HEADER PROTEIN 29-APR-22 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 29-APR-22 0 HETATM 1 C UNK 0 37.849 2.145 0.000 0.00 0.00 C+0 HETATM 2 C UNK 0 38.694 0.858 0.000 0.00 0.00 C+0 HETATM 3 C UNK 0 38.001 -0.518 0.000 0.00 0.00 C+0 HETATM 4 C UNK 0 36.464 -0.605 0.000 0.00 0.00 C+0 HETATM 5 C UNK 0 35.619 0.682 0.000 0.00 0.00 C+0 HETATM 6 O UNK 0 36.311 2.058 0.000 0.00 0.00 O+0 HETATM 7 C UNK 0 34.081 0.594 0.000 0.00 0.00 C+0 HETATM 8 C UNK 0 33.389 -0.781 0.000 0.00 0.00 C+0 HETATM 9 C UNK 0 34.234 -2.069 0.000 0.00 0.00 C+0 HETATM 10 O UNK 0 35.771 -1.981 0.000 0.00 0.00 O+0 HETATM 11 C UNK 0 33.541 -3.444 0.000 0.00 0.00 C+0 HETATM 12 C UNK 0 32.003 -3.532 0.000 0.00 0.00 C+0 HETATM 13 C UNK 0 31.159 -2.245 0.000 0.00 0.00 C+0 HETATM 14 O UNK 0 31.851 -0.869 0.000 0.00 0.00 O+0 HETATM 15 C UNK 0 29.621 -2.333 0.000 0.00 0.00 C+0 HETATM 16 C UNK 0 28.929 -3.708 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 29.773 -4.996 0.000 0.00 0.00 C+0 HETATM 18 O UNK 0 31.311 -4.908 0.000 0.00 0.00 O+0 HETATM 19 C UNK 0 29.294 -6.459 0.000 0.00 0.00 C+0 HETATM 20 C UNK 0 27.850 -6.997 0.000 0.00 0.00 C+0 HETATM 21 C UNK 0 26.531 -6.203 0.000 0.00 0.00 C+0 HETATM 22 C UNK 0 26.328 -4.677 0.000 0.00 0.00 C+0 HETATM 23 O UNK 0 27.395 -3.566 0.000 0.00 0.00 O+0 HETATM 24 C UNK 0 24.904 -4.089 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 23.684 -5.028 0.000 0.00 0.00 C+0 HETATM 26 C UNK 0 23.886 -6.554 0.000 0.00 0.00 C+0 HETATM 27 O UNK 0 25.310 -7.142 0.000 0.00 0.00 O+0 HETATM 28 C UNK 0 22.950 -7.777 0.000 0.00 0.00 C+0 HETATM 29 C UNK 0 21.424 -7.980 0.000 0.00 0.00 C+0 HETATM 30 C UNK 0 20.201 -7.043 0.000 0.00 0.00 C+0 HETATM 31 C UNK 0 19.998 -5.517 0.000 0.00 0.00 C+0 HETATM 32 C UNK 0 20.934 -4.294 0.000 0.00 0.00 C+0 HETATM 33 O UNK 0 22.461 -4.091 0.000 0.00 0.00 O+0 HETATM 34 C UNK 0 20.343 -2.872 0.000 0.00 0.00 C+0 HETATM 35 C UNK 0 18.816 -2.672 0.000 0.00 0.00 C+0 HETATM 36 C UNK 0 17.880 -3.895 0.000 0.00 0.00 C+0 HETATM 37 O UNK 0 18.471 -5.317 0.000 0.00 0.00 O+0 HETATM 38 C UNK 0 16.353 -3.696 0.000 0.00 0.00 C+0 HETATM 39 C UNK 0 15.762 -2.274 0.000 0.00 0.00 C+0 HETATM 40 C UNK 0 16.699 -1.051 0.000 0.00 0.00 C+0 HETATM 41 O UNK 0 18.226 -1.250 0.000 0.00 0.00 O+0 HETATM 42 C UNK 0 16.108 0.371 0.000 0.00 0.00 C+0 HETATM 43 C UNK 0 14.581 0.571 0.000 0.00 0.00 C+0 HETATM 44 C UNK 0 13.644 -0.652 0.000 0.00 0.00 C+0 HETATM 45 O UNK 0 14.235 -2.074 0.000 0.00 0.00 O+0 HETATM 