HEADER PROTEIN 24-JUN-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 24-JUN-21 0 HETATM 1 C UNK 0 -0.828 -0.720 -3.062 0.00 0.00 C-1 HETATM 2 N UNK 0 -1.017 -0.703 -1.906 0.00 0.00 N+1 HETATM 3 C UNK 0 -1.280 -0.676 -0.498 0.00 0.00 C+0 HETATM 4 C UNK 0 -2.473 0.069 -0.189 0.00 0.00 C+0 HETATM 5 C UNK 0 -2.717 1.297 0.157 0.00 0.00 C+0 HETATM 6 C UNK 0 -1.842 2.423 0.370 0.00 0.00 C+0 HETATM 7 C UNK 0 -2.271 3.530 -0.606 0.00 0.00 C+0 HETATM 8 C UNK 0 -2.167 3.000 1.758 0.00 0.00 C+0 HETATM 9 C UNK 0 -0.422 2.239 0.207 0.00 0.00 C+0 HETATM 10 N UNK 0 0.406 3.317 0.104 0.00 0.00 N+0 HETATM 11 C UNK 0 1.673 2.901 -0.035 0.00 0.00 C+0 HETATM 12 C UNK 0 2.922 3.457 -0.180 0.00 0.00 C+0 HETATM 13 C UNK 0 4.045 2.666 -0.299 0.00 0.00 C+0 HETATM 14 C UNK 0 3.959 1.275 -0.277 0.00 0.00 C+0 HETATM 15 C UNK 0 2.700 0.713 -0.131 0.00 0.00 C+0 HETATM 16 C UNK 0 1.613 1.521 -0.017 0.00 0.00 C+0 HETATM 17 C UNK 0 0.335 1.092 0.132 0.00 0.00 C+0 HETATM 18 C UNK 0 0.001 -0.340 0.183 0.00 0.00 C+0 HETATM 19 O UNK 0 0.007 -0.807 1.528 0.00 0.00 O+0 HETATM 20 C UNK 0 1.087 -1.149 -0.489 0.00 0.00 C+0 HETATM 21 C UNK 0 0.881 -2.593 -0.102 0.00 0.00 C+0 HETATM 22 C UNK 0 -0.503 -3.092 -0.306 0.00 0.00 C+0 HETATM 23 Cl UNK 0 -0.756 -4.467 0.802 0.00 0.00 Cl+0 HETATM 24 C UNK 0 -1.605 -2.145 -0.155 0.00 0.00 C+0 HETATM 25 C UNK 0 -2.302 -2.213 1.194 0.00 0.00 C+0 HETATM 26 C UNK 0 -2.703 -2.502 -1.139 0.00 0.00 C+0 HETATM 27 C UNK 0 -3.447 -3.577 -0.937 0.00 0.00 C+0 HETATM 28 C UNK 0 2.481 -0.752 -0.096 0.00 0.00 C+0 HETATM 29 C UNK 0 2.929 -1.254 1.236 0.00 0.00 C+0 HETATM 30 C UNK 0 3.481 -1.302 -1.127 0.00 0.00 C+0 HETATM 31 H UNK 0 -3.407 -0.517 -0.261 0.00 0.00 H+0 HETATM 32 H UNK 0 -3.780 1.579 0.332 0.00 0.00 H+0 HETATM 33 H UNK 0 -2.105 4.528 -0.169 0.00 0.00 H+0 HETATM 34 H UNK 0 -1.691 3.486 -1.549 0.00 0.00 H+0 HETATM 35 H UNK 0 -3.340 3.419 -0.885 0.00 0.00 H+0 HETATM 36 H UNK 0 -3.219 3.360 1.676 0.00 0.00 H+0 HETATM 37 H UNK 0 -1.459 3.779 2.051 0.00 0.00 H+0 HETATM 38 H UNK 0 -2.191 2.121 2.436 0.00 0.00 H+0 HETATM 39 H UNK 0 0.125 4.316 0.127 0.00 0.00 H+0 HETATM 40 H UNK 0 3.025 4.525 -0.201 0.00 0.00 H+0 HETATM 41 H UNK 0 5.026 3.111 -0.412 0.00 0.00 H+0 HETATM 42 H UNK 0 4.790 0.608 -0.363 0.00 0.00 H+0 HETATM 43 H UNK 0 -0.236 -0.015 2.082 0.00 0.00 H+0 HETATM 44 H UNK 0 1.054 -1.116 -1.592 0.00 0.00 H+0 HETATM 45 H UNK 0 1.229 -2.684 0.948 0.00 0.00 H+0 HETATM 46 H UNK 0 1.589 -3.186 -0.714 0.00 0.00 H+0 HETATM 47 H UNK 0 -0.544 -3.556 -1.336 0.00 0.00 H+0 HETATM 48 H UNK 0 -2.304 -1.245 1.721 0.00 0.00 H+0 HETATM 49 H UNK 0 -1.664 -2.890 1.831 0.00 0.00 H+0 HETATM 50 H UNK 0 -3.299 -2.640 1.176 0.00 0.00 H+0 HETATM 51 H UNK 0 -2.909 -1.903 -2.018 0.00 0.00 H+0 HETATM 52 H UNK 0 -3.313 -4.233 -0.090 0.00 0.00 H+0 HETATM 53 H UNK 0 -4.221 -3.815 -1.645 0.00 0.00 H+0 HETATM 54 H UNK 0 3.894 -0.709 1.464 0.00 0.00 H+0 HETATM 55 H UNK 0 2.262 -0.981 2.078 0.00 0.00 H+0 HETATM 56 H UNK 0 3.209 -2.325 1.254 0.00 0.00 H+0 HETATM 57 H UNK 0 3.220 -2.291 -1.494 0.00 0.00 H+0 HETATM 58 H UNK 0 4.461 -1.380 -0.619 0.00 0.00 H+0 HETATM 59 H UNK 0 3.611 -0.553 -1.948 0.00 0.00 H+0 CONECT 1 2 CONECT 2 1 3 CONECT 3 2 4 18 24 CONECT 4 3 5 31 CONECT 5 4 6 32 CONECT 6 5 7 8 9 CONECT 7 6 33 34 35 CONECT 8 6 36 37 38 CONECT 9 6 10 17 CONECT 10 9 11 39 CONECT 11 10 12 16 CONECT 12 11 13 40 CONECT 13 12 14 41 CONECT 14 13 15 42 CONECT 15 14 16 28 CONECT 16 15 17 11 CONECT 17 16 18 9 CONECT 18 17 19 20 3 CONECT 19 18 43 CONECT 20 18 21 28 44 CONECT 21 20 22 45 46 CONECT 22 21 23 24 47 CONECT 23 22 CONECT 24 22 25 26 3 CONECT 25 24 48 49 50 CONECT 26 24 27 51 CONECT 27 26 52 53 CONECT 28 20 29 30 15 CONECT 29 28 54 55 56 CONECT 30 28 57 58 59 CONECT 31 4 CONECT 32 5 CONECT 33 7 CONECT 34 7 CONECT 35 7 CONECT 36 8 CONECT 37 8 CONECT 38 8 CONECT 39 10 CONECT 40 12 CONECT 41 13 CONECT 42 14 CONECT 43 19 CONECT 44 20 CONECT 45 21 CONECT 46 21 CONECT 47 22 CONECT 48 25 CONECT 49 25 CONECT 50 25 CONECT 51 26 CONECT 52 27 CONECT 53 27 CONECT 54 29 CONECT 55 29 CONECT 56 29 CONECT 57 30 CONECT 58 30 CONECT 59 30 MASTER 0 0 0 0 0 0 0 0 59 0 126 0 END