HEADER PROTEIN 21-JUN-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 21-JUN-21 0 HETATM 1 C UNK 0 -3.104 -0.269 3.868 0.00 0.00 C+0 HETATM 2 C UNK 0 -4.170 -0.362 2.808 0.00 0.00 C+0 HETATM 3 C UNK 0 -4.140 -1.642 2.019 0.00 0.00 C+0 HETATM 4 C UNK 0 -5.032 0.654 2.610 0.00 0.00 C+0 HETATM 5 C UNK 0 -6.152 0.743 1.605 0.00 0.00 C+0 HETATM 6 C UNK 0 -5.838 1.702 0.447 0.00 0.00 C+0 HETATM 7 C UNK 0 -4.800 1.159 -0.523 0.00 0.00 C+0 HETATM 8 C UNK 0 -5.326 0.170 -1.527 0.00 0.00 C+0 HETATM 9 C UNK 0 -3.520 1.579 -0.438 0.00 0.00 C+0 HETATM 10 C UNK 0 -2.309 1.122 -1.234 0.00 0.00 C+0 HETATM 11 C UNK 0 -1.819 2.210 -2.189 0.00 0.00 C+0 HETATM 12 C UNK 0 -1.994 1.995 -3.571 0.00 0.00 C+0 HETATM 13 C UNK 0 -1.611 2.956 -4.499 0.00 0.00 C+0 HETATM 14 O UNK 0 -1.810 2.676 -5.819 0.00 0.00 O+0 HETATM 15 C UNK 0 -1.051 4.160 -4.090 0.00 0.00 C+0 HETATM 16 C UNK 0 -0.866 4.410 -2.725 0.00 0.00 C+0 HETATM 17 C UNK 0 -0.261 5.710 -2.275 0.00 0.00 C+0 HETATM 18 C UNK 0 -1.243 3.430 -1.788 0.00 0.00 C+0 HETATM 19 O UNK 0 -1.022 3.743 -0.473 0.00 0.00 O+0 HETATM 20 C UNK 0 -1.193 0.551 -0.389 0.00 0.00 C+0 HETATM 21 O UNK 0 -0.836 1.267 0.725 0.00 0.00 O+0 HETATM 22 C UNK 0 0.152 0.570 1.322 0.00 0.00 C+0 HETATM 23 C UNK 0 0.459 -0.575 0.627 0.00 0.00 C+0 HETATM 24 C UNK 0 -0.416 -0.598 -0.495 0.00 0.00 C+0 HETATM 25 C UNK 0 -0.499 -1.628 -1.561 0.00 0.00 C+0 HETATM 26 C UNK 0 1.513 -1.528 1.085 0.00 0.00 C+0 HETATM 27 C UNK 0 2.456 -0.886 2.167 0.00 0.00 C+0 HETATM 28 C UNK 0 3.465 0.047 1.440 0.00 0.00 C+0 HETATM 29 C UNK 0 1.571 -0.087 3.211 0.00 0.00 C+0 HETATM 30 C UNK 0 2.363 0.372 4.409 0.00 0.00 C+0 HETATM 31 C UNK 0 3.491 -0.221 4.818 0.00 0.00 C+0 HETATM 32 C UNK 0 4.028 -1.412 4.111 0.00 0.00 C+0 HETATM 33 O UNK 0 5.075 -1.909 4.520 0.00 0.00 O+0 HETATM 34 C UNK 0 3.215 -2.003 2.954 0.00 0.00 C+0 HETATM 35 C UNK 0 4.112 -2.894 2.089 0.00 0.00 C+0 HETATM 36 C UNK 0 0.771 1.076 2.565 0.00 0.00 C+0 HETATM 37 H UNK 0 -3.130 0.687 4.401 0.00 0.00 H+0 HETATM 38 H UNK 0 -3.235 -1.066 4.607 0.00 0.00 H+0 HETATM 39 H UNK 0 -2.111 -0.371 3.418 0.00 0.00 H+0 HETATM 40 H UNK 0 -3.161 -1.765 1.542 0.00 0.00 H+0 HETATM 41 H UNK 0 -4.310 -2.496 2.682 0.00 0.00 H+0 HETATM 42 H UNK 0 -4.891 -1.685 1.228 0.00 0.00 H+0 HETATM 43 H UNK 0 -4.934 1.542 3.236 0.00 0.00 H+0 HETATM 44 H UNK 0 -7.035 1.122 2.137 0.00 0.00 H+0 HETATM 45 H UNK 0 -6.444 -0.240 1.225 0.00 0.00 H+0 HETATM 46 H UNK 0 -5.516 2.672 0.850 0.00 0.00 H+0 HETATM 47 H UNK 0 -6.762 1.912 -0.107 0.00 0.00 H+0 HETATM 48 H UNK 0 -6.206 0.581 -2.034 0.00 0.00 H+0 HETATM 49 H UNK 0 -5.620 -0.760 -1.031 0.00 0.00 H+0 HETATM 