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 -2.110 5.672 0.376 0.00 0.00 C+0 HETATM 2 C UNK 0 -1.385 4.352 0.686 0.00 0.00 C+0 HETATM 3 C UNK 0 -1.598 3.475 -0.500 0.00 0.00 C+0 HETATM 4 C UNK 0 -0.992 4.211 -1.704 0.00 0.00 C+0 HETATM 5 C UNK 0 -0.857 2.148 -0.439 0.00 0.00 C+0 HETATM 6 N UNK 0 0.562 2.402 -0.342 0.00 0.00 N+0 HETATM 7 C UNK 0 1.571 1.408 -0.384 0.00 0.00 C+0 HETATM 8 O UNK 0 2.569 1.569 -1.172 0.00 0.00 O+0 HETATM 9 C UNK 0 1.584 0.166 0.417 0.00 0.00 C+0 HETATM 10 C UNK 0 2.625 0.133 1.495 0.00 0.00 C+0 HETATM 11 C UNK 0 3.956 0.261 0.899 0.00 0.00 C+0 HETATM 12 C UNK 0 4.552 1.485 0.716 0.00 0.00 C+0 HETATM 13 C UNK 0 5.813 1.615 0.158 0.00 0.00 C+0 HETATM 14 C UNK 0 6.481 0.470 -0.222 0.00 0.00 C+0 HETATM 15 O UNK 0 7.740 0.547 -0.782 0.00 0.00 O+0 HETATM 16 C UNK 0 8.405 -0.640 -1.163 0.00 0.00 C+0 HETATM 17 C UNK 0 5.868 -0.761 -0.032 0.00 0.00 C+0 HETATM 18 C UNK 0 4.621 -0.883 0.521 0.00 0.00 C+0 HETATM 19 N UNK 0 1.750 -0.950 -0.509 0.00 0.00 N+0 HETATM 20 C UNK 0 1.182 -2.234 -0.337 0.00 0.00 C+0 HETATM 21 O UNK 0 1.988 -3.207 -0.555 0.00 0.00 O+0 HETATM 22 C UNK 0 -0.246 -2.475 0.068 0.00 0.00 C+0 HETATM 23 C UNK 0 -0.370 -3.877 0.561 0.00 0.00 C+0 HETATM 24 O UNK 0 0.693 -4.714 0.176 0.00 0.00 O+0 HETATM 25 C UNK 0 -1.638 -4.589 0.219 0.00 0.00 C+0 HETATM 26 O UNK 0 -2.633 -4.424 1.186 0.00 0.00 O+0 HETATM 27 C UNK 0 -2.114 -4.351 -1.185 0.00 0.00 C+0 HETATM 28 N UNK 0 -1.196 -3.465 -1.901 0.00 0.00 N+0 HETATM 29 N UNK 0 -1.129 -2.299 -1.071 0.00 0.00 N+0 HETATM 30 C UNK 0 -1.863 -1.141 -1.402 0.00 0.00 C+0 HETATM 31 O UNK 0 -1.693 -0.740 -2.610 0.00 0.00 O+0 HETATM 32 C UNK 0 -2.774 -0.353 -0.578 0.00 0.00 C+0 HETATM 33 C UNK 0 -4.003 -1.133 -0.166 0.00 0.00 C+0 HETATM 34 C UNK 0 -4.962 -0.347 0.649 0.00 0.00 C+0 HETATM 35 C UNK 0 -4.930 0.957 1.026 0.00 0.00 C+0 HETATM 36 N UNK 0 -6.027 1.224 1.774 0.00 0.00 N+0 HETATM 37 C UNK 0 -6.746 0.101 1.870 0.00 0.00 C+0 HETATM 38 N UNK 0 -6.107 -0.855 1.190 0.00 0.00 N+0 HETATM 39 N UNK 0 -2.163 0.197 0.616 0.00 0.00 N+0 HETATM 40 C UNK 0 -1.397 1.366 0.706 0.00 0.00 C+0 HETATM 41 O UNK 0 -1.124 1.824 1.846 0.00 0.00 O+0 HETATM 42 H UNK 0 -3.167 5.508 0.163 0.00 0.00 H+0 HETATM 43 H UNK 0 -1.604 6.218 -0.448 0.00 0.00 H+0 HETATM 44 H UNK 0 -2.051 6.329 1.274 0.00 0.00 H+0 HETATM 45 H UNK 0 -1.898 3.987 1.609 0.00 0.00 H+0 HETATM 46 H UNK 0 -0.346 4.597 0.911 0.00 0.00 H+0 HETATM 47 H UNK 0 -2.681 3.333 -0.646 0.00 0.00 H+0 HETATM 48 H UNK 0 -0.096 4.771 -1.373 0.00 0.00 H+0 HETATM 49 H UNK 0 -0.674 3.466 -2.455 0.00 0.00 H+0 HETATM 50 H UNK 0 -1.746 4.873 -2.177 0.00 0.00 H+0 HETATM 51 H UNK 0 -1.117 1.657 -1.412 0.00 0.00 H+0 