HEADER PROTEIN 28-APR-22 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 28-APR-22 0 HETATM 1 C UNK 0 9.006 0.886 0.000 0.00 0.00 C+0 HETATM 2 C UNK 0 7.484 1.120 0.000 0.00 0.00 C+0 HETATM 3 C UNK 0 6.791 -0.255 0.000 0.00 0.00 C+0 HETATM 4 C UNK 0 7.885 -1.339 0.000 0.00 0.00 C+0 HETATM 5 C UNK 0 9.254 -0.634 0.000 0.00 0.00 C+0 HETATM 6 O UNK 0 10.694 -1.179 0.000 0.00 0.00 O+0 HETATM 7 C UNK 0 11.886 -0.205 0.000 0.00 0.00 C+0 HETATM 8 C UNK 0 11.638 1.315 0.000 0.00 0.00 C+0 HETATM 9 N UNK 0 12.831 2.290 0.000 0.00 0.00 N+0 HETATM 10 C UNK 0 14.271 1.745 0.000 0.00 0.00 C+0 HETATM 11 C UNK 0 14.519 0.225 0.000 0.00 0.00 C+0 HETATM 12 C UNK 0 13.326 -0.750 0.000 0.00 0.00 C+0 HETATM 13 C UNK 0 15.959 -0.321 0.000 0.00 0.00 C+0 HETATM 14 O UNK 0 17.151 0.654 0.000 0.00 0.00 O+0 HETATM 15 C UNK 0 18.592 0.108 0.000 0.00 0.00 C+0 HETATM 16 O UNK 0 18.839 -1.412 0.000 0.00 0.00 O+0 HETATM 17 C UNK 0 20.280 -1.957 0.000 0.00 0.00 C+0 HETATM 18 C UNK 0 21.472 -0.982 0.000 0.00 0.00 C+0 HETATM 19 C UNK 0 21.224 0.538 0.000 0.00 0.00 C+0 HETATM 20 C UNK 0 19.784 1.083 0.000 0.00 0.00 C+0 HETATM 21 O UNK 0 19.536 2.603 0.000 0.00 0.00 O+0 HETATM 22 O UNK 0 22.417 1.512 0.000 0.00 0.00 O+0 HETATM 23 O UNK 0 22.912 -1.528 0.000 0.00 0.00 O+0 HETATM 24 C UNK 0 20.527 -3.477 0.000 0.00 0.00 C+0 HETATM 25 O UNK 0 21.968 -4.022 0.000 0.00 0.00 O+0 HETATM 26 C UNK 0 10.198 1.861 0.000 0.00 0.00 C+0 HETATM 27 O UNK 0 10.693 3.319 0.000 0.00 0.00 O+0 HETATM 28 C UNK 0 9.266 3.086 0.000 0.00 0.00 C+0 HETATM 29 O UNK 0 12.134 -1.724 0.000 0.00 0.00 O+0 HETATM 30 C UNK 0 13.574 -2.270 0.000 0.00 0.00 C+0 HETATM 31 C UNK 0 5.253 -0.343 0.000 0.00 0.00 C+0 HETATM 32 C UNK 0 4.409 0.945 0.000 0.00 0.00 C+0 HETATM 33 C UNK 0 5.102 2.320 0.000 0.00 0.00 C+0 HETATM 34 C UNK 0 6.639 2.408 0.000 0.00 0.00 C+0 HETATM 35 C UNK 0 2.871 0.858 0.000 0.00 0.00 C+0 HETATM 36 C UNK 0 2.178 -0.518 0.000 0.00 0.00 C+0 HETATM 37 C UNK 0 3.023 -1.805 0.000 0.00 0.00 C+0 HETATM 38 C UNK 0 4.560 -1.718 0.000 0.00 0.00 C+0 HETATM 39 C UNK 0 0.641 -0.605 0.000 0.00 0.00 C+0 HETATM 40 C UNK 0 -0.204 0.682 0.000 0.00 0.00 C+0 HETATM 41 C UNK 0 0.489 2.058 0.000 0.00 0.00 C+0 HETATM 42 C UNK 0 2.027 2.145 0.000 0.00 0.00 C+0 HETATM 43 O UNK 0 -1.741 0.595 0.000 0.00 0.00 O+0 HETATM 44 C UNK 0 -2.586 1.883 0.000 0.00 0.00 C+0 HETATM 45 O UNK 0 -1.893 3.258 0.000 0.00 0.00 O+0 HETATM 46 C UNK 0 -2.738 4.546 0.000 0.00 0.00 C+0 HETATM 47 C UNK 0 -4.275 4.458 0.000 0.00 0.00 C+0 HETATM 48 C UNK 0 -4.968 3.083 0.000 0.00 0.00 C+0 HETATM 49 C UNK 0 -4.123 1.795 0.000 0.00 0.00 C+0 HETATM 50 O UNK 0 -4.816 0.420 0.000 0.00 0.00 O+0 HETATM 51 O UNK 0 -6.506 2.995 0.000 0.00 0.00 O+0 HETATM 52 O UNK 0 -5.120 5.746 0.000 0.00 0.00 O+0 HETATM 53 C UNK 0 -6.657 5.658 0.000 0.00 0.00 C+0 HETATM 54 C UNK 0 -7.502 6.946 0.000 0.00 0.00 C+0 HETATM 55 C UNK 0 -9.039 6.859 0.000 0.00 0.00 C+0 HETATM 56 C UNK 0 -9.732 5.483 0.000 0.00 0.00 C+0 HETATM 57 C UNK 0 -8.888 4.195 0.000 0.00 0.00 C+0 HETATM 