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 13.724 -0.363 -0.649 0.00 0.00 C+0 HETATM 2 C UNK 0 13.574 0.221 0.520 0.00 0.00 C+0 HETATM 3 N UNK 0 12.368 0.654 1.104 0.00 0.00 N+0 HETATM 4 C UNK 0 11.106 0.542 0.530 0.00 0.00 C+0 HETATM 5 O UNK 0 10.999 0.011 -0.624 0.00 0.00 O+0 HETATM 6 C UNK 0 9.850 1.006 1.192 0.00 0.00 C+0 HETATM 7 C UNK 0 9.957 1.539 2.385 0.00 0.00 C+0 HETATM 8 N UNK 0 8.651 0.822 0.482 0.00 0.00 N+0 HETATM 9 C UNK 0 7.339 1.134 0.850 0.00 0.00 C+0 HETATM 10 O UNK 0 7.070 1.662 1.986 0.00 0.00 O+0 HETATM 11 C UNK 0 6.156 0.895 -0.003 0.00 0.00 C+0 HETATM 12 C UNK 0 6.343 0.441 -1.282 0.00 0.00 C+0 HETATM 13 C UNK 0 5.213 0.247 -2.048 0.00 0.00 C+0 HETATM 14 C UNK 0 3.926 0.509 -1.516 0.00 0.00 C+0 HETATM 15 C UNK 0 3.771 0.962 -0.263 0.00 0.00 C+0 HETATM 16 N UNK 0 4.931 1.143 0.477 0.00 0.00 N+0 HETATM 17 C UNK 0 2.577 1.460 0.467 0.00 0.00 C+0 HETATM 18 C UNK 0 1.926 0.949 1.577 0.00 0.00 C+0 HETATM 19 O UNK 0 1.045 1.811 1.980 0.00 0.00 O+0 HETATM 20 C UNK 0 1.091 2.877 1.178 0.00 0.00 C+0 HETATM 21 N UNK 0 2.015 2.651 0.264 0.00 0.00 N+0 HETATM 22 C UNK 0 0.280 4.135 1.268 0.00 0.00 C+0 HETATM 23 C UNK 0 -0.292 4.320 2.500 0.00 0.00 C+0 HETATM 24 N UNK 0 0.159 5.125 0.287 0.00 0.00 N+0 HETATM 25 C UNK 0 -0.582 5.395 -0.864 0.00 0.00 C+0 HETATM 26 O UNK 0 -0.185 4.874 -1.984 0.00 0.00 O+0 HETATM 27 C UNK 0 -1.813 6.226 -1.046 0.00 0.00 C+0 HETATM 28 C UNK 0 -1.977 6.748 -2.308 0.00 0.00 C+0 HETATM 29 N UNK 0 -2.762 6.507 -0.043 0.00 0.00 N+0 HETATM 30 C UNK 0 -3.691 5.644 0.628 0.00 0.00 C+0 HETATM 31 O UNK 0 -4.001 5.762 1.846 0.00 0.00 O+0 HETATM 32 C UNK 0 -4.366 4.536 -0.082 0.00 0.00 C+0 HETATM 33 N UNK 0 -3.691 3.735 -0.911 0.00 0.00 N+0 HETATM 34 C UNK 0 -4.544 2.850 -1.448 0.00 0.00 C+0 HETATM 35 O UNK 0 -5.721 3.108 -0.953 0.00 0.00 O+0 HETATM 36 C UNK 0 -5.683 4.111 -0.122 0.00 0.00 C+0 HETATM 37 C UNK 0 -6.820 4.731 0.673 0.00 0.00 C+0 HETATM 38 C UNK 0 -4.090 1.822 -2.404 0.00 0.00 C+0 HETATM 39 C UNK 0 -4.683 1.697 -3.555 0.00 0.00 C+0 HETATM 40 N UNK 0 -2.973 0.991 -2.091 0.00 0.00 N+0 HETATM 41 C UNK 0 -2.579 0.684 -0.760 0.00 0.00 C+0 HETATM 42 O UNK 0 -1.375 0.667 -0.449 0.00 0.00 O+0 HETATM 43 C UNK 0 -3.574 0.371 0.310 0.00 0.00 C+0 HETATM 44 C UNK 0 -2.926 0.383 1.664 0.00 0.00 