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 8.584 -0.121 -0.042 0.00 0.00 C+0 HETATM 2 C UNK 0 7.568 -1.002 0.677 0.00 0.00 C+0 HETATM 3 C UNK 0 7.803 -2.429 0.255 0.00 0.00 C+0 HETATM 4 C UNK 0 6.206 -0.590 0.245 0.00 0.00 C+0 HETATM 5 C UNK 0 5.342 -0.212 1.151 0.00 0.00 C+0 HETATM 6 C UNK 0 3.981 0.199 0.716 0.00 0.00 C+0 HETATM 7 C UNK 0 3.077 0.586 1.572 0.00 0.00 C+0 HETATM 8 C UNK 0 1.703 1.013 1.289 0.00 0.00 C+0 HETATM 9 C UNK 0 1.328 0.901 -0.132 0.00 0.00 C+0 HETATM 10 N UNK 0 -0.010 1.409 -0.420 0.00 0.00 N+0 HETATM 11 C UNK 0 -0.480 2.719 -0.395 0.00 0.00 C+0 HETATM 12 O UNK 0 -1.125 3.212 -1.417 0.00 0.00 O+0 HETATM 13 C UNK 0 -0.375 3.743 0.664 0.00 0.00 C+0 HETATM 14 C UNK 0 0.832 4.622 0.445 0.00 0.00 C+0 HETATM 15 C UNK 0 0.551 6.084 0.346 0.00 0.00 C+0 HETATM 16 O UNK 0 0.221 6.410 -0.965 0.00 0.00 O+0 HETATM 17 C UNK 0 -0.456 6.598 1.325 0.00 0.00 C+0 HETATM 18 N UNK 0 -1.397 5.597 1.759 0.00 0.00 N+0 HETATM 19 N UNK 0 -1.551 4.590 0.761 0.00 0.00 N+0 HETATM 20 C UNK 0 -2.738 4.560 0.056 0.00 0.00 C+0 HETATM 21 O UNK 0 -3.132 5.652 -0.501 0.00 0.00 O+0 HETATM 22 C UNK 0 -3.675 3.427 -0.172 0.00 0.00 C+0 HETATM 23 O UNK 0 -3.318 2.269 0.497 0.00 0.00 O+0 HETATM 24 C UNK 0 -3.943 1.086 0.610 0.00 0.00 C+0 HETATM 25 O UNK 0 -3.958 0.501 1.750 0.00 0.00 O+0 HETATM 26 C UNK 0 -4.631 0.384 -0.496 0.00 0.00 C+0 HETATM 27 C UNK 0 -3.915 0.598 -1.781 0.00 0.00 C+0 HETATM 28 C UNK 0 -5.991 1.101 -0.658 0.00 0.00 C+0 HETATM 29 O UNK 0 -6.739 1.043 0.509 0.00 0.00 O+0 HETATM 30 N UNK 0 -4.887 -1.018 -0.170 0.00 0.00 N+0 HETATM 31 C UNK 0 -4.450 -2.177 -0.778 0.00 0.00 C+0 HETATM 32 O UNK 0 -5.371 -2.913 -1.314 0.00 0.00 O+0 HETATM 33 C UNK 0 -3.071 -2.736 -0.924 0.00 0.00 C+0 HETATM 34 C UNK 0 -3.294 -4.252 -1.065 0.00 0.00 C+0 HETATM 35 C UNK 0 -3.786 -4.832 0.212 0.00 0.00 C+0 HETATM 36 C UNK 0 -3.105 -4.350 1.454 0.00 0.00 C+0 HETATM 37 N UNK 0 -3.083 -2.904 1.396 0.00 0.00 N+0 HETATM 38 N UNK 0 -2.264 -2.569 0.244 0.00 0.00 N+0 HETATM 39 C UNK 0 -0.941 -2.167 0.429 0.00 0.00 C+0 HETATM 40 O UNK 0 -0.832 -1.200 1.235 0.00 0.00 O+0 HETATM 41 C UNK 0 0.301 -2.664 -0.133 0.00 0.00 C+0 HETATM 42 C UNK 0 0.109 -3.669 -1.255 