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 -7.223 0.954 -2.522 0.00 0.00 C+0 HETATM 2 O UNK 0 -7.209 1.287 -1.178 0.00 0.00 O+0 HETATM 3 C UNK 0 -6.944 0.127 -0.456 0.00 0.00 C+0 HETATM 4 C UNK 0 -5.601 0.352 0.241 0.00 0.00 C+0 HETATM 5 O UNK 0 -4.633 0.370 -0.759 0.00 0.00 O+0 HETATM 6 C UNK 0 -3.624 -0.593 -0.517 0.00 0.00 C+0 HETATM 7 C UNK 0 -2.653 -0.463 -1.661 0.00 0.00 C+0 HETATM 8 O UNK 0 -3.461 -0.695 -2.817 0.00 0.00 O+0 HETATM 9 C UNK 0 -2.053 0.885 -1.782 0.00 0.00 C+0 HETATM 10 C UNK 0 -2.843 2.002 -1.139 0.00 0.00 C+0 HETATM 11 O UNK 0 -0.722 1.049 -1.340 0.00 0.00 O+0 HETATM 12 C UNK 0 0.028 0.174 -0.511 0.00 0.00 C+0 HETATM 13 O UNK 0 0.825 -0.507 -1.287 0.00 0.00 O+0 HETATM 14 C UNK 0 -0.048 0.032 0.903 0.00 0.00 C+0 HETATM 15 C UNK 0 0.757 0.350 1.887 0.00 0.00 C+0 HETATM 16 C UNK 0 2.081 0.997 1.690 0.00 0.00 C+0 HETATM 17 C UNK 0 2.095 1.906 0.485 0.00 0.00 C+0 HETATM 18 C UNK 0 3.174 -0.051 1.548 0.00 0.00 C+0 HETATM 19 O UNK 0 3.858 0.030 0.340 0.00 0.00 O+0 HETATM 20 C UNK 0 5.160 0.424 0.408 0.00 0.00 C+0 HETATM 21 O UNK 0 5.978 -0.640 -0.001 0.00 0.00 O+0 HETATM 22 C UNK 0 7.316 -0.419 0.273 0.00 0.00 C+0 HETATM 23 C UNK 0 7.577 -0.058 1.702 0.00 0.00 C+0 HETATM 24 C UNK 0 7.805 0.657 -0.700 0.00 0.00 C+0 HETATM 25 C UNK 0 6.611 1.338 -1.314 0.00 0.00 C+0 HETATM 26 N UNK 0 6.982 2.372 -2.216 0.00 0.00 N+0 HETATM 27 C UNK 0 7.723 1.869 -3.366 0.00 0.00 C+0 HETATM 28 C UNK 0 7.639 3.515 -1.636 0.00 0.00 C+0 HETATM 29 C UNK 0 5.515 1.664 -0.345 0.00 0.00 C+0 HETATM 30 O UNK 0 5.845 2.722 0.500 0.00 0.00 O+0 HETATM 31 C UNK 0 2.919 -1.407 2.044 0.00 0.00 C+0 HETATM 32 C UNK 0 2.499 -1.294 3.519 0.00 0.00 C+0 HETATM 33 C UNK 0 2.147 -2.461 1.403 0.00 0.00 C+0 HETATM 34 C UNK 0 2.465 -2.886 0.043 0.00 0.00 C+0 HETATM 35 C UNK 0 3.721 -3.769 0.149 0.00 0.00 C+0 HETATM 36 C UNK 0 1.443 -3.581 -0.774 0.00 0.00 C+0 HETATM 37 O UNK 0 1.834 -3.577 -2.023 0.00 0.00 O+0 HETATM 38 C UNK 0 0.221 -4.211 -0.465 0.00 0.00 C+0 HETATM 39 C UNK 0 -0.996 -3.759 -0.428 0.00 0.00 C+0 HETATM 40 C UNK 0 -1.589 -2.479 -0.682 0.00 0.00 C+0 HETATM 41 O UNK 0 -2.630 -2.805 -1.755 0.00 0.00 O+0 HETATM 42 C UNK 0 -1.658 -1.643 -1.717 0.00 0.00 C+0 HETATM 43 O UNK 0 -5.640 1.620 0.794 0.00 0.00 O+0 HETATM 44 C UNK 0 -6.699 1.837 1.643 0.00 0.00 C+0 HETATM 45 C UNK 0 -7.468 3.072 1.226 0.00 0.00 C+0 HETATM 46 C UNK 0 -7.589 0.653 1.857 0.00 0.00 C+0 HETATM 47 O UNK 0 -8.741 1.088 2.510 0.00 0.00 O+0 HETATM 48 C UNK 0 -8.011 -0.037 