C+0 HETATM 45 C UNK 0 -3.974 0.061 2.739 0.00 0.00 C+0 HETATM 46 C UNK 0 -2.506 1.841 1.950 0.00 0.00 C+0 HETATM 47 N UNK 0 -4.171 -0.906 -0.045 0.00 0.00 N+0 HETATM 48 C UNK 0 -5.523 -1.101 -0.421 0.00 0.00 C+0 HETATM 49 O UNK 0 -5.777 -1.566 -1.593 0.00 0.00 O+0 HETATM 50 C UNK 0 -6.700 -0.809 0.439 0.00 0.00 C+0 HETATM 51 C UNK 0 -7.638 -0.047 -0.076 0.00 0.00 C+0 HETATM 52 N UNK 0 -6.804 -1.361 1.771 0.00 0.00 N+0 HETATM 53 C UNK 0 -6.731 -2.713 2.153 0.00 0.00 C+0 HETATM 54 O UNK 0 -7.533 -3.177 3.079 0.00 0.00 O+0 HETATM 55 C UNK 0 -5.835 -3.757 1.643 0.00 0.00 C+0 HETATM 56 N UNK 0 -4.489 -3.684 1.590 0.00 0.00 N+0 HETATM 57 C UNK 0 -4.018 -4.822 1.104 0.00 0.00 C+0 HETATM 58 O UNK 0 -5.045 -5.636 0.836 0.00 0.00 O+0 HETATM 59 C UNK 0 -6.146 -5.030 1.147 0.00 0.00 C+0 HETATM 60 C UNK 0 -7.521 -5.574 1.012 0.00 0.00 C+0 HETATM 61 C UNK 0 -2.597 -5.162 0.894 0.00 0.00 C+0 HETATM 62 C UNK 0 -2.296 -6.487 0.907 0.00 0.00 C+0 HETATM 63 C UNK 0 -0.930 -7.034 0.719 0.00 0.00 C+0 HETATM 64 N UNK 0 -1.523 -4.301 0.718 0.00 0.00 N+0 HETATM 65 C UNK 0 -1.214 -3.227 -0.110 0.00 0.00 C+0 HETATM 66 O UNK 0 -0.675 -2.218 0.523 0.00 0.00 O+0 HETATM 67 C UNK 0 -1.362 -2.992 -1.545 0.00 0.00 C+0 HETATM 68 C UNK 0 -2.427 -3.792 -2.248 0.00 0.00 C+0 HETATM 69 C UNK 0 -1.960 -5.206 -2.494 0.00 0.00 C+0 HETATM 70 O UNK 0 -3.690 -3.709 -1.772 0.00 0.00 O+0 HETATM 71 N UNK 0 -0.138 -3.250 -2.280 0.00 0.00 N+0 HETATM 72 C UNK 0 0.480 -2.571 -3.324 0.00 0.00 C+0 HETATM 73 O UNK 0 0.439 -3.130 -4.527 0.00 0.00 O+0 HETATM 74 C UNK 0 1.217 -1.272 -3.352 0.00 0.00 C+0 HETATM 75 C UNK 0 1.178 -0.352 -4.410 0.00 0.00 C+0 HETATM 76 S UNK 0 2.355 0.802 -3.942 0.00 0.00 S+0 HETATM 77 C UNK 0 2.837 0.101 -2.465 0.00 0.00 C+0 HETATM 78 N UNK 0 2.083 -0.965 -2.402 0.00 0.00 N+0 HETATM 79 C UNK 0 14.839 0.442 1.284 0.00 0.00 C+0 HETATM 80 N UNK 0 14.757 1.088 2.551 0.00 0.00 N+0 HETATM 81 O UNK 0 15.947 0.085 0.839 0.00 0.00 O+0 HETATM 82 H UNK 0 12.933 -0.594 -1.340 0.00 0.00 H+0 HETATM 83 H UNK 0 14.725 -0.649 -0.967 0.00 0.00 H+0 HETATM 84 H UNK 0 12.443 1.098 2.045 0.00 0.00 H+0 HETATM 85 H UNK 0 9.050 1.881 2.884 0.00 0.00 H+0 HETATM 86 H UNK 0 10.857 1.677 2.945 0.00 0.00 H+0 HETATM 87 H UNK 0 8.754 0.375 -0.484 0.00 0.00 H+0 HETATM 88 H UNK 0 7.308 0.243 -1.714 0.00 0.00 H+0 HETATM 89 H UNK 0 5.326 -0.067 -3.100 0.00 0.00 H+0 HETATM 90 H UNK 0 2.193 -0.035 1.979 0.00 0.00 H+0 HETATM 91 H UNK 0 -0.901 5.174 2.723 0.00 0.00 H+0 HETATM 92 H UNK 0 -0.138 3.613 3.310 0.00 0.00 H+0 HETATM 93 H UNK 0 0.894 5.968 0.520 0.00 0.00 H+0 HETATM 94 H UNK 0 -2.821 7.350 -2.523 0.00 0.00 H+0 HETATM 95 H UNK 0 -1.271 6.563 -3.082 0.00 0.00 H+0 HETATM 96 H UNK 0 -2.807 7.540 0.250 0.00 0.00 H+0 HETATM 97 H UNK 0 -7.692 4.065 0.699 0.00 0.00 H+0 HETATM 98 H UNK 0 -7.059 5.664 0.124 0.00 0.00 H+0 HETATM 99 H UNK 0 -6.367 4.916 1.666 0.00 0.00 H+0 HETATM 100 H UNK 0 -4.422 0.967 -4.327 0.00 0.00 H+0 HETATM 101 H UNK 0 -5.530 2.353 -3.821 0.00 0.00 H+0 HETATM 102 H UNK 0 -2.434 0.609 -2.891 0.00 0.00 H+0 HETATM 103 H UNK 0 -4.307 1.194 0.321 0.00 0.00 H+0 HETATM 104 H UNK 0 -2.047 -0.239 1.777 0.00 0.00 H+0 HETATM 105 H UNK 0 -3.646 0.357 3.741 0.00 0.00 H+0 HETATM 106 H UNK 0 -4.158 -1.051 2.798 0.00 0.00 H+0 HETATM 107 H UNK 0 -4.888 0.639 2.516 0.00 0.00 H+0 HETATM 108 H UNK 0 -2.148 2.319 1.003 0.00 0.00 H+0 HETATM 109 H UNK 0 -3.365 2.448 2.305 0.00 0.00 H+0 HETATM 110 H UNK 0 -1.746 1.869 2.762 0.00 0.00 H+0 HETATM 111 H UNK 0 -3.544 -1.727 -0.026 0.00 0.00 H+0 HETATM 112 H UNK 0 -7.574 0.344 -1.059 0.00 0.00 H+0 HETATM 113 H UNK 0 -8.507 0.211 0.491 0.00 0.00 H+0 HETATM 114 H UNK 0 -6.969 -0.664 2.528 0.00 0.00 H+0 HETATM 115 H UNK 0 -7.557 -6.345 0.222 0.00 0.00 H+0 HETATM 116 H UNK 0 -7.955 -5.935 1.969 0.00 0.00 H+0 HETATM 117 H UNK 0 -8.203 -4.747 0.657 0.00 0.00 H+0 HETATM 118 H UNK 0 -3.111 -7.214 1.072 0.00 0.00 H+0 HETATM 119 H UNK 0 -0.171 -6.267 0.596 0.00 0.00 H+0 HETATM 120 H UNK 0 -0.679 -7.651 1.613 0.00 0.00 H+0 HETATM 121 H UNK 0 -0.917 -7.734 -0.177 0.00 0.00 H+0 HETATM 122 H UNK 0 -0.703 -4.555 1.426 0.00 0.00 H+0 HETATM 123 H UNK 0 -1.618 -1.878 -1.637 0.00 0.00 H+0 HETATM 124 H UNK 0 -2.463 -3.329 -3.290 0.00 0.00 H+0 HETATM 125 H UNK 0 -2.779 -5.943 -2.402 0.00 0.00 H+0 HETATM 126 H UNK 0 -1.233 -5.489 -1.690 0.00 0.00 H+0 HETATM 127 H UNK 0 -1.416 -5.348 -3.452 0.00 0.00 H+0 HETATM 128 H UNK 0 -4.314 -4.245 -2.356 0.00 0.00 H+0 HETATM 129 H UNK 0 0.338 -4.166 -1.960 0.00 0.00 H+0 HETATM 130 H UNK 0 0.542 -0.414 -5.286 0.00 0.00 H+0 HETATM 131 H UNK 0 14.597 2.127 2.544 0.00 