HEADER PROTEIN 04-JUL-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 04-JUL-21 0 HETATM 1 C UNK 0 1.734 -6.785 2.209 0.00 0.00 C+0 HETATM 2 C UNK 0 1.843 -5.586 1.355 0.00 0.00 C+0 HETATM 3 C UNK 0 1.327 -4.391 1.821 0.00 0.00 C+0 HETATM 4 O UNK 0 0.734 -4.309 2.981 0.00 0.00 O+0 HETATM 5 C UNK 0 0.238 -3.163 3.360 0.00 0.00 C+0 HETATM 6 C UNK 0 -0.398 -3.018 4.579 0.00 0.00 C+0 HETATM 7 C UNK 0 -0.496 -4.257 5.451 0.00 0.00 C+0 HETATM 8 C UNK 0 -0.920 -1.837 4.982 0.00 0.00 C+0 HETATM 9 C UNK 0 -0.828 -0.700 4.146 0.00 0.00 C+0 HETATM 10 C UNK 0 -0.206 -0.834 2.942 0.00 0.00 C+0 HETATM 11 C UNK 0 -0.369 0.241 1.892 0.00 0.00 C+0 HETATM 12 O UNK 0 0.282 1.281 1.881 0.00 0.00 O+0 HETATM 13 N UNK 0 -1.353 -0.055 0.922 0.00 0.00 N+0 HETATM 14 C UNK 0 -1.780 0.715 -0.227 0.00 0.00 C+0 HETATM 15 C UNK 0 -2.231 2.078 0.123 0.00 0.00 C+0 HETATM 16 O UNK 0 -1.191 2.910 0.099 0.00 0.00 O+0 HETATM 17 N UNK 0 -3.427 2.675 0.465 0.00 0.00 N+0 HETATM 18 C UNK 0 -4.608 3.264 -0.011 0.00 0.00 C+0 HETATM 19 C UNK 0 -5.449 3.857 1.143 0.00 0.00 C+0 HETATM 20 C UNK 0 -5.832 2.872 2.182 0.00 0.00 C+0 HETATM 21 C UNK 0 -4.571 4.908 1.862 0.00 0.00 C+0 HETATM 22 C UNK 0 -5.395 2.838 -1.109 0.00 0.00 C+0 HETATM 23 O UNK 0 -4.722 2.124 -1.994 0.00 0.00 O+0 HETATM 24 N UNK 0 -6.735 2.981 -1.520 0.00 0.00 N+0 HETATM 25 C UNK 0 -7.169 3.356 -2.906 0.00 0.00 C+0 HETATM 26 C UNK 0 -7.228 2.187 -3.818 0.00 0.00 C+0 HETATM 27 C UNK 0 -8.450 4.127 -2.737 0.00 0.00 C+0 HETATM 28 C UNK 0 -8.702 4.128 -1.250 0.00 0.00 C+0 HETATM 29 C UNK 0 -7.968 2.835 -0.831 0.00 0.00 C+0 HETATM 30 C UNK 0 -8.860 1.722 -1.287 0.00 0.00 C+0 HETATM 31 O UNK 0 -9.784 1.936 -2.157 0.00 0.00 O+0 HETATM 32 N UNK 0 -8.774 0.381 -0.820 0.00 0.00 N+0 HETATM 33 C UNK 0 -8.915 -0.706 -1.795 0.00 0.00 C+0 HETATM 34 C UNK 0 -8.573 0.031 0.548 0.00 0.00 C+0 HETATM 35 C UNK 0 -8.148 -1.339 0.799 0.00 0.00 C+0 HETATM 36 O UNK 0 -9.030 -2.145 1.197 0.00 0.00 O+0 HETATM 37 N UNK 0 -6.837 -1.859 0.641 0.00 0.00 N+0 HETATM 38 C UNK 0 -6.770 -3.287 0.392 0.00 0.00 C+0 HETATM 39 C UNK 0 -5.639 -1.093 0.717 0.00 0.00 C+0 HETATM 40 C UNK 0 -4.851 -1.204 1.959 0.00 0.00 C+0 HETATM 41 C UNK 0 -5.580 -0.792 3.218 0.00 0.00 C+0 HETATM 42 C UNK 0 -4.034 -2.440 2.134 0.00 0.00 C+0 HETATM 43 C UNK 0 -4.784 -1.275 -0.510 0.00 0.00 C+0 HETATM 44 O UNK 0 -5.154 -2.323 -1.163 0.00 0.00 O+0 HETATM 45 O UNK 0 -3.802 -0.492 -0.879 0.00 0.00 O+0 HETATM 46 C UNK 0 -2.576 -0.089 -1.180 0.00 0.00 C+0 HETATM 47 C UNK 0 -1.616 -1.241 -1.614 0.00 0.00 C+0 HETATM 48 C UNK 0 0.331 -2.028 2.544 0.00 0.00 C+0 HETATM 49 N UNK 0 0.945 -2.063 1.344 0.00 0.00 N+0 HETATM 50 C UNK 0 1.475 -3.223 0.922 0.00 0.00 C+0 HETATM 51 C UNK 0 2.096 -3.334 -0.289 0.00 0.00 C+0 HETATM 52 C UNK 0 2.340 -2.199 -1.144 0.00 0.00 C+0 HETATM 53 O UNK 0 2.735 -2.429 -2.349 0.00 0.00 O+0 HETATM 54 N UNK 0 2.230 -0.833 -0.840 0.00 0.00 N+0 HETATM 55 C UNK 0 2.542 0.259 -1.768 0.00 0.00 C+0 HETATM 56 C UNK 0 3.547 -0.090 -2.799 0.00 0.00 C+0 HETATM 57 O UNK 0 2.992 0.046 -4.008 0.00 0.00 O+0 HETATM 58 N UNK 0 4.852 -0.504 -2.878 0.00 0.00 N+0 HETATM 59 C UNK 0 6.147 0.056 -2.655 0.00 0.00 C+0 HETATM 60 C UNK 0 6.689 0.980 -3.695 0.00 0.00 C+0 HETATM 61 C UNK 0 5.901 2.220 -3.976 0.00 0.00 C+0 HETATM 62 C UNK 0 7.149 0.286 -4.960 0.00 0.00 C+0 HETATM 63 C UNK 0 7.200 -1.033 -2.523 0.00 0.00 C+0 HETATM 64 O UNK 0 6.743 -2.177 -2.934 0.00 0.00 O+0 HETATM 65 N UNK 0 8.498 -0.926 -2.045 0.00 0.00 N+0 HETATM 66 C UNK 0 9.748 -1.154 -2.836 0.00 0.00 C+0 HETATM 67 C UNK 0 10.412 0.153 -2.504 0.00 0.00 C+0 HETATM 68 O UNK 0 11.236 0.737 -3.134 0.00 0.00 O+0 HETATM 69 C UNK 0 9.845 0.642 -1.178 0.00 0.00 C+0 HETATM 70 C UNK 0 9.117 -0.624 -0.808 0.00 0.00 C+0 HETATM 71 C UNK 0 8.506 -0.760 0.463 0.00 0.00 C+0 HETATM 72 O UNK 0 7.817 -1.871 0.573 0.00 0.00 O+0 HETATM 73 N UNK 0 8.483 0.029 1.630 0.00 0.00 N+0 HETATM 74 C UNK 0 8.973 -0.565 2.908 0.00 0.00 C+0 HETATM 75 C UNK 0 7.983 1.395 1.770 0.00 0.00 C+0 HETATM 76 C UNK 0 6.677 1.580 1.095 0.00 0.00 C+0 HETATM 77 O UNK 0 6.825 2.148 -0.056 0.00 0.00 O+0 HETATM 78 N UNK 0 5.363 1.271 1.432 0.00 0.00 N+0 HETATM 79 C UNK 0 4.746 -0.034 1.069 0.00 0.00 C+0 HETATM 80 C UNK 0 4.378 2.123 2.124 0.00 0.00 C+0 HETATM 81 C UNK 0 4.930 3.279 2.860 0.00 0.00 C+0 HETATM 82 C UNK 0 3.220 2.465 1.220 0.00 0.00 C+0 HETATM 83 O UNK 0 2.733 3.613 1.543 0.00 0.00 O+0 HETATM 84 O UNK 0 2.810 1.654 0.245 0.00 0.00 O+0 HETATM 85 C UNK 0 2.709 1.583 -1.129 0.00 0.00 C+0 HETATM 86 C UNK 0 1.629 2.511 -1.720 0.00 0.00 C+0 HETATM 87 C UNK 0 2.598 -4.593 -0.710 0.00 0.00 C+0 HETATM 88 N UNK 0 3.219 -4.652 -1.978 0.00 0.00 N+0 HETATM 89 C UNK 0 2.449 -5.652 0.125 0.00 0.00 C+0 HETATM 90 O UNK 0 2.921 -6.774 -0.289 0.00 0.00 O+0 HETATM 91 H UNK 0 2.660 -6.973 2.783 0.00 0.00 H+0 HETATM 92 H UNK 