58 O UNK 0 -7.350 4.283 0.000 0.00 0.00 O+0 HETATM 59 C UNK 0 -9.581 2.820 0.000 0.00 0.00 C+0 HETATM 60 O UNK 0 -11.118 2.733 0.000 0.00 0.00 O+0 HETATM 61 O UNK 0 -11.270 5.396 0.000 0.00 0.00 O+0 HETATM 62 O UNK 0 -9.884 8.146 0.000 0.00 0.00 O+0 HETATM 63 C UNK 0 -11.421 8.059 0.000 0.00 0.00 C+0 HETATM 64 C UNK 0 -12.266 9.346 0.000 0.00 0.00 C+0 HETATM 65 C UNK 0 -13.803 9.259 0.000 0.00 0.00 C+0 HETATM 66 C UNK 0 -14.496 7.884 0.000 0.00 0.00 C+0 HETATM 67 C UNK 0 -13.652 6.596 0.000 0.00 0.00 C+0 HETATM 68 O UNK 0 -12.114 6.683 0.000 0.00 0.00 O+0 HETATM 69 O UNK 0 -16.034 7.796 0.000 0.00 0.00 O+0 HETATM 70 O UNK 0 -14.648 10.547 0.000 0.00 0.00 O+0 HETATM 71 O UNK 0 -11.573 10.722 0.000 0.00 0.00 O+0 HETATM 72 O UNK 0 -6.809 8.321 0.000 0.00 0.00 O+0 HETATM 73 C UNK 0 -7.653 9.609 0.000 0.00 0.00 C+0 HETATM 74 O UNK 0 -6.960 10.984 0.000 0.00 0.00 O+0 HETATM 75 C UNK 0 -7.805 12.272 0.000 0.00 0.00 C+0 HETATM 76 C UNK 0 -9.343 12.185 0.000 0.00 0.00 C+0 HETATM 77 C UNK 0 -10.035 10.809 0.000 0.00 0.00 C+0 HETATM 78 C UNK 0 -9.191 9.522 0.000 0.00 0.00 C+0 HETATM 79 O UNK 0 -10.560 8.816 0.000 0.00 0.00 O+0 HETATM 80 O UNK 0 -11.331 11.642 0.000 0.00 0.00 O+0 HETATM 81 O UNK 0 -10.187 13.472 0.000 0.00 0.00 O+0 HETATM 82 C UNK 0 -7.112 13.647 0.000 0.00 0.00 C+0 HETATM 83 O UNK 0 -5.575 13.735 0.000 0.00 0.00 O+0 HETATM 84 C UNK 0 -2.045 5.921 0.000 0.00 0.00 C+0 HETATM 85 O UNK 0 -2.889 7.209 0.000 0.00 0.00 O+0 HETATM 86 C UNK 0 3.564 2.233 0.000 0.00 0.00 C+0 HETATM 87 C UNK 0 8.317 2.416 0.000 0.00 0.00 C+0 CONECT 1 2 5 26 CONECT 2 1 3 34 87 CONECT 3 2 4 31 CONECT 4 3 5 CONECT 5 4 1 6 CONECT 6 5 7 CONECT 7 6 8 12 29 CONECT 8 7 9 26 CONECT 9 8 10 CONECT 10 9 11 CONECT 11 10 12 13 CONECT 12 11 7 CONECT 13 11 14 CONECT 14 13 15 CONECT 15 14 16 20 CONECT 16 15 17 CONECT 17 16 18 24 CONECT 18 17 19 23 CONECT 19 18 20 22 CONECT 20 19 15 21 CONECT 21 20 CONECT 22 19 CONECT 23 18 CONECT 24 17 25 CONECT 25 24 CONECT 26 8 1 27 28 CONECT 27 26 CONECT 28 26 CONECT 29 7 30 CONECT 30 29 CONECT 31 3 32 38 CONECT 32 31 33 35 CONECT 33 32 34 CONECT 34 33 2 CONECT 35 32 36 42 86 CONECT 36 35 37 39 CONECT 37 36 38 CONECT 38 37 31 CONECT 39 36 40 CONECT 40 39 41 43 CONECT 41 40 42 CONECT 42 41 35 CONECT 43 40 44 CONECT 44 43 45 49 CONECT 45 44 46 CONECT 46 45 47 84 CONECT 47 46 48 52 CONECT 48 47 49 51 CONECT 49 48 44 50 CONECT 50 49 CONECT 51 48 CONECT 52 47 53 CONECT 53 52 54 58 CONECT 54 53 55 72 CONECT 55 54 56 62 CONECT 56 55 57 61 CONECT 57 56 58 59 CONECT 58 57 53 CONECT 59 57 60 CONECT 60 59 CONECT 61 56 CONECT 62 55 63 CONECT 63 62 64 68 CONECT 64 63 65 71 CONECT 65 64 66 70 CONECT 66 65 67 69 CONECT 67 66 68 CONECT 68 67 63 CONECT 69 66 CONECT 70 65 CONECT 71 64 CONECT 72 54 73 CONECT 73 72 74 78 CONECT 74 73 75 CONECT 75 74 76 82 CONECT 76 75 77 81 CONECT 77 76 78 80 CONECT 78 77 73 79 CONECT 79 78 CONECT 80 77 CONECT 81 76 CONECT 82 75 83 CONECT 83 82 CONECT 84 46 85 CONECT 85 84 CONECT 86 35 CONECT 87 2 MASTER 0 0 0 0 0 0 0 0 87 0 194 0 END