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 O UNK 0 -0.957 -7.381 0.000 0.00 0.00 O+0 HETATM 2 C UNK 0 -0.163 -6.972 0.000 0.00 0.00 C+0 HETATM 3 C UNK 0 0.880 -8.105 0.000 0.00 0.00 C+0 HETATM 4 O UNK 0 0.124 -9.447 0.000 0.00 0.00 O+0 HETATM 5 C UNK 0 -1.386 -9.143 0.000 0.00 0.00 C+0 HETATM 6 C UNK 0 -2.872 -9.937 0.000 0.00 0.00 C+0 HETATM 7 C UNK 0 -4.214 -9.182 0.000 0.00 0.00 C+0 HETATM 8 C UNK 0 -5.539 -9.966 0.000 0.00 0.00 C+0 HETATM 9 C UNK 0 -5.523 -11.506 0.000 0.00 0.00 C+0 HETATM 10 O UNK 0 -6.848 -12.290 0.000 0.00 0.00 O+0 HETATM 11 C UNK 0 -4.181 -12.262 0.000 0.00 0.00 C+0 HETATM 12 O UNK 0 -4.164 -13.801 0.000 0.00 0.00 O+0 HETATM 13 C UNK 0 -2.856 -11.477 0.000 0.00 0.00 C+0 HETATM 14 C UNK 0 -4.230 -7.642 0.000 0.00 0.00 C+0 HETATM 15 C UNK 0 -3.475 -6.300 0.000 0.00 0.00 C+0 HETATM 16 C UNK 0 -4.196 -5.183 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 -5.799 -4.991 0.000 0.00 0.00 C+0 HETATM 18 O UNK 0 -6.583 -3.666 0.000 0.00 0.00 O+0 HETATM 19 C UNK 0 -6.554 -6.333 0.000 0.00 0.00 C+0 HETATM 20 O UNK 0 -8.094 -6.349 0.000 0.00 0.00 O+0 HETATM 21 C UNK 0 -5.770 -7.658 0.000 0.00 0.00 C+0 HETATM 22 O UNK 0 -6.526 -9.000 0.000 0.00 0.00 O+0 HETATM 23 C UNK 0 -2.823 -6.378 0.000 0.00 0.00 C+0 HETATM 24 O UNK 0 -0.971 -4.344 0.000 0.00 0.00 O+0 HETATM 25 C UNK 0 -0.254 -5.289 0.000 0.00 0.00 C+0 HETATM 26 C UNK 0 1.054 -4.476 0.000 0.00 0.00 C+0 HETATM 27 C UNK 0 2.412 -5.203 0.000 0.00 0.00 C+0 HETATM 28 O UNK 0 3.720 -4.390 0.000 0.00 0.00 O+0 HETATM 29 C UNK 0 3.670 -2.851 0.000 0.00 0.00 C+0 HETATM 30 C UNK 0 2.312 -2.124 0.000 0.00 0.00 C+0 HETATM 31 C UNK 0 0.379 -3.127 0.000 0.00 0.00 C+0 HETATM 32 C UNK 0 -0.979 -2.400 0.000 0.00 0.00 C+0 HETATM 33 O UNK 0 -2.287 -3.213 0.000 0.00 0.00 O+0 HETATM 34 C UNK 0 -1.029 -0.861 0.000 0.00 0.00 C+0 HETATM 35 O UNK 0 -1.762 0.055 0.000 0.00 0.00 O+0 HETATM 36 C UNK 0 0.904 0.141 0.000 0.00 0.00 C+0 HETATM 37 O UNK 0 0.854 1.680 0.000 0.00 0.00 O+0 HETATM 38 C UNK 0 2.262 -0.585 0.000 0.00 0.00 C+0 HETATM 39 O UNK 0 3.570 0.228 0.000 0.00 0.00 O+0 HETATM 40 C UNK 0 4.928 -0.499 0.000 0.00 0.00 C+0 HETATM 41 C UNK 0 4.353 -2.227 0.000 0.00 0.00 C+0 HETATM 42 C UNK 0 6.336 -2.764 0.000 0.00 0.00 C+0 HETATM 43 C UNK 0 7.875 -2.714 0.000 0.00 0.00 C+0 HETATM 44 O UNK 0 5.609 -4.122 0.000 0.00 0.00 O+0 HETATM 45 C UNK 0 6.422 -5.430 0.000 0.00 0.00 C+0 HETATM 46 C UNK 0 8.107 -5.449 0.000 0.00 0.00 C+0 HETATM 47 O UNK 0 8.644 -4.005 0.000 0.00 0.00 O+0 HETATM 48 C UNK 0 9.285 -6.442 0.000 0.00 0.00 C+0 HETATM 49 C UNK 0 9.173 -7.978 