM 112 H UNK 0 0.065 -2.057 3.578 0.00 0.00 H+0 HETATM 113 H UNK 0 0.163 -0.441 2.879 0.00 0.00 H+0 HETATM 114 H UNK 0 -1.482 -1.091 3.311 0.00 0.00 H+0 HETATM 115 H UNK 0 -2.737 -1.193 -0.749 0.00 0.00 H+0 HETATM 116 H UNK 0 -1.754 -2.662 -0.606 0.00 0.00 H+0 HETATM 117 H UNK 0 -2.754 -2.554 1.917 0.00 0.00 H+0 HETATM 118 H UNK 0 -3.820 -4.617 2.496 0.00 0.00 H+0 HETATM 119 H UNK 0 -3.774 -5.721 1.112 0.00 0.00 H+0 HETATM 120 H UNK 0 -2.233 -4.989 1.625 0.00 0.00 H+0 HETATM 121 H UNK 0 -3.832 -1.152 3.089 0.00 0.00 H+0 HETATM 122 H UNK 0 -5.402 -0.327 2.704 0.00 0.00 H+0 HETATM 123 H UNK 0 -4.923 -1.570 -0.989 0.00 0.00 H+0 HETATM 124 H UNK 0 -6.021 -2.958 -2.276 0.00 0.00 H+0 HETATM 125 H UNK 0 -5.449 -4.626 -1.859 0.00 0.00 H+0 HETATM 126 H UNK 0 -4.336 -3.148 -1.837 0.00 0.00 H+0 HETATM 127 H UNK 0 -6.584 -0.259 -0.684 0.00 0.00 H+0 HETATM 128 H UNK 0 -7.426 -1.799 -0.774 0.00 0.00 H+0 HETATM 129 H UNK 0 -7.152 -1.583 1.946 0.00 0.00 H+0 HETATM 130 H UNK 0 -9.188 -1.560 -0.084 0.00 0.00 H+0 HETATM 131 H UNK 0 -9.236 -2.280 1.573 0.00 0.00 H+0 HETATM 132 H UNK 0 -10.688 -0.468 2.246 0.00 0.00 H+0 HETATM 133 H UNK 0 -10.422 1.682 1.001 0.00 0.00 H+0 HETATM 134 H UNK 0 -8.309 0.648 -0.525 0.00 0.00 H+0 HETATM 135 H UNK 0 -7.214 2.773 1.301 0.00 0.00 H+0 HETATM 136 H UNK 0 -8.704 3.157 0.287 0.00 0.00 H+0 CONECT 1 2 62 63 64 CONECT 2 1 3 CONECT 3 2 4 60 65 CONECT 4 3 5 66 67 CONECT 5 4 6 68 CONECT 6 5 7 8 CONECT 7 6 69 70 71 CONECT 8 6 9 72 CONECT 9 8 10 73 CONECT 10 9 11 12 CONECT 11 10 CONECT 12 10 13 CONECT 13 12 14 39 74 CONECT 14 13 15 16 75 CONECT 15 14 76 77 78 CONECT 16 14 17 18 79 CONECT 17 16 80 CONECT 18 16 19 20 81 CONECT 19 18 82 83 84 CONECT 20 18 21 85 86 CONECT 21 20 22 87 88 CONECT 22 21 23 24 CONECT 23 22 CONECT 24 22 25 26 89 CONECT 25 24 90 91 92 CONECT 26 24 27 31 93 CONECT 27 26 28 CONECT 28 27 29 30 CONECT 29 28 94 95 96 CONECT 30 28 CONECT 31 26 32 33 97 CONECT 32 31 98 99 100 CONECT 33 31 34 101 CONECT 34 33 35 102 CONECT 35 34 36 37 CONECT 36 35 103 104 105 CONECT 37 35 38 106 CONECT 38 37 CONECT 39 13 40 41 107 CONECT 40 39 108 109 110 CONECT 41 39 42 44 111 CONECT 42 41 43 CONECT 43 42 112 113 114 CONECT 44 41 45 115 116 CONECT 45 44 46 48 117 CONECT 46 45 47 CONECT 47 46 118 119 120 CONECT 48 45 49 51 50 CONECT 49 48 50 121 122 CONECT 50 49 48 CONECT 51 48 52 54 123 CONECT 52 51 53 CONECT 53 52 124 125 126 CONECT 54 51 55 127 128 CONECT 55 54 56 61 129 CONECT 56 55 57 130 131 CONECT 57 56 58 132 CONECT 58 57 59 133 CONECT 59 58 60 61 134 CONECT 60 59 3 135 136 CONECT 61 59 55 CONECT 62 1 CONECT 63 1 CONECT 64 1 CONECT 65 3 CONECT 66 4 CONECT 67 4 CONECT 68 5 CONECT 69 7 CONECT 70 7 CONECT 71 7 CONECT 72 8 CONECT 73 9 CONECT 74 13 CONECT 75 14 CONECT 76 15 CONECT 77 15 CONECT 78 15 CONECT 79 16 CONECT 80 17 CONECT 81 18 CONECT 82 19 CONECT 83 19 CONECT 84 19 CONECT 85 20 CONECT 86 20 CONECT 87 21 CONECT 88 21 CONECT 89 24 CONECT 90 25 CONECT 91 25 CONECT 92 25 CONECT 93 26 CONECT 94 29 CONECT 95 29 CONECT 96 29 CONECT 97 31 CONECT 98 32 CONECT 99 32 CONECT 100 32 CONECT 101 33 CONECT 102 34 CONECT 103 36 CONECT 104 36 CONECT 105 36 CONECT 106 37 CONECT 107 39 CONECT 108 40 CONECT 109 40 CONECT 110 40 CONECT 111 41 CONECT 112 43 CONECT 113 43 CONECT 114 43 CONECT 115 44 CONECT 116 44 CONECT 117 45 CONECT 118 47 CONECT 119 47 CONECT 120 47 CONECT 121 49 CONECT 122 49 CONECT 123 51 CONECT 124 53 CONECT 125 53 CONECT 126 53 CONECT 127 54 CONECT 128 54 CONECT 129 55 CONECT 130 56 CONECT 131 56 CONECT 132 57 CONECT 133 58 CONECT 134 59 CONECT 135 60 CONECT 136 60 MASTER 0 0 0 0 0 0 0 0 136 0 276 0 END