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 -7.418 0.778 -2.579 0.00 0.00 C+0 HETATM 2 C UNK 0 -7.767 0.778 -1.115 0.00 0.00 C+0 HETATM 3 C UNK 0 -8.231 2.117 -0.636 0.00 0.00 C+0 HETATM 4 C UNK 0 -6.654 0.209 -0.293 0.00 0.00 C+0 HETATM 5 C UNK 0 -5.474 -0.081 -0.801 0.00 0.00 C+0 HETATM 6 C UNK 0 -4.428 -0.632 0.044 0.00 0.00 C+0 HETATM 7 C UNK 0 -3.228 -0.939 -0.420 0.00 0.00 C+0 HETATM 8 C UNK 0 -2.165 -1.505 0.462 0.00 0.00 C+0 HETATM 9 C UNK 0 -0.971 -0.566 0.457 0.00 0.00 C+0 HETATM 10 N UNK 0 0.102 -1.046 1.294 0.00 0.00 N+0 HETATM 11 C UNK 0 0.329 -2.272 1.878 0.00 0.00 C+0 HETATM 12 O UNK 0 0.468 -2.252 3.169 0.00 0.00 O+0 HETATM 13 C UNK 0 0.451 -3.629 1.353 0.00 0.00 C+0 HETATM 14 C UNK 0 -0.597 -4.434 2.096 0.00 0.00 C+0 HETATM 15 C UNK 0 -0.913 -5.762 1.531 0.00 0.00 C+0 HETATM 16 O UNK 0 -2.159 -6.166 2.031 0.00 0.00 O+0 HETATM 17 C UNK 0 -1.115 -5.571 0.028 0.00 0.00 C+0 HETATM 18 N UNK 0 0.147 -5.154 -0.478 0.00 0.00 N+0 HETATM 19 N UNK 0 0.525 -3.846 -0.035 0.00 0.00 N+0 HETATM 20 C UNK 0 0.917 -2.985 -1.081 0.00 0.00 C+0 HETATM 21 O UNK 0 0.081 -2.920 -2.059 0.00 0.00 O+0 HETATM 22 C UNK 0 2.117 -2.165 -1.218 0.00 0.00 C+0 HETATM 23 O UNK 0 3.286 -2.748 -0.755 0.00 0.00 O+0 HETATM 24 C UNK 0 4.567 -2.280 -0.821 0.00 0.00 C+0 HETATM 25 O UNK 0 5.517 -3.026 -1.134 0.00 0.00 O+0 HETATM 26 C UNK 0 4.857 -0.861 -0.517 0.00 0.00 C+0 HETATM 27 C UNK 0 4.580 -0.058 -1.762 0.00 0.00 C+0 HETATM 28 C UNK 0 6.362 -0.680 -0.252 0.00 0.00 C+0 HETATM 29 O UNK 0 7.082 -1.074 -1.377 0.00 0.00 O+0 HETATM 30 N UNK 0 4.093 -0.459 0.636 0.00 0.00 N+0 HETATM 31 C UNK 0 3.887 0.811 1.159 0.00 0.00 C+0 HETATM 32 O UNK 0 4.190 1.034 2.391 0.00 0.00 O+0 HETATM 33 C UNK 0 3.339 2.022 0.483 0.00 0.00 C+0 HETATM 34 C UNK 0 4.452 3.074 0.309 0.00 0.00 C+0 HETATM 35 C UNK 0 3.732 4.430 0.347 0.00 0.00 C+0 HETATM 36 O UNK 0 4.589 5.430 -0.094 0.00 0.00 O+0 HETATM 37 C UNK 0 3.250 4.725 1.758 0.00 0.00 C+0 HETATM 38 N UNK 0 2.922 3.458 2.361 0.00 0.00 N+0 HETATM 39 N UNK 0 2.334 2.658 1.336 0.00 0.00 N+0 HETATM 40 C UNK 0 0.953 2.546 1.242 0.00 0.00 C+0 HETATM 41 O UNK 0 0.351 2.267 2.354 0.00 0.00 O+0 HETATM 42 C UNK 0 0.040 2.684 0.127 0.00 0.00 C+0 HETATM 43 