0.000 0.00 0.00 C+0 HETATM 50 O UNK 0 10.448 -8.842 0.000 0.00 0.00 O+0 HETATM 51 C UNK 0 9.711 -10.567 0.000 0.00 0.00 C+0 HETATM 52 O UNK 0 9.140 -11.675 0.000 0.00 0.00 O+0 HETATM 53 C UNK 0 7.787 -8.649 0.000 0.00 0.00 C+0 HETATM 54 C UNK 0 6.513 -7.785 0.000 0.00 0.00 C+0 HETATM 55 O UNK 0 5.127 -8.457 0.000 0.00 0.00 O+0 HETATM 56 O UNK 0 7.676 -10.185 0.000 0.00 0.00 O+0 HETATM 57 C UNK 0 8.951 -11.050 0.000 0.00 0.00 C+0 HETATM 58 C UNK 0 8.839 -12.586 0.000 0.00 0.00 C+0 HETATM 59 C UNK 0 7.454 -13.257 0.000 0.00 0.00 C+0 HETATM 60 C UNK 0 7.342 -14.793 0.000 0.00 0.00 C+0 HETATM 61 O UNK 0 5.957 -15.465 0.000 0.00 0.00 O+0 HETATM 62 C UNK 0 8.617 -15.658 0.000 0.00 0.00 C+0 HETATM 63 O UNK 0 8.506 -17.194 0.000 0.00 0.00 O+0 HETATM 64 C UNK 0 10.003 -14.986 0.000 0.00 0.00 C+0 HETATM 65 O UNK 0 11.277 -15.850 0.000 0.00 0.00 O+0 HETATM 66 C UNK 0 10.114 -13.450 0.000 0.00 0.00 C+0 HETATM 67 C UNK 0 11.500 -12.778 0.000 0.00 0.00 C+0 HETATM 68 C UNK 0 11.611 -11.242 0.000 0.00 0.00 C+0 HETATM 69 C UNK 0 12.997 -10.571 0.000 0.00 0.00 C+0 HETATM 70 C UNK 0 14.272 -11.435 0.000 0.00 0.00 C+0 HETATM 71 O UNK 0 15.657 -10.763 0.000 0.00 0.00 O+0 HETATM 72 C UNK 0 14.160 -12.971 0.000 0.00 0.00 C+0 HETATM 73 O UNK 0 15.435 -13.835 0.000 0.00 0.00 O+0 HETATM 74 C UNK 0 12.774 -13.643 0.000 0.00 0.00 C+0 HETATM 75 O UNK 0 12.663 -15.179 0.000 0.00 0.00 O+0 HETATM 76 O UNK 0 10.337 -10.378 0.000 0.00 0.00 O+0 HETATM 77 O UNK 0 10.593 -5.629 0.000 0.00 0.00 O+0 HETATM 78 C UNK 0 10.224 -4.134 0.000 0.00 0.00 C+0 HETATM 79 C UNK 0 10.953 -2.615 0.000 0.00 0.00 C+0 HETATM 80 C UNK 0 10.141 -1.307 0.000 0.00 0.00 C+0 HETATM 81 C UNK 0 10.867 0.051 0.000 0.00 0.00 C+0 HETATM 82 O UNK 0 10.054 1.359 0.000 0.00 0.00 O+0 HETATM 83 C UNK 0 12.406 0.101 0.000 0.00 0.00 C+0 HETATM 84 O UNK 0 13.133 1.459 0.000 0.00 0.00 O+0 HETATM 85 C UNK 0 13.219 -1.207 0.000 0.00 0.00 C+0 HETATM 86 O UNK 0 14.758 -1.157 0.000 0.00 0.00 O+0 HETATM 87 C UNK 0 12.493 -2.565 0.000 0.00 0.00 C+0 HETATM 88 O UNK 0 8.816 -3.510 0.000 0.00 0.00 O+0 HETATM 89 O UNK 0 9.349 -2.268 0.000 0.00 0.00 O+0 HETATM 90 C UNK 0 7.644 -1.951 0.000 0.00 0.00 C+0 HETATM 91 C UNK 0 7.594 -0.412 0.000 0.00 0.00 C+0 HETATM 92 O UNK 0 8.902 0.401 0.000 0.00 0.00 O+0 HETATM 93 C UNK 0 6.236 0.314 0.000 0.00 0.00 C+0 HETATM 94 O UNK 0 6.186 1.853 0.000 0.00 0.00 O+0 HETATM 95 O UNK 0 4.978 -2.038 0.000 0.00 0.00 O+0 HETATM 96 C UNK 0 2.462 -6.742 0.000 0.00 0.00 C+0 HETATM 97 O UNK 0 3.820 -7.468 0.000 0.00 0.00 O+0 HETATM 98 O UNK 0 1.004 -2.937 0.000 0.00 0.00 O+0 HETATM 