50 H UNK 0 -4.607 -0.081 -2.309 0.00 0.00 H+0 HETATM 51 H UNK 0 -3.285 2.310 0.337 0.00 0.00 H+0 HETATM 52 H UNK 0 -2.625 0.274 -1.853 0.00 0.00 H+0 HETATM 53 H UNK 0 -2.443 1.074 -3.936 0.00 0.00 H+0 HETATM 54 H UNK 0 -1.514 3.439 -6.343 0.00 0.00 H+0 HETATM 55 H UNK 0 -0.758 4.908 -4.820 0.00 0.00 H+0 HETATM 56 H UNK 0 0.679 5.527 -1.744 0.00 0.00 H+0 HETATM 57 H UNK 0 -0.041 6.367 -3.123 0.00 0.00 H+0 HETATM 58 H UNK 0 -0.954 6.243 -1.615 0.00 0.00 H+0 HETATM 59 H UNK 0 -0.984 2.920 0.048 0.00 0.00 H+0 HETATM 60 H UNK 0 -0.332 -1.175 -2.544 0.00 0.00 H+0 HETATM 61 H UNK 0 -1.487 -2.099 -1.560 0.00 0.00 H+0 HETATM 62 H UNK 0 0.249 -2.414 -1.421 0.00 0.00 H+0 HETATM 63 H UNK 0 1.009 -2.406 1.510 0.00 0.00 H+0 HETATM 64 H UNK 0 2.096 -1.873 0.223 0.00 0.00 H+0 HETATM 65 H UNK 0 2.966 0.860 0.903 0.00 0.00 H+0 HETATM 66 H UNK 0 4.178 0.508 2.130 0.00 0.00 H+0 HETATM 67 H UNK 0 4.044 -0.504 0.691 0.00 0.00 H+0 HETATM 68 H UNK 0 0.821 -0.792 3.607 0.00 0.00 H+0 HETATM 69 H UNK 0 1.978 1.213 4.983 0.00 0.00 H+0 HETATM 70 H UNK 0 4.049 0.118 5.683 0.00 0.00 H+0 HETATM 71 H UNK 0 2.471 -2.661 3.426 0.00 0.00 H+0 HETATM 72 H UNK 0 3.560 -3.343 1.259 0.00 0.00 H+0 HETATM 73 H UNK 0 4.520 -3.719 2.686 0.00 0.00 H+0 HETATM 74 H UNK 0 4.967 -2.343 1.685 0.00 0.00 H+0 HETATM 75 H UNK 0 -0.002 1.431 3.257 0.00 0.00 H+0 HETATM 76 H UNK 0 1.424 1.927 2.338 0.00 0.00 H+0 CONECT 1 2 37 38 39 CONECT 2 4 1 3 CONECT 3 2 40 41 42 CONECT 4 5 2 43 CONECT 5 6 4 44 45 CONECT 6 7 5 46 47 CONECT 7 9 6 8 CONECT 8 7 48 49 50 CONECT 9 7 10 51 CONECT 10 11 20 9 52 CONECT 11 10 12 18 CONECT 12 11 13 53 CONECT 13 12 15 14 CONECT 14 13 54 CONECT 15 13 16 55 CONECT 16 15 18 17 CONECT 17 16 56 57 58 CONECT 18 16 11 19 CONECT 19 18 59 CONECT 20 24 21 10 CONECT 21 20 22 CONECT 22 36 23 21 CONECT 23 26 22 24 CONECT 24 23 20 25 CONECT 25 24 60 61 62 CONECT 26 23 27 63 64 CONECT 27 34 29 26 28 CONECT 28 27 65 66 67 CONECT 29 30 27 36 68 CONECT 30 29 31 69 CONECT 31 32 30 70 CONECT 32 34 33 31 CONECT 33 32 CONECT 34 32 27 35 71 CONECT 35 34 72 73 74 CONECT 36 22 29 75 76 CONECT 37 1 CONECT 38 1 CONECT 39 1 CONECT 40 3 CONECT 41 3 CONECT 42 3 CONECT 43 4 CONECT 44 5 CONECT 45 5 CONECT 46 6 CONECT 47 6 CONECT 48 8 CONECT 49 8 CONECT 50 8 CONECT 51 9 CONECT 52 10 CONECT 53 12 CONECT 54 14 CONECT 55 15 CONECT 56 17 CONECT 57 17 CONECT 58 17 CONECT 59 19 CONECT 60 25 CONECT 61 25 CONECT 62 25 CONECT 63 26 CONECT 64 26 CONECT 65 28 CONECT 66 28 CONECT 67 28 CONECT 68 29 CONECT 69 30 CONECT 70 31 CONECT 71 34 CONECT 72 35 CONECT 73 35 CONECT 74 35 CONECT 75 36 CONECT 76 36 MASTER 0 0 0 0 0 0 0 0 76 0 158 0 END