C UNK 0 0.489 2.253 -1.232 0.00 0.00 C+0 HETATM 44 C UNK 0 -0.814 2.282 -2.060 0.00 0.00 C+0 HETATM 45 Cl UNK 0 -0.472 2.763 -3.724 0.00 0.00 Cl+0 HETATM 46 C UNK 0 -1.815 3.260 -1.495 0.00 0.00 C+0 HETATM 47 N UNK 0 -2.339 2.832 -0.183 0.00 0.00 N+0 HETATM 48 N UNK 0 -1.248 2.017 0.303 0.00 0.00 N+0 HETATM 49 C UNK 0 -1.502 0.761 0.844 0.00 0.00 C+0 HETATM 50 O UNK 0 -2.329 0.746 1.833 0.00 0.00 O+0 HETATM 51 H UNK 0 -8.277 1.275 -3.103 0.00 0.00 H+0 HETATM 52 H UNK 0 -7.370 -0.258 -2.976 0.00 0.00 H+0 HETATM 53 H UNK 0 -6.522 1.353 -2.832 0.00 0.00 H+0 HETATM 54 H UNK 0 -8.622 0.065 -0.988 0.00 0.00 H+0 HETATM 55 H UNK 0 -8.059 2.316 0.423 0.00 0.00 H+0 HETATM 56 H UNK 0 -9.341 2.199 -0.795 0.00 0.00 H+0 HETATM 57 H UNK 0 -7.773 2.960 -1.201 0.00 0.00 H+0 HETATM 58 H UNK 0 -6.787 0.015 0.763 0.00 0.00 H+0 HETATM 59 H UNK 0 -5.279 0.085 -1.829 0.00 0.00 H+0 HETATM 60 H UNK 0 -4.605 -0.811 1.096 0.00 0.00 H+0 HETATM 61 H UNK 0 -3.043 -0.764 -1.470 0.00 0.00 H+0 HETATM 62 H UNK 0 -2.588 -1.611 1.468 0.00 0.00 H+0 HETATM 63 H UNK 0 -1.888 -2.472 0.000 0.00 0.00 H+0 HETATM 64 H UNK 0 -0.584 -0.591 -0.583 0.00 0.00 H+0 HETATM 65 H UNK 0 0.842 -0.293 1.480 0.00 0.00 H+0 HETATM 66 H UNK 0 1.434 -4.034 1.767 0.00 0.00 H+0 HETATM 67 H UNK 0 -1.541 -3.820 2.067 0.00 0.00 H+0 HETATM 68 H UNK 0 -0.265 -4.509 3.164 0.00 0.00 H+0 HETATM 69 H UNK 0 -0.153 -6.535 1.678 0.00 0.00 H+0 HETATM 70 H UNK 0 -2.787 -6.437 1.316 0.00 0.00 H+0 HETATM 71 H UNK 0 -1.896 -4.851 -0.200 0.00 0.00 H+0 HETATM 72 H UNK 0 -1.323 -6.575 -0.390 0.00 0.00 H+0 HETATM 73 H UNK 0 0.908 -5.777 -0.069 0.00 0.00 H+0 HETATM 74 H UNK 0 1.904 -1.164 -0.796 0.00 0.00 H+0 HETATM 75 H UNK 0 2.262 -1.951 -2.320 0.00 0.00 H+0 HETATM 76 H UNK 0 5.053 -0.638 -2.604 0.00 0.00 H+0 HETATM 77 H UNK 0 5.097 0.919 -1.782 0.00 0.00 H+0 HETATM 78 H UNK 0 3.536 0.056 -2.031 0.00 0.00 H+0 HETATM 79 H UNK 0 6.688 -1.270 0.611 0.00 0.00 H+0 HETATM 80 H UNK 0 6.571 0.384 -0.075 0.00 0.00 H+0 HETATM 81 H UNK 0 8.012 -0.801 -1.356 0.00 0.00 H+0 HETATM 82 H UNK 0 3.623 -1.258 1.168 0.00 0.00 H+0 HETATM 83 H UNK 0 2.983 1.831 -0.540 0.00 0.00 H+0 HETATM 84 H UNK 0 4.943 3.018 -0.659 0.00 0.00 H+0 HETATM 85 H UNK 0 5.159 3.042 