0.00 0.00 C+0 HETATM 43 C UNK 0 1.445 -3.853 -1.933 0.00 0.00 C+0 HETATM 44 Cl UNK 0 1.517 -5.451 -2.701 0.00 0.00 Cl+0 HETATM 45 C UNK 0 2.579 -3.731 -0.972 0.00 0.00 C+0 HETATM 46 N UNK 0 2.653 -2.464 -0.327 0.00 0.00 N+0 HETATM 47 N UNK 0 1.373 -1.752 -0.413 0.00 0.00 N+0 HETATM 48 C UNK 0 1.484 -0.424 -0.777 0.00 0.00 C+0 HETATM 49 O UNK 0 1.820 -0.264 -2.048 0.00 0.00 O+0 HETATM 50 H UNK 0 8.807 0.769 0.567 0.00 0.00 H+0 HETATM 51 H UNK 0 9.504 -0.677 -0.276 0.00 0.00 H+0 HETATM 52 H UNK 0 8.144 0.185 -1.017 0.00 0.00 H+0 HETATM 53 H UNK 0 7.725 -0.829 1.760 0.00 0.00 H+0 HETATM 54 H UNK 0 6.918 -2.816 -0.317 0.00 0.00 H+0 HETATM 55 H UNK 0 7.947 -3.050 1.181 0.00 0.00 H+0 HETATM 56 H UNK 0 8.713 -2.513 -0.367 0.00 0.00 H+0 HETATM 57 H UNK 0 5.904 -0.592 -0.778 0.00 0.00 H+0 HETATM 58 H UNK 0 5.585 -0.188 2.200 0.00 0.00 H+0 HETATM 59 H UNK 0 3.753 0.189 -0.332 0.00 0.00 H+0 HETATM 60 H UNK 0 3.445 0.570 2.627 0.00 0.00 H+0 HETATM 61 H UNK 0 1.698 2.092 1.617 0.00 0.00 H+0 HETATM 62 H UNK 0 1.056 0.411 1.958 0.00 0.00 H+0 HETATM 63 H UNK 0 2.019 1.623 -0.658 0.00 0.00 H+0 HETATM 64 H UNK 0 -0.694 0.676 -0.693 0.00 0.00 H+0 HETATM 65 H UNK 0 -0.306 3.253 1.643 0.00 0.00 H+0 HETATM 66 H UNK 0 1.328 4.281 -0.486 0.00 0.00 H+0 HETATM 67 H UNK 0 1.548 4.428 1.270 0.00 0.00 H+0 HETATM 68 H UNK 0 1.512 6.619 0.556 0.00 0.00 H+0 HETATM 69 H UNK 0 -0.494 5.880 -1.352 0.00 0.00 H+0 HETATM 70 H UNK 0 -1.035 7.409 0.841 0.00 0.00 H+0 HETATM 71 H UNK 0 0.002 7.040 2.240 0.00 0.00 H+0 HETATM 72 H UNK 0 -1.082 5.186 2.655 0.00 0.00 H+0 HETATM 73 H UNK 0 -4.705 3.720 0.209 0.00 0.00 H+0 HETATM 74 H UNK 0 -3.860 3.291 -1.280 0.00 0.00 H+0 HETATM 75 H UNK 0 -2.859 0.852 -1.705 0.00 0.00 H+0 HETATM 76 H UNK 0 -4.432 1.320 -2.482 0.00 0.00 H+0 HETATM 77 H UNK 0 -3.975 -0.374 -2.355 0.00 0.00 H+0 HETATM 78 H UNK 0 -5.904 2.104 -1.054 0.00 0.00 H+0 HETATM 79 H UNK 0 -6.558 0.442 -1.387 0.00 0.00 H+0 HETATM 80 H UNK 0 -6.226 0.707 1.271 0.00 0.00 H+0 HETATM 81 H UNK 0 -5.535 -1.115 0.679 0.00 0.00 H+0 HETATM 82 H UNK 0 -2.682 -2.300 -1.842 0.00 0.00 H+0 HETATM 83 H UNK 0 -2.465 -4.809 -1.450 0.00 0.00 H+0 HETATM 84 H UNK 0 -4.124 -4.349 -1.814 0.00 0.00 