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 2.823 2.983 2.579 0.00 0.00 C+0 HETATM 2 C UNK 0 1.436 2.461 2.444 0.00 0.00 C+0 HETATM 3 C UNK 0 0.563 3.597 1.867 0.00 0.00 C+0 HETATM 4 C UNK 0 1.205 1.217 1.681 0.00 0.00 C+0 HETATM 5 C UNK 0 1.874 -0.019 2.189 0.00 0.00 C+0 HETATM 6 N UNK 0 3.289 -0.083 2.198 0.00 0.00 N+0 HETATM 7 C UNK 0 4.205 0.404 1.257 0.00 0.00 C+0 HETATM 8 O UNK 0 3.757 0.997 0.210 0.00 0.00 O+0 HETATM 9 C UNK 0 5.663 0.278 1.378 0.00 0.00 C+0 HETATM 10 N UNK 0 6.313 0.714 0.109 0.00 0.00 N+0 HETATM 11 C UNK 0 7.067 -0.199 -0.648 0.00 0.00 C+0 HETATM 12 O UNK 0 7.177 -1.380 -0.248 0.00 0.00 O+0 HETATM 13 N UNK 0 7.710 0.185 -1.854 0.00 0.00 N+0 HETATM 14 C UNK 0 8.478 -0.818 -2.584 0.00 0.00 C+0 HETATM 15 C UNK 0 9.902 -0.442 -2.553 0.00 0.00 C+0 HETATM 16 O UNK 0 10.269 0.605 -1.974 0.00 0.00 O+0 HETATM 17 O UNK 0 10.857 -1.244 -3.166 0.00 0.00 O+0 HETATM 18 C UNK 0 8.022 -0.965 -3.997 0.00 0.00 C+0 HETATM 19 C UNK 0 6.566 -1.387 -4.091 0.00 0.00 C+0 HETATM 20 C UNK 0 8.846 -2.054 -4.675 0.00 0.00 C+0 HETATM 21 C UNK 0 6.307 0.966 2.511 0.00 0.00 C+0 HETATM 22 C UNK 0 5.867 0.505 3.854 0.00 0.00 C+0 HETATM 23 C UNK 0 6.873 1.113 4.877 0.00 0.00 C+0 HETATM 24 N UNK 0 6.796 2.561 4.746 0.00 0.00 N+0 HETATM 25 C UNK 0 6.456 3.169 3.680 0.00 0.00 C+0 HETATM 26 N UNK 0 6.411 4.594 3.658 0.00 0.00 N+0 HETATM 27 N UNK 0 6.117 2.432 2.493 0.00 0.00 N+0 HETATM 28 C UNK 0 1.278 -1.225 1.534 0.00 0.00 C+0 HETATM 29 O UNK 0 1.884 -1.875 0.637 0.00 0.00 O+0 HETATM 30 N UNK 0 -0.003 -1.662 1.932 0.00 0.00 N+0 HETATM 31 C UNK 0 -0.625 -2.829 1.333 0.00 0.00 C+0 HETATM 32 C UNK 0 -1.936 -3.137 1.979 0.00 0.00 C+0 HETATM 33 C UNK 0 -2.991 -2.106 1.981 0.00 0.00 C+0 HETATM 34 N UNK 0 -3.570 -1.661 0.815 0.00 0.00 N+0 HETATM 35 C UNK 0 -2.908 -0.898 -0.118 0.00 0.00 C+0 HETATM 36 C UNK 0 -2.435 0.426 0.409 0.00 0.00 C+0 HETATM 37 O UNK 0 -2.647 0.781 1.581 0.00 0.00 O+0 HETATM 38 O UNK 0 -1.747 1.264 -0.444 0.00 0.00 O+0 HETATM 39 C UNK 0 -3.888 -0.546 -1.300 0.00 0.00 C+0 HETATM 40 O UNK 0 -4.938 0.177 -0.786 0.00 0.00 O+0 HETATM 41 C UNK 0 -4.893 1.491 -1.259 0.00 0.00 C+0 HETATM 42 O UNK 