0.00 H+0 HETATM 132 H UNK 0 14.850 0.557 3.458 0.00 0.00 H+0 CONECT 1 2 82 83 CONECT 2 1 3 79 CONECT 3 2 4 84 CONECT 4 3 5 6 CONECT 5 4 CONECT 6 4 7 8 CONECT 7 6 85 86 CONECT 8 6 9 87 CONECT 9 8 10 11 CONECT 10 9 CONECT 11 9 12 16 CONECT 12 11 13 88 CONECT 13 12 14 89 CONECT 14 13 15 77 CONECT 15 14 16 17 CONECT 16 15 11 CONECT 17 15 18 21 CONECT 18 17 19 90 CONECT 19 18 20 CONECT 20 19 21 22 CONECT 21 20 17 CONECT 22 20 23 24 CONECT 23 22 91 92 CONECT 24 22 25 93 CONECT 25 24 26 27 CONECT 26 25 CONECT 27 25 28 29 CONECT 28 27 94 95 CONECT 29 27 30 96 CONECT 30 29 31 32 CONECT 31 30 CONECT 32 30 33 36 CONECT 33 32 34 CONECT 34 33 35 38 CONECT 35 34 36 CONECT 36 35 37 32 CONECT 37 36 97 98 99 CONECT 38 34 39 40 CONECT 39 38 100 101 CONECT 40 38 41 102 CONECT 41 40 42 43 CONECT 42 41 CONECT 43 41 44 47 103 CONECT 44 43 45 46 104 CONECT 45 44 105 106 107 CONECT 46 44 108 109 110 CONECT 47 43 48 111 CONECT 48 47 49 50 CONECT 49 48 CONECT 50 48 51 52 CONECT 51 50 112 113 CONECT 52 50 53 114 CONECT 53 52 54 55 CONECT 54 53 CONECT 55 53 56 59 CONECT 56 55 57 CONECT 57 56 58 61 CONECT 58 57 59 CONECT 59 58 60 55 CONECT 60 59 115 116 117 CONECT 61 57 62 64 CONECT 62 61 63 118 CONECT 63 62 119 120 121 CONECT 64 61 65 122 CONECT 65 64 66 67 CONECT 66 65 CONECT 67 65 68 71 123 CONECT 68 67 69 70 124 CONECT 69 68 125 126 127 CONECT 70 68 128 CONECT 71 67 72 129 CONECT 72 71 73 74 CONECT 73 72 CONECT 74 72 75 78 CONECT 75 74 76 130 CONECT 76 75 77 CONECT 77 76 78 14 CONECT 78 77 74 CONECT 79 2 80 81 CONECT 80 79 131 132 CONECT 81 79 CONECT 82 1 CONECT 83 1 CONECT 84 3 CONECT 85 7 CONECT 86 7 CONECT 87 8 CONECT 88 12 CONECT 89 13 CONECT 90 18 CONECT 91 23 CONECT 92 23 CONECT 93 24 CONECT 94 28 CONECT 95 28 CONECT 96 29 CONECT 97 37 CONECT 98 37 CONECT 99 37 CONECT 100 39 CONECT 101 39 CONECT 102 40 CONECT 103 43 CONECT 104 44 CONECT 105 45 CONECT 106 45 CONECT 107 45 CONECT 108 46 CONECT 109 46 CONECT 110 46 CONECT 111 47 CONECT 112 51 CONECT 113 51 CONECT 114 52 CONECT 115 60 CONECT 116 60 CONECT 117 60 CONECT 118 62 CONECT 119 63 CONECT 120 63 CONECT 121 63 CONECT 122 64 CONECT 123 67 CONECT 124 68 CONECT 125 69 CONECT 126 69 CONECT 127 69 CONECT 128 70 CONECT 129 71 CONECT 130 75 CONECT 131 80 CONECT 132 80 MASTER 0 0 0 0 0 0 0 0 132 0 274 0 END