1.137 0.00 0.00 H+0 HETATM 86 H UNK 0 2.898 4.360 -0.368 0.00 0.00 H+0 HETATM 87 H UNK 0 5.499 5.081 -0.275 0.00 0.00 H+0 HETATM 88 H UNK 0 2.373 5.402 1.652 0.00 0.00 H+0 HETATM 89 H UNK 0 4.014 5.233 2.361 0.00 0.00 H+0 HETATM 90 H UNK 0 2.317 3.530 3.188 0.00 0.00 H+0 HETATM 91 H UNK 0 -0.121 3.808 0.020 0.00 0.00 H+0 HETATM 92 H UNK 0 1.217 2.969 -1.678 0.00 0.00 H+0 HETATM 93 H UNK 0 0.822 1.203 -1.308 0.00 0.00 H+0 HETATM 94 H UNK 0 -1.305 1.278 -2.046 0.00 0.00 H+0 HETATM 95 H UNK 0 -1.421 4.279 -1.474 0.00 0.00 H+0 HETATM 96 H UNK 0 -2.677 3.254 -2.177 0.00 0.00 H+0 HETATM 97 H UNK 0 -2.296 3.680 0.419 0.00 0.00 H+0 CONECT 1 2 51 52 53 CONECT 2 1 3 4 54 CONECT 3 2 55 56 57 CONECT 4 2 5 58 CONECT 5 4 6 59 CONECT 6 5 7 60 CONECT 7 6 8 61 CONECT 8 7 9 62 63 CONECT 9 8 10 49 64 CONECT 10 9 11 65 CONECT 11 10 12 13 CONECT 12 11 CONECT 13 11 14 19 66 CONECT 14 13 15 67 68 CONECT 15 14 16 17 69 CONECT 16 15 70 CONECT 17 15 18 71 72 CONECT 18 17 19 73 CONECT 19 18 20 13 CONECT 20 19 21 22 CONECT 21 20 CONECT 22 20 23 74 75 CONECT 23 22 24 CONECT 24 23 25 26 CONECT 25 24 CONECT 26 24 27 28 30 CONECT 27 26 76 77 78 CONECT 28 26 29 79 80 CONECT 29 28 81 CONECT 30 26 31 82 CONECT 31 30 32 33 CONECT 32 31 CONECT 33 31 34 39 83 CONECT 34 33 35 84 85 CONECT 35 34 36 37 86 CONECT 36 35 87 CONECT 37 35 38 88 89 CONECT 38 37 39 90 CONECT 39 38 40 33 CONECT 40 39 41 42 CONECT 41 40 CONECT 42 40 43 48 91 CONECT 43 42 44 92 93 CONECT 44 43 45 46 94 CONECT 45 44 CONECT 46 44 47 95 96 CONECT 47 46 48 97 CONECT 48 47 49 42 CONECT 49 48 50 9 CONECT 50 49 CONECT 51 1 CONECT 52 1 CONECT 53 1 CONECT 54 2 CONECT 55 3 CONECT 56 3 CONECT 57 3 CONECT 58 4 CONECT 59 5 CONECT 60 6 CONECT 61 7 CONECT 62 8 CONECT 63 8 CONECT 64 9 CONECT 65 10 CONECT 66 13 CONECT 67 14 CONECT 68 14 CONECT 69 15 CONECT 70 16 CONECT 71 17 CONECT 72 17 CONECT 73 18 CONECT 74 22 CONECT 75 22 CONECT 76 27 CONECT 77 27 CONECT 78 27 CONECT 79 28 CONECT 80 28 CONECT 81 29 CONECT 82 30 CONECT 83 33 CONECT 84 34 CONECT 85 34 CONECT 86 35 CONECT 87 36 CONECT 88 37 CONECT 89 37 CONECT 90 38 CONECT 91 42 CONECT 92 43 CONECT 93 43 CONECT 94 44 CONECT 95 46 CONECT 96 46 CONECT 97 47 MASTER 0 0 0 0 0 0 0 0 97 0 200 0 END