0 1.564 -7.672 1.576 0.00 0.00 H+0 HETATM 93 H UNK 0 0.835 -6.656 2.849 0.00 0.00 H+0 HETATM 94 H UNK 0 0.497 -4.580 5.745 0.00 0.00 H+0 HETATM 95 H UNK 0 -1.145 -5.006 4.988 0.00 0.00 H+0 HETATM 96 H UNK 0 -1.011 -3.921 6.379 0.00 0.00 H+0 HETATM 97 H UNK 0 -1.407 -1.756 5.945 0.00 0.00 H+0 HETATM 98 H UNK 0 -1.244 0.232 4.460 0.00 0.00 H+0 HETATM 99 H UNK 0 -1.861 -0.991 1.025 0.00 0.00 H+0 HETATM 100 H UNK 0 -0.774 0.900 -0.744 0.00 0.00 H+0 HETATM 101 H UNK 0 -3.454 2.751 1.603 0.00 0.00 H+0 HETATM 102 H UNK 0 -4.229 4.344 -0.445 0.00 0.00 H+0 HETATM 103 H UNK 0 -6.298 4.419 0.782 0.00 0.00 H+0 HETATM 104 H UNK 0 -5.435 3.152 3.201 0.00 0.00 H+0 HETATM 105 H UNK 0 -5.378 1.891 1.920 0.00 0.00 H+0 HETATM 106 H UNK 0 -6.903 2.763 2.272 0.00 0.00 H+0 HETATM 107 H UNK 0 -4.030 4.427 2.694 0.00 0.00 H+0 HETATM 108 H UNK 0 -5.161 5.732 2.261 0.00 0.00 H+0 HETATM 109 H UNK 0 -3.809 5.290 1.157 0.00 0.00 H+0 HETATM 110 H UNK 0 -6.456 4.079 -3.366 0.00 0.00 H+0 HETATM 111 H UNK 0 -8.216 2.002 -4.287 0.00 0.00 H+0 HETATM 112 H UNK 0 -6.549 2.358 -4.712 0.00 0.00 H+0 HETATM 113 H UNK 0 -6.938 1.227 -3.311 0.00 0.00 H+0 HETATM 114 H UNK 0 -8.319 5.210 -3.009 0.00 0.00 H+0 HETATM 115 H UNK 0 -9.282 3.789 -3.349 0.00 0.00 H+0 HETATM 116 H UNK 0 -8.188 4.984 -0.763 0.00 0.00 H+0 HETATM 117 H UNK 0 -9.763 4.072 -1.031 0.00 0.00 H+0 HETATM 118 H UNK 0 -7.907 2.827 0.280 0.00 0.00 H+0 HETATM 119 H UNK 0 -9.319 -1.587 -1.258 0.00 0.00 H+0 HETATM 120 H UNK 0 -7.960 -0.993 -2.229 0.00 0.00 H+0 HETATM 121 H UNK 0 -9.710 -0.443 -2.543 0.00 0.00 H+0 HETATM 122 H UNK 0 -9.557 0.207 1.081 0.00 0.00 H+0 HETATM 123 H UNK 0 -7.876 0.716 1.111 0.00 0.00 H+0 HETATM 124 H UNK 0 -7.068 -3.509 -0.652 0.00 0.00 H+0 HETATM 125 H UNK 0 -7.421 -3.859 1.091 0.00 0.00 H+0 HETATM 126 H UNK 0 -5.745 -3.622 0.641 0.00 0.00 H+0 HETATM 127 H UNK 0 -6.008 -0.006 0.718 0.00 0.00 H+0 HETATM 128 H UNK 0 -4.055 -0.380 1.891 0.00 0.00 H+0 HETATM 129 H UNK 0 -6.185 -1.698 3.538 0.00 0.00 H+0 HETATM 130 H UNK 0 -4.883 -0.640 4.065 0.00 0.00 H+0 HETATM 131 H UNK 0 -6.305 0.007 3.050 0.00 0.00 H+0 HETATM 132 H UNK 0 -4.529 -3.277 2.654 0.00 0.00 H+0 HETATM 133 H UNK 0 -3.595 -2.745 1.137 0.00 0.00 H+0 HETATM 134 H UNK 0 -3.110 -2.234 2.762 0.00 0.00 H+0 HETATM 135 H UNK 0 -2.611 0.518 -2.143 0.00 0.00 H+0 HETATM 136 H UNK 0 -0.977 -1.474 -0.742 0.00 0.00 H+0 HETATM 137 H UNK 0 -2.245 -2.121 -1.863 