HETATM 52 H UNK 0 0.883 3.390 -0.234 0.00 0.00 H+0 HETATM 53 H UNK 0 0.613 -0.028 0.912 0.00 0.00 H+0 HETATM 54 H UNK 0 2.512 -0.838 2.024 0.00 0.00 H+0 HETATM 55 H UNK 0 2.384 0.975 2.203 0.00 0.00 H+0 HETATM 56 H UNK 0 4.040 2.391 1.008 0.00 0.00 H+0 HETATM 57 H UNK 0 6.306 2.565 0.002 0.00 0.00 H+0 HETATM 58 H UNK 0 8.578 -1.244 -0.236 0.00 0.00 H+0 HETATM 59 H UNK 0 7.714 -1.220 -1.803 0.00 0.00 H+0 HETATM 60 H UNK 0 9.339 -0.405 -1.694 0.00 0.00 H+0 HETATM 61 H UNK 0 6.368 -1.682 -0.319 0.00 0.00 H+0 HETATM 62 H UNK 0 4.165 -1.870 0.657 0.00 0.00 H+0 HETATM 63 H UNK 0 2.348 -0.751 -1.363 0.00 0.00 H+0 HETATM 64 H UNK 0 -0.458 -1.720 0.871 0.00 0.00 H+0 HETATM 65 H UNK 0 -0.320 -3.840 1.680 0.00 0.00 H+0 HETATM 66 H UNK 0 0.387 -5.578 -0.149 0.00 0.00 H+0 HETATM 67 H UNK 0 -1.410 -5.699 0.265 0.00 0.00 H+0 HETATM 68 H UNK 0 -2.284 -4.852 2.029 0.00 0.00 H+0 HETATM 69 H UNK 0 -3.098 -3.841 -1.129 0.00 0.00 H+0 HETATM 70 H UNK 0 -2.293 -5.287 -1.755 0.00 0.00 H+0 HETATM 71 H UNK 0 -0.255 -3.901 -2.002 0.00 0.00 H+0 HETATM 72 H UNK 0 -3.160 0.532 -1.136 0.00 0.00 H+0 HETATM 73 H UNK 0 -3.720 -2.083 0.353 0.00 0.00 H+0 HETATM 74 H UNK 0 -4.543 -1.391 -1.124 0.00 0.00 H+0 HETATM 75 H UNK 0 -4.202 1.696 0.801 0.00 0.00 H+0 HETATM 76 H UNK 0 -7.675 0.005 2.406 0.00 0.00 H+0 HETATM 77 H UNK 0 -6.422 -1.851 1.079 0.00 0.00 H+0 HETATM 78 H UNK 0 -2.323 -0.356 1.486 0.00 0.00 H+0 CONECT 1 2 42 43 44 CONECT 2 1 3 45 46 CONECT 3 2 4 5 47 CONECT 4 3 48 49 50 CONECT 5 3 6 40 51 CONECT 6 5 7 52 CONECT 7 6 8 9 CONECT 8 7 CONECT 9 7 10 19 53 CONECT 10 9 11 54 55 CONECT 11 10 12 18 CONECT 12 11 13 56 CONECT 13 12 14 57 CONECT 14 13 15 17 CONECT 15 14 16 CONECT 16 15 58 59 60 CONECT 17 14 18 61 CONECT 18 17 11 62 CONECT 19 9 20 63 CONECT 20 19 21 22 CONECT 21 20 CONECT 22 20 23 29 64 CONECT 23 22 24 25 65 CONECT 24 23 66 CONECT 25 23 26 27 67 CONECT 26 25 68 CONECT 27 25 28 69 70 CONECT 28 27 29 71 CONECT 29 28 30 22 CONECT 30 29 31 32 CONECT 31 30 CONECT 32 30 33 39 72 CONECT 33 32 34 73 74 CONECT 34 33 35 38 CONECT 35 34 36 75 CONECT 36 35 37 CONECT 37 36 38 76 CONECT 38 37 34 77 CONECT 39 32 40 78 CONECT 40 39 41 5 CONECT 41 40 CONECT 42 1 CONECT 43 1 CONECT 44 1 CONECT 45 2 CONECT 46 2 CONECT 47 3 CONECT 48 4 CONECT 49 4 CONECT 50 4 CONECT 51 5 CONECT 52 6 CONECT 53 9 CONECT 54 10 CONECT 55 10 CONECT 56 12 CONECT 57 13 CONECT 58 16 CONECT 59 16 CONECT 60 16 CONECT 61 17 CONECT 62 18 CONECT 63 19 CONECT 64 22 CONECT 65 23 CONECT 66 24 CONECT 67 25 CONECT 68 26 CONECT 69 27 CONECT 70 27 CONECT 71 28 CONECT 72 32 CONECT 73 33 CONECT 74 33 CONECT 75 35 CONECT 76 37 CONECT 77 38 CONECT 78 39 MASTER 0 0 0 0 0 0 0 0 78 0 162 0 END