0.594 0.00 0.00 C+0 HETATM 49 O UNK 0 -9.219 0.516 0.168 0.00 0.00 O+0 HETATM 50 C UNK 0 -10.230 -0.412 0.088 0.00 0.00 C+0 HETATM 51 H UNK 0 -7.436 1.875 -3.122 0.00 0.00 H+0 HETATM 52 H UNK 0 -8.029 0.234 -2.765 0.00 0.00 H+0 HETATM 53 H UNK 0 -6.217 0.598 -2.864 0.00 0.00 H+0 HETATM 54 H UNK 0 -6.812 -0.759 -1.097 0.00 0.00 H+0 HETATM 55 H UNK 0 -5.364 -0.405 0.986 0.00 0.00 H+0 HETATM 56 H UNK 0 -4.119 -1.565 -0.515 0.00 0.00 H+0 HETATM 57 H UNK 0 -3.155 -0.409 0.473 0.00 0.00 H+0 HETATM 58 H UNK 0 -2.807 -0.715 -3.560 0.00 0.00 H+0 HETATM 59 H UNK 0 -2.010 1.164 -2.879 0.00 0.00 H+0 HETATM 60 H UNK 0 -3.754 2.276 -1.708 0.00 0.00 H+0 HETATM 61 H UNK 0 -3.031 1.886 -0.076 0.00 0.00 H+0 HETATM 62 H UNK 0 -2.172 2.916 -1.222 0.00 0.00 H+0 HETATM 63 H UNK 0 -0.933 -0.527 1.325 0.00 0.00 H+0 HETATM 64 H UNK 0 0.400 0.123 2.913 0.00 0.00 H+0 HETATM 65 H UNK 0 2.200 1.661 2.565 0.00 0.00 H+0 HETATM 66 H UNK 0 1.084 2.404 0.350 0.00 0.00 H+0 HETATM 67 H UNK 0 2.764 2.803 0.660 0.00 0.00 H+0 HETATM 68 H UNK 0 2.449 1.450 -0.433 0.00 0.00 H+0 HETATM 69 H UNK 0 3.973 0.342 2.281 0.00 0.00 H+0 HETATM 70 H UNK 0 5.412 0.623 1.494 0.00 0.00 H+0 HETATM 71 H UNK 0 7.843 -1.378 0.081 0.00 0.00 H+0 HETATM 72 H UNK 0 6.844 -0.608 2.325 0.00 0.00 H+0 HETATM 73 H UNK 0 8.605 -0.375 1.996 0.00 0.00 H+0 HETATM 74 H UNK 0 7.469 1.012 1.933 0.00 0.00 H+0 HETATM 75 H UNK 0 8.517 1.346 -0.243 0.00 0.00 H+0 HETATM 76 H UNK 0 8.327 0.130 -1.525 0.00 0.00 H+0 HETATM 77 H UNK 0 6.155 0.528 -1.979 0.00 0.00 H+0 HETATM 78 H UNK 0 7.446 0.837 -3.620 0.00 0.00 H+0 HETATM 79 H UNK 0 8.803 1.875 -3.134 0.00 0.00 H+0 HETATM 80 H UNK 0 7.537 2.539 -4.217 0.00 0.00 H+0 HETATM 81 H UNK 0 7.188 4.445 -2.031 0.00 0.00 H+0 HETATM 82 H UNK 0 7.722 3.535 -0.557 0.00 0.00 H+0 HETATM 83 H UNK 0 8.692 3.516 -2.048 0.00 0.00 H+0 HETATM 84 H UNK 0 4.653 2.002 -0.935 0.00 0.00 H+0 HETATM 85 H UNK 0 5.107 3.078 1.012 0.00 0.00 H+0 HETATM 86 H UNK 0 3.974 -1.867 2.133 0.00 0.00 H+0 HETATM 87 H UNK 0 3.225 -1.837 4.195 0.00 0.00 H+0 HETATM 88 H UNK 0 2.548 -0.248 3.880 0.00 0.00 H+0 HETATM 89 H UNK 0 1.544 -1.806 3.708 0.00 0.00 H+0 HETATM 90 H UNK 0 2.307 -3.441 2.016 0.00 0.00 H+0 HETATM 91 H UNK 0 1.061 -2.355 1.569 0.00 0.00 H+0 HETATM 92 H UNK 0 2.762 -2.006 -0.556 0.00 0.00 H+0 HETATM 93 H UNK 0 3.340 -4.798 0.253 0.00 0.00 H+0 HETATM 94 H UNK 0 4.243 -3.708 -0.828 0.00 0.00 H+0 HETATM 95 H UNK 0 4.346 -3.505 0.996 0.00 0.00 H+0 HETATM 96 H UNK 0 0.254 -5.339 -0.232 0.00 