99 C UNK 0 -0.354 -2.211 0.000 0.00 0.00 C+0 HETATM 100 C UNK 0 -1.662 -3.024 0.000 0.00 0.00 C+0 HETATM 101 C UNK 0 -1.612 -4.563 0.000 0.00 0.00 C+0 HETATM 102 C UNK 0 -2.920 -5.376 0.000 0.00 0.00 C+0 HETATM 103 O UNK 0 -2.870 -6.915 0.000 0.00 0.00 O+0 HETATM 104 C UNK 0 -4.278 -4.649 0.000 0.00 0.00 C+0 HETATM 105 O UNK 0 -5.586 -5.462 0.000 0.00 0.00 O+0 HETATM 106 C UNK 0 -4.328 -3.110 0.000 0.00 0.00 C+0 HETATM 107 O UNK 0 -5.686 -2.384 0.000 0.00 0.00 O+0 HETATM 108 C UNK 0 -3.020 -2.297 0.000 0.00 0.00 C+0 HETATM 109 O UNK 0 -0.404 -0.672 0.000 0.00 0.00 O+0 HETATM 110 O UNK 0 -2.907 -8.398 0.000 0.00 0.00 O+0 HETATM 111 O UNK 0 -1.610 -7.619 0.000 0.00 0.00 O+0 CONECT 1 2 CONECT 2 1 3 25 CONECT 3 2 4 CONECT 4 3 5 CONECT 5 4 6 111 CONECT 6 5 7 13 CONECT 7 6 8 14 CONECT 8 7 9 CONECT 9 8 10 11 CONECT 10 9 CONECT 11 9 12 13 CONECT 12 11 CONECT 13 11 6 CONECT 14 7 15 21 CONECT 15 14 16 23 CONECT 16 15 17 CONECT 17 16 18 19 CONECT 18 17 CONECT 19 17 20 21 CONECT 20 19 CONECT 21 19 14 22 CONECT 22 21 CONECT 23 15 24 110 CONECT 24 23 25 CONECT 25 24 2 26 CONECT 26 25 27 98 CONECT 27 26 28 96 CONECT 28 27 29 CONECT 29 28 30 95 CONECT 30 29 31 38 CONECT 31 30 32 CONECT 32 31 33 34 CONECT 33 32 CONECT 34 32 35 36 CONECT 35 34 CONECT 36 34 37 38 CONECT 37 36 CONECT 38 36 30 39 CONECT 39 38 40 CONECT 40 39 41 93 CONECT 41 40 42 CONECT 42 41 43 90 CONECT 43 42 44 89 CONECT 44 43 45 CONECT 45 44 46 CONECT 46 45 47 48 CONECT 47 46 CONECT 48 46 49 77 CONECT 49 48 50 53 CONECT 50 49 51 CONECT 51 50 52 68 CONECT 52 51 CONECT 53 49 54 56 CONECT 54 53 55 CONECT 55 54 CONECT 56 53 57 CONECT 57 56 58 76 CONECT 58 57 59 66 CONECT 59 58 60 CONECT 60 59 61 62 CONECT 61 60 CONECT 62 60 63 64 CONECT 63 62 CONECT 64 62 65 66 CONECT 65 64 CONECT 66 58 64 67 CONECT 67 66 68 74 CONECT 68 67 51 69 CONECT 69 68 70 CONECT 70 69 71 72 CONECT 71 70 CONECT 72 70 73 74 CONECT 73 72 CONECT 74 72 67 75 CONECT 75 74 CONECT 76 57 CONECT 77 48 78 CONECT 78 77 79 88 CONECT 79 78 80 87 CONECT 80 79 81 90 CONECT 81 80 82 83 CONECT 82 81 CONECT 83 81 84 85 CONECT 84 83 CONECT 85 83 86 87 CONECT 86 85 CONECT 87 85 79 CONECT 88 78 CONECT 89 43 CONECT 90 42 80 91 CONECT 91 90 92 93 CONECT 92 91 CONECT 93 91 40 94 CONECT 94 93 CONECT 95 29 CONECT 96 27 97 CONECT 97 96 CONECT 98 26 99 CONECT 99 98 100 109 CONECT 100 99 101 108 CONECT 101 100 102 CONECT 102 101 103 104 CONECT 103 102 CONECT 104 102 105 106 CONECT 105 104 CONECT 106 104 107 108 CONECT 107 106 CONECT 108 106 100 CONECT 109 99 CONECT 110 23 CONECT 111 5 MASTER 0 0 0 0 0 0 0 0 111 0 242 0 END