0.00 0.00 H+0 HETATM 138 H UNK 0 -1.003 -0.896 -2.443 0.00 0.00 H+0 HETATM 139 H UNK 0 1.899 -0.527 0.086 0.00 0.00 H+0 HETATM 140 H UNK 0 1.545 0.295 -2.364 0.00 0.00 H+0 HETATM 141 H UNK 0 4.990 -1.525 -3.229 0.00 0.00 H+0 HETATM 142 H UNK 0 6.107 0.594 -1.706 0.00 0.00 H+0 HETATM 143 H UNK 0 7.659 1.372 -3.236 0.00 0.00 H+0 HETATM 144 H UNK 0 5.291 2.032 -4.904 0.00 0.00 H+0 HETATM 145 H UNK 0 6.577 3.105 -4.157 0.00 0.00 H+0 HETATM 146 H UNK 0 5.259 2.459 -3.116 0.00 0.00 H+0 HETATM 147 H UNK 0 6.564 0.529 -5.853 0.00 0.00 H+0 HETATM 148 H UNK 0 8.199 0.556 -5.208 0.00 0.00 H+0 HETATM 149 H UNK 0 7.188 -0.807 -4.748 0.00 0.00 H+0 HETATM 150 H UNK 0 9.609 -1.358 -3.877 0.00 0.00 H+0 HETATM 151 H UNK 0 10.245 -2.017 -2.306 0.00 0.00 H+0 HETATM 152 H UNK 0 9.198 1.492 -1.425 0.00 0.00 H+0 HETATM 153 H UNK 0 10.653 0.874 -0.467 0.00 0.00 H+0 HETATM 154 H UNK 0 10.042 -1.381 -0.773 0.00 0.00 H+0 HETATM 155 H UNK 0 8.446 -0.110 3.769 0.00 0.00 H+0 HETATM 156 H UNK 0 8.675 -1.638 2.937 0.00 0.00 H+0 HETATM 157 H UNK 0 10.048 -0.398 3.044 0.00 0.00 H+0 HETATM 158 H UNK 0 8.781 2.065 1.424 0.00 0.00 H+0 HETATM 159 H UNK 0 7.805 1.642 2.841 0.00 0.00 H+0 HETATM 160 H UNK 0 5.164 -0.897 1.609 0.00 0.00 H+0 HETATM 161 H UNK 0 3.683 -0.032 1.380 0.00 0.00 H+0 HETATM 162 H UNK 0 4.807 -0.161 -0.011 0.00 0.00 H+0 HETATM 163 H UNK 0 3.913 1.453 2.919 0.00 0.00 H+0 HETATM 164 H UNK 0 4.861 4.239 2.297 0.00 0.00 H+0 HETATM 165 H UNK 0 5.931 3.074 3.236 0.00 0.00 H+0 HETATM 166 H UNK 0 4.300 3.467 3.764 0.00 0.00 H+0 HETATM 167 H UNK 0 3.671 2.003 -1.591 0.00 0.00 H+0 HETATM 168 H UNK 0 1.341 3.181 -0.857 0.00 0.00 H+0 HETATM 169 H UNK 0 2.083 3.191 -2.459 0.00 0.00 H+0 HETATM 170 H UNK 0 0.769 1.969 -2.103 0.00 0.00 H+0 HETATM 171 H UNK 0 4.167 -4.259 -2.069 0.00 0.00 H+0 HETATM 172 H UNK 0 2.749 -5.074 -2.791 0.00 0.00 H+0 CONECT 1 2 91 92 93 CONECT 2 1 3 89 CONECT 3 2 4 50 CONECT 4 3 5 CONECT 5 4 6 48 CONECT 6 5 7 8 CONECT 7 6 94 95 96 CONECT 8 6 9 97 CONECT 9 8 10 98 CONECT 10 9 11 48 CONECT 11 10 12 13 CONECT 12 11 CONECT 13 11 14 99 CONECT 14 13 15 46 100 CONECT 15 14 16 17 CONECT 16 15 CONECT 17 15 18 101 CONECT 18 17 19 22 102 CONECT 19 18 20 21 103 CONECT 20 19 104 105 106 CONECT 21 19 107 108 109 CONECT 22 18 23 24 CONECT 23 22 CONECT 24 22 25 29 CONECT 25 24 26 27 110 CONECT 26 25 111 112 113 CONECT 27 25 28 114 115 CONECT 28 27 29 116 117 CONECT 29 