46 C UNK 0 12.117 -0.453 0.000 0.00 0.00 C+0 HETATM 47 C UNK 0 11.527 0.969 0.000 0.00 0.00 C+0 HETATM 48 C UNK 0 10.000 1.169 0.000 0.00 0.00 C+0 HETATM 49 C UNK 0 12.463 2.192 0.000 0.00 0.00 C+0 HETATM 50 O UNK 0 13.990 1.993 0.000 0.00 0.00 O+0 HETATM 51 C UNK 0 11.872 3.614 0.000 0.00 0.00 C+0 HETATM 52 C UNK 0 11.281 5.036 0.000 0.00 0.00 C+0 HETATM 53 C UNK 0 9.754 5.236 0.000 0.00 0.00 C+0 HETATM 54 C UNK 0 9.163 6.658 0.000 0.00 0.00 C+0 HETATM 55 C UNK 0 7.636 6.857 0.000 0.00 0.00 C+0 HETATM 56 C UNK 0 10.099 7.881 0.000 0.00 0.00 C+0 HETATM 57 C UNK 0 9.509 9.303 0.000 0.00 0.00 C+0 HETATM 58 C UNK 0 10.445 10.526 0.000 0.00 0.00 C+0 HETATM 59 O UNK 0 13.294 4.205 0.000 0.00 0.00 O+0 HETATM 60 C UNK 0 10.450 3.023 0.000 0.00 0.00 C+0 HETATM 61 C UNK 0 14.826 -3.496 0.000 0.00 0.00 C+0 HETATM 62 O UNK 0 15.417 -4.919 0.000 0.00 0.00 O+0 HETATM 63 C UNK 0 13.890 -4.719 0.000 0.00 0.00 C+0 HETATM 64 O UNK 0 13.154 -3.367 0.000 0.00 0.00 O+0 HETATM 65 C UNK 0 11.640 -3.649 0.000 0.00 0.00 C+0 HETATM 66 C UNK 0 11.440 -5.176 0.000 0.00 0.00 C+0 HETATM 67 C UNK 0 12.831 -5.837 0.000 0.00 0.00 C+0 HETATM 68 O UNK 0 13.113 -7.351 0.000 0.00 0.00 O+0 HETATM 69 O UNK 0 10.088 -5.912 0.000 0.00 0.00 O+0 HETATM 70 C UNK 0 10.522 -2.590 0.000 0.00 0.00 C+0 HETATM 71 O UNK 0 9.045 -3.029 0.000 0.00 0.00 O+0 HETATM 72 C UNK 0 7.927 -1.970 0.000 0.00 0.00 C+0 HETATM 73 C UNK 0 6.413 -2.252 0.000 0.00 0.00 C+0 HETATM 74 C UNK 0 5.677 -0.900 0.000 0.00 0.00 C+0 HETATM 75 C UNK 0 6.736 0.218 0.000 0.00 0.00 C+0 HETATM 76 O UNK 0 8.127 -0.443 0.000 0.00 0.00 O+0 HETATM 77 C UNK 0 6.454 1.732 0.000 0.00 0.00 C+0 HETATM 78 O UNK 0 5.002 2.245 0.000 0.00 0.00 O+0 HETATM 79 C UNK 0 4.719 3.759 0.000 0.00 0.00 C+0 HETATM 80 O UNK 0 3.329 4.420 0.000 0.00 0.00 O+0 HETATM 81 C UNK 0 3.528 5.947 0.000 0.00 0.00 C+0 HETATM 82 C UNK 0 5.042 6.230 0.000 0.00 0.00 C+0 HETATM 83 C UNK 0 5.778 4.877 0.000 0.00 0.00 C+0 HETATM 84 O UNK 0 7.305 4.678 0.000 0.00 0.00 O+0 HETATM 85 O UNK 0 5.703 7.620 0.000 0.00 0.00 O+0 HETATM 86 C UNK 0 2.410 7.006 0.000 0.00 0.00 C+0 HETATM 87 O UNK 0 2.768 8.504 0.000 0.00 0.00 O+0 HETATM 88 O UNK 0 4.150 -0.700 0.000 0.00 0.00 O+0 HETATM 89 O UNK 0 5.752 -3.643 0.000 0.00 0.00 O+0 HETATM 90 C UNK 0 18.868 -7.815 0.000 0.00 0.00 C+0 HETATM 91 C UNK 0 24.287 -8.041 0.000 0.00 0.00 C+0 HETATM 92 C UNK 0 26.619 -7.741 0.000 0.00 0.00 C+0 HETATM 93 O UNK 0 40.231 0.946 0.000 0.00 0.00 O+0 HETATM 94 S UNK 