0 -4.737 2.386 -0.213 0.00 0.00 O+0 HETATM 43 C UNK 0 -5.574 3.449 -0.359 0.00 0.00 C+0 HETATM 44 C UNK 0 -6.677 3.331 0.687 0.00 0.00 C+0 HETATM 45 N UNK 0 -7.615 4.438 0.590 0.00 0.00 N+0 HETATM 46 C UNK 0 -6.220 3.363 -1.710 0.00 0.00 C+0 HETATM 47 O UNK 0 -5.391 3.963 -2.674 0.00 0.00 O+0 HETATM 48 C UNK 0 -6.163 1.875 -1.974 0.00 0.00 C+0 HETATM 49 O UNK 0 -6.077 1.643 -3.346 0.00 0.00 O+0 HETATM 50 C UNK 0 -4.257 -1.831 -1.962 0.00 0.00 C+0 HETATM 51 O UNK 0 -4.880 -2.725 -1.101 0.00 0.00 O+0 HETATM 52 C UNK 0 -5.725 -3.537 -1.804 0.00 0.00 C+0 HETATM 53 N UNK 0 -6.972 -3.651 -1.073 0.00 0.00 N+0 HETATM 54 C UNK 0 -7.309 -2.655 -0.219 0.00 0.00 C+0 HETATM 55 C UNK 0 -8.475 -2.708 0.510 0.00 0.00 C+0 HETATM 56 C UNK 0 -9.272 -3.818 0.324 0.00 0.00 C+0 HETATM 57 O UNK 0 -10.349 -3.870 0.994 0.00 0.00 O+0 HETATM 58 N UNK 0 -8.903 -4.789 -0.536 0.00 0.00 N+0 HETATM 59 C UNK 0 -7.753 -4.728 -1.250 0.00 0.00 C+0 HETATM 60 O UNK 0 -7.462 -5.674 -2.044 0.00 0.00 O+0 HETATM 61 C UNK 0 -5.861 -3.010 -3.190 0.00 0.00 C+0 HETATM 62 O UNK 0 -5.024 -3.757 -4.037 0.00 0.00 O+0 HETATM 63 C UNK 0 -5.329 -1.601 -3.039 0.00 0.00 C+0 HETATM 64 O UNK 0 -4.817 -1.066 -4.193 0.00 0.00 O+0 HETATM 65 H UNK 0 3.399 2.284 3.199 0.00 0.00 H+0 HETATM 66 H UNK 0 2.805 3.946 3.196 0.00 0.00 H+0 HETATM 67 H UNK 0 3.301 3.211 1.614 0.00 0.00 H+0 HETATM 68 H UNK 0 1.048 2.313 3.513 0.00 0.00 H+0 HETATM 69 H UNK 0 1.099 3.970 0.986 0.00 0.00 H+0 HETATM 70 H UNK 0 -0.436 3.190 1.668 0.00 0.00 H+0 HETATM 71 H UNK 0 0.529 4.411 2.622 0.00 0.00 H+0 HETATM 72 H UNK 0 0.087 1.026 1.647 0.00 0.00 H+0 HETATM 73 H UNK 0 1.505 1.402 0.598 0.00 0.00 H+0 HETATM 74 H UNK 0 1.538 -0.045 3.305 0.00 0.00 H+0 HETATM 75 H UNK 0 3.713 -0.612 3.032 0.00 0.00 H+0 HETATM 76 H UNK 0 5.894 -0.819 1.469 0.00 0.00 H+0 HETATM 77 H UNK 0 6.183 1.683 -0.167 0.00 0.00 H+0 HETATM 78 H UNK 0 7.662 1.149 -2.241 0.00 0.00 H+0 HETATM 79 H UNK 0 8.400 -1.797 -2.065 0.00 0.00 H+0 HETATM 80 H UNK 0 11.804 -1.309 -2.771 0.00 0.00 H+0 HETATM 81 H UNK 0 8.174 0.020 -4.500 0.00 0.00 H+0 HETATM 82 H UNK 0 6.470 -1.934 -5.074 0.00 0.00 H+0 HETATM 83 H UNK 0 6.340 -2.059 -3.234 