28 30 24 118 CONECT 30 29 31 32 CONECT 31 30 CONECT 32 30 33 34 CONECT 33 32 119 120 121 CONECT 34 32 35 122 123 CONECT 35 34 36 37 CONECT 36 35 CONECT 37 35 38 39 CONECT 38 37 124 125 126 CONECT 39 37 40 43 127 CONECT 40 39 41 42 128 CONECT 41 40 129 130 131 CONECT 42 40 132 133 134 CONECT 43 39 44 45 CONECT 44 43 CONECT 45 43 46 CONECT 46 45 47 14 135 CONECT 47 46 136 137 138 CONECT 48 10 49 5 CONECT 49 48 50 CONECT 50 49 51 3 CONECT 51 50 52 87 CONECT 52 51 53 54 CONECT 53 52 CONECT 54 52 55 139 CONECT 55 54 56 85 140 CONECT 56 55 57 58 CONECT 57 56 CONECT 58 56 59 141 CONECT 59 58 60 63 142 CONECT 60 59 61 62 143 CONECT 61 60 144 145 146 CONECT 62 60 147 148 149 CONECT 63 59 64 65 CONECT 64 63 CONECT 65 63 66 70 CONECT 66 65 67 150 151 CONECT 67 66 68 69 CONECT 68 67 CONECT 69 67 70 152 153 CONECT 70 69 71 65 154 CONECT 71 70 72 73 CONECT 72 71 CONECT 73 71 74 75 CONECT 74 73 155 156 157 CONECT 75 73 76 158 159 CONECT 76 75 77 78 CONECT 77 76 CONECT 78 76 79 80 CONECT 79 78 160 161 162 CONECT 80 78 81 82 163 CONECT 81 80 164 165 166 CONECT 82 80 83 84 CONECT 83 82 CONECT 84 82 85 CONECT 85 84 86 55 167 CONECT 86 85 168 169 170 CONECT 87 51 88 89 CONECT 88 87 171 172 CONECT 89 87 90 2 CONECT 90 89 CONECT 91 1 CONECT 92 1 CONECT 93 1 CONECT 94 7 CONECT 95 7 CONECT 96 7 CONECT 97 8 CONECT 98 9 CONECT 99 13 CONECT 100 14 CONECT 101 17 CONECT 102 18 CONECT 103 19 CONECT 104 20 CONECT 105 20 CONECT 106 20 CONECT 107 21 CONECT 108 21 CONECT 109 21 CONECT 110 25 CONECT 111 26 CONECT 112 26 CONECT 113 26 CONECT 114 27 CONECT 115 27 CONECT 116 28 CONECT 117 28 CONECT 118 29 CONECT 119 33 CONECT 120 33 CONECT 121 33 CONECT 122 34 CONECT 123 34 CONECT 124 38 CONECT 125 38 CONECT 126 38 CONECT 127 39 CONECT 128 40 CONECT 129 41 CONECT 130 41 CONECT 131 41 CONECT 132 42 CONECT 133 42 CONECT 134 42 CONECT 135 46 CONECT 136 47 CONECT 137 47 CONECT 138 47 CONECT 139 54 CONECT 140 55 CONECT 141 58 CONECT 142 59 CONECT 143 60 CONECT 144 61 CONECT 145 61 CONECT 146 61 CONECT 147 62 CONECT 148 62 CONECT 149 62 CONECT 150 66 CONECT 151 66 CONECT 152 69 CONECT 153 69 CONECT 154 70 CONECT 155 74 CONECT 156 74 CONECT 157 74 CONECT 158 75 CONECT 159 75 CONECT 160 79 CONECT 161 79 CONECT 162 79 CONECT 163 80 CONECT 164 81 CONECT 165 81 CONECT 166 81 CONECT 167 85 CONECT 168 86 CONECT 169 86 CONECT 170 86 CONECT 171 88 CONECT 172 88 MASTER 0 0 0 0 0 0 0 0 172 0 356 0 END