H+0 HETATM 85 H UNK 0 -4.889 -4.763 0.327 0.00 0.00 H+0 HETATM 86 H UNK 0 -3.587 -5.943 0.159 0.00 0.00 H+0 HETATM 87 H UNK 0 -2.090 -4.775 1.591 0.00 0.00 H+0 HETATM 88 H UNK 0 -3.741 -4.621 2.326 0.00 0.00 H+0 HETATM 89 H UNK 0 -2.742 -2.445 2.241 0.00 0.00 H+0 HETATM 90 H UNK 0 0.697 -3.338 0.715 0.00 0.00 H+0 HETATM 91 H UNK 0 -0.565 -3.309 -2.058 0.00 0.00 H+0 HETATM 92 H UNK 0 -0.176 -4.634 -0.841 0.00 0.00 H+0 HETATM 93 H UNK 0 1.596 -3.104 -2.750 0.00 0.00 H+0 HETATM 94 H UNK 0 3.527 -3.842 -1.576 0.00 0.00 H+0 HETATM 95 H UNK 0 2.594 -4.594 -0.277 0.00 0.00 H+0 HETATM 96 H UNK 0 2.744 -2.624 0.702 0.00 0.00 H+0 CONECT 1 2 50 51 52 CONECT 2 1 3 4 53 CONECT 3 2 54 55 56 CONECT 4 2 5 57 CONECT 5 4 6 58 CONECT 6 5 7 59 CONECT 7 6 8 60 CONECT 8 7 9 61 62 CONECT 9 8 10 48 63 CONECT 10 9 11 64 CONECT 11 10 12 13 CONECT 12 11 CONECT 13 11 14 19 65 CONECT 14 13 15 66 67 CONECT 15 14 16 17 68 CONECT 16 15 69 CONECT 17 15 18 70 71 CONECT 18 17 19 72 CONECT 19 18 20 13 CONECT 20 19 21 22 CONECT 21 20 CONECT 22 20 23 73 74 CONECT 23 22 24 CONECT 24 23 25 26 CONECT 25 24 CONECT 26 24 27 28 30 CONECT 27 26 75 76 77 CONECT 28 26 29 78 79 CONECT 29 28 80 CONECT 30 26 31 81 CONECT 31 30 32 33 CONECT 32 31 CONECT 33 31 34 38 82 CONECT 34 33 35 83 84 CONECT 35 34 36 85 86 CONECT 36 35 37 87 88 CONECT 37 36 38 89 CONECT 38 37 39 33 CONECT 39 38 40 41 CONECT 40 39 CONECT 41 39 42 47 90 CONECT 42 41 43 91 92 CONECT 43 42 44 45 93 CONECT 44 43 CONECT 45 43 46 94 95 CONECT 46 45 47 96 CONECT 47 46 48 41 CONECT 48 47 49 9 CONECT 49 48 CONECT 50 1 CONECT 51 1 CONECT 52 1 CONECT 53 2 CONECT 54 3 CONECT 55 3 CONECT 56 3 CONECT 57 4 CONECT 58 5 CONECT 59 6 CONECT 60 7 CONECT 61 8 CONECT 62 8 CONECT 63 9 CONECT 64 10 CONECT 65 13 CONECT 66 14 CONECT 67 14 CONECT 68 15 CONECT 69 16 CONECT 70 17 CONECT 71 17 CONECT 72 18 CONECT 73 22 CONECT 74 22 CONECT 75 27 CONECT 76 27 CONECT 77 27 CONECT 78 28 CONECT 79 28 CONECT 80 29 CONECT 81 30 CONECT 82 33 CONECT 83 34 CONECT 84 34 CONECT 85 35 CONECT 86 35 CONECT 87 36 CONECT 88 36 CONECT 89 37 CONECT 90 41 CONECT 91 42 CONECT 92 42 CONECT 93 43 CONECT 94 45 CONECT 95 45 CONECT 96 46 MASTER 0 0 0 0 0 0 0 0 96 0 198 0 END