0.00 0.00 H+0 HETATM 84 H UNK 0 5.956 -0.483 -4.136 0.00 0.00 H+0 HETATM 85 H UNK 0 9.703 -1.538 -5.178 0.00 0.00 H+0 HETATM 86 H UNK 0 9.221 -2.736 -3.907 0.00 0.00 H+0 HETATM 87 H UNK 0 8.201 -2.541 -5.451 0.00 0.00 H+0 HETATM 88 H UNK 0 7.425 0.797 2.473 0.00 0.00 H+0 HETATM 89 H UNK 0 5.940 -0.591 3.991 0.00 0.00 H+0 HETATM 90 H UNK 0 4.885 0.893 4.188 0.00 0.00 H+0 HETATM 91 H UNK 0 7.858 0.705 4.590 0.00 0.00 H+0 HETATM 92 H UNK 0 6.540 0.793 5.881 0.00 0.00 H+0 HETATM 93 H UNK 0 7.088 5.181 3.132 0.00 0.00 H+0 HETATM 94 H UNK 0 5.656 5.101 4.200 0.00 0.00 H+0 HETATM 95 H UNK 0 5.755 2.952 1.687 0.00 0.00 H+0 HETATM 96 H UNK 0 -0.514 -1.146 2.666 0.00 0.00 H+0 HETATM 97 H UNK 0 0.044 -3.722 1.594 0.00 0.00 H+0 HETATM 98 H UNK 0 -0.681 -2.845 0.259 0.00 0.00 H+0 HETATM 99 H UNK 0 -2.334 -4.065 1.450 0.00 0.00 H+0 HETATM 100 H UNK 0 -1.716 -3.461 3.055 0.00 0.00 H+0 HETATM 101 H UNK 0 -2.545 -1.240 2.615 0.00 0.00 H+0 HETATM 102 H UNK 0 -3.805 -2.518 2.716 0.00 0.00 H+0 HETATM 103 H UNK 0 -4.568 -1.328 0.975 0.00 0.00 H+0 HETATM 104 H UNK 0 -2.079 -1.375 -0.635 0.00 0.00 H+0 HETATM 105 H UNK 0 -1.586 2.237 -0.226 0.00 0.00 H+0 HETATM 106 H UNK 0 -3.289 0.074 -1.971 0.00 0.00 H+0 HETATM 107 H UNK 0 -4.044 1.664 -1.954 0.00 0.00 H+0 HETATM 108 H UNK 0 -5.064 4.421 -0.167 0.00 0.00 H+0 HETATM 109 H UNK 0 -6.227 3.273 1.701 0.00 0.00 H+0 HETATM 110 H UNK 0 -7.222 2.369 0.449 0.00 0.00 H+0 HETATM 111 H UNK 0 -7.509 5.010 1.459 0.00 0.00 H+0 HETATM 112 H UNK 0 -8.597 4.120 0.512 0.00 0.00 H+0 HETATM 113 H UNK 0 -7.240 3.764 -1.732 0.00 0.00 H+0 HETATM 114 H UNK 0 -5.955 4.598 -3.204 0.00 0.00 H+0 HETATM 115 H UNK 0 -7.065 1.425 -1.507 0.00 0.00 H+0 HETATM 116 H UNK 0 -6.927 1.897 -3.762 0.00 0.00 H+0 HETATM 117 H UNK 0 -3.375 -2.235 -2.481 0.00 0.00 H+0 HETATM 118 H UNK 0 -5.300 -4.578 -1.827 0.00 0.00 H+0 HETATM 119 H UNK 0 -6.677 -1.787 -0.079 0.00 0.00 H+0 HETATM 120 H UNK 0 -8.771 -1.917 1.207 0.00 0.00 H+0 HETATM 121 H UNK 0 -9.524 -5.618 -0.656 0.00 0.00 H+0 HETATM 122 H UNK 0 -6.905 -3.007 -3.569 0.00 0.00 H+0 HETATM 123 H UNK 0 -4.626 -4.540 -3.546 0.00 0.00 H+0 HETATM 124 H UNK 0 -6.162 -0.993 -2.612 0.00 0.00 H+0 HETATM 125 H UNK 0 -4.065 -0.460 -3.938 0.00 0.00 H+0 CONECT 1 2 65 66 67 CONECT 2 1 3 4 68 CONECT 3 2 69 70 71 CONECT 4 2 5 72 73 CONECT 5 4 6 28 74 CONECT 6 5 7 75 CONECT 7 6 8 9 CONECT 8 7 CONECT 9 7 10 21 76 CONECT 10 9 11 77 CONECT 11 10 12 13 CONECT 12 11 CONECT 13 11 14 78 CONECT 14 13 15 18 79 CONECT 15 14 16 17 CONECT 16 15 CONECT 17 15 80 CONECT 18 14 19 20 81 CONECT 19 18 82 83 84 CONECT 20 18 85 86 87 CONECT 21 9 22 27 88 CONECT 22 21 23 89 90 CONECT 23 22 24 91 92 CONECT 24 23 25 CONECT 25 24 26 27 CONECT 26 25 93 94 CONECT 27 25 21 95 CONECT 28 5 29 30 CONECT 29 28 CONECT 30 28 31 96 CONECT 31 30 32 97 98 CONECT 32 31 33 99 100 CONECT 33 32 34 101 102 CONECT 34 33 35 103 CONECT 35 34 36 39 104 CONECT 36 35 37 38 CONECT 37 36 CONECT 38 36 105 CONECT 39 35 40 50 106 CONECT 40 39 41 CONECT 41 40 42 48 107 CONECT 42 41 43 CONECT 43 42 44 46 108 CONECT 44 43 45 109 110 CONECT 45 44 111 112 CONECT 46 43 47 48 113 CONECT 47 46 114 CONECT 48 46 49 41 115 CONECT 49 48 116 CONECT 50 39 51 63 117 CONECT 51 50 52 CONECT 52 51 53 61 118 CONECT 53 52 54 59 CONECT 54 53 55 119 CONECT 55 54 56 120 CONECT 56 55 57 58 CONECT 57 56 CONECT 58 56 59 121 CONECT 59 58 60 53 CONECT 60 59 CONECT 61 52 62 63 122 CONECT 62 61 123 CONECT 63 61 64 50 124 CONECT 64 63 125 CONECT 65 1 CONECT 66 1 CONECT 67 1 CONECT 68 2 CONECT 69 3 CONECT 70 3 CONECT 71 3 CONECT 72 4 CONECT 73 4 CONECT 74 5 CONECT 75 6 CONECT 76 9 CONECT 77 10 CONECT 78 13 CONECT 79 14 CONECT 80 17 CONECT 81 18 CONECT 82 19 CONECT 83 19 CONECT 84 19 CONECT 85 20 CONECT 86 20 CONECT 87 20 CONECT 88 21 CONECT 89 22 CONECT 90 22 CONECT 91 23 CONECT 92 23 CONECT 93 26 CONECT 94 26 CONECT 95 27 CONECT 96 30 CONECT 97 31 CONECT 98 31 CONECT 99 32 CONECT 100 32 CONECT 101 33 CONECT 102 33 CONECT 103 34 CONECT 104 35 CONECT 105 38 CONECT 106 39 CONECT 107 41 CONECT 108 43 CONECT 109 44 CONECT 110 44 CONECT 111 45 CONECT 112 45 CONECT 113 46 CONECT 114 47 CONECT 115 48 CONECT 116 49 CONECT 117 50 CONECT 118 52 CONECT 119 54 CONECT 120 55 CONECT 121 58 CONECT 122 61 CONECT 123 62 CONECT 124 63 CONECT 125 64 MASTER 0 0 0 0 0 0 0 0 125 0 256 0 END