0 41.076 -0.342 0.000 0.00 0.00 S+0 HETATM 95 O UNK 0 39.788 -1.186 0.000 0.00 0.00 O+0 HETATM 96 O UNK 0 42.363 0.503 0.000 0.00 0.00 O+0 HETATM 97 O UNK 0 41.921 -1.629 0.000 0.00 0.00 O+0 HETATM 98 C UNK 0 39.106 3.035 0.000 0.00 0.00 C+0 HETATM 99 C UNK 0 40.505 2.391 0.000 0.00 0.00 C+0 HETATM 100 C UNK 0 41.762 3.280 0.000 0.00 0.00 C+0 HETATM 101 O UNK 0 43.161 2.636 0.000 0.00 0.00 O+0 HETATM 102 S UNK 0 44.418 3.525 0.000 0.00 0.00 S+0 HETATM 103 O UNK 0 45.675 4.415 0.000 0.00 0.00 O+0 HETATM 104 O UNK 0 45.307 2.268 0.000 0.00 0.00 O+0 HETATM 105 O UNK 0 43.529 4.783 0.000 0.00 0.00 O+0 HETATM 106 C UNK 0 37.814 3.685 0.000 0.00 0.00 C+0 CONECT 1 2 6 98 106 CONECT 2 1 3 93 CONECT 3 2 4 CONECT 4 3 5 10 CONECT 5 4 6 7 CONECT 6 5 1 CONECT 7 5 8 CONECT 8 7 9 14 CONECT 9 8 10 11 CONECT 10 9 4 CONECT 11 9 12 CONECT 12 11 13 18 CONECT 13 12 14 15 CONECT 14 13 8 CONECT 15 13 16 CONECT 16 15 17 23 CONECT 17 16 18 19 CONECT 18 17 12 CONECT 19 17 20 CONECT 20 19 21 CONECT 21 20 22 27 92 CONECT 22 21 23 24 CONECT 23 22 16 CONECT 24 22 25 CONECT 25 24 26 33 CONECT 26 25 27 28 91 CONECT 27 26 21 CONECT 28 26 29 CONECT 29 28 30 CONECT 30 29 31 90 CONECT 31 30 32 37 CONECT 32 31 33 34 CONECT 33 32 25 CONECT 34 32 35 CONECT 35 34 36 41 CONECT 36 35 37 38 CONECT 37 36 31 CONECT 38 36 39 62 CONECT 39 38 40 45 61 CONECT 40 39 41 42 CONECT 41 40 35 CONECT 42 40 43 CONECT 43 42 44 50 CONECT 44 43 45 46 CONECT 45 44 39 CONECT 46 44 47 CONECT 47 46 48 49 CONECT 48 47 CONECT 49 47 50 51 CONECT 50 49 43 CONECT 51 49 52 59 60 CONECT 52 51 53 CONECT 53 52 54 CONECT 54 53 55 56 CONECT 55 54 CONECT 56 54 57 CONECT 57 56 58 CONECT 58 57 CONECT 59 51 CONECT 60 51 CONECT 61 39 CONECT 62 38 63 CONECT 63 62 64 67 CONECT 64 63 65 CONECT 65 64 66 70 CONECT 66 65 67 69 CONECT 67 66 63 68 CONECT 68 67 CONECT 69 66 CONECT 70 65 71 CONECT 71 70 72 CONECT 72 71 73 76 CONECT 73 72 74 89 CONECT 74 73 75 88 CONECT 75 74 76 77 CONECT 76 75 72 CONECT 77 75 78 CONECT 78 77 79 CONECT 79 78 80 83 CONECT 80 79 81 CONECT 81 80 82 86 CONECT 82 81 83 85 CONECT 83 82 79 84 CONECT 84 83 CONECT 85 82 CONECT 86 81 87 CONECT 87 86 CONECT 88 74 CONECT 89 73 CONECT 90 30 CONECT 91 26 CONECT 92 21 CONECT 93 2 94 CONECT 94 93 95 96 97 CONECT 95 94 CONECT 96 94 CONECT 97 94 CONECT 98 1 99 CONECT 99 98 100 CONECT 100 99 101 CONECT 101 100 102 CONECT 102 101 103 104 105 CONECT 103 102 CONECT 104 102 CONECT 105 102 CONECT 106 1 MASTER 0 0 0 0 0 0 0 0 106 0 238 0 END