0.00 H+0 HETATM 97 H UNK 0 -1.758 -4.555 -0.105 0.00 0.00 H+0 HETATM 98 H UNK 0 -2.194 -2.161 0.256 0.00 0.00 H+0 HETATM 99 H UNK 0 -1.167 -1.717 -2.733 0.00 0.00 H+0 HETATM 100 H UNK 0 -6.250 2.088 2.648 0.00 0.00 H+0 HETATM 101 H UNK 0 -6.862 3.687 0.532 0.00 0.00 H+0 HETATM 102 H UNK 0 -8.432 2.826 0.745 0.00 0.00 H+0 HETATM 103 H UNK 0 -7.708 3.731 2.092 0.00 0.00 H+0 HETATM 104 H UNK 0 -7.062 -0.025 2.575 0.00 0.00 H+0 HETATM 105 H UNK 0 -8.542 1.680 3.260 0.00 0.00 H+0 HETATM 106 H UNK 0 -8.103 -1.139 0.790 0.00 0.00 H+0 HETATM 107 H UNK 0 -10.398 -0.863 1.088 0.00 0.00 H+0 HETATM 108 H UNK 0 -11.171 0.151 -0.147 0.00 0.00 H+0 HETATM 109 H UNK 0 -10.044 -1.224 -0.623 0.00 0.00 H+0 CONECT 1 2 51 52 53 CONECT 2 1 3 CONECT 3 2 4 48 54 CONECT 4 3 5 43 55 CONECT 5 4 6 CONECT 6 5 7 56 57 CONECT 7 6 8 9 42 CONECT 8 7 58 CONECT 9 7 10 11 59 CONECT 10 9 60 61 62 CONECT 11 9 12 CONECT 12 11 13 14 CONECT 13 12 CONECT 14 12 15 63 CONECT 15 14 16 64 CONECT 16 15 17 18 65 CONECT 17 16 66 67 68 CONECT 18 16 19 31 69 CONECT 19 18 20 CONECT 20 19 21 29 70 CONECT 21 20 22 CONECT 22 21 23 24 71 CONECT 23 22 72 73 74 CONECT 24 22 25 75 76 CONECT 25 24 26 29 77 CONECT 26 25 27 28 CONECT 27 26 78 79 80 CONECT 28 26 81 82 83 CONECT 29 25 30 20 84 CONECT 30 29 85 CONECT 31 18 32 33 86 CONECT 32 31 87 88 89 CONECT 33 31 34 90 91 CONECT 34 33 35 36 92 CONECT 35 34 93 94 95 CONECT 36 34 37 38 CONECT 37 36 CONECT 38 36 39 96 CONECT 39 38 40 97 CONECT 40 39 41 42 98 CONECT 41 40 42 CONECT 42 41 7 40 99 CONECT 43 4 44 CONECT 44 43 45 46 100 CONECT 45 44 101 102 103 CONECT 46 44 47 48 104 CONECT 47 46 105 CONECT 48 46 49 3 106 CONECT 49 48 50 CONECT 50 49 107 108 109 CONECT 51 1 CONECT 52 1 CONECT 53 1 CONECT 54 3 CONECT 55 4 CONECT 56 6 CONECT 57 6 CONECT 58 8 CONECT 59 9 CONECT 60 10 CONECT 61 10 CONECT 62 10 CONECT 63 14 CONECT 64 15 CONECT 65 16 CONECT 66 17 CONECT 67 17 CONECT 68 17 CONECT 69 18 CONECT 70 20 CONECT 71 22 CONECT 72 23 CONECT 73 23 CONECT 74 23 CONECT 75 24 CONECT 76 24 CONECT 77 25 CONECT 78 27 CONECT 79 27 CONECT 80 27 CONECT 81 28 CONECT 82 28 CONECT 83 28 CONECT 84 29 CONECT 85 30 CONECT 86 31 CONECT 87 32 CONECT 88 32 CONECT 89 32 CONECT 90 33 CONECT 91 33 CONECT 92 34 CONECT 93 35 CONECT 94 35 CONECT 95 35 CONECT 96 38 CONECT 97 39 CONECT 98 40 CONECT 99 42 CONECT 100 44 CONECT 101 45 CONECT 102 45 CONECT 103 45 CONECT 104 46 CONECT 105 47 CONECT 106 48 CONECT 107 50 CONECT 108 50 CONECT 109 50 MASTER 0 0 0 0 0 0 0 0 109 0 224 0 END